*HEADER    DNA-BINDING                             17-NOV-94   1HSN      
*COMPND    HIGH MOBILITY GROUP PROTEIN 1 (HMG1) BOX 2, COMPLEXED WITH    
*COMPND   2 MERCAPTOETHANOL (NMR, 49 STRUCTURES)                         
*SOURCE    ORGANISM: CHINESE HAMSTER (CRICETULUS GRISEUS);               
*SOURCE   2 EXPRESSION SYSTEM: (ESCHERICHIA COLI); STRAIN: DH5 ALPHA     
*SOURCE   3 OR BL21; PLASMID: PGEX-2T; GENE: INSERT DERIVED BY PCR       
*SOURCE   4 USING AS TEMPLATE A PARTIAL CDNA CLONE OF CHINESE HAMSTER    
*SOURCE   5 HMG1 (PLASMID PCH1, LEE ET AL., (1987) NUCLEIC ACIDS         
*SOURCE   6 RES. 15, 5051-5068)                                          
*EXPDTA    NMR                                                           
*AUTHOR    C.M.READ,P.D.CARY,C.CRANE-ROBINSON,P.C.DRISCOLL,              
*AUTHOR   2 M.O.M.CARILLO,D.G.NORMAN                                     
*REVDAT   1   12-OCT-04 1HSN    0   

REMARK
REMARK   Experimental Restraints for NMR Structures of Hamster High
REMARK   Mobility Group Protein 1 (HMG1) Box 2, containing a mercaptoethanol
REMARK   molecule adducted to residue cysteine 16.
REMARK
REMARK   Authors: C.M. READ, P.D. CARY, C. CRANE-ROBINSON, P.C. DRISCOLL,
REMARK            M.O.M. CARILLO, AND D.G. NORMAN
REMARK   Address: Biophysics Laboratories, Department of Biological Sciences
REMARK            University of Portsmouth, St. Michael's Building, White
REMARK            Swan Road, Portsmouth PO1 2DT. United Kingdom.
REMARK
REMARK   References:
REMARK 1 C.M. READ, P.D. CARY, C. CRANE-ROBINSON, P.C. DRISCOLL,
REMARK   M.O.M. CARILLO, AND D.G. NORMAN (1994). In "Nucleic Acids and
REMARK   Molecular Biology." Eds. F. Eckstein and D.M.J. Lilley. Publ. by
REMARK   Springer-Verlag, Berlin, Heidelberg. Volume 9, in press.
REMARK   
REMARK 2 C.M. READ, P.D. CARY, C. CRANE-ROBINSON, P.C. DRISCOLL, and D.G.
REMARK   NORMAN (1993).  Solution structure of a DNA-binding domain from HMG1.
REMARK   Nucleic Acids Research, 21, 3427-3436
REMARK 
REMARK   SUMMARY OF NMR DERIVED RESTRAINTS:
REMARK    1. NOE RESTRAINTS
REMARK        INTRA-RESIDUE               =  129
REMARK        SEQUENTIAL  (|I-J| = 1)     =  455
REMARK        SHORT RANGE (|I-J| = 2,3,4) =  530
REMARK        LONG RANGE  (|I-J| >= 5)    =  273
REMARK        TOTAL                       = 1387
REMARK    2. DIHEDRAL ANGLE RESTRAINTS
REMARK        38 RESTRAINTS WITH (-170 > PHI > -10)
REMARK        38 RESTRAINTS WITH (  +5 > PSI > -85)
REMARK        TOTAL                       =   76
REMARK    3. HYDROGEN BOND RESTRAINTS
REMARK        32 RESTRAINTS WITH D(O-H) 1.5 - 2.5 ANGSTROMS
REMARK        32 RESTRAINTS WITH D(N-O) 2.5 - 3.5 ANGSTROMS
REMARK        TOTAL                       =   64
REMARK     
REMARK    GRAND TOTAL OF RESTRAINTS       = 1527
REMARK
REMARK  A.  NOE INTERPROTON DISTANCE RESTRAINTS
REMARK

!ASN 3, intra-residue NOES
assign (resid   3 and name HN   )(resid   3 and name HA   ) 0.0 0.0 2.5 !
assign (resid   3 and name HN   )(resid   3 and name HB*  ) 0.0 1.0 6.0 !
assign (resid   3 and name HN   )(resid   3 and name HD2* ) 0.0 1.0 6.0 !
assign (resid   3 and name HB*  )(resid   3 and name HD21 ) 0.0 1.0 4.5 !
assign (resid   3 and name HB1  )(resid   3 and name HD22 ) 0.0 0.0 5.0 !
assign (resid   3 and name HB2  )(resid   3 and name HD22 ) 0.0 0.0 5.0 !
!ASN 3, sequential NOES
assign (resid   3 and name HN   )(resid   4 and name HN   ) 0.0 0.0 6.0 !
assign (resid   3 and name HN   )(resid   4 and name HB*  ) 0.0 1.0 7.0 !
assign (resid   3 and name HA   )(resid   4 and name HN   ) 0.0 0.0 2.5 !
assign (resid   3 and name HB*  )(resid   4 and name HN   ) 0.0 1.0 4.5 !
!ASN 3, short-range NOES
!ASN 3, long-range NOES
assign (resid   3 and name HB*  )(resid  72 and name HE*  ) 0.0 3.0 8.0 !

!ALA 4, intra-residue NOES
assign (resid   4 and name HN   )(resid   4 and name HA   ) 0.0 0.0 2.5 !
!ALA 4, sequential NOES
assign (resid   4 and name HN   )(resid   5 and name HG*  ) 0.0 1.0 6.0 !
assign (resid   4 and name HN   )(resid   5 and name HD1  ) 0.0 0.0 3.5 !
assign (resid   4 and name HN   )(resid   5 and name HD2  ) 0.0 0.0 3.5 !
assign (resid   4 and name HA   )(resid   5 and name HD1  ) 0.0 0.0 3.5 !
assign (resid   4 and name HA   )(resid   5 and name HD2  ) 0.0 0.0 3.5 !
assign (resid   4 and name HB*  )(resid   5 and name HA   ) 0.0 1.0 6.0 !
assign (resid   4 and name HB*  )(resid   5 and name HD1  ) 0.0 1.0 4.5 !
assign (resid   4 and name HB*  )(resid   5 and name HD2  ) 0.0 1.0 4.5 !
!ALA 4, short-range NOES
assign (resid   4 and name HA   )(resid   6 and name HN   ) 0.0 0.0 5.0 !
!ALA 4, long-range NOES
assign (resid   4 and name HB*  )(resid  65 and name HE*  ) 0.0 3.0 8.0 !
assign (resid   4 and name HN   )(resid  69 and name HD1* ) 0.0 1.0 7.0 !
assign (resid   4 and name HA   )(resid  69 and name HG1* ) 0.0 1.0 6.0 !
assign (resid   4 and name HA   )(resid  69 and name HD1* ) 0.0 1.0 6.0 !
assign (resid   4 and name HB*  )(resid  69 and name HD1* ) 0.0 2.0 5.5 !
assign (resid   4 and name HN   )(resid  72 and name HD*  ) 0.0 2.0 7.0 !
assign (resid   4 and name HN   )(resid  72 and name HE*  ) 0.0 2.0 5.5 !
assign (resid   4 and name HA   )(resid  72 and name HD*  ) 0.0 2.0 5.5 !
assign (resid   4 and name HA   )(resid  72 and name HE*  ) 0.0 2.0 5.5 !
assign (resid   4 and name HB*  )(resid  72 and name HD*  ) 0.0 3.0 6.5 !
assign (resid   4 and name HB*  )(resid  72 and name HE*  ) 0.0 3.0 5.5 !

!PRO 5, intra-residue NOES
!PRO 5, sequential NOES
assign (resid   5 and name HA   )(resid   6 and name HN   ) 0.0 0.0 2.5 !
assign (resid   5 and name HB*  )(resid   6 and name HN   ) 0.0 1.0 4.5 !
assign (resid   5 and name HD*  )(resid   6 and name HN   ) 0.0 1.0 6.0 !
!PRO 5, short-range NOES
!PRO 5, long-range NOES
assign (resid   5 and name HA   )(resid  65 and name HB*  ) 0.0 1.0 6.0 !
assign (resid   5 and name HA   )(resid  65 and name HE*  ) 0.0 2.0 7.0 !
assign (resid   5 and name HB*  )(resid  65 and name HB*  ) 0.0 2.0 7.0 !
assign (resid   5 and name HB*  )(resid  65 and name HD*  ) 0.0 3.0 5.5 !
assign (resid   5 and name HB*  )(resid  65 and name HE*  ) 0.0 3.0 6.5 !
assign (resid   5 and name HG1  )(resid  65 and name HD*  ) 0.0 2.0 7.0 !
assign (resid   5 and name HG1  )(resid  65 and name HE*  ) 0.0 2.0 7.0 !
assign (resid   5 and name HG2  )(resid  65 and name HD*  ) 0.0 2.0 7.0 !
assign (resid   5 and name HG2  )(resid  65 and name HE*  ) 0.0 2.0 7.0 !
assign (resid   5 and name HB*  )(resid  69 and name HN   ) 0.0 1.0 7.0 !
assign (resid   5 and name HB*  )(resid  69 and name HG1* ) 0.0 2.0 7.0 !
assign (resid   5 and name HB*  )(resid  69 and name HD1* ) 0.0 2.0 7.0 !
assign (resid   5 and name HG*  )(resid  69 and name HD1* ) 0.0 3.0 8.0 !
assign (resid   5 and name HD*  )(resid  69 and name HN   ) 0.0 1.0 7.0 !
assign (resid   5 and name HD*  )(resid  69 and name HA   ) 0.0 1.0 6.0 !
assign (resid   5 and name HD*  )(resid  69 and name HG2* ) 0.0 1.0 6.0 !
assign (resid   5 and name HD1  )(resid  69 and name HG1* ) 0.0 1.0 6.0 !
assign (resid   5 and name HD1  )(resid  69 and name HD1* ) 0.0 1.0 4.5 !
assign (resid   5 and name HD2  )(resid  69 and name HG1* ) 0.0 1.0 6.0 !
assign (resid   5 and name HD2  )(resid  69 and name HD1* ) 0.0 1.0 4.5 !
assign (resid   5 and name HD*  )(resid  72 and name HD*  ) 0.0 3.0 6.5 !
assign (resid   5 and name HD1  )(resid  72 and name HE*  ) 0.0 2.0 7.0 !
assign (resid   5 and name HD2  )(resid  72 and name HE*  ) 0.0 2.0 7.0 !

!LYS 6, intra-residue NOES
assign (resid   6 and name HN   )(resid   6 and name HA   ) 0.0 0.0 3.5 !
!LYS 6, sequential NOES
assign (resid   6 and name HN   )(resid   7 and name HN   ) 0.0 0.0 5.0 !
assign (resid   6 and name HN   )(resid   7 and name HA   ) 0.0 0.0 5.0 !
assign (resid   6 and name HA   )(resid   7 and name HN   ) 0.0 0.0 2.5 !
assign (resid   6 and name HB*  )(resid   7 and name HN   ) 0.0 1.0 4.5 !
!LYS 6, short-range NOES
!LYS 6, long-range NOES
assign (resid   6 and name HN   )(resid  65 and name HD*  ) 0.0 2.0 7.0 !
assign (resid   6 and name HN   )(resid  65 and name HE*  ) 0.0 2.0 7.0 !
assign (resid   6 and name HA   )(resid  65 and name HD*  ) 0.0 2.0 5.5 !
assign (resid   6 and name HA   )(resid  65 and name HE*  ) 0.0 2.0 5.5 !

!ARG 7, intra-residue NOES
assign (resid   7 and name HN   )(resid   7 and name HA   ) 0.0 0.0 3.5 !
!ARG 7, sequential NOES
assign (resid   7 and name HN   )(resid   8 and name HD1  ) 0.0 0.0 5.0 !
assign (resid   7 and name HN   )(resid   8 and name HD2  ) 0.0 0.0 5.0 !
assign (resid   7 and name HA   )(resid   8 and name HD1  ) 0.0 0.0 3.5 !
assign (resid   7 and name HA   )(resid   8 and name HD2  ) 0.0 0.0 3.5 !
!ARG 7, short-range NOES
!ARG 7, long-range NOES
assign (resid   7 and name HN   )(resid  65 and name HD*  ) 0.0 2.0 7.0 !
assign (resid   7 and name HN   )(resid  65 and name HE*  ) 0.0 2.0 5.5 !
assign (resid   7 and name HA   )(resid  65 and name HD*  ) 0.0 2.0 5.5 !
assign (resid   7 and name HA   )(resid  65 and name HE*  ) 0.0 2.0 5.5 !
assign (resid   7 and name HB*  )(resid  65 and name HD*  ) 0.0 3.0 6.5 !
assign (resid   7 and name HB*  )(resid  65 and name HE*  ) 0.0 3.0 8.0 !

!PRO 8, intra-residue NOES
!PRO 8, sequential NOES
assign (resid   8 and name HA   )(resid   9 and name HG*  ) 0.0 1.0 6.0 !
assign (resid   8 and name HA   )(resid   9 and name HD1  ) 0.0 0.0 3.5 !
assign (resid   8 and name HA   )(resid   9 and name HD2  ) 0.0 0.0 3.5 !
assign (resid   8 and name HB1  )(resid   9 and name HD*  ) 0.0 1.0 6.0 !
assign (resid   8 and name HB2  )(resid   9 and name HD*  ) 0.0 1.0 6.0 !
!PRO 8, short-range NOES
!PRO 8, long-range NOES
assign (resid   8 and name HA   )(resid  61 and name HD*  ) 0.0 2.4 7.4 !
assign (resid   8 and name HD*  )(resid  65 and name HN   ) 0.0 1.0 6.0 !
assign (resid   8 and name HD*  )(resid  65 and name HD*  ) 0.0 3.0 6.5 !
assign (resid   8 and name HD1  )(resid  65 and name HE*  ) 0.0 2.0 5.5 !
assign (resid   8 and name HD2  )(resid  65 and name HE*  ) 0.0 2.0 5.5 !
assign (resid   8 and name HD1  )(resid  66 and name HN   ) 0.0 0.0 6.0 !
assign (resid   8 and name HD2  )(resid  66 and name HN   ) 0.0 0.0 6.0 !

!PRO 9, intra-residue NOES
!PRO 9, sequential NOES
assign (resid   9 and name HA   )(resid  10 and name HN   ) 0.0 0.0 2.5 !
assign (resid   9 and name HB*  )(resid  10 and name HN   ) 0.0 1.0 4.5 !
assign (resid   9 and name HD*  )(resid  10 and name HN   ) 0.0 1.0 7.0 !
!PRO 9, short-range NOES
assign (resid   9 and name HA   )(resid  11 and name HN   ) 0.0 0.0 5.0 !
assign (resid   9 and name HB*  )(resid  11 and name HN   ) 0.0 1.0 7.0 !
assign (resid   9 and name HA   )(resid  13 and name HN   ) 0.0 0.0 5.0 !
assign (resid   9 and name HA   )(resid  13 and name HB*  ) 0.0 1.0 6.0 !
assign (resid   9 and name HA   )(resid  13 and name HD*  ) 0.0 2.0 5.5 !
assign (resid   9 and name HA   )(resid  13 and name HE*  ) 0.0 2.0 7.0 !
assign (resid   9 and name HB*  )(resid  13 and name HN   ) 0.0 1.0 4.5 !
assign (resid   9 and name HB1  )(resid  13 and name HE*  ) 0.0 2.0 7.0 !
assign (resid   9 and name HB2  )(resid  13 and name HE*  ) 0.0 2.0 7.0 !
!PRO 9, long-range NOES
assign (resid   9 and name HA   )(resid  14 and name HN   ) 0.0 0.0 6.0 !
assign (resid   9 and name HB*  )(resid  14 and name HN   ) 0.0 1.0 6.0 !
assign (resid   9 and name HD1  )(resid  61 and name HD*  ) 0.0 2.4 7.4 !
assign (resid   9 and name HD2  )(resid  61 and name HD*  ) 0.0 2.4 7.4 !

!SER 10, intra-residue NOES
assign (resid  10 and name HN   )(resid  10 and name HA   ) 0.0 0.0 3.5 !
!SER 10, sequential NOES
assign (resid  10 and name HN   )(resid  11 and name HN   ) 0.0 0.0 5.0 !
assign (resid  10 and name HN   )(resid  11 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  10 and name HA   )(resid  11 and name HN   ) 0.0 0.0 3.5 !
assign (resid  10 and name HB*  )(resid  11 and name HN   ) 0.0 1.0 6.0 !
!SER 10, short-range NOES
assign (resid  10 and name HN   )(resid  12 and name HN   ) 0.0 0.0 5.0 !
assign (resid  10 and name HN   )(resid  12 and name HB*  ) 0.0 1.0 7.0 !
assign (resid  10 and name HA   )(resid  12 and name HN   ) 0.0 0.0 5.0 !
assign (resid  10 and name HA   )(resid  12 and name HD*  ) 0.0 2.0 7.0 !
assign (resid  10 and name HB*  )(resid  12 and name HN   ) 0.0 1.0 6.0 !
assign (resid  10 and name HN   )(resid  13 and name HN   ) 0.0 0.0 3.5 !
assign (resid  10 and name HN   )(resid  13 and name HA   ) 0.0 0.0 5.0 !
assign (resid  10 and name HN   )(resid  13 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  10 and name HN   )(resid  13 and name HD*  ) 0.0 2.0 5.5 !
assign (resid  10 and name HA   )(resid  13 and name HN   ) 0.0 0.0 5.0 !
assign (resid  10 and name HA   )(resid  13 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  10 and name HB*  )(resid  13 and name HN   ) 0.0 1.0 4.5 !
assign (resid  10 and name HN   )(resid  14 and name HN   ) 0.0 0.0 5.0 !
assign (resid  10 and name HN   )(resid  14 and name HD1* ) 0.0 1.0 7.0 !
assign (resid  10 and name HN   )(resid  14 and name HD2* ) 0.0 1.0 7.0 !
!SER 10, long-range NOES

!ALA 11, intra-residue NOES
assign (resid  11 and name HN   )(resid  11 and name HA   ) 0.0 0.0 2.5 !
!ALA 11, sequential NOES
assign (resid  11 and name HN   )(resid  12 and name HN   ) 0.0 0.0 3.5 !
assign (resid  11 and name HN   )(resid  12 and name HA   ) 0.0 0.0 6.0 !
assign (resid  11 and name HN   )(resid  12 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  11 and name HA   )(resid  12 and name HN   ) 0.0 0.0 3.5 !
assign (resid  11 and name HA   )(resid  12 and name HD*  ) 0.0 2.0 7.0 !
assign (resid  11 and name HB*  )(resid  12 and name HN   ) 0.0 1.0 3.5 !
assign (resid  11 and name HB*  )(resid  12 and name HD*  ) 0.0 3.0 8.0 !
!ALA 11, short-range NOES
assign (resid  11 and name HN   )(resid  13 and name HN   ) 0.0 0.0 5.0 !
assign (resid  11 and name HN   )(resid  13 and name HA   ) 0.0 0.0 5.0 !
assign (resid  11 and name HN   )(resid  13 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  11 and name HN   )(resid  13 and name HD*  ) 0.0 2.0 7.0 !
assign (resid  11 and name HB*  )(resid  13 and name HN   ) 0.0 1.0 4.5 !
assign (resid  11 and name HN   )(resid  14 and name HN   ) 0.0 0.0 6.0 !
assign (resid  11 and name HN   )(resid  14 and name HD* ) 0.0 2.4 7.4 !
!ALA 11, long-range NOES
assign (resid  11 and name HN   )(resid  43 and name HZ2  ) 0.0 0.0 5.0 !
assign (resid  11 and name HA   )(resid  43 and name HH2  ) 0.0 0.0 5.0 !
assign (resid  11 and name HB*  )(resid  43 and name HD1  ) 0.0 1.0 6.0 !
assign (resid  11 and name HB*  )(resid  43 and name HE1  ) 0.0 1.0 4.5 !
assign (resid  11 and name HB*  )(resid  43 and name HH2  ) 0.0 1.0 4.5 !
assign (resid  11 and name HB*  )(resid  43 and name HZ2  ) 0.0 1.0 3.5 !
assign (resid  11 and name HA   )(resid  54 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  11 and name HB*  )(resid  54 and name HB*  ) 0.0 2.0 4.5 !
assign (resid  11 and name HN   )(resid  55 and name HA   ) 0.0 0.0 6.0 !
assign (resid  11 and name HN   )(resid  55 and name HG*  ) 0.0 1.0 6.0 !
assign (resid  11 and name HN   )(resid  58 and name HN   ) 0.0 0.0 6.0 !

!PHE 12, intra-residue NOES
assign (resid  12 and name HN   )(resid  12 and name HA   ) 0.0 0.0 4.5 !
assign (resid  12 and name HN   )(resid  12 and name HB*  ) 0.0 1.0 3.5 !
assign (resid  12 and name HN   )(resid  12 and name HD*  ) 0.0 2.0 5.5 !
assign (resid  12 and name HN   )(resid  12 and name HE*  ) 0.0 2.0 7.0 !
assign (resid  12 and name HA   )(resid  12 and name HD*  ) 0.0 2.0 5.5 !
assign (resid  12 and name HA   )(resid  12 and name HE*  ) 0.0 2.0 5.5 !
assign (resid  12 and name HB*  )(resid  12 and name HD*  ) 0.0 3.0 5.5 !
assign (resid  12 and name HB*  )(resid  12 and name HE*  ) 0.0 3.0 6.5 !
!PHE 12, sequential NOES
assign (resid  12 and name HN   )(resid  13 and name HN   ) 0.0 0.0 3.5 !
assign (resid  12 and name HN   )(resid  13 and name HA   ) 0.0 0.0 5.0 !
assign (resid  12 and name HN   )(resid  13 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  12 and name HA   )(resid  13 and name HN   ) 0.0 0.0 3.5 !
assign (resid  12 and name HB*  )(resid  13 and name HN   ) 0.0 1.0 4.5 !
assign (resid  12 and name HD*  )(resid  13 and name HN   ) 0.0 2.0 5.5 !
assign (resid  12 and name HD*  )(resid  13 and name HA   ) 0.0 2.0 7.0 !
assign (resid  12 and name HE*  )(resid  13 and name HN   ) 0.0 2.0 7.0 !
assign (resid  12 and name HE*  )(resid  13 and name HA   ) 0.0 2.0 7.0 !
!PHE 12, short-range NOES
assign (resid  12 and name HN   )(resid  14 and name HN   ) 0.0 0.0 5.0 !
assign (resid  12 and name HN   )(resid  14 and name HB*  ) 0.0 1.0 7.0 !
assign (resid  12 and name HA   )(resid  14 and name HN   ) 0.0 0.0 5.0 !
assign (resid  12 and name HB*  )(resid  14 and name HN   ) 0.0 1.0 6.0 !
assign (resid  12 and name HN   )(resid  15 and name HN   ) 0.0 0.0 6.0 !
assign (resid  12 and name HN   )(resid  15 and name HD*  ) 0.0 2.0 8.0 !
assign (resid  12 and name HA   )(resid  15 and name HN   ) 0.0 0.0 3.5 !
assign (resid  12 and name HA   )(resid  15 and name HD*  ) 0.0 2.0 5.5 !
assign (resid  12 and name HB*  )(resid  15 and name HN   ) 0.0 1.0 6.0 !
assign (resid  12 and name HB*  )(resid  15 and name HD*  ) 0.0 3.0 6.5 !
assign (resid  12 and name HB*  )(resid  15 and name HE*  ) 0.0 3.0 8.0 !
assign (resid  12 and name HD*  )(resid  15 and name HN   ) 0.0 2.0 7.0 !
assign (resid  12 and name HD*  )(resid  15 and name HB*  ) 0.0 3.0 6.5 !
assign (resid  12 and name HD*  )(resid  15 and name HD*  ) 0.0 4.0 7.5 !
assign (resid  12 and name HD*  )(resid  15 and name HE*  ) 0.0 4.0 7.5 !
assign (resid  12 and name HE*  )(resid  15 and name HN   ) 0.0 2.0 8.0 !
assign (resid  12 and name HE*  )(resid  15 and name HD*  ) 0.0 4.0 7.5 !
assign (resid  12 and name HE*  )(resid  15 and name HE*  ) 0.0 4.0 7.5 !
assign (resid  12 and name HA   )(resid  16 and name HN   ) 0.0 0.0 5.0 !
assign (resid  12 and name HB*  )(resid  16 and name HN   ) 0.0 1.0 6.0 !
assign (resid  12 and name HD*  )(resid  16 and name HN   ) 0.0 2.0 7.0 !
assign (resid  12 and name HD*  )(resid  16 and name HB*  ) 0.0 3.0 6.5 !
assign (resid  12 and name HE*  )(resid  16 and name HN   ) 0.0 2.0 7.0 !
assign (resid  12 and name HE*  )(resid  16 and name HB*  ) 0.0 3.0 6.5 !
!PHE 12, long-range NOES
assign (resid  12 and name HE*  )(resid  35 and name HA   ) 0.0 2.0 8.0 !
assign (resid  12 and name HE*  )(resid  36 and name HA   ) 0.0 2.0 5.5 !
assign (resid  12 and name HN   )(resid  39 and name HD*  ) 0.0 2.4 8.4 !
assign (resid  12 and name HD*  )(resid  39 and name HB1  ) 0.0 2.0 7.0 !
assign (resid  12 and name HD*  )(resid  39 and name HB2  ) 0.0 2.0 7.0 !
assign (resid  12 and name HD*  )(resid  39 and name HG   ) 0.0 2.0 7.0 !
assign (resid  12 and name HD*  )(resid  39 and name HD1* ) 0.0 3.0 8.0 !
assign (resid  12 and name HD*  )(resid  39 and name HD2* ) 0.0 3.0 8.0 !
assign (resid  12 and name HE*  )(resid  39 and name HN   ) 0.0 2.0 7.0 !
assign (resid  12 and name HE*  )(resid  39 and name HA   ) 0.0 2.0 5.5 !
assign (resid  12 and name HE*  )(resid  39 and name HB1  ) 0.0 2.0 5.5 !
assign (resid  12 and name HE*  )(resid  39 and name HB2  ) 0.0 2.0 5.5 !
assign (resid  12 and name HE*  )(resid  39 and name HG   ) 0.0 2.0 5.5 !
assign (resid  12 and name HE*  )(resid  39 and name HD1* ) 0.0 3.0 6.5 !
assign (resid  12 and name HE*  )(resid  39 and name HD2* ) 0.0 3.0 6.5 !
assign (resid  12 and name HD*  )(resid  40 and name HN   ) 0.0 2.0 8.0 !
assign (resid  12 and name HD*  )(resid  40 and name HA1  ) 0.0 2.0 7.0 !
assign (resid  12 and name HD*  )(resid  40 and name HA2  ) 0.0 2.0 7.0 !
assign (resid  12 and name HE*  )(resid  40 and name HN   ) 0.0 2.0 5.5 !
assign (resid  12 and name HE*  )(resid  40 and name HA1  ) 0.0 2.0 4.5 !
assign (resid  12 and name HE*  )(resid  40 and name HA2  ) 0.0 2.0 4.5 !
assign (resid  12 and name HE*  )(resid  41 and name HN   ) 0.0 2.0 7.0 !
assign (resid  12 and name HE*  )(resid  41 and name HB*  ) 0.0 3.0 8.0 !
assign (resid  12 and name HE*  )(resid  42 and name HN   ) 0.0 2.0 7.0 !
assign (resid  12 and name HN   )(resid  43 and name HE1  ) 0.0 0.0 5.0 !
assign (resid  12 and name HN   )(resid  43 and name HH2  ) 0.0 0.0 5.0 !
assign (resid  12 and name HN   )(resid  43 and name HZ2  ) 0.0 0.0 5.0 !
assign (resid  12 and name HA   )(resid  43 and name HD1  ) 0.0 0.0 5.0 !
assign (resid  12 and name HA   )(resid  43 and name HE1  ) 0.0 0.0 5.0 !
assign (resid  12 and name HA   )(resid  43 and name HZ2  ) 0.0 0.0 5.0 !
assign (resid  12 and name HA   )(resid  43 and name HZ3  ) 0.0 0.0 5.0 !
assign (resid  12 and name HB*  )(resid  43 and name HD1  ) 0.0 1.0 4.5 !
assign (resid  12 and name HB*  )(resid  43 and name HE1  ) 0.0 1.0 4.5 !
assign (resid  12 and name HB*  )(resid  43 and name HZ2  ) 0.0 1.0 4.5 !
assign (resid  12 and name HB*  )(resid  43 and name HZ3  ) 0.0 1.0 6.0 !
assign (resid  12 and name HD*  )(resid  43 and name HN   ) 0.0 2.0 7.0 !
assign (resid  12 and name HD*  )(resid  43 and name HA   ) 0.0 2.0 7.0 !
assign (resid  12 and name HD*  )(resid  43 and name HB*  ) 0.0 3.0 6.5 !
assign (resid  12 and name HD*  )(resid  43 and name HD1  ) 0.0 2.0 5.5 !
assign (resid  12 and name HD*  )(resid  43 and name HE1  ) 0.0 2.0 5.5 !
assign (resid  12 and name HD*  )(resid  43 and name HE3  ) 0.0 2.0 7.0 !
assign (resid  12 and name HD*  )(resid  43 and name HZ2  ) 0.0 2.0 7.0 !
assign (resid  12 and name HE*  )(resid  43 and name HN   ) 0.0 2.0 5.5 !
assign (resid  12 and name HE*  )(resid  43 and name HB*  ) 0.0 3.0 5.5 !
assign (resid  12 and name HE*  )(resid  43 and name HD1  ) 0.0 2.0 5.5 !
assign (resid  12 and name HE*  )(resid  43 and name HE3  ) 0.0 2.0 7.0 !
assign (resid  12 and name HD*  )(resid  44 and name HN   ) 0.0 2.0 7.0 !
assign (resid  12 and name HE*  )(resid  44 and name HN   ) 0.0 2.0 7.0 !
assign (resid  12 and name HA   )(resid  54 and name HE*  ) 0.0 3.0 8.0 !

!PHE 13, intra-residue NOES
assign (resid  13 and name HN   )(resid  13 and name HA   ) 0.0 0.0 3.5 !
assign (resid  13 and name HN   )(resid  13 and name HB*  ) 0.0 1.0 3.5 !
assign (resid  13 and name HN   )(resid  13 and name HD*  ) 0.0 2.0 5.5 !
assign (resid  13 and name HN   )(resid  13 and name HE*  ) 0.0 2.0 7.0 !
assign (resid  13 and name HA   )(resid  13 and name HE*  ) 0.0 2.0 7.0 !
assign (resid  13 and name HB*  )(resid  13 and name HE*  ) 0.0 3.0 8.0 !
!PHE 13, sequential NOES
assign (resid  13 and name HN   )(resid  14 and name HN   ) 0.0 0.0 3.5 !
assign (resid  13 and name HN   )(resid  14 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  13 and name HN   )(resid  14 and name HD1* ) 0.0 1.0 6.0 !
assign (resid  13 and name HN   )(resid  14 and name HD2* ) 0.0 1.0 6.0 !
assign (resid  13 and name HA   )(resid  14 and name HN   ) 0.0 0.0 3.5 !
assign (resid  13 and name HB*  )(resid  14 and name HN   ) 0.0 1.0 4.5 !
assign (resid  13 and name HB*  )(resid  14 and name HD*  ) 0.0 3.4 6.9 !
assign (resid  13 and name HD*  )(resid  14 and name HN   ) 0.0 2.0 5.5 !
assign (resid  13 and name HD*  )(resid  14 and name HD*  ) 0.0 4.4 7.9 !
assign (resid  13 and name HE*  )(resid  14 and name HD*  ) 0.0 4.4 9.4 !
!PHE 13, short-range NOES
assign (resid  13 and name HN   )(resid  15 and name HN   ) 0.0 0.0 5.0 !
assign (resid  13 and name HN   )(resid  15 and name HD*  ) 0.0 2.0 8.0 !
assign (resid  13 and name HA   )(resid  15 and name HN   ) 0.0 0.0 5.0 !
assign (resid  13 and name HB*  )(resid  15 and name HN   ) 0.0 1.0 6.0 !
assign (resid  13 and name HA   )(resid  16 and name HN   ) 0.0 0.0 5.0 !
assign (resid  13 and name HB*  )(resid  16 and name HN   ) 0.0 1.0 6.0 !
assign (resid  13 and name HB*  )(resid  16 and name HB*  ) 0.0 2.0 7.0 !
assign (resid  13 and name HD*  )(resid  16 and name HN   ) 0.0 2.0 7.0 !
assign (resid  13 and name HE*  )(resid  16 and name HE*  ) 0.0 3.0 8.0 !
assign (resid  13 and name HE*  )(resid  16 and name HZ*  ) 0.0 3.0 8.0 !
assign (resid  13 and name HB*  )(resid  17 and name HN   ) 0.0 1.0 6.0 !
assign (resid  13 and name HD*  )(resid  17 and name HN   ) 0.0 2.0 7.0 !
assign (resid  13 and name HE*  )(resid  17 and name HA   ) 0.0 2.0 7.0 !
!PHE 13, long-range NOES
assign (resid  13 and name HN   )(resid  43 and name HZ2  ) 0.0 0.0 6.0 !

!LEU 14, intra-residue NOES
assign (resid  14 and name HN   )(resid  14 and name HA   ) 0.0 0.0 3.5 !
!LEU 14, sequential NOES
assign (resid  14 and name HN   )(resid  15 and name HN   ) 0.0 0.0 3.5 !
assign (resid  14 and name HN   )(resid  15 and name HA   ) 0.0 0.0 5.0 !
assign (resid  14 and name HN   )(resid  15 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  14 and name HN   )(resid  15 and name HD*  ) 0.0 2.0 7.0 !
assign (resid  14 and name HA   )(resid  15 and name HN   ) 0.0 0.0 3.5 !
assign (resid  14 and name HB*  )(resid  15 and name HN   ) 0.0 1.0 4.5 !
assign (resid  14 and name HG   )(resid  15 and name HN   ) 0.0 0.0 5.0 !
assign (resid  14 and name HD1* )(resid  15 and name HN   ) 0.0 1.0 6.0 !
assign (resid  14 and name HD2* )(resid  15 and name HN   ) 0.0 1.0 4.5 !
!LEU 14, short-range NOES
assign (resid  14 and name HA   )(resid  16 and name HN   ) 0.0 0.0 5.0 !
assign (resid  14 and name HB*  )(resid  16 and name HN   ) 0.0 1.0 6.0 !
assign (resid  14 and name HD1* )(resid  16 and name HN   ) 0.0 1.0 7.0 !
assign (resid  14 and name HD2* )(resid  16 and name HN   ) 0.0 1.0 7.0 !
assign (resid  14 and name HA   )(resid  17 and name HN   ) 0.0 0.0 3.5 !
assign (resid  14 and name HB*  )(resid  17 and name HN   ) 0.0 1.0 6.0 !
assign (resid  14 and name HD*  )(resid  17 and name HN   ) 0.0 2.4 7.4 !
assign (resid  14 and name HD*  )(resid  18 and name HN   ) 0.0 2.4 7.4 !
!LEU 14, long-range NOES
assign (resid  14 and name HN   )(resid  54 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  14 and name HN   )(resid  54 and name HD*  ) 0.0 2.0 7.0 !
assign (resid  14 and name HA   )(resid  54 and name HD*  ) 0.0 2.0 5.5 !
assign (resid  14 and name HB1  )(resid  54 and name HD*  ) 0.0 2.0 5.5 !
assign (resid  14 and name HB1  )(resid  54 and name HE*  ) 0.0 2.0 7.0 !
assign (resid  14 and name HB2  )(resid  54 and name HD*  ) 0.0 2.0 5.5 !
assign (resid  14 and name HB2  )(resid  54 and name HE*  ) 0.0 2.0 7.0 !
assign (resid  14 and name HG   )(resid  54 and name HD*  ) 0.0 2.0 5.5 !
assign (resid  14 and name HG   )(resid  54 and name HE*  ) 0.0 2.0 5.5 !
assign (resid  14 and name HD*  )(resid  54 and name HN   ) 0.0 2.4 8.4 !
assign (resid  14 and name HD*  )(resid  54 and name HA   ) 0.0 2.4 7.4 !
assign (resid  14 and name HD*  )(resid  54 and name HB1  ) 0.0 2.4 7.4 !
assign (resid  14 and name HD*  )(resid  54 and name HB2  ) 0.0 2.4 7.4 !
assign (resid  14 and name HD1* )(resid  54 and name HD*  ) 0.0 3.0 6.5 !
assign (resid  14 and name HD1* )(resid  54 and name HE*  ) 0.0 3.0 8.0 !
assign (resid  14 and name HD2* )(resid  54 and name HD*  ) 0.0 3.0 6.5 !
assign (resid  14 and name HD2* )(resid  54 and name HE*  ) 0.0 3.0 8.0 !
assign (resid  14 and name HD*  )(resid  55 and name HN   ) 0.0 2.4 8.4 !
assign (resid  14 and name HG   )(resid  57 and name HN   ) 0.0 0.0 5.0 !
assign (resid  14 and name HD*  )(resid  57 and name HN   ) 0.0 2.4 5.9 !
assign (resid  14 and name HD*  )(resid  57 and name HA   ) 0.0 2.4 7.4 !
assign (resid  14 and name HG   )(resid  58 and name HN   ) 0.0 0.0 5.0 !
assign (resid  14 and name HD*  )(resid  58 and name HN   ) 0.0 2.4 4.9 !
assign (resid  14 and name HD*  )(resid  59 and name HN   ) 0.0 2.4 7.4 !
assign (resid  14 and name HD*  )(resid  60 and name HN   ) 0.0 2.4 8.4 !
assign (resid  14 and name HD*  )(resid  61 and name HN   ) 0.0 2.4 7.4 !

!PHE 15, intra-residue NOES
assign (resid  15 and name HN   )(resid  15 and name HA   ) 0.0 0.0 3.5 !
assign (resid  15 and name HN   )(resid  15 and name HB*  ) 0.0 1.0 3.5 !
assign (resid  15 and name HN   )(resid  15 and name HD*  ) 0.0 2.0 5.5 !
assign (resid  15 and name HA   )(resid  15 and name HD*  ) 0.0 2.0 4.5 !
assign (resid  15 and name HB*  )(resid  15 and name HD*  ) 0.0 3.0 5.5 !
assign (resid  15 and name HB*  )(resid  15 and name HE*  ) 0.0 3.0 6.5 !
!PHE 15, sequential NOES
assign (resid  15 and name HN   )(resid  16 and name HN   ) 0.0 0.0 3.5 !
assign (resid  15 and name HN   )(resid  16 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  15 and name HA   )(resid  16 and name HN   ) 0.0 0.0 3.5 !
assign (resid  15 and name HB*  )(resid  16 and name HN   ) 0.0 1.0 4.5 !
assign (resid  15 and name HD*  )(resid  16 and name HN   ) 0.0 2.0 5.5 !
assign (resid  15 and name HD*  )(resid  16 and name HA   ) 0.0 2.0 5.5 !
!PHE 15, short-range NOES
assign (resid  15 and name HN   )(resid  17 and name HN   ) 0.0 0.0 5.0 !
assign (resid  15 and name HD*  )(resid  17 and name HN   ) 0.0 2.0 7.0 !
assign (resid  15 and name HA   )(resid  19 and name HD*  ) 0.0 2.0 7.0 !
assign (resid  15 and name HB*  )(resid  19 and name HD*  ) 0.0 3.0 8.0 !
assign (resid  15 and name HD*  )(resid  19 and name HB*  ) 0.0 3.0 8.0 !
assign (resid  15 and name HE*  )(resid  19 and name HD*  ) 0.0 4.0 7.5 !
!PHE 15, long-range NOES
assign (resid  15 and name HD*  )(resid  39 and name HA   ) 0.0 2.0 7.0 !
assign (resid  15 and name HD*  )(resid  39 and name HD1* ) 0.0 3.0 6.5 !
assign (resid  15 and name HD*  )(resid  39 and name HD2* ) 0.0 3.0 6.5 !
assign (resid  15 and name HE*  )(resid  39 and name HN   ) 0.0 2.0 7.0 !
assign (resid  15 and name HE*  )(resid  39 and name HG   ) 0.0 2.0 5.5 !
assign (resid  15 and name HE*  )(resid  39 and name HD1* ) 0.0 3.0 6.5 !
assign (resid  15 and name HE*  )(resid  39 and name HD2* ) 0.0 3.0 6.5 !
assign (resid  15 and name HZ   )(resid  39 and name HA   ) 0.0 0.0 5.0 !
assign (resid  15 and name HD*  )(resid  40 and name HN   ) 0.0 2.0 8.0 !
assign (resid  15 and name HD*  )(resid  42 and name HB*  ) 0.0 3.0 8.0 !
assign (resid  15 and name HE*  )(resid  42 and name HN   ) 0.0 2.0 7.0 !
assign (resid  15 and name HE*  )(resid  42 and name HB*  ) 0.0 3.0 5.5 !
assign (resid  15 and name HE*  )(resid  42 and name HG*  ) 0.0 3.0 8.0 !
assign (resid  15 and name HZ   )(resid  42 and name HN   ) 0.0 0.0 5.0 !
assign (resid  15 and name HZ   )(resid  42 and name HA   ) 0.0 0.0 5.0 !
assign (resid  15 and name HZ   )(resid  42 and name HB*  ) 0.0 1.0 3.5 !
assign (resid  15 and name HZ   )(resid  42 and name HG*  ) 0.0 1.0 6.0 !
assign (resid  15 and name HN   )(resid  43 and name HE3  ) 0.0 0.0 6.0 !
assign (resid  15 and name HN   )(resid  43 and name HH2  ) 0.0 0.0 6.0 !
assign (resid  15 and name HN   )(resid  43 and name HZ3  ) 0.0 0.0 5.0 !
assign (resid  15 and name HB*  )(resid  43 and name HE3  ) 0.0 1.0 6.0 !
assign (resid  15 and name HB*  )(resid  43 and name HZ3  ) 0.0 1.0 6.0 !
assign (resid  15 and name HD*  )(resid  43 and name HA   ) 0.0 2.0 7.0 !
assign (resid  15 and name HD*  )(resid  43 and name HB*  ) 0.0 3.0 6.5 !
assign (resid  15 and name HD*  )(resid  43 and name HE3  ) 0.0 2.0 5.5 !
assign (resid  15 and name HD*  )(resid  43 and name HH2  ) 0.0 2.0 7.0 !
assign (resid  15 and name HD*  )(resid  43 and name HZ3  ) 0.0 2.0 5.5 !
assign (resid  15 and name HE*  )(resid  43 and name HN   ) 0.0 2.0 5.5 !
assign (resid  15 and name HE*  )(resid  43 and name HA   ) 0.0 2.0 7.0 !
assign (resid  15 and name HE*  )(resid  43 and name HB*  ) 0.0 3.0 6.5 !
assign (resid  15 and name HE*  )(resid  43 and name HE3  ) 0.0 2.0 5.5 !
assign (resid  15 and name HZ   )(resid  43 and name HN   ) 0.0 0.0 5.0 !
assign (resid  15 and name HZ   )(resid  43 and name HA   ) 0.0 0.0 5.0 !
assign (resid  15 and name HZ   )(resid  43 and name HB*  ) 0.0 1.0 7.0 !
assign (resid  15 and name HE*  )(resid  44 and name HN   ) 0.0 2.0 7.0 !
assign (resid  15 and name HD*  )(resid  46 and name HG2* ) 0.0 3.0 8.0 !
assign (resid  15 and name HE*  )(resid  46 and name HG2* ) 0.0 3.0 8.0 !
assign (resid  15 and name HN   )(resid  54 and name HB*  ) 0.0 1.0 7.0 !
assign (resid  15 and name HN   )(resid  54 and name HD*  ) 0.0 2.0 7.0 !
assign (resid  15 and name HA   )(resid  54 and name HD*  ) 0.0 2.0 5.5 !
assign (resid  15 and name HA   )(resid  54 and name HE*  ) 0.0 2.0 4.5 !
assign (resid  15 and name HB*  )(resid  54 and name HD*  ) 0.0 3.0 8.0 !
assign (resid  15 and name HB*  )(resid  54 and name HE*  ) 0.0 3.0 6.5 !
assign (resid  15 and name HD*  )(resid  54 and name HB*  ) 0.0 3.0 8.0 !
assign (resid  15 and name HD*  )(resid  54 and name HD*  ) 0.0 4.0 7.5 !

!MER 16, intra-residue NOES
assign (resid  16 and name HN   )(resid  16 and name HA   ) 0.0 0.0 2.5 !
assign (resid  16 and name HN   )(resid  16 and name HE*  ) 0.0 1.0 7.0 !
!MER 16, sequential NOES
assign (resid  16 and name HN   )(resid  17 and name HN   ) 0.0 0.0 3.5 !
assign (resid  16 and name HN   )(resid  17 and name HA   ) 0.0 0.0 5.0 !
assign (resid  16 and name HA   )(resid  17 and name HN   ) 0.0 0.0 3.5 !
assign (resid  16 and name HB*  )(resid  17 and name HN   ) 0.0 1.0 4.5 !
assign (resid  16 and name HE*  )(resid  17 and name HN   ) 0.0 1.0 6.0 !
!MER 16, short-range NOES
assign (resid  16 and name HN   )(resid  18 and name HN   ) 0.0 0.0 5.0 !
assign (resid  16 and name HN   )(resid  18 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  16 and name HA   )(resid  18 and name HN   ) 0.0 0.0 5.0 !
assign (resid  16 and name HB*  )(resid  18 and name HN   ) 0.0 1.0 6.0 !
assign (resid  16 and name HN   )(resid  19 and name HD*  ) 0.0 2.0 7.0 !
assign (resid  16 and name HA   )(resid  19 and name HN   ) 0.0 0.0 3.5 !
assign (resid  16 and name HA   )(resid  19 and name HD*  ) 0.0 2.0 7.0 !
assign (resid  16 and name HB*  )(resid  19 and name HN   ) 0.0 1.0 6.0 !
assign (resid  16 and name HB*  )(resid  19 and name HD*  ) 0.0 3.0 8.0 !
assign (resid  16 and name HA   )(resid  20 and name HN   ) 0.0 0.0 5.0 !
!MER 16, long-range NOES
assign (resid  16 and name HN   )(resid  39 and name HD*  ) 0.0 2.4 5.9 !
assign (resid  16 and name HA   )(resid  39 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  16 and name HA   )(resid  39 and name HG   ) 0.0 0.0 5.0 !
assign (resid  16 and name HA   )(resid  39 and name HD*  ) 0.0 2.4 5.9 !
assign (resid  16 and name HB*  )(resid  39 and name HN   ) 0.0 1.0 7.0 !
assign (resid  16 and name HB*  )(resid  39 and name HD*  ) 0.0 3.4 6.9 !
assign (resid  16 and name HN   )(resid  43 and name HE3  ) 0.0 0.0 6.0 !
assign (resid  16 and name HN   )(resid  43 and name HZ3  ) 0.0 0.0 5.0 !
assign (resid  16 and name HN   )(resid  54 and name HD*  ) 0.0 2.0 8.0 !

!SER 17, intra-residue NOES
assign (resid  17 and name HN   )(resid  17 and name HA   ) 0.0 0.0 2.5 !
!SER 17, sequential NOES
assign (resid  17 and name HN   )(resid  18 and name HN   ) 0.0 0.0 3.5 !
assign (resid  17 and name HN   )(resid  18 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  17 and name HA   )(resid  18 and name HN   ) 0.0 0.0 3.5 !
!SER 17, short-range NOES
assign (resid  17 and name HN   )(resid  19 and name HN   ) 0.0 0.0 5.0 !
assign (resid  17 and name HN   )(resid  19 and name HD*  ) 0.0 2.0 8.0 !
assign (resid  17 and name HA   )(resid  19 and name HN   ) 0.0 0.0 5.0 !
assign (resid  17 and name HA   )(resid  19 and name HD*  ) 0.0 2.0 7.0 !
assign (resid  17 and name HB1  )(resid  19 and name HN   ) 0.0 0.0 5.0 !
assign (resid  17 and name HB2  )(resid  19 and name HN   ) 0.0 0.0 5.0 !
assign (resid  17 and name HA   )(resid  20 and name HN   ) 0.0 0.0 5.0 !
assign (resid  17 and name HB*  )(resid  20 and name HN   ) 0.0 1.0 6.0 !
!SER 17, long-range NOES
assign (resid  17 and name HN   )(resid  39 and name HD*  ) 0.0 2.4 5.9 !

!GLU 18, intra-residue NOES
assign (resid  18 and name HN   )(resid  18 and name HA   ) 0.0 0.0 2.5 !
!GLU 18, sequential NOES
assign (resid  18 and name HN   )(resid  19 and name HN   ) 0.0 0.0 3.5 !
assign (resid  18 and name HN   )(resid  19 and name HA   ) 0.0 0.0 6.0 !
assign (resid  18 and name HN   )(resid  19 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  18 and name HN   )(resid  19 and name HD*  ) 0.0 2.0 5.5 !
assign (resid  18 and name HN   )(resid  19 and name HE*  ) 0.0 2.0 7.0 !
assign (resid  18 and name HA   )(resid  19 and name HN   ) 0.0 0.0 3.5 !
assign (resid  18 and name HA   )(resid  19 and name HD*  ) 0.0 2.0 7.0 !
assign (resid  18 and name HB*  )(resid  19 and name HN   ) 0.0 1.0 3.5 !
assign (resid  18 and name HB*  )(resid  19 and name HD*  ) 0.0 3.0 6.5 !
assign (resid  18 and name HB*  )(resid  19 and name HE*  ) 0.0 3.0 6.5 !
assign (resid  18 and name HG*  )(resid  19 and name HN   ) 0.0 1.0 6.0 !
assign (resid  18 and name HG*  )(resid  19 and name HD*  ) 0.0 3.0 8.0 !
assign (resid  18 and name HG*  )(resid  19 and name HE*  ) 0.0 3.0 8.0 !
!GLU 18, short-range NOES
assign (resid  18 and name HN   )(resid  20 and name HN   ) 0.0 0.0 5.0 !
assign (resid  18 and name HB*  )(resid  20 and name HN   ) 0.0 1.0 6.0 !
assign (resid  18 and name HG*  )(resid  20 and name HN   ) 0.0 1.0 6.0 !
assign (resid  18 and name HN   )(resid  21 and name HD*  ) 0.0 1.0 6.0 !
!GLU 18, long-range NOES
assign (resid  18 and name HN   )(resid  39 and name HD*  ) 0.0 2.4 7.4 !

!TYR 19, intra-residue NOES
assign (resid  19 and name HN   )(resid  19 and name HA   ) 0.0 0.0 3.5 !
assign (resid  19 and name HN   )(resid  19 and name HB*  ) 0.0 1.0 3.5 !
assign (resid  19 and name HN   )(resid  19 and name HD*  ) 0.0 2.0 5.5 !
assign (resid  19 and name HN   )(resid  19 and name HE*  ) 0.0 2.0 7.0 !
assign (resid  19 and name HA   )(resid  19 and name HD*  ) 0.0 2.0 4.5 !
assign (resid  19 and name HB*  )(resid  19 and name HD*  ) 0.0 3.0 5.5 !
assign (resid  19 and name HB*  )(resid  19 and name HE*  ) 0.0 3.0 6.5 !
!TYR 19, sequential NOES
assign (resid  19 and name HN   )(resid  20 and name HN   ) 0.0 0.0 3.5 !
assign (resid  19 and name HN   )(resid  20 and name HA   ) 0.0 0.0 5.0 !
assign (resid  19 and name HN   )(resid  20 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  19 and name HN   )(resid  20 and name HG*  ) 0.0 1.0 7.0 !
assign (resid  19 and name HA   )(resid  20 and name HN   ) 0.0 0.0 3.5 !
assign (resid  19 and name HB*  )(resid  20 and name HN   ) 0.0 1.0 6.0 !
assign (resid  19 and name HD*  )(resid  20 and name HN   ) 0.0 2.0 7.0 !
assign (resid  19 and name HD*  )(resid  20 and name HA   ) 0.0 2.0 7.0 !
assign (resid  19 and name HE*  )(resid  20 and name HN   ) 0.0 2.0 8.0 !
!TYR 19, short-range NOES
assign (resid  19 and name HN   )(resid  21 and name HD*  ) 0.0 1.0 6.0 !
assign (resid  19 and name HA   )(resid  21 and name HD*  ) 0.0 1.0 6.0 !
assign (resid  19 and name HD*  )(resid  22 and name HG1  ) 0.0 2.0 7.0 !
assign (resid  19 and name HD*  )(resid  22 and name HG2  ) 0.0 2.0 7.0 !
assign (resid  19 and name HN   )(resid  23 and name HN   ) 0.0 0.0 6.0 !
assign (resid  19 and name HN   )(resid  23 and name HG1* ) 0.0 1.0 6.0 !
assign (resid  19 and name HB*  )(resid  23 and name HN   ) 0.0 1.0 7.0 !
assign (resid  19 and name HD*  )(resid  23 and name HN   ) 0.0 2.0 8.0 !
assign (resid  19 and name HD*  )(resid  23 and name HG2* ) 0.0 3.0 8.0 !
assign (resid  19 and name HD*  )(resid  23 and name HD1* ) 0.0 3.0 6.5 !
assign (resid  19 and name HE*  )(resid  23 and name HG1* ) 0.0 3.0 6.5 !
assign (resid  19 and name HE*  )(resid  23 and name HG2* ) 0.0 3.0 8.0 !
assign (resid  19 and name HE*  )(resid  23 and name HD1* ) 0.0 3.0 8.0 !
!TYR 19, long-range NOES
assign (resid  19 and name HN   )(resid  39 and name HD*  ) 0.0 2.4 5.9 !
assign (resid  19 and name HB*  )(resid  39 and name HD*  ) 0.0 3.4 6.9 !
assign (resid  19 and name HD*  )(resid  39 and name HD1* ) 0.0 3.0 6.5 !
assign (resid  19 and name HD*  )(resid  39 and name HD2* ) 0.0 3.0 6.5 !
assign (resid  19 and name HE*  )(resid  39 and name HD1* ) 0.0 3.0 6.5 !
assign (resid  19 and name HE*  )(resid  39 and name HD2* ) 0.0 3.0 6.5 !

!ARG 20, intra-residue NOES
assign (resid  20 and name HN   )(resid  20 and name HA   ) 0.0 0.0 3.5 !
!ARG 20, sequential NOES
assign (resid  20 and name HN   )(resid  21 and name HA   ) 0.0 0.0 6.0 !
assign (resid  20 and name HN   )(resid  21 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  20 and name HN   )(resid  21 and name HD*  ) 0.0 1.0 4.5 !
assign (resid  20 and name HA   )(resid  21 and name HD1  ) 0.0 0.0 5.0 !
assign (resid  20 and name HA   )(resid  21 and name HD2  ) 0.0 0.0 5.0 !
!ARG 20, short-range NOES
assign (resid  20 and name HN   )(resid  22 and name HN   ) 0.0 0.0 5.0 !
assign (resid  20 and name HA   )(resid  22 and name HN   ) 0.0 0.0 5.0 !
assign (resid  20 and name HN   )(resid  23 and name HN   ) 0.0 0.0 6.0 !
assign (resid  20 and name HN   )(resid  23 and name HG1* ) 0.0 1.0 6.0 !
assign (resid  20 and name HA   )(resid  23 and name HD1* ) 0.0 1.0 6.0 !
!ARG 20, long-range NOES
assign (resid  20 and name HN   )(resid  39 and name HD*  ) 0.0 2.4 5.9 !
assign (resid  20 and name HA   )(resid  39 and name HD*  ) 0.0 2.4 5.9 !

!PRO 21, intra-residue NOES
!PRO 21, sequential NOES
assign (resid  21 and name HA   )(resid  22 and name HN   ) 0.0 0.0 3.5 !
assign (resid  21 and name HB*  )(resid  22 and name HN   ) 0.0 1.0 4.5 !
assign (resid  21 and name HD*  )(resid  22 and name HN   ) 0.0 1.0 4.5 !
!PRO 21, short-range NOES
assign (resid  21 and name HA   )(resid  23 and name HN   ) 0.0 0.0 5.0 !
assign (resid  21 and name HB*  )(resid  23 and name HN   ) 0.0 1.0 6.0 !
assign (resid  21 and name HD*  )(resid  23 and name HN   ) 0.0 1.0 6.0 !
assign (resid  21 and name HA   )(resid  24 and name HN   ) 0.0 0.0 3.5 !
assign (resid  21 and name HB*  )(resid  24 and name HN   ) 0.0 1.0 6.0 !
assign (resid  21 and name HD*  )(resid  24 and name HN   ) 0.0 1.0 7.0 !
!PRO 21, long-range NOES
assign (resid  21 and name HD*  )(resid  39 and name HD*  ) 0.0 3.4 8.4 !

!LYS 22, intra-residue NOES
assign (resid  22 and name HN   )(resid  22 and name HA   ) 0.0 0.0 3.5 !
!LYS 22, sequential NOES
assign (resid  22 and name HN   )(resid  23 and name HN   ) 0.0 0.0 3.5 !
assign (resid  22 and name HN   )(resid  23 and name HG1* ) 0.0 1.0 6.0 !
assign (resid  22 and name HN   )(resid  23 and name HD1* ) 0.0 1.0 7.0 !
assign (resid  22 and name HA   )(resid  23 and name HN   ) 0.0 0.0 3.5 !
assign (resid  22 and name HG*  )(resid  23 and name HN   ) 0.0 1.0 6.0 !
!LYS 22, short-range NOES
assign (resid  22 and name HN   )(resid  24 and name HN   ) 0.0 0.0 5.0 !
assign (resid  22 and name HA   )(resid  24 and name HN   ) 0.0 0.0 5.0 !
assign (resid  22 and name HN   )(resid  25 and name HN   ) 0.0 0.0 6.0 !
assign (resid  22 and name HA   )(resid  25 and name HN   ) 0.0 0.0 3.5 !
assign (resid  22 and name HA   )(resid  26 and name HN   ) 0.0 0.0 5.0 !
!LYS 22, long-range NOES
assign (resid  22 and name HN   )(resid  39 and name HD*  ) 0.0 2.4 8.4 !

!ILE 23, intra-residue NOES
assign (resid  23 and name HN   )(resid  23 and name HA   ) 0.0 0.0 2.5 !
!ILE 23, sequential NOES
assign (resid  23 and name HN   )(resid  24 and name HN   ) 0.0 0.0 3.5 !
assign (resid  23 and name HN   )(resid  24 and name HA   ) 0.0 0.0 5.0 !
assign (resid  23 and name HN   )(resid  24 and name HB1  ) 0.0 0.0 3.5 !
assign (resid  23 and name HN   )(resid  24 and name HB2  ) 0.0 0.0 3.5 !
assign (resid  23 and name HN   )(resid  24 and name HE*  ) 0.0 1.0 6.0 !
assign (resid  23 and name HA   )(resid  24 and name HN   ) 0.0 0.0 3.5 !
assign (resid  23 and name HB   )(resid  24 and name HN   ) 0.0 0.0 3.5 !
assign (resid  23 and name HG2* )(resid  24 and name HN   ) 0.0 1.0 4.5 !
assign (resid  23 and name HD1* )(resid  24 and name HN   ) 0.0 1.0 4.5 !
!ILE 23, short-range NOES
assign (resid  23 and name HN   )(resid  25 and name HN   ) 0.0 0.0 5.0 !
assign (resid  23 and name HN   )(resid  25 and name HA*  ) 0.0 1.0 6.0 !
assign (resid  23 and name HA   )(resid  25 and name HN   ) 0.0 0.0 5.0 !
assign (resid  23 and name HB   )(resid  25 and name HN   ) 0.0 0.0 5.0 !
assign (resid  23 and name HG2* )(resid  25 and name HN   ) 0.0 1.0 6.0 !
assign (resid  23 and name HG2* )(resid  26 and name HN   ) 0.0 1.0 7.0 !
assign (resid  23 and name HA   )(resid  27 and name HD2  ) 0.0 0.0 3.5 !
assign (resid  23 and name HG1* )(resid  27 and name HD2  ) 0.0 1.0 6.0 !
assign (resid  23 and name HG2* )(resid  27 and name HD2  ) 0.0 1.0 4.5 !
assign (resid  23 and name HD1* )(resid  27 and name HD2  ) 0.0 1.0 6.0 !
!ILE 23, long-range NOES
assign (resid  23 and name HN   )(resid  30 and name HD*  ) 0.0 2.4 8.4 !
assign (resid  23 and name HD1* )(resid  35 and name HA   ) 0.0 1.0 6.0 !
assign (resid  23 and name HD1* )(resid  38 and name HN   ) 0.0 1.0 6.0 !
assign (resid  23 and name HD1* )(resid  39 and name HN   ) 0.0 1.0 6.0 !

!LYS 24, intra-residue NOES
assign (resid  24 and name HN   )(resid  24 and name HA   ) 0.0 0.0 2.5 !
!LYS 24, sequential NOES
assign (resid  24 and name HN   )(resid  25 and name HN   ) 0.0 0.0 3.5 !
assign (resid  24 and name HN   )(resid  25 and name HA*  ) 0.0 1.0 4.5 !
assign (resid  24 and name HA   )(resid  25 and name HN   ) 0.0 0.0 3.5 !
assign (resid  24 and name HB1  )(resid  25 and name HN   ) 0.0 0.0 3.5 !
assign (resid  24 and name HB2  )(resid  25 and name HN   ) 0.0 0.0 3.5 !
assign (resid  24 and name HG*  )(resid  25 and name HN   ) 0.0 1.0 6.0 !
assign (resid  24 and name HD*  )(resid  25 and name HN   ) 0.0 1.0 6.0 !
assign (resid  24 and name HE*  )(resid  25 and name HN   ) 0.0 1.0 7.0 !
!LYS 24, short-range NOES
assign (resid  24 and name HN   )(resid  26 and name HN   ) 0.0 0.0 5.0 !
assign (resid  24 and name HA   )(resid  26 and name HN   ) 0.0 0.0 5.0 !
assign (resid  24 and name HN   )(resid  27 and name HN   ) 0.0 0.0 5.0 !
assign (resid  24 and name HN   )(resid  27 and name HD2  ) 0.0 0.0 6.0 !
assign (resid  24 and name HA   )(resid  27 and name HN   ) 0.0 0.0 3.5 !
assign (resid  24 and name HB*  )(resid  27 and name HN   ) 0.0 1.0 6.0 !
!LYS 24, long-range NOES
assign (resid  24 and name HN   )(resid  30 and name HD*  ) 0.0 2.4 7.4 !
assign (resid  24 and name HN   )(resid  35 and name HG*  ) 0.0 2.4 7.4 !

!GLY 25, intra-residue NOES
assign (resid  25 and name HN   )(resid  25 and name HA*  ) 0.0 1.0 3.5 !
!GLY 25, sequential NOES
assign (resid  25 and name HN   )(resid  26 and name HN   ) 0.0 0.0 3.5 !
assign (resid  25 and name HN   )(resid  26 and name HG1  ) 0.0 0.0 5.0 !
assign (resid  25 and name HN   )(resid  26 and name HG2  ) 0.0 0.0 5.0 !
assign (resid  25 and name HA*  )(resid  26 and name HN   ) 0.0 1.0 3.5 !
!GLY 25, short-range NOES
assign (resid  25 and name HN   )(resid  27 and name HN   ) 0.0 0.0 5.0 !
assign (resid  25 and name HA*  )(resid  27 and name HN   ) 0.0 1.0 6.0 !
!GLY 25, long-range NOES

!GLU 26, intra-residue NOES
assign (resid  26 and name HN   )(resid  26 and name HA   ) 0.0 0.0 2.5 !
!GLU 26, sequential NOES
assign (resid  26 and name HN   )(resid  27 and name HN   ) 0.0 0.0 2.5 !
assign (resid  26 and name HN   )(resid  27 and name HA   ) 0.0 0.0 5.0 !
assign (resid  26 and name HN   )(resid  27 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  26 and name HN   )(resid  27 and name HD2  ) 0.0 0.0 5.0 !
assign (resid  26 and name HA   )(resid  27 and name HN   ) 0.0 0.0 3.5 !
assign (resid  26 and name HB1  )(resid  27 and name HN   ) 0.0 0.0 3.5 !
assign (resid  26 and name HB2  )(resid  27 and name HN   ) 0.0 0.0 3.5 !
assign (resid  26 and name HG1  )(resid  27 and name HN   ) 0.0 0.0 5.0 !
assign (resid  26 and name HG2  )(resid  27 and name HN   ) 0.0 0.0 5.0 !
!GLU 26, short-range NOES
assign (resid  26 and name HB1  )(resid  27 and name HD2  ) 0.0 0.0 3.5 !
assign (resid  26 and name HB1  )(resid  27 and name HE1  ) 0.0 0.0 6.0 !
assign (resid  26 and name HB2  )(resid  27 and name HD2  ) 0.0 0.0 3.5 !
assign (resid  26 and name HB2  )(resid  27 and name HE1  ) 0.0 0.0 6.0 !
assign (resid  26 and name HG1  )(resid  27 and name HD2  ) 0.0 0.0 5.0 !
assign (resid  26 and name HG2  )(resid  27 and name HD2  ) 0.0 0.0 5.0 !
assign (resid  26 and name HN   )(resid  28 and name HD*  ) 0.0 1.0 7.0 !
assign (resid  26 and name HN   )(resid  30 and name HD*  ) 0.0 2.4 8.4 !
!GLU 26, long-range NOES

!HIS 27, intra-residue NOES
assign (resid  27 and name HN   )(resid  27 and name HA   ) 0.0 0.0 3.5 !
assign (resid  27 and name HN   )(resid  27 and name HD2  ) 0.0 0.0 5.0 !
!HIS 27, sequential NOES
assign (resid  27 and name HN   )(resid  28 and name HA   ) 0.0 0.0 5.0 !
assign (resid  27 and name HN   )(resid  28 and name HD1  ) 0.0 0.0 3.5 !
assign (resid  27 and name HN   )(resid  28 and name HD2  ) 0.0 0.0 3.5 !
assign (resid  27 and name HA   )(resid  28 and name HG*  ) 0.0 1.0 6.0 !
assign (resid  27 and name HA   )(resid  28 and name HD1  ) 0.0 0.0 2.5 !
assign (resid  27 and name HA   )(resid  28 and name HD2  ) 0.0 0.0 2.5 !
assign (resid  27 and name HB*  )(resid  28 and name HD*  ) 0.0 2.0 7.0 !
!HIS 27, short-range NOES
assign (resid  27 and name HA   )(resid  29 and name HN   ) 0.0 0.0 5.0 !
assign (resid  27 and name HB*  )(resid  29 and name HN   ) 0.0 1.0 6.0 !
assign (resid  27 and name HN   )(resid  30 and name HN   ) 0.0 0.0 6.0 !
assign (resid  27 and name HN   )(resid  30 and name HD*  ) 0.0 2.4 7.4 !
assign (resid  27 and name HA   )(resid  30 and name HN   ) 0.0 0.0 5.0 !
assign (resid  27 and name HA   )(resid  30 and name HG   ) 0.0 0.0 5.0 !
assign (resid  27 and name HA   )(resid  30 and name HD*  ) 0.0 2.4 7.4 !
assign (resid  27 and name HB*  )(resid  30 and name HD*  ) 0.0 3.4 6.9 !
assign (resid  27 and name HB1  )(resid  30 and name HN   ) 0.0 0.0 5.0 !
assign (resid  27 and name HB2  )(resid  30 and name HN   ) 0.0 0.0 5.0 !
assign (resid  27 and name HD2  )(resid  30 and name HG   ) 0.0 0.0 5.0 !
assign (resid  27 and name HD2  )(resid  30 and name HD*  ) 0.0 2.4 5.9 !
assign (resid  27 and name HE1  )(resid  30 and name HD*  ) 0.0 2.4 8.4 !
assign (resid  27 and name HB*  )(resid  31 and name HN   ) 0.0 1.0 7.0 !
!HIS 27, long-range NOES

!PRO 28, intra-residue NOES
!PRO 28, sequential NOES
assign (resid  28 and name HA   )(resid  29 and name HN   ) 0.0 0.0 2.5 !
assign (resid  28 and name HB*  )(resid  29 and name HN   ) 0.0 1.0 4.5 !
assign (resid  28 and name HG*  )(resid  29 and name HN   ) 0.0 1.0 4.5 !
assign (resid  28 and name HD1  )(resid  29 and name HN   ) 0.0 0.0 5.0 !
assign (resid  28 and name HD2  )(resid  29 and name HN   ) 0.0 0.0 5.0 !
!PRO 28, short-range NOES
assign (resid  28 and name HA   )(resid  30 and name HN   ) 0.0 0.0 3.5 !
!PRO 28, long-range NOES

!GLY 29, intra-residue NOES
assign (resid  29 and name HN   )(resid  29 and name HA1  ) 0.0 0.0 2.5 !
assign (resid  29 and name HN   )(resid  29 and name HA2  ) 0.0 0.0 2.5 !
!GLY 29, sequential NOES
assign (resid  29 and name HN   )(resid  30 and name HN   ) 0.0 0.0 3.5 !
assign (resid  29 and name HN   )(resid  30 and name HA   ) 0.0 0.0 6.0 !
assign (resid  29 and name HN   )(resid  30 and name HB1  ) 0.0 0.0 5.0 !
assign (resid  29 and name HN   )(resid  30 and name HB2  ) 0.0 0.0 5.0 !
assign (resid  29 and name HN   )(resid  30 and name HG   ) 0.0 0.0 5.0 !
assign (resid  29 and name HN   )(resid  30 and name HD*  ) 0.0 2.4 7.4 !
assign (resid  29 and name HA1  )(resid  30 and name HN   ) 0.0 0.0 3.5 !
assign (resid  29 and name HA2  )(resid  30 and name HN   ) 0.0 0.0 3.5 !
!GLY 29, short-range NOES
!GLY 29, long-range NOES
assign (resid  29 and name HN   )(resid  35 and name HG*  ) 0.0 2.4 8.4 !

!LEU 30, intra-residue NOES
assign (resid  30 and name HN   )(resid  30 and name HA   ) 0.0 0.0 2.5 !
!LEU 30, sequential NOES
assign (resid  30 and name HN   )(resid  31 and name HN   ) 0.0 0.0 5.0 !
assign (resid  30 and name HA   )(resid  31 and name HN   ) 0.0 0.0 3.5 !
assign (resid  30 and name HB1  )(resid  31 and name HN   ) 0.0 0.0 3.5 !
assign (resid  30 and name HB2  )(resid  31 and name HN   ) 0.0 0.0 3.5 !
assign (resid  30 and name HG   )(resid  31 and name HN   ) 0.0 0.0 5.0 !
assign (resid  30 and name HD*  )(resid  31 and name HN   ) 0.0 2.4 5.9 !
!LEU 30, short-range NOES
assign (resid  30 and name HN   )(resid  34 and name HB1  ) 0.0 0.0 5.0 !
assign (resid  30 and name HN   )(resid  34 and name HB2  ) 0.0 0.0 5.0 !
assign (resid  30 and name HA   )(resid  34 and name HB1  ) 0.0 0.0 5.0 !
assign (resid  30 and name HA   )(resid  34 and name HB2  ) 0.0 0.0 5.0 !
assign (resid  30 and name HB*  )(resid  34 and name HN   ) 0.0 1.0 6.0 !
assign (resid  30 and name HD*  )(resid  34 and name HN   ) 0.0 2.4 5.9 !
assign (resid  30 and name HD*  )(resid  34 and name HB1  ) 0.0 2.4 5.9 !
assign (resid  30 and name HD*  )(resid  34 and name HB2  ) 0.0 2.4 5.9 !
!LEU 30, long-range NOES
assign (resid  30 and name HN   )(resid  35 and name HG*  ) 0.0 2.4 5.9 !
assign (resid  30 and name HB*  )(resid  35 and name HN   ) 0.0 1.0 6.0 !
assign (resid  30 and name HB*  )(resid  35 and name HG*  ) 0.0 3.4 6.9 !
assign (resid  30 and name HG   )(resid  35 and name HN   ) 0.0 0.0 5.0 !
assign (resid  30 and name HD*  )(resid  35 and name HN   ) 0.0 2.4 5.9 !
assign (resid  30 and name HD*  )(resid  35 and name HA   ) 0.0 2.4 5.9 !
assign (resid  30 and name HD*  )(resid  35 and name HG*  ) 0.0 4.8 7.3 !
assign (resid  30 and name HB*  )(resid  36 and name HN   ) 0.0 1.0 7.0 !
assign (resid  30 and name HD*  )(resid  36 and name HN   ) 0.0 2.4 7.4 !
assign (resid  30 and name HD*  )(resid  38 and name HN   ) 0.0 2.4 7.4 !
assign (resid  30 and name HD*  )(resid  39 and name HN   ) 0.0 2.4 8.4 !

!SER 31, intra-residue NOES
assign (resid  31 and name HN   )(resid  31 and name HA   ) 0.0 0.0 2.5 !
!SER 31, sequential NOES
assign (resid  31 and name HN   )(resid  32 and name HN   ) 0.0 0.0 5.0 !
assign (resid  31 and name HN   )(resid  32 and name HA   ) 0.0 0.0 5.0 !
assign (resid  31 and name HA   )(resid  32 and name HN   ) 0.0 0.0 2.5 !
assign (resid  31 and name HA   )(resid  32 and name HA   ) 0.0 0.0 6.0 !
assign (resid  31 and name HA   )(resid  32 and name HB   ) 0.0 0.0 5.0 !
assign (resid  31 and name HB1  )(resid  32 and name HN   ) 0.0 0.0 3.5 !
assign (resid  31 and name HB2  )(resid  32 and name HN   ) 0.0 0.0 3.5 !
!SER 31, short-range NOES
assign (resid  31 and name HN   )(resid  33 and name HN   ) 0.0 0.0 6.0 !
assign (resid  31 and name HA   )(resid  33 and name HN   ) 0.0 0.0 3.5 !
assign (resid  31 and name HB1  )(resid  33 and name HN   ) 0.0 0.0 3.5 !
assign (resid  31 and name HB2  )(resid  33 and name HN   ) 0.0 0.0 3.5 !
assign (resid  31 and name HN   )(resid  34 and name HN   ) 0.0 0.0 3.5 !
assign (resid  31 and name HN   )(resid  34 and name HB1  ) 0.0 0.0 3.5 !
assign (resid  31 and name HN   )(resid  34 and name HB2  ) 0.0 0.0 3.5 !
assign (resid  31 and name HA   )(resid  34 and name HN   ) 0.0 0.0 5.0 !
assign (resid  31 and name HB1  )(resid  34 and name HN   ) 0.0 0.0 5.0 !
assign (resid  31 and name HB2  )(resid  34 and name HN   ) 0.0 0.0 5.0 !
assign (resid  31 and name HN   )(resid  35 and name HN   ) 0.0 0.0 6.0 !
assign (resid  31 and name HN   )(resid  35 and name HB   ) 0.0 0.0 6.0 !
assign (resid  31 and name HN   )(resid  35 and name HG*  ) 0.0 2.4 7.4 !
assign (resid  31 and name HA   )(resid  35 and name HN   ) 0.0 0.0 5.0 !
!SER 31, long-range NOES

!ILE 32, intra-residue NOES
assign (resid  32 and name HN   )(resid  32 and name HA   ) 0.0 0.0 2.5 !
!ILE 32, sequential NOES
assign (resid  32 and name HN   )(resid  33 and name HN   ) 0.0 0.0 5.0 !
assign (resid  32 and name HN   )(resid  33 and name HA*  ) 0.0 1.0 6.0 !
assign (resid  32 and name HA   )(resid  33 and name HN   ) 0.0 0.0 3.5 !
assign (resid  32 and name HB   )(resid  33 and name HN   ) 0.0 0.0 3.5 !
assign (resid  32 and name HG2* )(resid  33 and name HN   ) 0.0 1.0 3.5 !
assign (resid  32 and name HG11 )(resid  33 and name HN   ) 0.0 0.0 5.0 !
assign (resid  32 and name HG12 )(resid  33 and name HN   ) 0.0 0.0 5.0 !
assign (resid  32 and name HD1* )(resid  33 and name HN   ) 0.0 1.0 6.0 !
!ILE 32, short-range NOES
assign (resid  32 and name HN   )(resid  34 and name HN   ) 0.0 0.0 5.0 !
assign (resid  32 and name HN   )(resid  34 and name HB*  ) 0.0 1.0 7.0 !
assign (resid  32 and name HA   )(resid  34 and name HN   ) 0.0 0.0 3.5 !
assign (resid  32 and name HG1* )(resid  34 and name HN   ) 0.0 1.0 7.0 !
assign (resid  32 and name HD1* )(resid  34 and name HN   ) 0.0 1.0 6.0 !
assign (resid  32 and name HN   )(resid  35 and name HB   ) 0.0 0.0 5.0 !
assign (resid  32 and name HA   )(resid  35 and name HN   ) 0.0 0.0 3.5 !
assign (resid  32 and name HA   )(resid  35 and name HB   ) 0.0 0.0 2.5 !
assign (resid  32 and name HG1* )(resid  35 and name HN   ) 0.0 1.0 7.0 !
assign (resid  32 and name HA   )(resid  36 and name HN   ) 0.0 0.0 3.5 !
assign (resid  32 and name HA   )(resid  36 and name HB*  ) 0.0 1.0 7.0 !
!ILE 32, long-range NOES

!GLY 33, intra-residue NOES
assign (resid  33 and name HN   )(resid  33 and name HA*  ) 0.0 1.0 3.5 !
!GLY 33, sequential NOES
assign (resid  33 and name HN   )(resid  34 and name HN   ) 0.0 0.0 3.5 !
assign (resid  33 and name HN   )(resid  34 and name HA   ) 0.0 0.0 5.0 !
assign (resid  33 and name HN   )(resid  34 and name HB1  ) 0.0 0.0 6.0 !
assign (resid  33 and name HN   )(resid  34 and name HB2  ) 0.0 0.0 6.0 !
assign (resid  33 and name HA*  )(resid  34 and name HN   ) 0.0 1.0 3.5 !
!GLY 33, short-range NOES
assign (resid  33 and name HN   )(resid  35 and name HN   ) 0.0 0.0 5.0 !
assign (resid  33 and name HN   )(resid  35 and name HB   ) 0.0 0.0 6.0 !
assign (resid  33 and name HA*  )(resid  35 and name HN   ) 0.0 1.0 4.5 !
assign (resid  33 and name HN   )(resid  36 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  33 and name HA*  )(resid  36 and name HN   ) 0.0 1.0 4.5 !
assign (resid  33 and name HA*  )(resid  36 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  33 and name HN   )(resid  37 and name HN   ) 0.0 0.0 5.0 !
assign (resid  33 and name HA*  )(resid  37 and name HN   ) 0.0 1.0 6.0 !
!GLY 33, long-range NOES

!ASP 34, intra-residue NOES
assign (resid  34 and name HN   )(resid  34 and name HA   ) 0.0 0.0 2.5 !
!ASP 34, sequential NOES
assign (resid  34 and name HN   )(resid  35 and name HN   ) 0.0 0.0 3.5 !
assign (resid  34 and name HN   )(resid  35 and name HA   ) 0.0 0.0 5.0 !
assign (resid  34 and name HN   )(resid  35 and name HB   ) 0.0 0.0 3.5 !
assign (resid  34 and name HN   )(resid  35 and name HG*  ) 0.0 2.4 5.9 !
assign (resid  34 and name HA   )(resid  35 and name HN   ) 0.0 0.0 3.5 !
assign (resid  34 and name HB1  )(resid  35 and name HN   ) 0.0 0.0 3.5 !
assign (resid  34 and name HB2  )(resid  35 and name HN   ) 0.0 0.0 3.5 !
!ASP 34, short-range NOES
assign (resid  34 and name HN   )(resid  36 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  34 and name HA   )(resid  36 and name HN   ) 0.0 0.0 3.5 !
assign (resid  34 and name HB1  )(resid  36 and name HN   ) 0.0 0.0 5.0 !
assign (resid  34 and name HB2  )(resid  36 and name HN   ) 0.0 0.0 5.0 !
assign (resid  34 and name HN   )(resid  37 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  34 and name HA   )(resid  37 and name HN   ) 0.0 0.0 3.5 !
assign (resid  34 and name HB1  )(resid  37 and name HN   ) 0.0 0.0 5.0 !
assign (resid  34 and name HB2  )(resid  37 and name HN   ) 0.0 0.0 5.0 !
assign (resid  34 and name HA   )(resid  38 and name HN   ) 0.0 0.0 3.5 !
!ASP 34, long-range NOES

!VAL 35, intra-residue NOES
assign (resid  35 and name HN   )(resid  35 and name HA   ) 0.0 0.0 3.5 !
!VAL 35, sequential NOES
assign (resid  35 and name HN   )(resid  36 and name HN   ) 0.0 0.0 2.5 !
assign (resid  35 and name HN   )(resid  36 and name HA   ) 0.0 0.0 5.0 !
assign (resid  35 and name HN   )(resid  36 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  35 and name HA   )(resid  36 and name HN   ) 0.0 0.0 3.5 !
assign (resid  35 and name HB   )(resid  36 and name HN   ) 0.0 0.0 2.5 !
assign (resid  35 and name HG*  )(resid  36 and name HN   ) 0.0 2.4 4.9 !
!VAL 35, short-range NOES
assign (resid  35 and name HN   )(resid  37 and name HN   ) 0.0 0.0 5.0 !
assign (resid  35 and name HA   )(resid  37 and name HN   ) 0.0 0.0 5.0 !
assign (resid  35 and name HB   )(resid  37 and name HN   ) 0.0 0.0 5.0 !
assign (resid  35 and name HG*  )(resid  37 and name HN   ) 0.0 2.4 7.4 !
assign (resid  35 and name HN   )(resid  38 and name HN   ) 0.0 0.0 5.0 !
assign (resid  35 and name HA   )(resid  38 and name HN   ) 0.0 0.0 3.5 !
assign (resid  35 and name HG*  )(resid  38 and name HN   ) 0.0 2.4 7.4 !
assign (resid  35 and name HA   )(resid  39 and name HN   ) 0.0 0.0 3.5 !
assign (resid  35 and name HB   )(resid  39 and name HD*  ) 0.0 2.4 7.4 !
assign (resid  35 and name HG*  )(resid  39 and name HN   ) 0.0 2.0 7.0 !
!VAL 35, long-range NOES

!ALA 36, intra-residue NOES
assign (resid  36 and name HN   )(resid  36 and name HA   ) 0.0 0.0 2.5 !
!ALA 36, sequential NOES
assign (resid  36 and name HN   )(resid  37 and name HN   ) 0.0 0.0 2.5 !
assign (resid  36 and name HN   )(resid  37 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  36 and name HN   )(resid  37 and name HG*  ) 0.0 1.0 6.0 !
assign (resid  36 and name HN   )(resid  37 and name HD*  ) 0.0 1.0 7.0 !
assign (resid  36 and name HA   )(resid  37 and name HN   ) 0.0 0.0 3.5 !
assign (resid  36 and name HB*  )(resid  37 and name HN   ) 0.0 1.0 3.5 !
!ALA 36, short-range NOES
assign (resid  36 and name HN   )(resid  38 and name HN   ) 0.0 0.0 5.0 !
assign (resid  36 and name HA   )(resid  38 and name HN   ) 0.0 0.0 5.0 !
assign (resid  36 and name HN   )(resid  39 and name HN   ) 0.0 0.0 5.0 !
assign (resid  36 and name HA   )(resid  39 and name HN   ) 0.0 0.0 3.5 !
assign (resid  36 and name HN   )(resid  40 and name HN   ) 0.0 0.0 5.0 !
assign (resid  36 and name HA   )(resid  40 and name HN   ) 0.0 0.0 5.0 !
!ALA 36, long-range NOES

!LYS 37, intra-residue NOES
assign (resid  37 and name HN   )(resid  37 and name HA   ) 0.0 0.0 2.5 !
!LYS 37, sequential NOES
assign (resid  37 and name HN   )(resid  38 and name HA   ) 0.0 0.0 5.0 !
assign (resid  37 and name HA   )(resid  38 and name HN   ) 0.0 0.0 3.5 !
assign (resid  37 and name HG*  )(resid  38 and name HN   ) 0.0 1.0 6.0 !
assign (resid  37 and name HD*  )(resid  38 and name HN   ) 0.0 1.0 6.0 !
!LYS 37, short-range NOES
assign (resid  37 and name HN   )(resid  39 and name HN   ) 0.0 0.0 5.0 !
assign (resid  37 and name HA   )(resid  39 and name HN   ) 0.0 0.0 5.0 !
assign (resid  37 and name HA   )(resid  40 and name HN   ) 0.0 0.0 3.5 !
assign (resid  37 and name HA   )(resid  41 and name HN   ) 0.0 0.0 5.0 !
assign (resid  37 and name HG*  )(resid  41 and name HN   ) 0.0 1.0 6.0 !
!LYS 37, long-range NOES

!LYS 38, intra-residue NOES
assign (resid  38 and name HN   )(resid  38 and name HA   ) 0.0 0.0 2.5 !
!LYS 38, sequential NOES
assign (resid  38 and name HN   )(resid  39 and name HN   ) 0.0 0.0 3.5 !
assign (resid  38 and name HN   )(resid  39 and name HA   ) 0.0 0.0 5.0 !
assign (resid  38 and name HN   )(resid  39 and name HB*  ) 0.0 1.0 5.0 !
assign (resid  38 and name HN   )(resid  39 and name HG   ) 0.0 0.0 5.0 !
assign (resid  38 and name HN   )(resid  39 and name HD*  ) 0.0 2.4 7.4 !
assign (resid  38 and name HA   )(resid  39 and name HN   ) 0.0 0.0 3.5 !
assign (resid  38 and name HG*  )(resid  39 and name HN   ) 0.0 1.0 6.0 !
!LYS 38, short-range NOES
assign (resid  38 and name HN   )(resid  40 and name HN   ) 0.0 0.0 3.5 !
assign (resid  38 and name HA   )(resid  40 and name HN   ) 0.0 0.0 5.0 !
assign (resid  38 and name HG*  )(resid  40 and name HN   ) 0.0 1.0 7.0 !
assign (resid  38 and name HN   )(resid  41 and name HN   ) 0.0 0.0 5.0 !
assign (resid  38 and name HA   )(resid  41 and name HN   ) 0.0 0.0 3.5 !
assign (resid  38 and name HA   )(resid  41 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  38 and name HA   )(resid  41 and name HG*  ) 0.0 1.0 7.0 !
assign (resid  38 and name HG*  )(resid  41 and name HN   ) 0.0 1.0 6.0 !
assign (resid  38 and name HA   )(resid  42 and name HN   ) 0.0 0.0 5.0 !
assign (resid  38 and name HG*  )(resid  42 and name HN   ) 0.0 1.0 6.0 !
!LYS 38, long-range NOES

!LEU 39, intra-residue NOES
assign (resid  39 and name HN   )(resid  39 and name HA   ) 0.0 0.0 3.5 !
!LEU 39, sequential NOES
assign (resid  39 and name HN   )(resid  40 and name HN   ) 0.0 0.0 3.5 !
assign (resid  39 and name HN   )(resid  40 and name HA*  ) 0.0 1.0 6.0 !
assign (resid  39 and name HA   )(resid  40 and name HN   ) 0.0 0.0 3.5 !
assign (resid  39 and name HB*  )(resid  40 and name HN   ) 0.0 1.0 4.5 !
assign (resid  39 and name HB*  )(resid  40 and name HA*  ) 0.0 2.0 8.0 !
assign (resid  39 and name HG   )(resid  40 and name HN   ) 0.0 0.0 3.5 !
assign (resid  39 and name HD*  )(resid  40 and name HN   ) 0.0 2.4 5.9 !
!LEU 39, short-range NOES
assign (resid  39 and name HN   )(resid  41 and name HN   ) 0.0 0.0 5.0 !
assign (resid  39 and name HA   )(resid  41 and name HN   ) 0.0 0.0 5.0 !
assign (resid  39 and name HG   )(resid  41 and name HN   ) 0.0 0.0 5.0 !
assign (resid  39 and name HD*  )(resid  41 and name HN   ) 0.0 2.4 7.4 !
assign (resid  39 and name HA   )(resid  42 and name HN   ) 0.0 0.0 3.5 !
assign (resid  39 and name HG   )(resid  42 and name HN   ) 0.0 0.0 5.0 !
assign (resid  39 and name HD*  )(resid  42 and name HN   ) 0.0 2.4 7.4 !
assign (resid  39 and name HN   )(resid  43 and name HB*  ) 0.0 1.0 7.0 !
assign (resid  39 and name HA   )(resid  43 and name HN   ) 0.0 0.0 5.0 !
assign (resid  39 and name HD*  )(resid  43 and name HN   ) 0.0 2.4 7.4 !
!LEU 39, long-range NOES
assign (resid  39 and name HD*  )(resid  44 and name HN   ) 0.0 2.4 8.4 !

!GLY 40, intra-residue NOES
assign (resid  40 and name HN   )(resid  40 and name HA*  ) 0.0 1.0 3.5 !
!GLY 40, sequential NOES
assign (resid  40 and name HN   )(resid  41 and name HN   ) 0.0 0.0 2.5 !
assign (resid  40 and name HN   )(resid  41 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  40 and name HN   )(resid  41 and name HG*  ) 0.0 1.0 6.0 !
assign (resid  40 and name HA*  )(resid  41 and name HN   ) 0.0 1.0 4.5 !
!GLY 40, short-range NOES
assign (resid  40 and name HN   )(resid  42 and name HN   ) 0.0 0.0 5.0 !
assign (resid  40 and name HN   )(resid  42 and name HG*  ) 0.0 1.0 7.0 !
assign (resid  40 and name HA*  )(resid  42 and name HN   ) 0.0 1.0 6.0 !
assign (resid  40 and name HN   )(resid  43 and name HN   ) 0.0 0.0 5.0 !
assign (resid  40 and name HN   )(resid  43 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  40 and name HA*  )(resid  43 and name HN   ) 0.0 1.0 6.0 !
assign (resid  40 and name HA1  )(resid  43 and name HD1  ) 0.0 0.0 5.0 !
assign (resid  40 and name HA2  )(resid  43 and name HD1  ) 0.0 0.0 5.0 !
assign (resid  40 and name HN   )(resid  44 and name HN   ) 0.0 0.0 6.0 !
!GLY 40, long-range NOES

!GLU 41, intra-residue NOES
assign (resid  41 and name HN   )(resid  41 and name HA   ) 0.0 0.0 2.5 !
!GLU 41, sequential NOES
assign (resid  41 and name HN   )(resid  42 and name HN   ) 0.0 0.0 3.5 !
assign (resid  41 and name HN   )(resid  42 and name HG1  ) 0.0 0.0 5.0 !
assign (resid  41 and name HN   )(resid  42 and name HG2  ) 0.0 0.0 5.0 !
assign (resid  41 and name HN   )(resid  42 and name HE*  ) 0.0 1.0 6.0 !
assign (resid  41 and name HA   )(resid  42 and name HN   ) 0.0 0.0 3.5 !
assign (resid  41 and name HB*  )(resid  42 and name HN   ) 0.0 1.0 4.5 !
!GLU 41, short-range NOES
assign (resid  41 and name HN   )(resid  43 and name HN   ) 0.0 0.0 5.0 !
assign (resid  41 and name HN   )(resid  43 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  41 and name HA   )(resid  43 and name HN   ) 0.0 0.0 5.0 !
assign (resid  41 and name HB*  )(resid  43 and name HN   ) 0.0 1.0 6.0 !
assign (resid  41 and name HN   )(resid  44 and name HD21 ) 0.0 0.0 5.0 !
assign (resid  41 and name HA   )(resid  44 and name HN   ) 0.0 0.0 3.5 !
assign (resid  41 and name HA   )(resid  44 and name HD21 ) 0.0 0.0 3.5 !
assign (resid  41 and name HA   )(resid  44 and name HD22 ) 0.0 0.0 3.5 !
assign (resid  41 and name HB*  )(resid  44 and name HD21 ) 0.0 1.0 6.0 !
assign (resid  41 and name HB*  )(resid  44 and name HD22 ) 0.0 1.0 6.0 !
assign (resid  41 and name HB1  )(resid  44 and name HN   ) 0.0 0.0 5.0 !
assign (resid  41 and name HB2  )(resid  44 and name HN   ) 0.0 0.0 5.0 !
assign (resid  41 and name HN   )(resid  45 and name HD22 ) 0.0 0.0 6.0 !
assign (resid  41 and name HB*  )(resid  45 and name HN   ) 0.0 1.0 7.0 !
assign (resid  41 and name HB*  )(resid  45 and name HD21 ) 0.0 1.0 4.5 !
assign (resid  41 and name HB*  )(resid  45 and name HD22 ) 0.0 1.0 4.5 !
!GLU 41, long-range NOES

!MET 42, intra-residue NOES
assign (resid  42 and name HN   )(resid  42 and name HA   ) 0.0 0.0 3.5 !
!MET 42, sequential NOES
assign (resid  42 and name HN   )(resid  43 and name HN   ) 0.0 0.0 3.5 !
assign (resid  42 and name HN   )(resid  43 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  42 and name HA   )(resid  43 and name HN   ) 0.0 0.0 3.5 !
assign (resid  42 and name HB*  )(resid  43 and name HN   ) 0.0 1.0 4.5 !
assign (resid  42 and name HG*  )(resid  43 and name HN   ) 0.0 1.0 6.0 !
!MET 42, short-range NOES
assign (resid  42 and name HN   )(resid  44 and name HN   ) 0.0 0.0 6.0 !
assign (resid  42 and name HA   )(resid  44 and name HN   ) 0.0 0.0 5.0 !
assign (resid  42 and name HB*  )(resid  44 and name HN   ) 0.0 1.0 4.5 !
assign (resid  42 and name HN   )(resid  45 and name HN   ) 0.0 0.0 6.0 !
assign (resid  42 and name HA   )(resid  45 and name HN   ) 0.0 0.0 3.5 !
assign (resid  42 and name HA   )(resid  45 and name HD2* ) 0.0 1.0 4.5 !
assign (resid  42 and name HB*  )(resid  45 and name HN   ) 0.0 1.0 6.0 !
assign (resid  42 and name HB*  )(resid  45 and name HD21 ) 0.0 1.0 6.0 !
assign (resid  42 and name HB*  )(resid  45 and name HD22 ) 0.0 1.0 6.0 !
!MET 42, long-range NOES

!TRP 43, intra-residue NOES
assign (resid  43 and name HN   )(resid  43 and name HA   ) 0.0 0.0 3.5 !
assign (resid  43 and name HN   )(resid  43 and name HB1  ) 0.0 0.0 2.5 !
assign (resid  43 and name HN   )(resid  43 and name HB2  ) 0.0 0.0 2.5 !
assign (resid  43 and name HN   )(resid  43 and name HD1  ) 0.0 0.0 5.0 !
assign (resid  43 and name HN   )(resid  43 and name HE3  ) 0.0 0.0 5.0 !
assign (resid  43 and name HA   )(resid  43 and name HD1  ) 0.0 0.0 5.0 !
assign (resid  43 and name HA   )(resid  43 and name HE1  ) 0.0 0.0 5.0 !
assign (resid  43 and name HA   )(resid  43 and name HE3  ) 0.0 0.0 3.5 !
assign (resid  43 and name HA   )(resid  43 and name HZ3  ) 0.0 0.0 5.0 !
assign (resid  43 and name HB*  )(resid  43 and name HD1  ) 0.0 1.0 3.5 !
assign (resid  43 and name HB*  )(resid  43 and name HE1  ) 0.0 1.0 4.5 !
assign (resid  43 and name HB*  )(resid  43 and name HE3  ) 0.0 1.0 4.5 !
assign (resid  43 and name HB*  )(resid  43 and name HZ2  ) 0.0 1.0 7.0 !
assign (resid  43 and name HB*  )(resid  43 and name HZ3  ) 0.0 1.0 6.0 !
!TRP 43, sequential NOES
assign (resid  43 and name HN   )(resid  44 and name HN   ) 0.0 0.0 3.5 !
assign (resid  43 and name HN   )(resid  44 and name HA   ) 0.0 0.0 5.0 !
assign (resid  43 and name HA   )(resid  44 and name HN   ) 0.0 0.0 3.5 !
assign (resid  43 and name HB*  )(resid  44 and name HN   ) 0.0 1.0 3.5 !
assign (resid  43 and name HD1  )(resid  44 and name HN   ) 0.0 0.0 3.5 !
assign (resid  43 and name HD1  )(resid  44 and name HA   ) 0.0 0.0 3.5 !
assign (resid  43 and name HD1  )(resid  44 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  43 and name HE1  )(resid  44 and name HN   ) 0.0 0.0 5.0 !
assign (resid  43 and name HE1  )(resid  44 and name HA   ) 0.0 0.0 5.0 !
assign (resid  43 and name HE3  )(resid  44 and name HN   ) 0.0 0.0 5.0 !
!TRP 43, short-range NOES
assign (resid  43 and name HN   )(resid  45 and name HN   ) 0.0 0.0 5.0 !
assign (resid  43 and name HA   )(resid  45 and name HN   ) 0.0 0.0 5.0 !
assign (resid  43 and name HB*  )(resid  45 and name HN   ) 0.0 1.0 6.0 !
assign (resid  43 and name HA   )(resid  46 and name HN   ) 0.0 0.0 5.0 !
assign (resid  43 and name HA   )(resid  46 and name HG2* ) 0.0 1.0 6.0 !
assign (resid  43 and name HB*  )(resid  46 and name HN   ) 0.0 1.0 7.0 !
assign (resid  43 and name HD1  )(resid  46 and name HG2* ) 0.0 1.0 7.0 !
assign (resid  43 and name HE3  )(resid  46 and name HN   ) 0.0 0.0 5.0 !
assign (resid  43 and name HE3  )(resid  46 and name HB   ) 0.0 0.0 5.0 !
assign (resid  43 and name HE3  )(resid  46 and name HG2* ) 0.0 1.0 6.0 !
assign (resid  43 and name HH2  )(resid  46 and name HG2* ) 0.0 1.0 6.0 !
assign (resid  43 and name HZ3  )(resid  46 and name HG2* ) 0.0 1.0 6.0 !
!TRP 43, long-range NOES
assign (resid  43 and name HD1  )(resid  51 and name HE*  ) 0.0 1.0 4.5 !
assign (resid  43 and name HE1  )(resid  51 and name HG*  ) 0.0 1.0 7.0 !
assign (resid  43 and name HE1  )(resid  51 and name HD*  ) 0.0 1.0 7.0 !
assign (resid  43 and name HE1  )(resid  51 and name HE*  ) 0.0 1.0 6.0 !
assign (resid  43 and name HE3  )(resid  51 and name HG*  ) 0.0 1.0 7.0 !
assign (resid  43 and name HE3  )(resid  51 and name HE*  ) 0.0 1.0 7.0 !
assign (resid  43 and name HH2  )(resid  51 and name HN   ) 0.0 0.0 6.0 !
assign (resid  43 and name HH2  )(resid  51 and name HG*  ) 0.0 1.0 6.0 !
assign (resid  43 and name HH2  )(resid  51 and name HD1  ) 0.0 0.0 6.0 !
assign (resid  43 and name HH2  )(resid  51 and name HD2  ) 0.0 0.0 6.0 !
assign (resid  43 and name HZ2  )(resid  51 and name HG*  ) 0.0 1.0 4.5 !
assign (resid  43 and name HZ2  )(resid  51 and name HD1  ) 0.0 0.0 5.0 !
assign (resid  43 and name HZ2  )(resid  51 and name HD2  ) 0.0 0.0 5.0 !
assign (resid  43 and name HZ2  )(resid  51 and name HE*  ) 0.0 1.0 4.5 !
assign (resid  43 and name HZ3  )(resid  51 and name HA   ) 0.0 0.0 3.5 !
assign (resid  43 and name HZ3  )(resid  51 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  43 and name HZ3  )(resid  51 and name HG*  ) 0.0 1.0 6.0 !
assign (resid  43 and name HZ3  )(resid  51 and name HD1  ) 0.0 0.0 6.0 !
assign (resid  43 and name HZ3  )(resid  51 and name HD2  ) 0.0 0.0 6.0 !
assign (resid  43 and name HE3  )(resid  54 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  43 and name HH2  )(resid  54 and name HN   ) 0.0 0.0 5.0 !
assign (resid  43 and name HH2  )(resid  54 and name HB1  ) 0.0 0.0 3.5 !
assign (resid  43 and name HH2  )(resid  54 and name HB2  ) 0.0 0.0 3.5 !
assign (resid  43 and name HZ3  )(resid  54 and name HN   ) 0.0 0.0 6.0 !
assign (resid  43 and name HZ3  )(resid  54 and name HA   ) 0.0 0.0 6.0 !
assign (resid  43 and name HZ3  )(resid  54 and name HB1  ) 0.0 0.0 5.0 !
assign (resid  43 and name HZ3  )(resid  54 and name HB2  ) 0.0 0.0 5.0 !
assign (resid  43 and name HZ3  )(resid  54 and name HE*  ) 0.0 2.0 5.5 !
assign (resid  43 and name HH2  )(resid  55 and name HN   ) 0.0 0.0 5.0 !
assign (resid  43 and name HZ3  )(resid  55 and name HN   ) 0.0 0.0 6.0 !

!ASN 44, intra-residue NOES
assign (resid  44 and name HN   )(resid  44 and name HA   ) 0.0 0.0 2.5 !
!ASN 44, sequential NOES
assign (resid  44 and name HN   )(resid  45 and name HN   ) 0.0 0.0 3.5 !
assign (resid  44 and name HN   )(resid  45 and name HA   ) 0.0 0.0 5.0 !
assign (resid  44 and name HN   )(resid  45 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  44 and name HN   )(resid  45 and name HD21 ) 0.0 0.0 6.0 !
assign (resid  44 and name HN   )(resid  45 and name HD22 ) 0.0 0.0 6.0 !
assign (resid  44 and name HA   )(resid  45 and name HN   ) 0.0 0.0 3.5 !
assign (resid  44 and name HB*  )(resid  45 and name HN   ) 0.0 1.0 4.5 !
assign (resid  44 and name HB*  )(resid  45 and name HD21 ) 0.0 1.0 6.0 !
assign (resid  44 and name HB*  )(resid  45 and name HD22 ) 0.0 1.0 6.0 !
assign (resid  44 and name HD2* )(resid  45 and name HN   ) 0.0 1.0 6.0 !
!ASN 44, short-range NOES
assign (resid  44 and name HN   )(resid  46 and name HN   ) 0.0 0.0 5.0 !
assign (resid  44 and name HN   )(resid  46 and name HG2* ) 0.0 1.0 7.0 !
assign (resid  44 and name HA   )(resid  46 and name HN   ) 0.0 0.0 5.0 !
assign (resid  44 and name HB*  )(resid  46 and name HN   ) 0.0 1.0 6.0 !
!ASN 44, long-range NOES

!ASN 45, intra-residue NOES
assign (resid  45 and name HN   )(resid  45 and name HA   ) 0.0 0.0 3.5 !
!ASN 45, sequential NOES
assign (resid  45 and name HN   )(resid  46 and name HN   ) 0.0 0.0 3.5 !
assign (resid  45 and name HN   )(resid  46 and name HB   ) 0.0 0.0 5.0 !
assign (resid  45 and name HN   )(resid  46 and name HG2* ) 0.0 1.0 6.0 !
assign (resid  45 and name HA   )(resid  46 and name HN   ) 0.0 0.0 3.5 !
assign (resid  45 and name HB1  )(resid  46 and name HN   ) 0.0 0.0 5.0 !
assign (resid  45 and name HB2  )(resid  46 and name HN   ) 0.0 0.0 5.0 !
assign (resid  45 and name HD2* )(resid  46 and name HN   ) 0.0 1.0 7.0 !
!ASN 45, short-range NOES
!ASN 45, long-range NOES

!THR 46, intra-residue NOES
assign (resid  46 and name HN   )(resid  46 and name HA   ) 0.0 0.0 3.5 !
!THR 46, sequential NOES
assign (resid  46 and name HN   )(resid  47 and name HN   ) 0.0 0.0 3.5 !
assign (resid  46 and name HA   )(resid  47 and name HN   ) 0.0 0.0 3.5 !
assign (resid  46 and name HB   )(resid  47 and name HN   ) 0.0 0.0 5.0 !
assign (resid  46 and name HG2* )(resid  47 and name HN   ) 0.0 1.0 3.5 !
!THR 46, short-range NOES
assign (resid  46 and name HN   )(resid  48 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  46 and name HG2* )(resid  48 and name HN   ) 0.0 1.0 6.0 !
assign (resid  46 and name HG2* )(resid  49 and name HN   ) 0.0 1.0 6.0 !
assign (resid  46 and name HG2* )(resid  50 and name HN   ) 0.0 1.0 4.5 !
assign (resid  46 and name HG2* )(resid  50 and name HA   ) 0.0 1.0 6.0 !
assign (resid  46 and name HG2* )(resid  50 and name HB1  ) 0.0 1.0 4.5 !
assign (resid  46 and name HG2* )(resid  50 and name HB2  ) 0.0 1.0 4.5 !
!THR 46, long-range NOES
assign (resid  46 and name HN   )(resid  51 and name HG1  ) 0.0 0.0 5.0 !
assign (resid  46 and name HN   )(resid  51 and name HG2  ) 0.0 0.0 5.0 !
assign (resid  46 and name HN   )(resid  51 and name HD1  ) 0.0 0.0 6.0 !
assign (resid  46 and name HN   )(resid  51 and name HD2  ) 0.0 0.0 6.0 !
assign (resid  46 and name HB   )(resid  51 and name HG*  ) 0.0 1.0 6.0 !
assign (resid  46 and name HB   )(resid  51 and name HE*  ) 0.0 1.0 6.0 !
assign (resid  46 and name HG2* )(resid  51 and name HN   ) 0.0 1.0 4.5 !
assign (resid  46 and name HG2* )(resid  51 and name HA   ) 0.0 1.0 4.5 !
assign (resid  46 and name HG2* )(resid  51 and name HG*  ) 0.0 1.0 4.5 !
assign (resid  46 and name HG2* )(resid  52 and name HN   ) 0.0 1.0 6.0 !
assign (resid  46 and name HG2* )(resid  54 and name HD*  ) 0.0 3.0 8.0 !
assign (resid  46 and name HG2* )(resid  54 and name HE*  ) 0.0 3.0 8.0 !
assign (resid  46 and name HG2* )(resid  55 and name HN   ) 0.0 1.0 7.0 !

!ALA 47, intra-residue NOES
assign (resid  47 and name HN   )(resid  47 and name HA   ) 0.0 0.0 2.5 !
!ALA 47, sequential NOES
assign (resid  47 and name HN   )(resid  48 and name HN   ) 0.0 0.0 3.5 !
assign (resid  47 and name HN   )(resid  48 and name HA   ) 0.0 0.0 5.0 !
assign (resid  47 and name HN   )(resid  48 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  47 and name HA   )(resid  48 and name HN   ) 0.0 0.0 3.5 !
assign (resid  47 and name HB*  )(resid  48 and name HN   ) 0.0 1.0 3.5 !
assign (resid  47 and name HB*  )(resid  48 and name HA   ) 0.0 1.0 6.0 !
!ALA 47, short-range NOES
assign (resid  47 and name HN   )(resid  49 and name HN   ) 0.0 0.0 6.0 !
assign (resid  47 and name HA   )(resid  49 and name HN   ) 0.0 0.0 3.5 !
assign (resid  47 and name HB*  )(resid  49 and name HN   ) 0.0 1.0 3.5 !
assign (resid  47 and name HN   )(resid  50 and name HN   ) 0.0 0.0 5.0 !
assign (resid  47 and name HN   )(resid  50 and name HB1  ) 0.0 0.0 5.0 !
assign (resid  47 and name HN   )(resid  50 and name HB2  ) 0.0 0.0 5.0 !
assign (resid  47 and name HA   )(resid  50 and name HN   ) 0.0 0.0 5.0 !
assign (resid  47 and name HB*  )(resid  50 and name HN   ) 0.0 1.0 3.5 !
assign (resid  47 and name HB*  )(resid  50 and name HB1  ) 0.0 1.0 4.5 !
assign (resid  47 and name HB*  )(resid  50 and name HB2  ) 0.0 1.0 4.5 !
assign (resid  47 and name HN   )(resid  51 and name HN   ) 0.0 0.0 6.0 !
assign (resid  47 and name HN   )(resid  51 and name HG*  ) 0.0 1.0 7.0 !
assign (resid  47 and name HB*  )(resid  51 and name HN   ) 0.0 1.0 4.5 !
!ALA 47, long-range NOES

!ALA 48, intra-residue NOES
assign (resid  48 and name HN   )(resid  48 and name HA   ) 0.0 0.0 2.5 !
!ALA 48, sequential NOES
assign (resid  48 and name HN   )(resid  49 and name HN   ) 0.0 0.0 3.5 !
assign (resid  48 and name HN   )(resid  49 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  48 and name HA   )(resid  49 and name HN   ) 0.0 0.0 3.5 !
assign (resid  48 and name HB*  )(resid  49 and name HN   ) 0.0 1.0 3.5 !
assign (resid  48 and name HB*  )(resid  49 and name HA   ) 0.0 1.0 6.0 !
!ALA 48, short-range NOES
assign (resid  48 and name HN   )(resid  50 and name HN   ) 0.0 0.0 5.0 !
assign (resid  48 and name HA   )(resid  50 and name HN   ) 0.0 0.0 5.0 !
assign (resid  48 and name HB*  )(resid  50 and name HN   ) 0.0 1.0 6.0 !
assign (resid  48 and name HN   )(resid  51 and name HN   ) 0.0 0.0 6.0 !
assign (resid  48 and name HN   )(resid  51 and name HG*  ) 0.0 1.0 6.0 !
assign (resid  48 and name HN   )(resid  51 and name HD*  ) 0.0 1.0 7.0 !
assign (resid  48 and name HA   )(resid  51 and name HN   ) 0.0 0.0 3.5 !
assign (resid  48 and name HA   )(resid  51 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  48 and name HA   )(resid  51 and name HD*  ) 0.0 1.0 6.0 !
assign (resid  48 and name HB*  )(resid  51 and name HN   ) 0.0 1.0 6.0 !
assign (resid  48 and name HB*  )(resid  52 and name HN   ) 0.0 1.0 6.0 !
assign (resid  48 and name HB*  )(resid  52 and name HE21 ) 0.0 1.0 6.0 !
assign (resid  48 and name HB*  )(resid  52 and name HE22 ) 0.0 1.0 6.0 !
!ALA 48, long-range NOES

!ASP 49, intra-residue NOES
assign (resid  49 and name HN   )(resid  49 and name HA   ) 0.0 0.0 2.5 !
!ASP 49, sequential NOES
assign (resid  49 and name HN   )(resid  50 and name HN   ) 0.0 0.0 3.5 !
assign (resid  49 and name HN   )(resid  50 and name HA   ) 0.0 0.0 6.0 !
assign (resid  49 and name HN   )(resid  50 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  49 and name HA   )(resid  50 and name HN   ) 0.0 0.0 3.5 !
assign (resid  49 and name HB*  )(resid  50 and name HN   ) 0.0 1.0 4.5 !
!ASP 49, short-range NOES
assign (resid  49 and name HN   )(resid  51 and name HN   ) 0.0 0.0 5.0 !
assign (resid  49 and name HN   )(resid  52 and name HN   ) 0.0 0.0 5.0 !
assign (resid  49 and name HN   )(resid  52 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  49 and name HA   )(resid  52 and name HE21 ) 0.0 0.0 5.0 !
assign (resid  49 and name HA   )(resid  52 and name HE22 ) 0.0 0.0 5.0 !
!ASP 49, long-range NOES

!ASP 50, intra-residue NOES
assign (resid  50 and name HN   )(resid  50 and name HA   ) 0.0 0.0 3.5 !
!ASP 50, sequential NOES
assign (resid  50 and name HN   )(resid  51 and name HN   ) 0.0 0.0 2.5 !
assign (resid  50 and name HN   )(resid  51 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  50 and name HN   )(resid  51 and name HG*  ) 0.0 1.0 6.0 !
assign (resid  50 and name HN   )(resid  51 and name HD*  ) 0.0 1.0 6.0 !
assign (resid  50 and name HN   )(resid  51 and name HE*  ) 0.0 1.0 6.0 !
assign (resid  50 and name HA   )(resid  51 and name HN   ) 0.0 0.0 3.5 !
assign (resid  50 and name HB*  )(resid  51 and name HN   ) 0.0 1.0 4.5 !
!ASP 50, short-range NOES
assign (resid  50 and name HN   )(resid  52 and name HN   ) 0.0 0.0 3.5 !
assign (resid  50 and name HN   )(resid  52 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  50 and name HB*  )(resid  52 and name HN   ) 0.0 1.0 6.0 !
assign (resid  50 and name HN   )(resid  53 and name HD*  ) 0.0 1.0 6.0 !
!ASP 50, long-range NOES

!LYS 51, intra-residue NOES
assign (resid  51 and name HN   )(resid  51 and name HA   ) 0.0 0.0 3.5 !
!LYS 51, sequential NOES
assign (resid  51 and name HN   )(resid  52 and name HN   ) 0.0 0.0 3.5 !
assign (resid  51 and name HN   )(resid  52 and name HB1  ) 0.0 0.0 5.0 !
assign (resid  51 and name HN   )(resid  52 and name HB2  ) 0.0 0.0 5.0 !
assign (resid  51 and name HA   )(resid  52 and name HN   ) 0.0 0.0 3.5 !
assign (resid  51 and name HB*  )(resid  52 and name HN   ) 0.0 1.0 4.5 !
assign (resid  51 and name HB*  )(resid  52 and name HE21 ) 0.0 1.0 4.5 !
assign (resid  51 and name HB*  )(resid  52 and name HE22 ) 0.0 1.0 4.5 !
assign (resid  51 and name HG*  )(resid  52 and name HN   ) 0.0 1.0 6.0 !
assign (resid  51 and name HD*  )(resid  52 and name HN   ) 0.0 1.0 6.0 !
!LYS 51, short-range NOES
assign (resid  51 and name HN   )(resid  53 and name HD*  ) 0.0 1.0 6.0 !
assign (resid  51 and name HN   )(resid  54 and name HN   ) 0.0 0.0 5.0 !
assign (resid  51 and name HA   )(resid  54 and name HN   ) 0.0 0.0 5.0 !
assign (resid  51 and name HA   )(resid  54 and name HD*  ) 0.0 2.0 4.5 !
assign (resid  51 and name HA   )(resid  54 and name HE*  ) 0.0 2.0 5.5 !
!LYS 51, long-range NOES

!GLN 52, intra-residue NOES
assign (resid  52 and name HN   )(resid  52 and name HA   ) 0.0 0.0 2.5 !
!GLN 52, sequential NOES
assign (resid  52 and name HN   )(resid  53 and name HG*  ) 0.0 1.0 6.0 !
assign (resid  52 and name HN   )(resid  53 and name HD*  ) 0.0 1.0 4.5 !
assign (resid  52 and name HA   )(resid  53 and name HD1  ) 0.0 0.0 5.0 !
assign (resid  52 and name HA   )(resid  53 and name HD2  ) 0.0 0.0 5.0 !
assign (resid  52 and name HB*  )(resid  53 and name HD1  ) 0.0 1.0 4.5 !
assign (resid  52 and name HB*  )(resid  53 and name HD2  ) 0.0 1.0 4.5 !
assign (resid  52 and name HE2* )(resid  53 and name HD*  ) 0.0 2.0 8.0 !
!GLN 52, short-range NOES
assign (resid  52 and name HN   )(resid  54 and name HN   ) 0.0 0.0 5.0 !
assign (resid  52 and name HA   )(resid  54 and name HN   ) 0.0 0.0 5.0 !
assign (resid  52 and name HN   )(resid  55 and name HN   ) 0.0 0.0 5.0 !
assign (resid  52 and name HA   )(resid  55 and name HN   ) 0.0 0.0 3.5 !
assign (resid  52 and name HA   )(resid  56 and name HN   ) 0.0 0.0 5.0 !
assign (resid  52 and name HE2* )(resid  56 and name HA   ) 0.0 1.0 7.0 !
!GLN 52, long-range NOES

!PRO 53, intra-residue NOES
!PRO 53, sequential NOES
assign (resid  53 and name HB*  )(resid  54 and name HD*  ) 0.0 3.0 8.0 !
assign (resid  53 and name HB*  )(resid  54 and name HE*  ) 0.0 3.0 8.0 !
assign (resid  53 and name HB1  )(resid  54 and name HN   ) 0.0 0.0 3.5 !
assign (resid  53 and name HB2  )(resid  54 and name HN   ) 0.0 0.0 3.5 !
assign (resid  53 and name HG1  )(resid  54 and name HN   ) 0.0 0.0 3.5 !
assign (resid  53 and name HG2  )(resid  54 and name HN   ) 0.0 0.0 3.5 !
assign (resid  53 and name HD*  )(resid  54 and name HN   ) 0.0 1.0 4.5 !
!PRO 53, short-range NOES
assign (resid  53 and name HB*  )(resid  55 and name HN   ) 0.0 1.0 6.0 !
assign (resid  53 and name HD*  )(resid  55 and name HN   ) 0.0 1.0 7.0 !
!PRO 53, long-range NOES

!TYR 54, intra-residue NOES
assign (resid  54 and name HN   )(resid  54 and name HA   ) 0.0 0.0 3.5 !
assign (resid  54 and name HA   )(resid  54 and name HD*  ) 0.0 2.0 4.5 !
assign (resid  54 and name HA   )(resid  54 and name HE*  ) 0.0 2.0 5.5 !
assign (resid  54 and name HB1  )(resid  54 and name HD*  ) 0.0 2.0 4.5 !
assign (resid  54 and name HB1  )(resid  54 and name HE*  ) 0.0 2.0 7.0 !
assign (resid  54 and name HB2  )(resid  54 and name HD*  ) 0.0 2.0 4.5 !
assign (resid  54 and name HB2  )(resid  54 and name HE*  ) 0.0 2.0 7.0 !
!TYR 54, sequential NOES
assign (resid  54 and name HN   )(resid  55 and name HN   ) 0.0 0.0 3.5 !
assign (resid  54 and name HN   )(resid  55 and name HA   ) 0.0 0.0 5.0 !
assign (resid  54 and name HN   )(resid  55 and name HB1  ) 0.0 0.0 5.0 !
assign (resid  54 and name HN   )(resid  55 and name HB2  ) 0.0 0.0 5.0 !
assign (resid  54 and name HN   )(resid  55 and name HG*  ) 0.0 1.0 6.0 !
assign (resid  54 and name HB1  )(resid  55 and name HN   ) 0.0 0.0 3.5 !
assign (resid  54 and name HB2  )(resid  55 and name HN   ) 0.0 0.0 3.5 !
assign (resid  54 and name HD*  )(resid  55 and name HN   ) 0.0 2.0 5.5 !
!TYR 54, short-range NOES
assign (resid  54 and name HN   )(resid  56 and name HN   ) 0.0 0.0 5.0 !
assign (resid  54 and name HA   )(resid  56 and name HN   ) 0.0 0.0 5.0 !
assign (resid  54 and name HD*  )(resid  56 and name HN   ) 0.0 2.0 8.0 !
assign (resid  54 and name HN   )(resid  57 and name HN   ) 0.0 0.0 5.0 !
assign (resid  54 and name HA   )(resid  57 and name HN   ) 0.0 0.0 3.5 !
assign (resid  54 and name HD*  )(resid  57 and name HN   ) 0.0 2.0 8.0 !
assign (resid  54 and name HA   )(resid  58 and name HN   ) 0.0 0.0 5.0 !
assign (resid  54 and name HB1  )(resid  58 and name HN   ) 0.0 0.0 6.0 !
assign (resid  54 and name HB2  )(resid  58 and name HN   ) 0.0 0.0 6.0 !
assign (resid  54 and name HD*  )(resid  58 and name HN   ) 0.0 2.0 7.0 !
!TYR 54, long-range NOES

!GLU 55, intra-residue NOES
assign (resid  55 and name HN   )(resid  55 and name HA   ) 0.0 0.0 3.5 !
!GLU 55, sequential NOES
assign (resid  55 and name HN   )(resid  56 and name HN   ) 0.0 0.0 3.5 !
assign (resid  55 and name HA   )(resid  56 and name HN   ) 0.0 0.0 3.5 !
assign (resid  55 and name HB1  )(resid  56 and name HN   ) 0.0 0.0 3.5 !
assign (resid  55 and name HB2  )(resid  56 and name HN   ) 0.0 0.0 3.5 !
assign (resid  55 and name HG*  )(resid  56 and name HN   ) 0.0 1.0 6.0 !
!GLU 55, short-range NOES
assign (resid  55 and name HN   )(resid  57 and name HN   ) 0.0 0.0 5.0 !
assign (resid  55 and name HA   )(resid  57 and name HN   ) 0.0 0.0 3.5 !
assign (resid  55 and name HN   )(resid  58 and name HN   ) 0.0 0.0 6.0 !
assign (resid  55 and name HA   )(resid  58 and name HN   ) 0.0 0.0 3.5 !
assign (resid  55 and name HA   )(resid  59 and name HN   ) 0.0 0.0 5.0 !
!GLU 55, long-range NOES

!LYS 56, intra-residue NOES
assign (resid  56 and name HN   )(resid  56 and name HA   ) 0.0 0.0 3.5 !
!LYS 56, sequential NOES
assign (resid  56 and name HN   )(resid  57 and name HN   ) 0.0 0.0 3.5 !
assign (resid  56 and name HA   )(resid  57 and name HN   ) 0.0 0.0 3.5 !
!LYS 56, short-range NOES
assign (resid  56 and name HN   )(resid  58 and name HN   ) 0.0 0.0 5.0 !
assign (resid  56 and name HA   )(resid  58 and name HN   ) 0.0 0.0 5.0 !
assign (resid  56 and name HN   )(resid  59 and name HN   ) 0.0 0.0 5.0 !
assign (resid  56 and name HA   )(resid  59 and name HN   ) 0.0 0.0 3.5 !
assign (resid  56 and name HA   )(resid  60 and name HN   ) 0.0 0.0 5.0 !
!LYS 56, long-range NOES

!LYS 57, intra-residue NOES
assign (resid  57 and name HN   )(resid  57 and name HA   ) 0.0 0.0 3.5 !
!LYS 57, sequential NOES
assign (resid  57 and name HN   )(resid  58 and name HN   ) 0.0 0.0 3.5 !
assign (resid  57 and name HN   )(resid  58 and name HA   ) 0.0 0.0 5.0 !
assign (resid  57 and name HA   )(resid  58 and name HN   ) 0.0 0.0 3.5 !
assign (resid  57 and name HB*  )(resid  58 and name HN   ) 0.0 1.0 3.5 !
assign (resid  57 and name HG*  )(resid  58 and name HN   ) 0.0 1.0 4.5 !
!LYS 57, short-range NOES
assign (resid  57 and name HN   )(resid  59 and name HN   ) 0.0 0.0 5.0 !
assign (resid  57 and name HA   )(resid  59 and name HN   ) 0.0 0.0 5.0 !
assign (resid  57 and name HN   )(resid  60 and name HN   ) 0.0 0.0 5.0 !
assign (resid  57 and name HA   )(resid  60 and name HN   ) 0.0 0.0 3.5 !
assign (resid  57 and name HN   )(resid  61 and name HD*  ) 0.0 2.4 7.4 !
assign (resid  57 and name HA   )(resid  61 and name HN   ) 0.0 0.0 5.0 !
!LYS 57, long-range NOES

!ALA 58, intra-residue NOES
assign (resid  58 and name HN   )(resid  58 and name HA   ) 0.0 0.0 2.5 !
!ALA 58, sequential NOES
assign (resid  58 and name HN   )(resid  59 and name HN   ) 0.0 0.0 3.5 !
assign (resid  58 and name HA   )(resid  59 and name HN   ) 0.0 0.0 3.5 !
!ALA 58, short-range NOES
assign (resid  58 and name HN   )(resid  60 and name HN   ) 0.0 0.0 5.0 !
assign (resid  58 and name HA   )(resid  60 and name HN   ) 0.0 0.0 5.0 !
assign (resid  58 and name HN   )(resid  61 and name HD*  ) 0.0 2.4 7.4 !
assign (resid  58 and name HA   )(resid  61 and name HN   ) 0.0 0.0 3.5 !
assign (resid  58 and name HA   )(resid  62 and name HN   ) 0.0 0.0 5.0 !
!ALA 58, long-range NOES

!ALA 59, intra-residue NOES
assign (resid  59 and name HN   )(resid  59 and name HA   ) 0.0 0.0 3.5 !
!ALA 59, sequential NOES
assign (resid  59 and name HN   )(resid  60 and name HN   ) 0.0 0.0 3.5 !
assign (resid  59 and name HN   )(resid  60 and name HB1  ) 0.0 0.0 5.0 !
assign (resid  59 and name HN   )(resid  60 and name HB2  ) 0.0 0.0 5.0 !
assign (resid  59 and name HA   )(resid  60 and name HN   ) 0.0 0.0 3.5 !
!ALA 59, short-range NOES
assign (resid  59 and name HN   )(resid  61 and name HG   ) 0.0 0.0 5.0 !
assign (resid  59 and name HA   )(resid  61 and name HN   ) 0.0 0.0 5.0 !
assign (resid  59 and name HA   )(resid  62 and name HN   ) 0.0 0.0 3.5 !
assign (resid  59 and name HA   )(resid  63 and name HN   ) 0.0 0.0 5.0 !
!ALA 59, long-range NOES

!LYS 60, intra-residue NOES
assign (resid  60 and name HN   )(resid  60 and name HA   ) 0.0 0.0 3.5 !
!LYS 60, sequential NOES
assign (resid  60 and name HN   )(resid  61 and name HN   ) 0.0 0.0 3.5 !
assign (resid  60 and name HN   )(resid  61 and name HD*  ) 0.0 2.4 5.9 !
assign (resid  60 and name HA   )(resid  61 and name HN   ) 0.0 0.0 3.5 !
assign (resid  60 and name HB*  )(resid  61 and name HN   ) 0.0 1.0 4.5 !
!LYS 60, short-range NOES
assign (resid  60 and name HN   )(resid  62 and name HN   ) 0.0 0.0 5.0 !
assign (resid  60 and name HA   )(resid  62 and name HN   ) 0.0 0.0 5.0 !
assign (resid  60 and name HN   )(resid  63 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  60 and name HA   )(resid  63 and name HN   ) 0.0 0.0 5.0 !
assign (resid  60 and name HA   )(resid  63 and name HG*  ) 0.0 1.0 6.0 !
assign (resid  60 and name HN   )(resid  64 and name HN   ) 0.0 0.0 6.0 !
assign (resid  60 and name HA   )(resid  64 and name HN   ) 0.0 0.0 5.0 !
!LYS 60, long-range NOES

!LEU 61, intra-residue NOES
assign (resid  61 and name HN   )(resid  61 and name HA   ) 0.0 0.0 3.5 !
!LEU 61, sequential NOES
assign (resid  61 and name HN   )(resid  62 and name HN   ) 0.0 0.0 3.5 !
assign (resid  61 and name HA   )(resid  62 and name HN   ) 0.0 0.0 3.5 !
assign (resid  61 and name HD*  )(resid  62 and name HN   ) 0.0 2.4 5.9 !
!LEU 61, short-range NOES
assign (resid  61 and name HN   )(resid  63 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  61 and name HA   )(resid  63 and name HN   ) 0.0 0.0 5.0 !
assign (resid  61 and name HD*  )(resid  63 and name HN   ) 0.0 2.4 7.4 !
assign (resid  61 and name HN   )(resid  64 and name HN   ) 0.0 0.0 5.0 !
assign (resid  61 and name HA   )(resid  64 and name HN   ) 0.0 0.0 3.5 !
assign (resid  61 and name HD*  )(resid  64 and name HN   ) 0.0 2.4 5.9 !
assign (resid  61 and name HA   )(resid  65 and name HN   ) 0.0 0.0 5.0 !
assign (resid  61 and name HD*  )(resid  65 and name HN   ) 0.0 2.4 8.4 !
!LEU 61, long-range NOES

!LYS 62, intra-residue NOES
assign (resid  62 and name HN   )(resid  62 and name HA   ) 0.0 0.0 3.5 !
!LYS 62, sequential NOES
assign (resid  62 and name HN   )(resid  63 and name HN   ) 0.0 0.0 3.5 !
assign (resid  62 and name HN   )(resid  63 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  62 and name HA   )(resid  63 and name HN   ) 0.0 0.0 3.5 !
!LYS 62, short-range NOES
assign (resid  62 and name HN   )(resid  64 and name HN   ) 0.0 0.0 5.0 !
assign (resid  62 and name HA   )(resid  64 and name HN   ) 0.0 0.0 5.0 !
assign (resid  62 and name HN   )(resid  65 and name HN   ) 0.0 0.0 5.0 !
assign (resid  62 and name HN   )(resid  65 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  62 and name HA   )(resid  65 and name HN   ) 0.0 0.0 3.5 !
assign (resid  62 and name HA   )(resid  65 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  62 and name HA   )(resid  66 and name HN   ) 0.0 0.0 5.0 !
!LYS 62, long-range NOES

!GLU 63, intra-residue NOES
assign (resid  63 and name HN   )(resid  63 and name HA   ) 0.0 0.0 2.5 !
!GLU 63, sequential NOES
assign (resid  63 and name HN   )(resid  64 and name HN   ) 0.0 0.0 2.5 !
assign (resid  63 and name HA   )(resid  64 and name HN   ) 0.0 0.0 3.5 !
assign (resid  63 and name HB*  )(resid  64 and name HN   ) 0.0 1.0 3.5 !
assign (resid  63 and name HG*  )(resid  64 and name HN   ) 0.0 1.0 6.0 !
!GLU 63, short-range NOES
assign (resid  63 and name HA   )(resid  65 and name HN   ) 0.0 0.0 5.0 !
assign (resid  63 and name HB*  )(resid  65 and name HN   ) 0.0 1.0 6.0 !
assign (resid  63 and name HA   )(resid  66 and name HN   ) 0.0 0.0 3.5 !
assign (resid  63 and name HA   )(resid  67 and name HN   ) 0.0 0.0 5.0 !
!GLU 63, long-range NOES

!LYS 64, intra-residue NOES
assign (resid  64 and name HN   )(resid  64 and name HA   ) 0.0 0.0 3.5 !
!LYS 64, sequential NOES
assign (resid  64 and name HN   )(resid  65 and name HN   ) 0.0 0.0 3.5 !
assign (resid  64 and name HN   )(resid  65 and name HB1  ) 0.0 0.0 5.0 !
assign (resid  64 and name HN   )(resid  65 and name HB2  ) 0.0 0.0 5.0 !
assign (resid  64 and name HN   )(resid  65 and name HD*  ) 0.0 2.0 7.0 !
assign (resid  64 and name HA   )(resid  65 and name HN   ) 0.0 0.0 3.5 !
assign (resid  64 and name HB*  )(resid  65 and name HN   ) 0.0 1.0 3.5 !
assign (resid  64 and name HG*  )(resid  65 and name HN   ) 0.0 1.0 4.5 !
assign (resid  64 and name HD*  )(resid  65 and name HN   ) 0.0 1.0 6.0 !
!LYS 64, short-range NOES
assign (resid  64 and name HN   )(resid  66 and name HN   ) 0.0 0.0 5.0 !
assign (resid  64 and name HA   )(resid  66 and name HN   ) 0.0 0.0 5.0 !
assign (resid  64 and name HA   )(resid  67 and name HN   ) 0.0 0.0 3.5 !
assign (resid  64 and name HA   )(resid  68 and name HN   ) 0.0 0.0 5.0 !
!LYS 64, long-range NOES

!TYR 65, intra-residue NOES
assign (resid  65 and name HN   )(resid  65 and name HA   ) 0.0 0.0 2.5 !
assign (resid  65 and name HA   )(resid  65 and name HD*  ) 0.0 2.0 4.5 !
assign (resid  65 and name HA   )(resid  65 and name HE*  ) 0.0 2.0 5.5 !
assign (resid  65 and name HB*  )(resid  65 and name HD*  ) 0.0 3.0 5.5 !
assign (resid  65 and name HB*  )(resid  65 and name HE*  ) 0.0 3.0 6.5 !
!TYR 65, sequential NOES
assign (resid  65 and name HN   )(resid  66 and name HN   ) 0.0 0.0 3.5 !
assign (resid  65 and name HN   )(resid  66 and name HA   ) 0.0 0.0 5.0 !
assign (resid  65 and name HN   )(resid  66 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  65 and name HN   )(resid  66 and name HG1  ) 0.0 0.0 5.0 !
assign (resid  65 and name HN   )(resid  66 and name HG2  ) 0.0 0.0 5.0 !
assign (resid  65 and name HA   )(resid  66 and name HN   ) 0.0 0.0 3.5 !
assign (resid  65 and name HB*  )(resid  66 and name HN   ) 0.0 1.0 4.5 !
assign (resid  65 and name HD*  )(resid  66 and name HN   ) 0.0 2.0 5.5 !
assign (resid  65 and name HD*  )(resid  66 and name HA   ) 0.0 2.0 5.5 !
assign (resid  65 and name HD*  )(resid  66 and name HB1  ) 0.0 2.0 7.0 !
assign (resid  65 and name HD*  )(resid  66 and name HB2  ) 0.0 2.0 7.0 !
assign (resid  65 and name HD*  )(resid  66 and name HG1  ) 0.0 2.0 5.5 !
assign (resid  65 and name HD*  )(resid  66 and name HG2  ) 0.0 2.0 5.5 !
assign (resid  65 and name HE*  )(resid  66 and name HN   ) 0.0 2.0 7.0 !
assign (resid  65 and name HE*  )(resid  66 and name HA   ) 0.0 2.0 7.0 !
assign (resid  65 and name HE*  )(resid  66 and name HG1  ) 0.0 2.0 7.0 !
assign (resid  65 and name HE*  )(resid  66 and name HG2  ) 0.0 2.0 7.0 !
!TYR 65, short-range NOES
assign (resid  65 and name HN   )(resid  67 and name HN   ) 0.0 0.0 5.0 !
assign (resid  65 and name HA   )(resid  67 and name HN   ) 0.0 0.0 3.5 !
assign (resid  65 and name HB*  )(resid  67 and name HN   ) 0.0 1.0 6.0 !
assign (resid  65 and name HD*  )(resid  67 and name HN   ) 0.0 2.0 7.0 !
assign (resid  65 and name HN   )(resid  68 and name HN   ) 0.0 0.0 6.0 !
assign (resid  65 and name HA   )(resid  68 and name HN   ) 0.0 0.0 3.5 !
assign (resid  65 and name HE*  )(resid  68 and name HB*  ) 0.0 3.0 8.0 !
assign (resid  65 and name HN   )(resid  69 and name HN   ) 0.0 0.0 6.0 !
assign (resid  65 and name HA   )(resid  69 and name HN   ) 0.0 0.0 5.0 !
assign (resid  65 and name HA   )(resid  69 and name HG2* ) 0.0 1.0 6.0 !
assign (resid  65 and name HD*  )(resid  69 and name HN   ) 0.0 2.0 7.0 !
assign (resid  65 and name HD*  )(resid  69 and name HB   ) 0.0 2.0 7.0 !
assign (resid  65 and name HD*  )(resid  69 and name HG1* ) 0.0 3.0 8.0 !
assign (resid  65 and name HE*  )(resid  69 and name HN   ) 0.0 2.0 7.0 !
assign (resid  65 and name HE*  )(resid  69 and name HA   ) 0.0 2.0 7.0 !
assign (resid  65 and name HE*  )(resid  69 and name HG1* ) 0.0 3.0 6.5 !
assign (resid  65 and name HE*  )(resid  69 and name HG2* ) 0.0 3.0 5.5 !
!TYR 65, long-range NOES

!GLU 66, intra-residue NOES
assign (resid  66 and name HN   )(resid  66 and name HA   ) 0.0 0.0 3.5 !
!GLU 66, sequential NOES
assign (resid  66 and name HN   )(resid  67 and name HN   ) 0.0 0.0 3.5 !
assign (resid  66 and name HN   )(resid  67 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  66 and name HN   )(resid  67 and name HD*  ) 0.0 1.0 4.5 !
assign (resid  66 and name HA   )(resid  67 and name HN   ) 0.0 0.0 3.5 !
assign (resid  66 and name HB*  )(resid  67 and name HN   ) 0.0 1.0 4.5 !
assign (resid  66 and name HG*  )(resid  67 and name HN   ) 0.0 1.0 6.0 !
!GLU 66, short-range NOES
assign (resid  66 and name HN   )(resid  68 and name HN   ) 0.0 0.0 5.0 !
assign (resid  66 and name HA   )(resid  68 and name HN   ) 0.0 0.0 5.0 !
assign (resid  66 and name HB*  )(resid  68 and name HN   ) 0.0 1.0 6.0 !
assign (resid  66 and name HN   )(resid  69 and name HN   ) 0.0 0.0 5.0 !
assign (resid  66 and name HN   )(resid  69 and name HG1* ) 0.0 1.0 7.0 !
assign (resid  66 and name HN   )(resid  69 and name HG2* ) 0.0 1.0 4.5 !
assign (resid  66 and name HA   )(resid  69 and name HN   ) 0.0 0.0 3.5 !
assign (resid  66 and name HA   )(resid  69 and name HG1* ) 0.0 1.0 4.5 !
assign (resid  66 and name HA   )(resid  69 and name HG2* ) 0.0 1.0 3.5 !
assign (resid  66 and name HA   )(resid  69 and name HD1* ) 0.0 1.0 6.0 !
assign (resid  66 and name HB1  )(resid  69 and name HN   ) 0.0 0.0 5.0 !
assign (resid  66 and name HB2  )(resid  69 and name HN   ) 0.0 0.0 5.0 !
assign (resid  66 and name HG*  )(resid  69 and name HG2* ) 0.0 2.0 7.0 !
assign (resid  66 and name HN   )(resid  70 and name HN   ) 0.0 0.0 6.0 !
assign (resid  66 and name HA   )(resid  70 and name HN   ) 0.0 0.0 5.0 !
!GLU 66, long-range NOES

!LYS 67, intra-residue NOES
assign (resid  67 and name HN   )(resid  67 and name HA   ) 0.0 0.0 2.5 !
!LYS 67, sequential NOES
assign (resid  67 and name HN   )(resid  68 and name HN   ) 0.0 0.0 3.5 !
assign (resid  67 and name HN   )(resid  68 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  67 and name HA   )(resid  68 and name HN   ) 0.0 0.0 3.5 !
assign (resid  67 and name HB*  )(resid  68 and name HN   ) 0.0 1.0 3.5 !
assign (resid  67 and name HG*  )(resid  68 and name HN   ) 0.0 1.0 4.5 !
!LYS 67, short-range NOES
assign (resid  67 and name HN   )(resid  69 and name HN   ) 0.0 0.0 5.0 !
assign (resid  67 and name HN   )(resid  69 and name HG2* ) 0.0 1.0 6.0 !
assign (resid  67 and name HA   )(resid  69 and name HN   ) 0.0 0.0 3.5 !
assign (resid  67 and name HB*  )(resid  69 and name HN   ) 0.0 1.0 6.0 !
assign (resid  67 and name HD*  )(resid  69 and name HN   ) 0.0 1.0 6.0 !
assign (resid  67 and name HN   )(resid  70 and name HN   ) 0.0 0.0 6.0 !
assign (resid  67 and name HA   )(resid  70 and name HN   ) 0.0 0.0 3.5 !
assign (resid  67 and name HB*  )(resid  70 and name HN   ) 0.0 1.0 6.0 !
assign (resid  67 and name HA   )(resid  71 and name HN   ) 0.0 0.0 5.0 !
!LYS 67, long-range NOES

!ASP 68, intra-residue NOES
assign (resid  68 and name HN   )(resid  68 and name HA   ) 0.0 0.0 2.5 !
!ASP 68, sequential NOES
assign (resid  68 and name HN   )(resid  69 and name HN   ) 0.0 0.0 3.5 !
assign (resid  68 and name HN   )(resid  69 and name HB   ) 0.0 0.0 5.0 !
assign (resid  68 and name HN   )(resid  69 and name HG1* ) 0.0 1.0 6.0 !
assign (resid  68 and name HN   )(resid  69 and name HG2* ) 0.0 1.0 4.5 !
assign (resid  68 and name HA   )(resid  69 and name HN   ) 0.0 0.0 3.5 !
assign (resid  68 and name HB1  )(resid  69 and name HN   ) 0.0 0.0 3.5 !
assign (resid  68 and name HB2  )(resid  69 and name HN   ) 0.0 0.0 3.5 !
!ASP 68, short-range NOES
assign (resid  68 and name HN   )(resid  70 and name HN   ) 0.0 0.0 5.0 !
assign (resid  68 and name HA   )(resid  70 and name HN   ) 0.0 0.0 5.0 !
assign (resid  68 and name HB1  )(resid  70 and name HN   ) 0.0 0.0 5.0 !
assign (resid  68 and name HB2  )(resid  70 and name HN   ) 0.0 0.0 5.0 !
assign (resid  68 and name HN   )(resid  71 and name HN   ) 0.0 0.0 5.0 !
assign (resid  68 and name HA   )(resid  71 and name HN   ) 0.0 0.0 3.5 !
assign (resid  68 and name HA   )(resid  71 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  68 and name HB1  )(resid  71 and name HN   ) 0.0 0.0 5.0 !
assign (resid  68 and name HB2  )(resid  71 and name HN   ) 0.0 0.0 5.0 !
assign (resid  68 and name HN   )(resid  72 and name HN   ) 0.0 0.0 5.0 !
assign (resid  68 and name HA   )(resid  72 and name HN   ) 0.0 0.0 3.5 !
!ASP 68, long-range NOES

!ILE 69, intra-residue NOES
assign (resid  69 and name HN   )(resid  69 and name HA   ) 0.0 0.0 3.5 !
!ILE 69, sequential NOES
assign (resid  69 and name HN   )(resid  70 and name HN   ) 0.0 0.0 2.5 !
assign (resid  69 and name HN   )(resid  70 and name HA   ) 0.0 0.0 5.0 !
assign (resid  69 and name HN   )(resid  70 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  69 and name HA   )(resid  70 and name HN   ) 0.0 0.0 3.5 !
assign (resid  69 and name HB   )(resid  70 and name HN   ) 0.0 0.0 3.5 !
assign (resid  69 and name HG1* )(resid  70 and name HN   ) 0.0 1.0 6.0 !
assign (resid  69 and name HG2* )(resid  70 and name HN   ) 0.0 1.0 4.5 !
assign (resid  69 and name HG2* )(resid  70 and name HA   ) 0.0 1.0 4.5 !
assign (resid  69 and name HD1* )(resid  70 and name HN   ) 0.0 1.0 4.5 !
assign (resid  69 and name HD1* )(resid  70 and name HA   ) 0.0 1.0 6.0 !
!ILE 69, short-range NOES
assign (resid  69 and name HN   )(resid  71 and name HN   ) 0.0 0.0 3.5 !
assign (resid  69 and name HA   )(resid  71 and name HN   ) 0.0 0.0 3.5 !
assign (resid  69 and name HG1* )(resid  71 and name HN   ) 0.0 1.0 6.0 !
assign (resid  69 and name HG2* )(resid  71 and name HN   ) 0.0 1.0 6.0 !
assign (resid  69 and name HD1* )(resid  71 and name HN   ) 0.0 1.0 6.0 !
assign (resid  69 and name HN   )(resid  72 and name HN   ) 0.0 0.0 5.0 !
assign (resid  69 and name HN   )(resid  72 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  69 and name HN   )(resid  72 and name HD*  ) 0.0 2.0 7.0 !
assign (resid  69 and name HA   )(resid  72 and name HN   ) 0.0 0.0 3.5 !
assign (resid  69 and name HA   )(resid  72 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  69 and name HG1* )(resid  72 and name HB*  ) 0.0 2.0 7.0 !
assign (resid  69 and name HG2* )(resid  72 and name HN   ) 0.0 1.0 6.0 !
assign (resid  69 and name HG2* )(resid  72 and name HB*  ) 0.0 2.0 7.0 !
assign (resid  69 and name HG2* )(resid  72 and name HE*  ) 0.0 3.0 9.0 !
assign (resid  69 and name HD1* )(resid  72 and name HN   ) 0.0 1.0 4.5 !
assign (resid  69 and name HD1* )(resid  72 and name HA   ) 0.0 1.0 7.0 !
assign (resid  69 and name HD1* )(resid  72 and name HB*  ) 0.0 2.0 5.5 !
assign (resid  69 and name HD1* )(resid  72 and name HE*  ) 0.0 3.0 8.0 !
assign (resid  69 and name HA   )(resid  73 and name HN   ) 0.0 0.0 5.0 !
assign (resid  69 and name HD1* )(resid  73 and name HN   ) 0.0 1.0 4.5 !
!ILE 69, long-range NOES
assign (resid  69 and name HD1* )(resid  74 and name HN   ) 0.0 1.0 6.0 !

!ALA 70, intra-residue NOES
assign (resid  70 and name HN   )(resid  70 and name HA   ) 0.0 0.0 2.5 !
!ALA 70, sequential NOES
assign (resid  70 and name HN   )(resid  71 and name HN   ) 0.0 0.0 3.5 !
assign (resid  70 and name HN   )(resid  71 and name HA   ) 0.0 0.0 5.0 !
assign (resid  70 and name HA   )(resid  71 and name HN   ) 0.0 0.0 3.5 !
!ALA 70, short-range NOES
assign (resid  70 and name HN   )(resid  72 and name HN   ) 0.0 0.0 5.0 !
assign (resid  70 and name HN   )(resid  72 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  70 and name HA   )(resid  72 and name HN   ) 0.0 0.0 5.0 !
assign (resid  70 and name HN   )(resid  73 and name HN   ) 0.0 0.0 6.0 !
assign (resid  70 and name HN   )(resid  73 and name HB*  ) 0.0 1.0 6.0 !
assign (resid  70 and name HN   )(resid  73 and name HG*  ) 0.0 1.0 6.0 !
assign (resid  70 and name HA   )(resid  73 and name HN   ) 0.0 0.0 3.5 !
!ALA 70, long-range NOES

!ALA 71, intra-residue NOES
assign (resid  71 and name HN   )(resid  71 and name HA   ) 0.0 0.0 2.5 !
!ALA 71, sequential NOES
assign (resid  71 and name HN   )(resid  72 and name HN   ) 0.0 0.0 2.5 !
assign (resid  71 and name HN   )(resid  72 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  71 and name HN   )(resid  72 and name HD*  ) 0.0 2.0 7.0 !
assign (resid  71 and name HB*  )(resid  72 and name HN   ) 0.0 1.0 4.5 !
!ALA 71, short-range NOES
assign (resid  71 and name HN   )(resid  73 and name HN   ) 0.0 0.0 5.0 !
assign (resid  71 and name HA   )(resid  73 and name HN   ) 0.0 0.0 5.0 !
!ALA 71, long-range NOES

!TYR 72, intra-residue NOES
assign (resid  72 and name HN   )(resid  72 and name HA   ) 0.0 0.0 2.5 !
assign (resid  72 and name HA   )(resid  72 and name HD*  ) 0.0 2.0 4.5 !
assign (resid  72 and name HB*  )(resid  72 and name HE*  ) 0.0 3.0 6.5 !
!TYR 72, sequential NOES
assign (resid  72 and name HN   )(resid  73 and name HN   ) 0.0 0.0 3.5 !
assign (resid  72 and name HN   )(resid  73 and name HA   ) 0.0 0.0 5.0 !
assign (resid  72 and name HA   )(resid  73 and name HN   ) 0.0 0.0 3.5 !
assign (resid  72 and name HB*  )(resid  73 and name HN   ) 0.0 1.0 3.5 !
assign (resid  72 and name HD*  )(resid  73 and name HN   ) 0.0 2.0 5.5 !
assign (resid  72 and name HE*  )(resid  73 and name HN   ) 0.0 2.0 8.0 !
!TYR 72, short-range NOES
assign (resid  72 and name HN   )(resid  74 and name HN   ) 0.0 0.0 3.5 !
assign (resid  72 and name HB*  )(resid  74 and name HN   ) 0.0 1.0 4.5 !
assign (resid  72 and name HD*  )(resid  74 and name HN   ) 0.0 2.0 7.0 !
assign (resid  72 and name HB*  )(resid  75 and name HN   ) 0.0 1.0 6.0 !
assign (resid  72 and name HD*  )(resid  75 and name HN   ) 0.0 2.0 7.0 !
assign (resid  72 and name HB*  )(resid  76 and name HN   ) 0.0 1.0 7.0 !
assign (resid  72 and name HD*  )(resid  76 and name HN   ) 0.0 2.0 8.0 !
!TYR 72, long-range NOES
assign (resid  72 and name HB*  )(resid  77 and name HN   ) 0.0 1.0 7.0 !

!ARG 73, intra-residue NOES
assign (resid  73 and name HN   )(resid  73 and name HA   ) 0.0 0.0 3.5 !
!ARG 73, sequential NOES
assign (resid  73 and name HN   )(resid  74 and name HN   ) 0.0 0.0 2.5 !
assign (resid  73 and name HN   )(resid  74 and name HA   ) 0.0 0.0 5.0 !
assign (resid  73 and name HN   )(resid  74 and name HB*  ) 0.0 1.0 4.5 !
assign (resid  73 and name HA   )(resid  74 and name HN   ) 0.0 0.0 3.5 !
assign (resid  73 and name HB*  )(resid  74 and name HN   ) 0.0 1.0 3.5 !
assign (resid  73 and name HG*  )(resid  74 and name HN   ) 0.0 1.0 4.5 !
!ARG 73, short-range NOES
assign (resid  73 and name HN   )(resid  75 and name HN   ) 0.0 0.0 5.0 !
assign (resid  73 and name HA   )(resid  75 and name HN   ) 0.0 0.0 3.5 !
assign (resid  73 and name HA   )(resid  76 and name HN   ) 0.0 0.0 5.0 !
!ARG 73, long-range NOES

!ALA 74, intra-residue NOES
assign (resid  74 and name HN   )(resid  74 and name HA   ) 0.0 0.0 2.5 !
!ALA 74, sequential NOES
!ALA 74, short-range NOES
!ARG 74, long-range NOES

!LYS 75, intra-residue NOES
assign (resid  75 and name HN   )(resid  75 and name HA   ) 0.0 0.0 5.0 !
!LYS 75, sequential NOES
assign (resid  75 and name HN   )(resid  76 and name HN   ) 0.0 0.0 2.5 !
assign (resid  75 and name HN   )(resid  76 and name HA*  ) 0.0 1.0 4.5 !
assign (resid  75 and name HB*  )(resid  76 and name HN   ) 0.0 1.0 4.5 !
!LYS 75, short-range NOES
assign (resid  75 and name HN   )(resid  77 and name HN   ) 0.0 0.0 5.0 !
assign (resid  75 and name HG*  )(resid  79 and name HN   ) 0.0 1.0 7.0 !
!LYS 75, long-range NOES

!GLY 76, intra-residue NOES
assign (resid  76 and name HN   )(resid  76 and name HA1  ) 0.0 0.0 2.5 !
assign (resid  76 and name HN   )(resid  76 and name HA2  ) 0.0 0.0 2.5 !
!GLY 76, sequential NOES
assign (resid  76 and name HN   )(resid  77 and name HG*  ) 0.0 1.0 4.5 !
assign (resid  76 and name HA1  )(resid  77 and name HN   ) 0.0 0.0 3.5 !
assign (resid  76 and name HA2  )(resid  77 and name HN   ) 0.0 0.0 3.5 !
!GLY 76, short-range NOES
assign (resid  76 and name HA*  )(resid  80 and name HN   ) 0.0 1.0 6.0 !
!GLY 76, long-range NOES

!LYS 77, intra-residue NOES
assign (resid  77 and name HN   )(resid  77 and name HA   ) 0.0 0.0 2.5 !
!LYS 77, sequential NOES
assign (resid  77 and name HN   )(resid  78 and name HD*  ) 0.0 1.0 6.0 !
!LYS 77, short-range NOES
assign (resid  77 and name HN   )(resid  79 and name HN   ) 0.0 0.0 6.0 !
assign (resid  77 and name HB1  )(resid  79 and name HN   ) 0.0 0.0 5.0 !
assign (resid  77 and name HB2  )(resid  79 and name HN   ) 0.0 0.0 5.0 !
assign (resid  77 and name HD*  )(resid  79 and name HN   ) 0.0 1.0 6.0 !
assign (resid  77 and name HG*  )(resid  79 and name HN   ) 0.0 1.0 7.0 !

!PRO 78, intra-residue NOES
!PRO 78, sequential NOES
assign (resid  78 and name HB*  )(resid  79 and name HN   ) 0.0 1.0 4.5 !
assign (resid  78 and name HD*  )(resid  79 and name HN   ) 0.0 1.0 6.0 !
!PRO 78, short-range NOES

!ASP 79, intra-residue NOES
assign (resid  79 and name HN   )(resid  79 and name HA   ) 0.0 0.0 3.5 !
!ASP 79, sequential NOES
assign (resid  79 and name HN   )(resid  80 and name HN   ) 0.0 0.0 3.5 !
assign (resid  79 and name HA   )(resid  80 and name HN   ) 0.0 0.0 2.5 !
assign (resid  79 and name HB*  )(resid  80 and name HN   ) 0.0 1.0 4.5 !
!ASP 79, short-range NOES
assign (resid  79 and name HA   )(resid  81 and name HN   ) 0.0 0.0 5.0 !

!ALA 80, intra-residue NOES
assign (resid  80 and name HN   )(resid  80 and name HA   ) 0.0 0.0 3.5 !
!ALA 80, sequential NOES
assign (resid  80 and name HA   )(resid  81 and name HN   ) 0.0 0.0 3.5 !

!ALA 81, intra-residue NOES
assign (resid  81 and name HN   )(resid  81 and name HA   ) 0.0 0.0 5.0 !
REMARK
REMARK
REMARK B. DIHEDRAL ANGLE RESTRAINTS
REMARK
!!PHI ANGLE RESTRAINTS HELIX 1
!ALA 11
assign ( resid 11 and name C  )
       ( resid 12 and name N  )
       ( resid 12 and name CA )
       ( resid 12 and name C  ) 1.0 -90 80 2
!PHE 12
assign ( resid 12 and name C  )
       ( resid 13 and name N  )
       ( resid 13 and name CA )
       ( resid 13 and name C  ) 1.0 -90 80 2
!PHE 13
assign ( resid 13 and name C  )
       ( resid 14 and name N  )
       ( resid 14 and name CA )
       ( resid 14 and name C  ) 1.0 -90 80 2
!LEU 14
assign ( resid 14 and name C  )
       ( resid 15 and name N  )
       ( resid 15 and name CA )
       ( resid 15 and name C  ) 1.0 -90 80 2
!PHE 15
assign ( resid 15 and name C  )
       ( resid 16 and name N  )
       ( resid 16 and name CA )
       ( resid 16 and name C  ) 1.0 -90 80 2
!MER 16
assign ( resid 16 and name C  )
       ( resid 17 and name N  )
       ( resid 17 and name CA )
       ( resid 17 and name C  ) 1.0 -90 80 2
!SER 17
assign ( resid 17 and name C  )
       ( resid 18 and name N  )
       ( resid 18 and name CA )
       ( resid 18 and name C  ) 1.0 -90 80 2

!!PHI ANGLE RESTRAINTS HELIX 2
!ILE 32
assign ( resid 32 and name C  )
       ( resid 33 and name N  )
       ( resid 33 and name CA )
       ( resid 33 and name C  ) 1.0 -90 80 2
!GLY 33
assign ( resid 33 and name C  )
       ( resid 34 and name N  )
       ( resid 34 and name CA )
       ( resid 34 and name C  ) 1.0 -90 80 2
!ASP 34
assign ( resid 34 and name C  )
       ( resid 35 and name N  )
       ( resid 35 and name CA )
       ( resid 35 and name C  ) 1.0 -90 80 2
!VAL 35
assign ( resid 35 and name C  )
       ( resid 36 and name N  )
       ( resid 36 and name CA )
       ( resid 36 and name C  ) 1.0 -90 80 2
!ALA 36
assign ( resid 36 and name C  )
       ( resid 37 and name N  )
       ( resid 37 and name CA )
       ( resid 37 and name C  ) 1.0 -90 80 2
!LYS 37
assign ( resid 37 and name C  )
       ( resid 38 and name N  )
       ( resid 38 and name CA )
       ( resid 38 and name C  ) 1.0 -90 80 2
!LYS 38
assign ( resid 38 and name C  )
       ( resid 39 and name N  )
       ( resid 39 and name CA )
       ( resid 39 and name C  ) 1.0 -90 80 2
!LEU 39
assign ( resid 39 and name C  )
       ( resid 40 and name N  )
       ( resid 40 and name CA )
       ( resid 40 and name C  ) 1.0 -90 80 2
!GLY 40
assign ( resid 40 and name C  )
       ( resid 41 and name N  )
       ( resid 41 and name CA )
       ( resid 41 and name C  ) 1.0 -90 80 2
!GLU 41
assign ( resid 41 and name C  )
       ( resid 42 and name N  )
       ( resid 42 and name CA )
       ( resid 42 and name C  ) 1.0 -90 80 2
!MET 42
assign ( resid 42 and name C  )
       ( resid 43 and name N  )
       ( resid 43 and name CA )
       ( resid 43 and name C  ) 1.0 -90 80 2
!TRP 43
assign ( resid 43 and name C  )
       ( resid 44 and name N  )
       ( resid 44 and name CA )
       ( resid 44 and name C  ) 1.0 -90 80 2

!!PHI ANGLE RESTRAINTS HELIX 3
!TYR 54
assign ( resid 54 and name C  )
       ( resid 55 and name N  )
       ( resid 55 and name CA )
       ( resid 55 and name C  ) 1.0 -90 80 2
!GLU 55
assign ( resid 55 and name C  )
       ( resid 56 and name N  )
       ( resid 56 and name CA )
       ( resid 56 and name C  ) 1.0 -90 80 2
!LYS 56
assign ( resid 56 and name C  )
       ( resid 57 and name N  )
       ( resid 57 and name CA )
       ( resid 57 and name C  ) 1.0 -90 80 2
!LYS 57
assign ( resid 57 and name C  )
       ( resid 58 and name N  )
       ( resid 58 and name CA )
       ( resid 58 and name C  ) 1.0 -90 80 2
!ALA 58
assign ( resid 58 and name C  )
       ( resid 59 and name N  )
       ( resid 59 and name CA )
       ( resid 59 and name C  ) 1.0 -90 80 2
!ALA 59
assign ( resid 59 and name C  )
       ( resid 60 and name N  )
       ( resid 60 and name CA )
       ( resid 60 and name C  ) 1.0 -90 80 2
!LYS 60
assign ( resid 60 and name C  )
       ( resid 61 and name N  )
       ( resid 61 and name CA )
       ( resid 61 and name C  ) 1.0 -90 80 2
!LEU 61
assign ( resid 61 and name C  )
       ( resid 62 and name N  )
       ( resid 62 and name CA )
       ( resid 62 and name C  ) 1.0 -90 80 2
!LYS 62
assign ( resid 62 and name C  )
       ( resid 63 and name N  )
       ( resid 63 and name CA )
       ( resid 63 and name C  ) 1.0 -90 80 2
!GLU 63
assign ( resid 63 and name C  )
       ( resid 64 and name N  )
       ( resid 64 and name CA )
       ( resid 64 and name C  ) 1.0 -90 80 2
!LYS 64
assign ( resid 64 and name C  )
       ( resid 65 and name N  )
       ( resid 65 and name CA )
       ( resid 65 and name C  ) 1.0 -90 80 2
!TYR 65
assign ( resid 65 and name C  )
       ( resid 66 and name N  )
       ( resid 66 and name CA )
       ( resid 66 and name C  ) 1.0 -90 80 2
!GLU 66
assign ( resid 66 and name C  )
       ( resid 67 and name N  )
       ( resid 67 and name CA )
       ( resid 67 and name C  ) 1.0 -90 80 2
!LYS 67
assign ( resid 67 and name C  )
       ( resid 68 and name N  )
       ( resid 68 and name CA )
       ( resid 68 and name C  ) 1.0 -90 80 2
!ASP 68
assign ( resid 68 and name C  )
       ( resid 69 and name N  )
       ( resid 69 and name CA )
       ( resid 69 and name C  ) 1.0 -90 80 2
!ILE 69
assign ( resid 69 and name C  )
       ( resid 70 and name N  )
       ( resid 70 and name CA )
       ( resid 70 and name C  ) 1.0 -90 80 2
!ALA 70
assign ( resid 70 and name C  )
       ( resid 71 and name N  )
       ( resid 71 and name CA )
       ( resid 71 and name C  ) 1.0 -90 80 2
!ALA 71
assign ( resid 71 and name C  )
       ( resid 72 and name N  )
       ( resid 72 and name CA )
       ( resid 72 and name C  ) 1.0 -90 80 2
!TYR 72
assign ( resid 72 and name C  )
       ( resid 73 and name N  )
       ( resid 73 and name CA )
       ( resid 73 and name C  ) 1.0 -90 80 2
!ARG 73
assign ( resid 73 and name C  )
       ( resid 74 and name N  )
       ( resid 74 and name CA )
       ( resid 74 and name C  ) 1.0 -90 80 2

!!PSI ANGLE RESTRAINTS HELIX 1
!PHE 12
assign ( resid 12 and name N  )
       ( resid 12 and name CA )
       ( resid 12 and name C  )
       ( resid 13 and name N  ) 1.0 -40 45 2
!PHE 13
assign ( resid 13 and name N  )
       ( resid 13 and name CA )
       ( resid 13 and name C  )
       ( resid 14 and name N  ) 1.0 -40 45 2
!LEU 14
assign ( resid 14 and name N  )
       ( resid 14 and name CA )
       ( resid 14 and name C  )
       ( resid 15 and name N  ) 1.0 -40 45 2
!PHE 15
assign ( resid 15 and name N  )
       ( resid 15 and name CA )
       ( resid 15 and name C  )
       ( resid 16 and name N  ) 1.0 -40 45 2
!ME 16
assign ( resid 16 and name N  )
       ( resid 16 and name CA )
       ( resid 16 and name C  )
       ( resid 17 and name N  ) 1.0 -40 45 2
!SER 17
assign ( resid 17 and name N  )
       ( resid 17 and name CA )
       ( resid 18 and name C  )
       ( resid 17 and name N  ) 1.0 -40 45 2

!!PSI ANGLE RESTRAINTS HELIX 2
!GLY 33
assign ( resid 33 and name N  )
       ( resid 33 and name CA )
       ( resid 33 and name C  )
       ( resid 34 and name N  ) 1.0 -40 45 2
!ASP 34
assign ( resid 34 and name N  )
       ( resid 34 and name CA )
       ( resid 34 and name C  )
       ( resid 35 and name N  ) 1.0 -40 45 2
!VAL 35
assign ( resid 35 and name N  )
       ( resid 35 and name CA )
       ( resid 35 and name C  )
       ( resid 36 and name N  ) 1.0 -40 45 2
!ALA 36
assign ( resid 36 and name N  )
       ( resid 36 and name CA )
       ( resid 36 and name C  )
       ( resid 37 and name N  ) 1.0 -40 45 2
!LYS 37
assign ( resid 37 and name N  )
       ( resid 37 and name CA )
       ( resid 37 and name C  )
       ( resid 38 and name N  ) 1.0 -40 45 2
!LYS 38
assign ( resid 38 and name N  )
       ( resid 38 and name CA )
       ( resid 38 and name C  )
       ( resid 39 and name N  ) 1.0 -40 45 2
!LEU 39
assign ( resid 39 and name N  )
       ( resid 39 and name CA )
       ( resid 39 and name C  )
       ( resid 40 and name N  ) 1.0 -40 45 2
!GLY 40
assign ( resid 40 and name N  )
       ( resid 40 and name CA )
       ( resid 40 and name C  )
       ( resid 41 and name N  ) 1.0 -40 45 2
!GLU 41
assign ( resid 41 and name N  )
       ( resid 41 and name CA )
       ( resid 41 and name C  )
       ( resid 42 and name N  ) 1.0 -40 45 2
!MET 42
assign ( resid 42 and name N  )
       ( resid 42 and name CA )
       ( resid 42 and name C  )
       ( resid 43 and name N  ) 1.0 -40 45 2
!TRP 43
assign ( resid 43 and name N  )
       ( resid 43 and name CA )
       ( resid 43 and name C  )
       ( resid 44 and name N  ) 1.0 -40 45 2

!!PSI ANGLE RESTRAINTS HELIX 3
!TYR 54
assign ( resid 54 and name N  )
       ( resid 54 and name CA )
       ( resid 54 and name C  )
       ( resid 55 and name N  ) 1.0 -40 45 2
!GLU 55
assign ( resid 55 and name N  )
       ( resid 55 and name CA )
       ( resid 55 and name C  )
       ( resid 56 and name N  ) 1.0 -40 45 2
!LYS 56
assign ( resid 56 and name N  )
       ( resid 56 and name CA )
       ( resid 56 and name C  )
       ( resid 57 and name N  ) 1.0 -40 45 2
!LYS 57
assign ( resid 57 and name N  )
       ( resid 57 and name CA )
       ( resid 57 and name C  )
       ( resid 58 and name N  ) 1.0 -40 45 2
!ALA 58
assign ( resid 58 and name N  )
       ( resid 58 and name CA )
       ( resid 58 and name C  )
       ( resid 59 and name N  ) 1.0 -40 45 2
!ALA 59
assign ( resid 59 and name N  )
       ( resid 59 and name CA )
       ( resid 59 and name C  )
       ( resid 60 and name N  ) 1.0 -40 45 2
!LYS 60
assign ( resid 60 and name N  )
       ( resid 60 and name CA )
       ( resid 60 and name C  )
       ( resid 61 and name N  ) 1.0 -40 45 2
!LEU 61
assign ( resid 61 and name N  )
       ( resid 61 and name CA )
       ( resid 61 and name C  )
       ( resid 62 and name N  ) 1.0 -40 45 2
!LYS 62
assign ( resid 62 and name N  )
       ( resid 62 and name CA )
       ( resid 62 and name C  )
       ( resid 63 and name N  ) 1.0 -40 45 2
!GLU 63
assign ( resid 63 and name N  )
       ( resid 63 and name CA )
       ( resid 63 and name C  )
       ( resid 64 and name N  ) 1.0 -40 45 2
!LYS 64
assign ( resid 64 and name N  )
       ( resid 64 and name CA )
       ( resid 64 and name C  )
       ( resid 65 and name N  ) 1.0 -40 45 2
!TYR 65
assign ( resid 65 and name N  )
       ( resid 65 and name CA )
       ( resid 65 and name C  )
       ( resid 66 and name N  ) 1.0 -40 45 2
!GLU 66
assign ( resid 66 and name N  )
       ( resid 66 and name CA )
       ( resid 66 and name C  )
       ( resid 67 and name N  ) 1.0 -40 45 2
!LYS 67
assign ( resid 67 and name N  )
       ( resid 67 and name CA )
       ( resid 67 and name C  )
       ( resid 68 and name N  ) 1.0 -40 45 2
!ASP 68
assign ( resid 68 and name N  )
       ( resid 68 and name CA )
       ( resid 68 and name C  )
       ( resid 69 and name N  ) 1.0 -40 45 2
!ILE 69
assign ( resid 69 and name N  )
       ( resid 69 and name CA )
       ( resid 69 and name C  )
       ( resid 70 and name N  ) 1.0 -40 45 2
!ALA 70
assign ( resid 70 and name N  )
       ( resid 70 and name CA )
       ( resid 70 and name C  )
       ( resid 71 and name N  ) 1.0 -40 45 2
!ALA 71
assign ( resid 71 and name N  )
       ( resid 71 and name CA )
       ( resid 71 and name C  )
       ( resid 72 and name N  ) 1.0 -40 45 2
!TYR 72
assign ( resid 72 and name N  )
       ( resid 72 and name CA )
       ( resid 72 and name C  )
       ( resid 73 and name N  ) 1.0 -40 45 2
!ARG 73
assign ( resid 73 and name N  )
       ( resid 73 and name CA )
       ( resid 73 and name C  )
       ( resid 74 and name N  ) 1.0 -40 45 2
REMARK
REMARK
REMARK C. H-BOND RESTRAINTS
REMARK
!!!H-BOND RESTRAINTS HELIX 1
!PHE 12
assign (resid 12 and name O  )(resid 16 and name HN ) 2.30 0.8 0.20
assign (resid 12 and name O  )(resid 16 and name  N ) 3.30 0.8 0.20 
!PHE 13
assign (resid 13 and name O  )(resid 17 and name HN ) 2.30 0.8 0.20
assign (resid 13 and name O  )(resid 17 and name  N ) 3.30 0.8 0.20 
!LEU 14
assign (resid 14 and name O  )(resid 18 and name HN ) 2.30 0.8 0.20
assign (resid 14 and name O  )(resid 18 and name  N ) 3.30 0.8 0.20 
!PHE 15
assign (resid 15 and name O  )(resid 19 and name HN ) 2.30 0.8 0.20
assign (resid 15 and name O  )(resid 19 and name  N ) 3.30 0.8 0.20 

!!!H-BOND RESTRAINTS HELIX 1'
!ARG 20
assign (resid 20 and name O  )(resid 24 and name HN ) 2.30 0.8 0.20
assign (resid 20 and name O  )(resid 24 and name  N ) 3.30 0.8 0.20 
!PRO 21
assign (resid 21 and name O  )(resid 25 and name HN ) 2.30 0.8 0.20
assign (resid 21 and name O  )(resid 25 and name  N ) 3.30 0.8 0.20 
!LYS 22
assign (resid 22 and name O  )(resid 26 and name HN ) 2.30 0.8 0.20
assign (resid 22 and name O  )(resid 26 and name  N ) 3.30 0.8 0.20 
!ILE 23
assign (resid 23 and name O  )(resid 27 and name HN ) 2.30 0.8 0.20
assign (resid 23 and name O  )(resid 27 and name  N ) 3.30 0.8 0.20 

!!!H-BOND RESTRAINTS HELIX 2
!GLY 33
assign (resid 33 and name O  )(resid 37 and name HN ) 2.30 0.8 0.20
assign (resid 33 and name O  )(resid 37 and name  N ) 3.30 0.8 0.20 
!ASP 34
assign (resid 34 and name O  )(resid 38 and name HN ) 2.30 0.8 0.20
assign (resid 34 and name O  )(resid 38 and name  N ) 3.30 0.8 0.20 
!VAL 35
assign (resid 35 and name O  )(resid 39 and name HN ) 2.30 0.8 0.20
assign (resid 35 and name O  )(resid 39 and name  N ) 3.30 0.8 0.20 
!ALA 36
assign (resid 36 and name O  )(resid 40 and name HN ) 2.30 0.8 0.20
assign (resid 36 and name O  )(resid 40 and name  N ) 3.30 0.8 0.20 
!LYS 37
assign (resid 37 and name O  )(resid 41 and name HN ) 2.30 0.8 0.20
assign (resid 37 and name O  )(resid 41 and name  N ) 3.30 0.8 0.20 
!LYS 38
assign (resid 38 and name O  )(resid 42 and name HN ) 2.30 0.8 0.20
assign (resid 38 and name O  )(resid 42 and name  N ) 3.30 0.8 0.20 
!LEU 39
assign (resid 39 and name O  )(resid 43 and name HN ) 2.30 0.8 0.20
assign (resid 39 and name O  )(resid 43 and name  N ) 3.30 0.8 0.20

!!!H-BOND RESTRAINTS HELIX 3
!TYR 54
assign (resid 54 and name O  )(resid 58 and name HN ) 2.30 0.8 0.20
assign (resid 54 and name O  )(resid 58 and name  N ) 3.30 0.8 0.20 
!GLU 55
assign (resid 55 and name O  )(resid 59 and name HN ) 2.30 0.8 0.20
assign (resid 55 and name O  )(resid 59 and name  N ) 3.30 0.8 0.20 
!LYS 56
assign (resid 56 and name O  )(resid 60 and name HN ) 2.30 0.8 0.20
assign (resid 56 and name O  )(resid 60 and name  N ) 3.30 0.8 0.20 
!LYS 57
assign (resid 57 and name O  )(resid 61 and name HN ) 2.30 0.8 0.20
assign (resid 57 and name O  )(resid 61 and name  N ) 3.30 0.8 0.20 
!ALA 58
assign (resid 58 and name O  )(resid 62 and name HN ) 2.30 0.8 0.20
assign (resid 58 and name O  )(resid 62 and name  N ) 3.30 0.8 0.20 
!ALA 59
assign (resid 59 and name O  )(resid 63 and name HN ) 2.30 0.8 0.20
assign (resid 59 and name O  )(resid 63 and name  N ) 3.30 0.8 0.20 
!LYS 60
assign (resid 60 and name O  )(resid 64 and name HN ) 2.30 0.8 0.20
assign (resid 60 and name O  )(resid 64 and name  N ) 3.30 0.8 0.20 
!LEU 61
assign (resid 61 and name O  )(resid 65 and name HN ) 2.30 0.8 0.20
assign (resid 61 and name O  )(resid 65 and name  N ) 3.30 0.8 0.20 
!LYS 62
assign (resid 62 and name O  )(resid 66 and name HN ) 2.30 0.8 0.20
assign (resid 62 and name O  )(resid 66 and name  N ) 3.30 0.8 0.20 
!GLU 63
assign (resid 63 and name O  )(resid 67 and name HN ) 2.30 0.8 0.20
assign (resid 63 and name O  )(resid 67 and name  N ) 3.30 0.8 0.20 
!LYS 64
assign (resid 64 and name O  )(resid 68 and name HN ) 2.30 0.8 0.20
assign (resid 64 and name O  )(resid 68 and name  N ) 3.30 0.8 0.20 
!TYR 65
assign (resid 65 and name O  )(resid 69 and name HN ) 2.30 0.8 0.20
assign (resid 65 and name O  )(resid 69 and name  N ) 3.30 0.8 0.20 
!GLU 66
assign (resid 66 and name O  )(resid 70 and name HN ) 2.30 0.8 0.20
assign (resid 66 and name O  )(resid 70 and name  N ) 3.30 0.8 0.20 
!LYS 67
assign (resid 67 and name O  )(resid 71 and name HN ) 2.30 0.8 0.20
assign (resid 67 and name O  )(resid 71 and name  N ) 3.30 0.8 0.20 
!ASP 68
assign (resid 68 and name O  )(resid 72 and name HN ) 2.30 0.8 0.20
assign (resid 68 and name O  )(resid 72 and name  N ) 3.30 0.8 0.20 
!ILE 69
assign (resid 69 and name O  )(resid 73 and name HN ) 2.30 0.8 0.20
assign (resid 69 and name O  )(resid 73 and name  N ) 3.30 0.8 0.20 
!ALA 70
assign (resid 70 and name O  )(resid 74 and name HN ) 2.30 0.8 0.20
assign (resid 70 and name O  )(resid 74 and name  N ) 3.30 0.8 0.20 

  Entry H atom name         Original H atom name

  Start of MODEL    1
    1    H    ASN   3           HN       ASN   3  -2.917 -11.355 -11.355
    2    HA   ASN   3           HA       ASN   3  -0.990 -11.722 -11.722
    3   1HB   ASN   3           HB1      ASN   3  -2.812 -12.514 -12.514
    4   2HB   ASN   3           HB2      ASN   3  -1.076 -12.628 -12.628
    5   1HD2  ASN   3          HD21      ASN   3  -2.178 -15.283 -15.283
    6   2HD2  ASN   3          HD22      ASN   3  -2.089 -13.619 -13.619
    7    H    ALA   4           HN       ALA   4  -0.339 -10.700 -10.700
    8    HA   ALA   4           HA       ALA   4  -0.133  -8.781  -8.781
    9   1HB   ALA   4           HB1      ALA   4  -2.515  -9.152  -9.152
   10   2HB   ALA   4           HB2      ALA   4  -3.059  -8.250  -8.250
   11   3HB   ALA   4           HB3      ALA   4  -2.152  -7.440  -7.440
   12    HA   PRO   5           HA       PRO   5   1.034  -6.379  -6.379
   13   1HB   PRO   5           HB1      PRO   5   2.943  -5.270  -5.270
   14   2HB   PRO   5           HB2      PRO   5   3.237  -5.771  -5.771
   15   1HG   PRO   5           HG1      PRO   5   3.941  -7.432  -7.432
   16   2HG   PRO   5           HG2      PRO   5   3.281  -8.083  -8.083
   17   1HD   PRO   5           HD1      PRO   5   1.875  -7.699  -7.699
   18   2HD   PRO   5           HD2      PRO   5   1.742  -9.019  -9.019
   19    H    LYS   6           HN       LYS   6  -0.309  -5.618  -5.618
   20    HA   LYS   6           HA       LYS   6  -1.797  -3.969  -3.969
   21   1HB   LYS   6           HB1      LYS   6  -2.409  -4.084  -4.084
   22   2HB   LYS   6           HB2      LYS   6  -1.396  -2.675  -2.675
   23   1HG   LYS   6           HG1      LYS   6  -2.825  -1.320  -1.320
   24   2HG   LYS   6           HG2      LYS   6  -3.789  -2.728  -2.728
   25   1HD   LYS   6           HD1      LYS   6  -4.426  -2.999  -2.999
   26   2HD   LYS   6           HD2      LYS   6  -3.429  -1.622  -1.622
   27   1HE   LYS   6           HE1      LYS   6  -5.832  -1.503  -1.503
   28   2HE   LYS   6           HE2      LYS   6  -5.829  -1.001  -1.001
   29   1HZ   LYS   6           HZ1      LYS   6  -3.680   0.243   0.243
   30   2HZ   LYS   6           HZ2      LYS   6  -5.060   0.463   0.463
   31   3HZ   LYS   6           HZ3      LYS   6  -5.071   0.955   0.955
   32    H    ARG   7           HN       ARG   7  -1.846  -1.415  -1.415
   33    HA   ARG   7           HA       ARG   7   0.904  -0.618  -0.618
   34   1HB   ARG   7           HB1      ARG   7  -1.840   0.179   0.179
   35   2HB   ARG   7           HB2      ARG   7  -0.480   1.256   1.256
   36   1HG   ARG   7           HG1      ARG   7   0.743  -0.515  -0.515
   37   2HG   ARG   7           HG2      ARG   7  -0.541  -1.668  -1.668
   38   1HD   ARG   7           HD1      ARG   7  -0.641  -0.658  -0.658
   39   2HD   ARG   7           HD2      ARG   7  -2.109  -0.423  -0.423
   40    HE   ARG   7           HE       ARG   7   0.029   1.661   1.661
   41   1HH1  ARG   7          HH11      ARG   7  -3.330   0.785   0.785
   42   2HH1  ARG   7          HH12      ARG   7  -3.856   2.427   2.427
   43   1HH2  ARG   7          HH21      ARG   7  -0.654   3.740   3.740
   44   2HH2  ARG   7          HH22      ARG   7  -2.345   4.106   4.106
   45    HA   PRO   8           HA       PRO   8   0.586   2.110   2.110
   46   1HB   PRO   8           HB1      PRO   8   3.356   2.724   2.724
   47   2HB   PRO   8           HB2      PRO   8   2.838   2.362   2.362
   48   1HG   PRO   8           HG1      PRO   8   4.077   0.434   0.434
   49   2HG   PRO   8           HG2      PRO   8   2.597   0.012   0.012
   50   1HD   PRO   8           HD1      PRO   8   2.865   0.707   0.707
   51   2HD   PRO   8           HD2      PRO   8   2.124  -0.721  -0.721
   52    HA   PRO   9           HA       PRO   9  -0.001   6.379   6.379
   53   1HB   PRO   9           HB1      PRO   9   2.915   6.753   6.753
   54   2HB   PRO   9           HB2      PRO   9   1.632   7.958   7.958
   55   1HG   PRO   9           HG1      PRO   9   2.098   6.564   6.564
   56   2HG   PRO   9           HG2      PRO   9   0.410   6.597   6.597
   57   1HD   PRO   9           HD1      PRO   9   2.483   4.405   4.405
   58   2HD   PRO   9           HD2      PRO   9   0.766   4.216   4.216
   59    H    SER  10           HN       SER  10   0.254   7.718   7.718
   60    HA   SER  10           HA       SER  10   1.944   6.610   6.610
   61   1HB   SER  10           HB1      SER  10  -0.796   7.948   7.948
   62   2HB   SER  10           HB2      SER  10   0.135   7.414   7.414
   63    HG   SER  10           HG       SER  10  -0.042   5.553   5.553
   64    H    ALA  11           HN       ALA  11   1.950   9.003   9.003
   65    HA   ALA  11           HA       ALA  11   3.554  10.791  10.791
   66   1HB   ALA  11           HB1      ALA  11   4.124  10.473  10.473
   67   2HB   ALA  11           HB2      ALA  11   2.623  11.306  11.306
   68   3HB   ALA  11           HB3      ALA  11   3.913  12.141  12.141
   69    H    PHE  12           HN       PHE  12   0.686  10.702  10.702
   70    HA   PHE  12           HA       PHE  12  -0.585  13.178  13.178
   71   1HB   PHE  12           HB1      PHE  12  -0.973  12.188  12.188
   72   2HB   PHE  12           HB2      PHE  12  -1.248  10.583  10.583
   73    HD1  PHE  12           HD1      PHE  12  -3.400  10.380  10.380
   74    HD2  PHE  12           HD2      PHE  12  -2.740  13.451  13.451
   75    HE1  PHE  12           HE1      PHE  12  -5.818  10.821  10.821
   76    HE2  PHE  12           HE2      PHE  12  -5.139  13.881  13.881
   77    HZ   PHE  12           HZ       PHE  12  -6.691  12.574  12.574
   78    H    PHE  13           HN       PHE  13  -0.056  10.324  10.324
   79    HA   PHE  13           HA       PHE  13  -2.605  10.324  10.324
   80   1HB   PHE  13           HB1      PHE  13  -1.016   8.310   8.310
   81   2HB   PHE  13           HB2      PHE  13  -0.175   8.848   8.848
   82    HD1  PHE  13           HD1      PHE  13  -3.354   7.582   7.582
   83    HD2  PHE  13           HD2      PHE  13  -1.228   8.586   8.586
   84    HE1  PHE  13           HE1      PHE  13  -5.086   6.478   6.478
   85    HE2  PHE  13           HE2      PHE  13  -2.965   7.481   7.481
   86    HZ   PHE  13           HZ       PHE  13  -4.894   6.429   6.429
   87    H    LEU  14           HN       LEU  14   0.805  10.994  10.994
   88    HA   LEU  14           HA       LEU  14   0.569  11.847  11.847
   89   1HB   LEU  14           HB1      LEU  14   2.511  12.937  12.937
   90   2HB   LEU  14           HB2      LEU  14   2.740  13.046  13.046
   91    HG   LEU  14           HG       LEU  14   4.193  11.382  11.382
   92   1HD1  LEU  14          HD11      LEU  14   2.871  10.437  10.437
   93   2HD1  LEU  14          HD12      LEU  14   1.746   9.702   9.702
   94   3HD1  LEU  14          HD13      LEU  14   3.417   9.169   9.169
   95   1HD2  LEU  14          HD21      LEU  14   3.696  11.147  11.147
   96   2HD2  LEU  14          HD22      LEU  14   3.831   9.549   9.549
   97   3HD2  LEU  14          HD23      LEU  14   2.259  10.196  10.196
   98    H    PHE  15           HN       PHE  15   0.757  13.803  13.803
   99    HA   PHE  15           HA       PHE  15   0.090  16.284  16.284
  100   1HB   PHE  15           HB1      PHE  15   0.786  16.919  16.919
  101   2HB   PHE  15           HB2      PHE  15   0.730  15.219  15.219
  102    HD1  PHE  15           HD1      PHE  15  -1.675  14.377  14.377
  103    HD2  PHE  15           HD2      PHE  15  -0.468  18.451  18.451
  104    HE1  PHE  15           HE1      PHE  15  -3.492  14.870  14.870
  105    HE2  PHE  15           HE2      PHE  15  -2.287  18.952  18.952
  106    HZ   PHE  15           HZ       PHE  15  -3.804  17.166  17.166
  107    H    CYS  16           HN       MER  16  -2.009  13.840  13.840
  108    HA   CYS  16           HA       MER  16  -4.448  15.240  15.240
  109   1HB   CYS  16           HB1      MER  16  -4.551  13.111  13.111
  110   2HB   CYS  16           HB2      MER  16  -3.777  12.299  12.299
  111    H    SER  17           HN       SER  17  -3.086  13.052  13.052
  112    HA   SER  17           HA       SER  17  -5.002  13.335  13.335
  113   1HB   SER  17           HB1      SER  17  -1.983  12.977  12.977
  114   2HB   SER  17           HB2      SER  17  -3.172  12.727  12.727
  115    HG   SER  17           HG       SER  17  -3.555  10.851  10.851
  116    H    GLU  18           HN       GLU  18  -1.998  15.111  15.111
  117    HA   GLU  18           HA       GLU  18  -1.877  16.847  16.847
  118   1HB   GLU  18           HB1      GLU  18  -0.346  16.729  16.729
  119   2HB   GLU  18           HB2      GLU  18  -1.519  17.608  17.608
  120   1HG   GLU  18           HG1      GLU  18  -1.345  19.579  19.579
  121   2HG   GLU  18           HG2      GLU  18  -0.271  18.722  18.722
  122    H    TYR  19           HN       TYR  19  -3.923  17.449  17.449
  123    HA   TYR  19           HA       TYR  19  -5.561  19.234  19.234
  124   1HB   TYR  19           HB1      TYR  19  -5.592  20.970  20.970
  125   2HB   TYR  19           HB2      TYR  19  -3.889  20.508  20.508
  126    HD1  TYR  19           HD1      TYR  19  -3.194  18.458  18.458
  127    HD2  TYR  19           HD2      TYR  19  -6.192  21.391  21.391
  128    HE1  TYR  19           HE1      TYR  19  -3.010  18.117  18.117
  129    HE2  TYR  19           HE2      TYR  19  -6.012  21.060  21.060
  130    HH   TYR  19           HH       TYR  19  -5.211  19.705  19.705
  131    H    ARG  20           HN       ARG  20  -6.364  16.746  16.746
  132    HA   ARG  20           HA       ARG  20  -8.350  16.758  16.758
  133   1HB   ARG  20           HB1      ARG  20  -7.549  14.611  14.611
  134   2HB   ARG  20           HB2      ARG  20  -7.304  14.681  14.681
  135   1HG   ARG  20           HG1      ARG  20  -9.867  14.591  14.591
  136   2HG   ARG  20           HG2      ARG  20  -9.966  14.443  14.443
  137   1HD   ARG  20           HD1      ARG  20  -8.802  12.314  12.314
  138   2HD   ARG  20           HD2      ARG  20  -8.411  12.519  12.519
  139    HE   ARG  20           HE       ARG  20 -10.853  12.365  12.365
  140   1HH1  ARG  20          HH11      ARG  20 -12.766  12.303  12.303
  141   2HH1  ARG  20          HH12      ARG  20 -12.799  10.860  10.860
  142   1HH2  ARG  20          HH21      ARG  20  -9.449  10.094  10.094
  143   2HH2  ARG  20          HH22      ARG  20 -10.869   9.574   9.574
  144    HA   PRO  21           HA       PRO  21 -11.214  17.115  17.115
  145   1HB   PRO  21           HB1      PRO  21  -9.210  18.156  18.156
  146   2HB   PRO  21           HB2      PRO  21 -10.615  17.119  17.119
  147   1HG   PRO  21           HG1      PRO  21  -8.205  15.970  15.970
  148   2HG   PRO  21           HG2      PRO  21  -9.492  15.192  15.192
  149   1HD   PRO  21           HD1      PRO  21  -7.353  17.130  17.130
  150   2HD   PRO  21           HD2      PRO  21  -7.775  15.506  15.506
  151    H    LYS  22           HN       LYS  22  -8.748  19.141  19.141
  152    HA   LYS  22           HA       LYS  22  -9.999  21.684  21.684
  153   1HB   LYS  22           HB1      LYS  22  -7.506  20.937  20.937
  154   2HB   LYS  22           HB2      LYS  22  -8.038  22.598  22.598
  155   1HG   LYS  22           HG1      LYS  22  -6.355  22.134  22.134
  156   2HG   LYS  22           HG2      LYS  22  -7.891  22.459  22.459
  157   1HD   LYS  22           HD1      LYS  22  -8.266  20.072  20.072
  158   2HD   LYS  22           HD2      LYS  22  -6.826  19.635  19.635
  159   1HE   LYS  22           HE1      LYS  22  -6.928  21.292  21.292
  160   2HE   LYS  22           HE2      LYS  22  -6.444  19.607  19.607
  161   1HZ   LYS  22           HZ1      LYS  22  -4.936  21.060  21.060
  162   2HZ   LYS  22           HZ2      LYS  22  -4.878  21.873  21.873
  163   3HZ   LYS  22           HZ3      LYS  22  -4.412  20.244  20.244
  164    H    ILE  23           HN       ILE  23  -9.814  19.631  19.631
  165    HA   ILE  23           HA       ILE  23 -11.046  21.753  21.753
  166    HB   ILE  23           HB       ILE  23 -11.008  19.934  19.934
  167   1HG1  ILE  23          HG11      ILE  23  -9.263  18.417  18.417
  168   2HG1  ILE  23          HG12      ILE  23 -10.931  17.979  17.979
  169   1HG2  ILE  23          HG21      ILE  23  -8.369  20.691  20.691
  170   2HG2  ILE  23          HG22      ILE  23  -8.517  20.133  20.133
  171   3HG2  ILE  23          HG23      ILE  23  -9.235  21.654  21.654
  172   1HD1  ILE  23          HD11      ILE  23 -10.394  17.654  17.654
  173   2HD1  ILE  23          HD12      ILE  23  -8.710  18.012  18.012
  174   3HD1  ILE  23          HD13      ILE  23  -9.461  16.597  16.597
  175    H    LYS  24           HN       LYS  24 -11.657  19.038  19.038
  176    HA   LYS  24           HA       LYS  24 -14.313  18.379  18.379
  177   1HB   LYS  24           HB1      LYS  24 -12.612  16.857  16.857
  178   2HB   LYS  24           HB2      LYS  24 -12.700  17.788  17.788
  179   1HG   LYS  24           HG1      LYS  24 -14.114  15.809  15.809
  180   2HG   LYS  24           HG2      LYS  24 -15.122  17.232  17.232
  181   1HD   LYS  24           HD1      LYS  24 -16.173  15.470  15.470
  182   2HD   LYS  24           HD2      LYS  24 -15.672  16.737  16.737
  183   1HE   LYS  24           HE1      LYS  24 -13.680  15.445  15.445
  184   2HE   LYS  24           HE2      LYS  24 -14.045  14.220  14.220
  185   1HZ   LYS  24           HZ1      LYS  24 -16.320  14.605  14.605
  186   2HZ   LYS  24           HZ2      LYS  24 -14.991  14.422  14.422
  187   3HZ   LYS  24           HZ3      LYS  24 -15.335  13.227  13.227
  188    H    GLY  25           HN       GLY  25 -12.751  20.529  20.529
  189   1HA   GLY  25           HA1      GLY  25 -15.031  21.152  21.152
  190   2HA   GLY  25           HA2      GLY  25 -13.496  22.023  22.023
  191    H    GLU  26           HN       GLU  26 -13.390  22.596  22.596
  192    HA   GLU  26           HA       GLU  26 -15.112  24.912  24.912
  193   1HB   GLU  26           HB1      GLU  26 -13.113  23.685  23.685
  194   2HB   GLU  26           HB2      GLU  26 -13.824  25.273  25.273
  195   1HG   GLU  26           HG1      GLU  26 -12.211  24.393  24.393
  196   2HG   GLU  26           HG2      GLU  26 -11.518  25.278  25.278
  197    H    HIS  27           HN       HIS  27 -14.712  21.870  21.870
  198    HA   HIS  27           HA       HIS  27 -17.363  22.058  22.058
  199   1HB   HIS  27           HB1      HIS  27 -14.902  20.603  20.603
  200   2HB   HIS  27           HB2      HIS  27 -16.404  20.940  20.940
  201    HD1  HIS  27           HD1      HIS  27 -16.843  23.733  23.733
  202    HD2  HIS  27           HD2      HIS  27 -12.974  22.469  22.469
  203    HE1  HIS  27           HE1      HIS  27 -15.429  25.654  25.654
  204    HA   PRO  28           HA       PRO  28 -17.527  18.307  18.307
  205   1HB   PRO  28           HB1      PRO  28 -19.681  18.969  18.969
  206   2HB   PRO  28           HB2      PRO  28 -18.104  19.659  19.659
  207   1HG   PRO  28           HG1      PRO  28 -20.302  20.910  20.910
  208   2HG   PRO  28           HG2      PRO  28 -19.507  21.626  21.626
  209   1HD   PRO  28           HD1      PRO  28 -18.607  22.145  22.145
  210   2HD   PRO  28           HD2      PRO  28 -17.461  22.014  22.014
  211    H    GLY  29           HN       GLY  29 -18.183  18.884  18.884
  212   1HA   GLY  29           HA1      GLY  29 -20.634  17.286  17.286
  213   2HA   GLY  29           HA2      GLY  29 -20.419  18.764  18.764
  214    H    LEU  30           HN       LEU  30 -17.710  16.720  16.720
  215    HA   LEU  30           HA       LEU  30 -17.346  16.026  16.026
  216   1HB   LEU  30           HB1      LEU  30 -15.387  15.823  15.823
  217   2HB   LEU  30           HB2      LEU  30 -14.997  15.633  15.633
  218    HG   LEU  30           HG       LEU  30 -16.047  18.207  18.207
  219   1HD1  LEU  30          HD11      LEU  30 -13.147  17.355  17.355
  220   2HD1  LEU  30          HD12      LEU  30 -13.637  18.969  18.969
  221   3HD1  LEU  30          HD13      LEU  30 -13.878  17.631  17.631
  222   1HD2  LEU  30          HD21      LEU  30 -16.260  17.975  17.975
  223   2HD2  LEU  30          HD22      LEU  30 -15.073  19.198  19.198
  224   3HD2  LEU  30          HD23      LEU  30 -14.538  17.611  17.611
  225    H    SER  31           HN       SER  31 -16.700  13.919  13.919
  226    HA   SER  31           HA       SER  31 -17.506  11.734  11.734
  227   1HB   SER  31           HB1      SER  31 -18.238  10.524  10.524
  228   2HB   SER  31           HB2      SER  31 -19.054  12.086  12.086
  229    HG   SER  31           HG       SER  31 -18.053  12.607  12.607
  230    H    ILE  32           HN       ILE  32 -16.393   9.628   9.628
  231    HA   ILE  32           HA       ILE  32 -13.567  10.202  10.202
  232    HB   ILE  32           HB       ILE  32 -14.717   8.104   8.104
  233   1HG1  ILE  32          HG11      ILE  32 -13.054   6.475   6.475
  234   2HG1  ILE  32          HG12      ILE  32 -12.602   7.461   7.461
  235   1HG2  ILE  32          HG21      ILE  32 -16.311   7.850   7.850
  236   2HG2  ILE  32          HG22      ILE  32 -14.999   7.534   7.534
  237   3HG2  ILE  32          HG23      ILE  32 -15.358   6.387   6.387
  238   1HD1  ILE  32          HD11      ILE  32 -12.208   8.214   8.214
  239   2HD1  ILE  32          HD12      ILE  32 -10.942   7.687   7.687
  240   3HD1  ILE  32          HD13      ILE  32 -11.745   9.222   9.222
  241    H    GLY  33           HN       GLY  33 -15.558  10.877  10.877
  242   1HA   GLY  33           HA1      GLY  33 -13.782  10.485  10.485
  243   2HA   GLY  33           HA2      GLY  33 -15.527  10.752  10.752
  244    H    ASP  34           HN       ASP  34 -15.038  12.812  12.812
  245    HA   ASP  34           HA       ASP  34 -14.345  15.034  15.034
  246   1HB   ASP  34           HB1      ASP  34 -15.935  15.030  15.030
  247   2HB   ASP  34           HB2      ASP  34 -15.590  16.485  16.485
  248    H    VAL  35           HN       VAL  35 -13.846  13.745  13.745
  249    HA   VAL  35           HA       VAL  35 -11.864  15.648  15.648
  250    HB   VAL  35           HB       VAL  35 -12.340  12.714  12.714
  251   1HG1  VAL  35          HG11      VAL  35 -10.660  14.839  14.839
  252   2HG1  VAL  35          HG12      VAL  35 -10.960  13.224  13.224
  253   3HG1  VAL  35          HG13      VAL  35  -9.996  13.445  13.445
  254   1HG2  VAL  35          HG21      VAL  35 -13.188  15.214  15.214
  255   2HG2  VAL  35          HG22      VAL  35 -14.230  14.046  14.046
  256   3HG2  VAL  35          HG23      VAL  35 -13.327  13.571  13.571
  257    H    ALA  36           HN       ALA  36 -11.947  12.886  12.886
  258    HA   ALA  36           HA       ALA  36  -9.087  12.468  12.468
  259   1HB   ALA  36           HB1      ALA  36 -11.474  11.293  11.293
  260   2HB   ALA  36           HB2      ALA  36  -9.835  10.665  10.665
  261   3HB   ALA  36           HB3      ALA  36 -10.679  10.610  10.610
  262    H    LYS  37           HN       LYS  37 -11.730  13.839  13.839
  263    HA   LYS  37           HA       LYS  37 -10.140  14.322  14.322
  264   1HB   LYS  37           HB1      LYS  37 -12.566  14.158  14.158
  265   2HB   LYS  37           HB2      LYS  37 -12.728  15.562  15.562
  266   1HG   LYS  37           HG1      LYS  37 -11.557  16.882  16.882
  267   2HG   LYS  37           HG2      LYS  37 -11.534  15.427  15.427
  268   1HD   LYS  37           HD1      LYS  37 -14.027  15.348  15.348
  269   2HD   LYS  37           HD2      LYS  37 -14.060  16.789  16.789
  270   1HE   LYS  37           HE1      LYS  37 -14.462  17.433  17.433
  271   2HE   LYS  37           HE2      LYS  37 -12.894  18.052  18.052
  272   1HZ   LYS  37           HZ1      LYS  37 -12.535  15.469  15.469
  273   2HZ   LYS  37           HZ2      LYS  37 -13.494  16.324  16.324
  274   3HZ   LYS  37           HZ3      LYS  37 -11.977  16.937  16.937
  275    H    LYS  38           HN       LYS  38 -11.093  16.305  16.305
  276    HA   LYS  38           HA       LYS  38  -9.974  18.767  18.767
  277   1HB   LYS  38           HB1      LYS  38 -11.512  17.909  17.909
  278   2HB   LYS  38           HB2      LYS  38  -9.947  17.950  17.950
  279   1HG   LYS  38           HG1      LYS  38 -10.954  20.083  20.083
  280   2HG   LYS  38           HG2      LYS  38  -9.637  20.311  20.311
  281   1HD   LYS  38           HD1      LYS  38 -11.547  21.632  21.632
  282   2HD   LYS  38           HD2      LYS  38 -11.309  20.344  20.344
  283   1HE   LYS  38           HE1      LYS  38 -13.322  20.136  20.136
  284   2HE   LYS  38           HE2      LYS  38 -13.736  20.794  20.794
  285   1HZ   LYS  38           HZ1      LYS  38 -12.460  18.367  18.367
  286   2HZ   LYS  38           HZ2      LYS  38 -13.608  18.117  18.117
  287   3HZ   LYS  38           HZ3      LYS  38 -14.090  18.774  18.774
  288    H    LEU  39           HN       LEU  39  -8.753  16.246  16.246
  289    HA   LEU  39           HA       LEU  39  -6.159  17.390  17.390
  290   1HB   LEU  39           HB1      LEU  39  -7.209  14.569  14.569
  291   2HB   LEU  39           HB2      LEU  39  -5.547  14.975  14.975
  292    HG   LEU  39           HG       LEU  39  -7.952  16.411  16.411
  293   1HD1  LEU  39          HD11      LEU  39  -7.902  13.957  13.957
  294   2HD1  LEU  39          HD12      LEU  39  -6.263  14.218  14.218
  295   3HD1  LEU  39          HD13      LEU  39  -7.575  15.045  15.045
  296   1HD2  LEU  39          HD21      LEU  39  -5.076  16.310  16.310
  297   2HD2  LEU  39          HD22      LEU  39  -5.824  17.675  17.675
  298   3HD2  LEU  39          HD23      LEU  39  -6.361  17.184  17.184
  299    H    GLY  40           HN       GLY  40  -7.507  15.005  15.005
  300   1HA   GLY  40           HA1      GLY  40  -5.238  14.148  14.148
  301   2HA   GLY  40           HA2      GLY  40  -6.801  14.257  14.257
  302    H    GLU  41           HN       GLU  41  -6.693  17.174  17.174
  303    HA   GLU  41           HA       GLU  41  -5.305  18.200  18.200
  304   1HB   GLU  41           HB1      GLU  41  -7.697  18.706  18.706
  305   2HB   GLU  41           HB2      GLU  41  -6.776  20.180  20.180
  306   1HG   GLU  41           HG1      GLU  41  -7.579  18.609  18.609
  307   2HG   GLU  41           HG2      GLU  41  -8.424  20.029  20.029
  308    H    MET  42           HN       MET  42  -5.886  19.210  19.210
  309    HA   MET  42           HA       MET  42  -3.947  21.137  21.137
  310   1HB   MET  42           HB1      MET  42  -4.749  18.959  18.959
  311   2HB   MET  42           HB2      MET  42  -3.858  20.412  20.412
  312   1HG   MET  42           HG1      MET  42  -6.626  20.389  20.389
  313   2HG   MET  42           HG2      MET  42  -6.356  20.530  20.530
  314   1HE   MET  42           HE1      MET  42  -8.299  22.232  22.232
  315   2HE   MET  42           HE2      MET  42  -7.822  23.805  23.805
  316   3HE   MET  42           HE3      MET  42  -7.549  22.392  22.392
  317    H    TRP  43           HN       TRP  43  -3.523  17.713  17.713
  318    HA   TRP  43           HA       TRP  43  -0.820  17.562  17.562
  319   1HB   TRP  43           HB1      TRP  43  -2.385  15.608  15.608
  320   2HB   TRP  43           HB2      TRP  43  -2.590  15.665  15.665
  321    HD1  TRP  43           HD1      TRP  43  -1.212  13.943  13.943
  322    HE1  TRP  43           HE1      TRP  43   1.043  12.978  12.978
  323    HE3  TRP  43           HE3      TRP  43  -0.021  16.319  16.319
  324    HZ2  TRP  43           HZ2      TRP  43   3.186  13.092  13.092
  325    HZ3  TRP  43           HZ3      TRP  43   2.102  15.887  15.887
  326    HH2  TRP  43           HH2      TRP  43   3.718  14.277  14.277
  327    H    ASN  44           HN       ASN  44  -2.385  17.172  17.172
  328    HA   ASN  44           HA       ASN  44  -0.114  16.965  16.965
  329   1HB   ASN  44           HB1      ASN  44  -2.065  16.339  16.339
  330   2HB   ASN  44           HB2      ASN  44  -3.048  17.579  17.579
  331   1HD2  ASN  44          HD21      ASN  44  -3.059  19.482  19.482
  332   2HD2  ASN  44          HD22      ASN  44  -3.756  19.026  19.026
  333    H    ASN  45           HN       ASN  45  -1.648  19.722  19.722
  334    HA   ASN  45           HA       ASN  45   0.398  21.531  21.531
  335   1HB   ASN  45           HB1      ASN  45  -2.218  22.621  22.621
  336   2HB   ASN  45           HB2      ASN  45  -1.180  23.266  23.266
  337   1HD2  ASN  45          HD21      ASN  45  -4.315  21.000  21.000
  338   2HD2  ASN  45          HD22      ASN  45  -4.022  21.698  21.698
  339    H    THR  46           HN       THR  46   1.032  20.094  20.094
  340    HA   THR  46           HA       THR  46   0.571  21.944  21.944
  341    HB   THR  46           HB       THR  46   0.407  19.410  19.410
  342    HG1  THR  46           HG1      THR  46   1.039  19.982  19.982
  343   1HG2  THR  46          HG21      THR  46   2.473  18.797  18.797
  344   2HG2  THR  46          HG22      THR  46   3.472  19.506  19.506
  345   3HG2  THR  46          HG23      THR  46   2.476  18.118  18.118
  346    H    ALA  47           HN       ALA  47   2.558  21.746  21.746
  347    HA   ALA  47           HA       ALA  47   4.234  23.619  23.619
  348   1HB   ALA  47           HB1      ALA  47   5.612  22.118  22.118
  349   2HB   ALA  47           HB2      ALA  47   6.289  23.468  23.468
  350   3HB   ALA  47           HB3      ALA  47   4.911  23.724  23.724
  351    H    ALA  48           HN       ALA  48   4.776  20.408  20.408
  352    HA   ALA  48           HA       ALA  48   5.187  18.437  18.437
  353   1HB   ALA  48           HB1      ALA  48   5.349  19.670  19.670
  354   2HB   ALA  48           HB2      ALA  48   6.963  20.206  20.206
  355   3HB   ALA  48           HB3      ALA  48   6.622  18.498  18.498
  356    H    ASP  49           HN       ASP  49   7.244  21.133  21.133
  357    HA   ASP  49           HA       ASP  49   9.545  19.566  19.566
  358   1HB   ASP  49           HB1      ASP  49   9.776  21.703  21.703
  359   2HB   ASP  49           HB2      ASP  49   9.002  22.574  22.574
  360    H    ASP  50           HN       ASP  50   6.735  20.004  20.004
  361    HA   ASP  50           HA       ASP  50   7.470  20.386  20.386
  362   1HB   ASP  50           HB1      ASP  50   5.821  22.076  22.076
  363   2HB   ASP  50           HB2      ASP  50   4.810  20.748  20.748
  364    H    LYS  51           HN       LYS  51   6.287  18.422  18.422
  365    HA   LYS  51           HA       LYS  51   4.938  16.404  16.404
  366   1HB   LYS  51           HB1      LYS  51   6.303  16.111  16.111
  367   2HB   LYS  51           HB2      LYS  51   5.272  14.908  14.908
  368   1HG   LYS  51           HG1      LYS  51   3.342  16.390  16.390
  369   2HG   LYS  51           HG2      LYS  51   4.383  17.673  17.673
  370   1HD   LYS  51           HD1      LYS  51   5.048  16.251  16.251
  371   2HD   LYS  51           HD2      LYS  51   4.057  14.937  14.937
  372   1HE   LYS  51           HE1      LYS  51   2.030  16.193  16.193
  373   2HE   LYS  51           HE2      LYS  51   2.915  17.670  17.670
  374   1HZ   LYS  51           HZ1      LYS  51   3.792  15.593  15.593
  375   2HZ   LYS  51           HZ2      LYS  51   2.094  15.669  15.669
  376   3HZ   LYS  51           HZ3      LYS  51   3.019  17.050  17.050
  377    H    GLN  52           HN       GLN  52   7.962  16.535  16.535
  378    HA   GLN  52           HA       GLN  52   9.498  14.542  14.542
  379   1HB   GLN  52           HB1      GLN  52  10.029  17.280  17.280
  380   2HB   GLN  52           HB2      GLN  52  10.934  16.898  16.898
  381   1HG   GLN  52           HG1      GLN  52  12.384  16.569  16.569
  382   2HG   GLN  52           HG2      GLN  52  12.053  15.010  15.010
  383   1HE2  GLN  52          HE21      GLN  52   9.546  15.010  15.010
  384   2HE2  GLN  52          HE22      GLN  52   9.190  15.730  15.730
  385    HA   PRO  53           HA       PRO  53  10.591  14.924  14.924
  386   1HB   PRO  53           HB1      PRO  53   8.718  16.318  16.318
  387   2HB   PRO  53           HB2      PRO  53  10.242  16.995  16.995
  388   1HG   PRO  53           HG1      PRO  53   7.519  17.103  17.103
  389   2HG   PRO  53           HG2      PRO  53   8.583  18.468  18.468
  390   1HD   PRO  53           HD1      PRO  53   8.720  17.480  17.480
  391   2HD   PRO  53           HD2      PRO  53  10.261  17.706  17.706
  392    H    TYR  54           HN       TYR  54   7.115  15.218  15.218
  393    HA   TYR  54           HA       TYR  54   6.354  13.045  13.045
  394   1HB   TYR  54           HB1      TYR  54   4.852  14.262  14.262
  395   2HB   TYR  54           HB2      TYR  54   4.153  13.178  13.178
  396    HD1  TYR  54           HD1      TYR  54   5.361  14.289  14.289
  397    HD2  TYR  54           HD2      TYR  54   3.734  16.286  16.286
  398    HE1  TYR  54           HE1      TYR  54   4.838  16.234  16.234
  399    HE2  TYR  54           HE2      TYR  54   3.215  18.229  18.229
  400    HH   TYR  54           HH       TYR  54   4.481  19.014  19.014
  401    H    GLU  55           HN       GLU  55   6.800  13.462  13.462
  402    HA   GLU  55           HA       GLU  55   6.091  11.041  11.041
  403   1HB   GLU  55           HB1      GLU  55   7.206  13.412  13.412
  404   2HB   GLU  55           HB2      GLU  55   8.578  12.346  12.346
  405   1HG   GLU  55           HG1      GLU  55   7.079  10.810  10.810
  406   2HG   GLU  55           HG2      GLU  55   5.825  12.041  12.041
  407    H    LYS  56           HN       LYS  56   9.385  11.908  11.908
  408    HA   LYS  56           HA       LYS  56  10.657   9.511   9.511
  409   1HB   LYS  56           HB1      LYS  56  11.713  11.666  11.666
  410   2HB   LYS  56           HB2      LYS  56  11.159  11.507  11.507
  411   1HG   LYS  56           HG1      LYS  56  12.527   9.531   9.531
  412   2HG   LYS  56           HG2      LYS  56  12.941   9.420   9.420
  413   1HD   LYS  56           HD1      LYS  56  13.714  11.750  11.750
  414   2HD   LYS  56           HD2      LYS  56  14.775  10.405  10.405
  415   1HE   LYS  56           HE1      LYS  56  14.584  10.982  10.982
  416   2HE   LYS  56           HE2      LYS  56  13.661  12.415  12.415
  417   1HZ   LYS  56           HZ1      LYS  56  16.008  12.290  12.290
  418   2HZ   LYS  56           HZ2      LYS  56  16.393  12.145  12.145
  419   3HZ   LYS  56           HZ3      LYS  56  15.501  13.482  13.482
  420    H    LYS  57           HN       LYS  57   8.586  10.361  10.361
  421    HA   LYS  57           HA       LYS  57   9.335   7.988   7.988
  422   1HB   LYS  57           HB1      LYS  57   6.967   9.899   9.899
  423   2HB   LYS  57           HB2      LYS  57   7.352   8.606   8.606
  424   1HG   LYS  57           HG1      LYS  57   9.652   9.660   9.660
  425   2HG   LYS  57           HG2      LYS  57   9.086  11.021  11.021
  426   1HD   LYS  57           HD1      LYS  57   7.247  11.414  11.414
  427   2HD   LYS  57           HD2      LYS  57   7.755  10.017  10.017
  428   1HE   LYS  57           HE1      LYS  57   9.985  11.110  11.110
  429   2HE   LYS  57           HE2      LYS  57   9.401  12.535  12.535
  430   1HZ   LYS  57           HZ1      LYS  57   7.500  11.836  11.836
  431   2HZ   LYS  57           HZ2      LYS  57   9.017  11.836  11.836
  432   3HZ   LYS  57           HZ3      LYS  57   8.477  13.222  13.222
  433    H    ALA  58           HN       ALA  58   6.411   9.035   9.035
  434    HA   ALA  58           HA       ALA  58   4.883   6.712   6.712
  435   1HB   ALA  58           HB1      ALA  58   4.192   8.812   8.812
  436   2HB   ALA  58           HB2      ALA  58   5.297   8.460   8.460
  437   3HB   ALA  58           HB3      ALA  58   3.918   7.415   7.415
  438    H    ALA  59           HN       ALA  59   7.475   7.501   7.501
  439    HA   ALA  59           HA       ALA  59   7.590   5.112   5.112
  440   1HB   ALA  59           HB1      ALA  59   8.846   7.205   7.205
  441   2HB   ALA  59           HB2      ALA  59   9.882   6.978   6.978
  442   3HB   ALA  59           HB3      ALA  59   9.937   5.832   5.832
  443    H    LYS  60           HN       LYS  60   9.771   6.023   6.023
  444    HA   LYS  60           HA       LYS  60  11.111   3.772   3.772
  445   1HB   LYS  60           HB1      LYS  60  11.190   5.850   5.850
  446   2HB   LYS  60           HB2      LYS  60   9.627   5.481   5.481
  447   1HG   LYS  60           HG1      LYS  60  10.773   3.218   3.218
  448   2HG   LYS  60           HG2      LYS  60  12.261   4.090   4.090
  449   1HD   LYS  60           HD1      LYS  60  11.599   5.877   5.877
  450   2HD   LYS  60           HD2      LYS  60  10.027   5.137   5.137
  451   1HE   LYS  60           HE1      LYS  60  12.695   3.885   3.885
  452   2HE   LYS  60           HE2      LYS  60  11.507   4.573   4.573
  453   1HZ   LYS  60           HZ1      LYS  60  10.191   2.720   2.720
  454   2HZ   LYS  60           HZ2      LYS  60  11.607   1.986   1.986
  455   3HZ   LYS  60           HZ3      LYS  60  10.484   2.651   2.651
  456    H    LEU  61           HN       LEU  61   7.812   4.308   4.308
  457    HA   LEU  61           HA       LEU  61   7.465   1.703   1.703
  458   1HB   LEU  61           HB1      LEU  61   5.307   3.644   3.644
  459   2HB   LEU  61           HB2      LEU  61   5.189   2.424   2.424
  460    HG   LEU  61           HG       LEU  61   7.031   4.860   4.860
  461   1HD1  LEU  61          HD11      LEU  61   4.679   5.408   5.408
  462   2HD1  LEU  61          HD12      LEU  61   4.521   4.220   4.220
  463   3HD1  LEU  61          HD13      LEU  61   5.552   5.631   5.631
  464   1HD2  LEU  61          HD21      LEU  61   6.575   2.698   2.698
  465   2HD2  LEU  61          HD22      LEU  61   8.053   2.929   2.929
  466   3HD2  LEU  61          HD23      LEU  61   7.544   4.153   4.153
  467    H    LYS  62           HN       LYS  62   6.114   3.098   3.098
  468    HA   LYS  62           HA       LYS  62   4.748   0.910   0.910
  469   1HB   LYS  62           HB1      LYS  62   5.258   3.348   3.348
  470   2HB   LYS  62           HB2      LYS  62   6.559   2.521   2.521
  471   1HG   LYS  62           HG1      LYS  62   4.909   0.907   0.907
  472   2HG   LYS  62           HG2      LYS  62   3.618   1.733   1.733
  473   1HD   LYS  62           HD1      LYS  62   4.395   3.884   3.884
  474   2HD   LYS  62           HD2      LYS  62   5.347   2.810   2.810
  475   1HE   LYS  62           HE1      LYS  62   3.176   3.203   3.203
  476   2HE   LYS  62           HE2      LYS  62   3.246   1.527   1.527
  477   1HZ   LYS  62           HZ1      LYS  62   2.261   3.097   3.097
  478   2HZ   LYS  62           HZ2      LYS  62   1.390   3.477   3.477
  479   3HZ   LYS  62           HZ3      LYS  62   1.475   1.867   1.867
  480    H    GLU  63           HN       GLU  63   8.123   1.722   1.722
  481    HA   GLU  63           HA       GLU  63   9.226  -0.374  -0.374
  482   1HB   GLU  63           HB1      GLU  63  10.677   1.437   1.437
  483   2HB   GLU  63           HB2      GLU  63  10.211   1.571   1.571
  484   1HG   GLU  63           HG1      GLU  63  12.533   0.801   0.801
  485   2HG   GLU  63           HG2      GLU  63  11.572  -0.407  -0.407
  486    H    LYS  64           HN       LYS  64   8.776  -0.129  -0.129
  487    HA   LYS  64           HA       LYS  64   9.832  -2.660  -2.660
  488   1HB   LYS  64           HB1      LYS  64   9.249  -1.222  -1.222
  489   2HB   LYS  64           HB2      LYS  64   7.628  -0.939  -0.939
  490   1HG   LYS  64           HG1      LYS  64   6.949  -3.221  -3.221
  491   2HG   LYS  64           HG2      LYS  64   8.589  -3.642  -3.642
  492   1HD   LYS  64           HD1      LYS  64   7.447  -1.281  -1.281
  493   2HD   LYS  64           HD2      LYS  64   6.604  -2.784  -2.784
  494   1HE   LYS  64           HE1      LYS  64   9.614  -2.387  -2.387
  495   2HE   LYS  64           HE2      LYS  64   8.441  -2.435  -2.435
  496   1HZ   LYS  64           HZ1      LYS  64   8.041  -4.683  -4.683
  497   2HZ   LYS  64           HZ2      LYS  64   9.701  -4.571  -4.571
  498   3HZ   LYS  64           HZ3      LYS  64   8.572  -4.609  -4.609
  499    H    TYR  65           HN       TYR  65   6.566  -1.762  -1.762
  500    HA   TYR  65           HA       TYR  65   5.321  -4.297  -4.297
  501   1HB   TYR  65           HB1      TYR  65   3.821  -2.528  -2.528
  502   2HB   TYR  65           HB2      TYR  65   4.830  -1.626  -1.626
  503    HD1  TYR  65           HD1      TYR  65   2.879  -4.853  -4.853
  504    HD2  TYR  65           HD2      TYR  65   3.967  -1.378  -1.378
  505    HE1  TYR  65           HE1      TYR  65   1.447  -5.577  -5.577
  506    HE2  TYR  65           HE2      TYR  65   2.538  -2.107  -2.107
  507    HH   TYR  65           HH       TYR  65   0.198  -3.985  -3.985
  508    H    GLU  66           HN       GLU  66   6.776  -2.638  -2.638
  509    HA   GLU  66           HA       GLU  66   6.334  -4.441  -4.441
  510   1HB   GLU  66           HB1      GLU  66   8.726  -2.698  -2.698
  511   2HB   GLU  66           HB2      GLU  66   8.335  -3.460  -3.460
  512   1HG   GLU  66           HG1      GLU  66   6.228  -1.749  -1.749
  513   2HG   GLU  66           HG2      GLU  66   7.506  -0.937  -0.937
  514    H    LYS  67           HN       LYS  67   8.622  -4.744  -4.744
  515    HA   LYS  67           HA       LYS  67   9.993  -6.976  -6.976
  516   1HB   LYS  67           HB1      LYS  67  10.656  -5.794  -5.794
  517   2HB   LYS  67           HB2      LYS  67  11.684  -6.826  -6.826
  518   1HG   LYS  67           HG1      LYS  67  11.149  -3.894  -3.894
  519   2HG   LYS  67           HG2      LYS  67  12.652  -4.759  -4.759
  520   1HD   LYS  67           HD1      LYS  67  11.282  -5.688  -5.688
  521   2HD   LYS  67           HD2      LYS  67  10.612  -4.084  -4.084
  522   1HE   LYS  67           HE1      LYS  67  12.900  -3.093  -3.093
  523   2HE   LYS  67           HE2      LYS  67  13.580  -4.698  -4.698
  524   1HZ   LYS  67           HZ1      LYS  67  11.645  -4.479  -4.479
  525   2HZ   LYS  67           HZ2      LYS  67  12.543  -3.035  -3.035
  526   3HZ   LYS  67           HZ3      LYS  67  13.334  -4.533  -4.533
  527    H    ASP  68           HN       ASP  68   7.648  -6.341  -6.341
  528    HA   ASP  68           HA       ASP  68   7.744  -8.957  -8.957
  529   1HB   ASP  68           HB1      ASP  68   6.009  -6.513  -6.513
  530   2HB   ASP  68           HB2      ASP  68   5.886  -7.984  -7.984
  531    H    ILE  69           HN       ILE  69   6.315  -7.279  -7.279
  532    HA   ILE  69           HA       ILE  69   3.997  -9.096  -9.096
  533    HB   ILE  69           HB       ILE  69   3.646  -6.608  -6.608
  534   1HG1  ILE  69          HG11      ILE  69   2.288  -6.823  -6.823
  535   2HG1  ILE  69          HG12      ILE  69   3.316  -8.067  -8.067
  536   1HG2  ILE  69          HG21      ILE  69   5.876  -6.295  -6.295
  537   2HG2  ILE  69          HG22      ILE  69   5.310  -7.124  -7.124
  538   3HG2  ILE  69          HG23      ILE  69   4.553  -5.612  -5.612
  539   1HD1  ILE  69          HD11      ILE  69   1.659  -8.414  -8.414
  540   2HD1  ILE  69          HD12      ILE  69   1.261  -9.043  -9.043
  541   3HD1  ILE  69          HD13      ILE  69   2.674  -9.625  -9.625
  542    H    ALA  70           HN       ALA  70   6.817  -8.073  -8.073
  543    HA   ALA  70           HA       ALA  70   6.747  -9.833  -9.833
  544   1HB   ALA  70           HB1      ALA  70   9.221  -8.802  -8.802
  545   2HB   ALA  70           HB2      ALA  70   9.234  -9.513  -9.513
  546   3HB   ALA  70           HB3      ALA  70   8.437  -7.976  -7.976
  547    H    ALA  71           HN       ALA  71   7.823 -10.069 -10.069
  548    HA   ALA  71           HA       ALA  71   8.886 -12.744 -12.744
  549   1HB   ALA  71           HB1      ALA  71   8.014 -11.151 -11.151
  550   2HB   ALA  71           HB2      ALA  71   8.930 -12.649 -12.649
  551   3HB   ALA  71           HB3      ALA  71   9.642 -11.215 -11.215
  552    H    TYR  72           HN       TYR  72   5.843 -11.344 -11.344
  553    HA   TYR  72           HA       TYR  72   4.600 -13.752 -13.752
  554   1HB   TYR  72           HB1      TYR  72   3.676 -11.687 -11.687
  555   2HB   TYR  72           HB2      TYR  72   3.581 -11.074 -11.074
  556    HD1  TYR  72           HD1      TYR  72   2.357 -14.277 -14.277
  557    HD2  TYR  72           HD2      TYR  72   1.376 -10.701 -10.701
  558    HE1  TYR  72           HE1      TYR  72   0.035 -15.026 -15.026
  559    HE2  TYR  72           HE2      TYR  72  -0.942 -11.446 -11.446
  560    HH   TYR  72           HH       TYR  72  -2.049 -14.012 -14.012
  561    H    ARG  73           HN       ARG  73   4.416 -12.208 -12.208
  562    HA   ARG  73           HA       ARG  73   2.666 -14.275 -14.275
  563   1HB   ARG  73           HB1      ARG  73   4.145 -11.986 -11.986
  564   2HB   ARG  73           HB2      ARG  73   2.849 -12.918 -12.918
  565   1HG   ARG  73           HG1      ARG  73   2.546 -11.313 -11.313
  566   2HG   ARG  73           HG2      ARG  73   2.147 -10.658 -10.658
  567   1HD   ARG  73           HD1      ARG  73   0.851 -13.256 -13.256
  568   2HD   ARG  73           HD2      ARG  73   0.267 -11.726 -11.726
  569    HE   ARG  73           HE       ARG  73   0.407 -12.285 -12.285
  570   1HH1  ARG  73          HH11      ARG  73  -0.526  -9.854  -9.854
  571   2HH1  ARG  73          HH12      ARG  73  -2.168  -9.784  -9.784
  572   1HH2  ARG  73          HH21      ARG  73  -1.933 -12.794 -12.794
  573   2HH2  ARG  73          HH22      ARG  73  -2.986 -11.487 -11.487
  574    H    ALA  74           HN       ALA  74   5.957 -13.862 -13.862
  575    HA   ALA  74           HA       ALA  74   6.628 -15.891 -15.891
  576   1HB   ALA  74           HB1      ALA  74   7.884 -13.774 -13.774
  577   2HB   ALA  74           HB2      ALA  74   8.471 -14.078 -14.078
  578   3HB   ALA  74           HB3      ALA  74   8.951 -15.134 -15.134
  579    H    LYS  75           HN       LYS  75   5.438 -16.368 -16.368
  580    HA   LYS  75           HA       LYS  75   5.387 -18.312 -18.312
  581   1HB   LYS  75           HB1      LYS  75   7.274 -19.262 -19.262
  582   2HB   LYS  75           HB2      LYS  75   8.406 -18.641 -18.641
  583   1HG   LYS  75           HG1      LYS  75   8.068 -20.245 -20.245
  584   2HG   LYS  75           HG2      LYS  75   6.331 -20.143 -20.143
  585   1HD   LYS  75           HD1      LYS  75   8.024 -21.628 -21.628
  586   2HD   LYS  75           HD2      LYS  75   7.361 -22.395 -22.395
  587   1HE   LYS  75           HE1      LYS  75   5.750 -22.850 -22.850
  588   2HE   LYS  75           HE2      LYS  75   5.040 -21.514 -21.514
  589   1HZ   LYS  75           HZ1      LYS  75   6.687 -20.533 -20.533
  590   2HZ   LYS  75           HZ2      LYS  75   5.588 -21.656 -21.656
  591   3HZ   LYS  75           HZ3      LYS  75   5.020 -20.313 -20.313
  592    H    GLY  76           HN       GLY  76   5.095 -16.171 -16.171
  593   1HA   GLY  76           HA1      GLY  76   7.077 -16.032 -16.032
  594   2HA   GLY  76           HA2      GLY  76   6.075 -14.678 -14.678
  595    H    LYS  77           HN       LYS  77   5.539 -18.077 -18.077
  596    HA   LYS  77           HA       LYS  77   3.244 -17.435 -17.435
  597   1HB   LYS  77           HB1      LYS  77   3.696 -20.061 -20.061
  598   2HB   LYS  77           HB2      LYS  77   2.342 -19.652 -19.652
  599   1HG   LYS  77           HG1      LYS  77   1.496 -19.320 -19.320
  600   2HG   LYS  77           HG2      LYS  77   1.887 -17.697 -17.697
  601   1HD   LYS  77           HD1      LYS  77   3.943 -17.675 -17.675
  602   2HD   LYS  77           HD2      LYS  77   3.794 -19.371 -19.371
  603   1HE   LYS  77           HE1      LYS  77   1.915 -17.126 -17.126
  604   2HE   LYS  77           HE2      LYS  77   3.145 -17.890 -17.890
  605   1HZ   LYS  77           HZ1      LYS  77   1.518 -19.888 -19.888
  606   2HZ   LYS  77           HZ2      LYS  77   0.526 -18.682 -18.682
  607   3HZ   LYS  77           HZ3      LYS  77   1.712 -19.432 -19.432
  608    HA   PRO  78           HA       PRO  78   5.785 -20.804 -20.804
  609   1HB   PRO  78           HB1      PRO  78   8.508 -20.414 -20.414
  610   2HB   PRO  78           HB2      PRO  78   7.730 -21.915 -21.915
  611   1HG   PRO  78           HG1      PRO  78   7.824 -21.419 -21.419
  612   2HG   PRO  78           HG2      PRO  78   6.288 -21.965 -21.965
  613   1HD   PRO  78           HD1      PRO  78   7.153 -19.063 -19.063
  614   2HD   PRO  78           HD2      PRO  78   5.720 -19.893 -19.893
  615    H    ASP  79           HN       ASP  79   5.833 -17.721 -17.721
  616    HA   ASP  79           HA       ASP  79   7.310 -15.967 -15.967
  617   1HB   ASP  79           HB1      ASP  79   4.953 -16.943 -16.943
  618   2HB   ASP  79           HB2      ASP  79   5.790 -15.455 -15.455
  619    H    ALA  80           HN       ALA  80   9.269 -16.957 -16.957
  620    HA   ALA  80           HA       ALA  80  10.970 -18.055 -18.055
  621   1HB   ALA  80           HB1      ALA  80  10.302 -15.445 -15.445
  622   2HB   ALA  80           HB2      ALA  80  11.836 -16.289 -16.289
  623   3HB   ALA  80           HB3      ALA  80  11.331 -15.630 -15.630
  624    H    ALA  81           HN       ALA  81   9.222 -19.659 -19.659
  625    HA   ALA  81           HA       ALA  81   8.781 -19.647 -19.647
  626   1HB   ALA  81           HB1      ALA  81   7.814 -21.539 -21.539
  627   2HB   ALA  81           HB2      ALA  81   7.353 -21.637 -21.637
  628   3HB   ALA  81           HB3      ALA  81   6.879 -20.242 -20.242
  629   1H1   BME  16           HE1      MER  16  -7.849   8.933   8.933
  630   2H1   BME  16           HE2      MER  16  -7.277  10.504  10.504
  631   1H2   BME  16           HZ1      MER  16  -6.428   9.321   9.321
  632   2H2   BME  16           HZ2      MER  16  -7.733  10.479  10.479
  633    HO1  BME  16           HH       MER  16  -5.219   9.051   9.051

  Start of MODEL    2
    1    H    ASN   3           HN       ASN   3  -1.698  -9.184  -9.184
    2    HA   ASN   3           HA       ASN   3   0.667 -10.452 -10.452
    3   1HB   ASN   3           HB1      ASN   3  -2.223 -11.416 -11.416
    4   2HB   ASN   3           HB2      ASN   3  -0.990 -12.242 -12.242
    5   1HD2  ASN   3          HD21      ASN   3   0.570 -12.552 -12.552
    6   2HD2  ASN   3          HD22      ASN   3   0.838 -11.260 -11.260
    7    H    ALA   4           HN       ALA   4   0.311 -10.866 -10.866
    8    HA   ALA   4           HA       ALA   4   0.276  -9.737  -9.737
    9   1HB   ALA   4           HB1      ALA   4  -1.667 -11.235 -11.235
   10   2HB   ALA   4           HB2      ALA   4  -2.646  -9.969  -9.969
   11   3HB   ALA   4           HB3      ALA   4  -2.036  -9.781  -9.781
   12    HA   PRO   5           HA       PRO   5  -0.091  -5.478  -5.478
   13   1HB   PRO   5           HB1      PRO   5   2.434  -5.298  -5.298
   14   2HB   PRO   5           HB2      PRO   5   2.094  -4.649  -4.649
   15   1HG   PRO   5           HG1      PRO   5   3.585  -6.865  -6.865
   16   2HG   PRO   5           HG2      PRO   5   2.289  -6.819  -6.819
   17   1HD   PRO   5           HD1      PRO   5   2.171  -8.118  -8.118
   18   2HD   PRO   5           HD2      PRO   5   1.737  -8.809  -8.809
   19    H    LYS   6           HN       LYS   6  -1.704  -4.727  -4.727
   20    HA   LYS   6           HA       LYS   6  -1.996  -4.679  -4.679
   21   1HB   LYS   6           HB1      LYS   6  -4.234  -3.751  -3.751
   22   2HB   LYS   6           HB2      LYS   6  -3.916  -5.173  -5.173
   23   1HG   LYS   6           HG1      LYS   6  -2.921  -3.239  -3.239
   24   2HG   LYS   6           HG2      LYS   6  -4.121  -2.297  -2.297
   25   1HD   LYS   6           HD1      LYS   6  -5.865  -3.970  -3.970
   26   2HD   LYS   6           HD2      LYS   6  -4.643  -4.910  -4.910
   27   1HE   LYS   6           HE1      LYS   6  -4.157  -2.847  -2.847
   28   2HE   LYS   6           HE2      LYS   6  -5.556  -2.088  -2.088
   29   1HZ   LYS   6           HZ1      LYS   6  -6.309  -4.629  -4.629
   30   2HZ   LYS   6           HZ2      LYS   6  -5.484  -3.862  -3.862
   31   3HZ   LYS   6           HZ3      LYS   6  -6.834  -3.114  -3.114
   32    H    ARG   7           HN       ARG   7  -1.437  -3.102  -3.102
   33    HA   ARG   7           HA       ARG   7   0.280  -1.291  -1.291
   34   1HB   ARG   7           HB1      ARG   7  -1.356  -1.553  -1.553
   35   2HB   ARG   7           HB2      ARG   7  -2.481  -0.503  -0.503
   36   1HG   ARG   7           HG1      ARG   7  -0.835   1.366   1.366
   37   2HG   ARG   7           HG2      ARG   7   0.342   0.312   0.312
   38   1HD   ARG   7           HD1      ARG   7  -0.732   1.682   1.682
   39   2HD   ARG   7           HD2      ARG   7  -1.245   0.015   0.015
   40    HE   ARG   7           HE       ARG   7  -3.374   0.637   0.637
   41   1HH1  ARG   7          HH11      ARG   7  -2.195   3.331   3.331
   42   2HH1  ARG   7          HH12      ARG   7  -3.024   4.411   4.411
   43   1HH2  ARG   7          HH21      ARG   7  -4.080   1.811   1.811
   44   2HH2  ARG   7          HH22      ARG   7  -4.123   3.525   3.525
   45    HA   PRO   8           HA       PRO   8  -0.629   1.239   1.239
   46   1HB   PRO   8           HB1      PRO   8   1.910   2.388   2.388
   47   2HB   PRO   8           HB2      PRO   8   1.537   0.776   0.776
   48   1HG   PRO   8           HG1      PRO   8   2.603   1.566   1.566
   49   2HG   PRO   8           HG2      PRO   8   3.301   0.405   0.405
   50   1HD   PRO   8           HD1      PRO   8   1.769  -0.484  -0.484
   51   2HD   PRO   8           HD2      PRO   8   1.468  -1.171  -1.171
   52    HA   PRO   9           HA       PRO   9  -1.319   5.671   5.671
   53   1HB   PRO   9           HB1      PRO   9   1.494   5.861   5.861
   54   2HB   PRO   9           HB2      PRO   9   0.228   7.097   7.097
   55   1HG   PRO   9           HG1      PRO   9   0.386   5.430   5.430
   56   2HG   PRO   9           HG2      PRO   9  -1.215   5.711   5.711
   57   1HD   PRO   9           HD1      PRO   9   0.564   3.293   3.293
   58   2HD   PRO   9           HD2      PRO   9  -1.207   3.371   3.371
   59    H    SER  10           HN       SER  10  -0.474   7.556   7.556
   60    HA   SER  10           HA       SER  10   0.768   6.656   6.656
   61   1HB   SER  10           HB1      SER  10  -1.522   7.505   7.505
   62   2HB   SER  10           HB2      SER  10  -1.066   9.024   9.024
   63    HG   SER  10           HG       SER  10  -0.319   9.640   9.640
   64    H    ALA  11           HN       ALA  11   0.595   9.658   9.658
   65    HA   ALA  11           HA       ALA  11   3.185  10.288  10.288
   66   1HB   ALA  11           HB1      ALA  11   2.429  11.453  11.453
   67   2HB   ALA  11           HB2      ALA  11   3.853  11.833  11.833
   68   3HB   ALA  11           HB3      ALA  11   3.696  10.247  10.247
   69    H    PHE  12           HN       PHE  12   0.146  11.333  11.333
   70    HA   PHE  12           HA       PHE  12   0.272  13.851  13.851
   71   1HB   PHE  12           HB1      PHE  12  -1.345  14.631  14.631
   72   2HB   PHE  12           HB2      PHE  12  -0.661  13.378  13.378
   73    HD1  PHE  12           HD1      PHE  12  -3.518  14.117  14.117
   74    HD2  PHE  12           HD2      PHE  12  -2.024  11.847  11.847
   75    HE1  PHE  12           HE1      PHE  12  -5.783  13.333  13.333
   76    HE2  PHE  12           HE2      PHE  12  -4.295  11.066  11.066
   77    HZ   PHE  12           HZ       PHE  12  -6.186  11.795  11.795
   78    H    PHE  13           HN       PHE  13  -0.376  10.749  10.749
   79    HA   PHE  13           HA       PHE  13  -2.890  10.911  10.911
   80   1HB   PHE  13           HB1      PHE  13  -1.506   8.785   8.785
   81   2HB   PHE  13           HB2      PHE  13  -0.628   9.182   9.182
   82    HD1  PHE  13           HD1      PHE  13  -3.985   8.512   8.512
   83    HD2  PHE  13           HD2      PHE  13  -1.690   8.818   8.818
   84    HE1  PHE  13           HE1      PHE  13  -5.876   7.625   7.625
   85    HE2  PHE  13           HE2      PHE  13  -3.590   7.933   7.933
   86    HZ   PHE  13           HZ       PHE  13  -5.684   7.334   7.334
   87    H    LEU  14           HN       LEU  14   0.499  11.256  11.256
   88    HA   LEU  14           HA       LEU  14   0.224  11.948  11.948
   89   1HB   LEU  14           HB1      LEU  14   2.282  13.090  13.090
   90   2HB   LEU  14           HB2      LEU  14   2.484  13.035  13.035
   91    HG   LEU  14           HG       LEU  14   3.864  11.345  11.345
   92   1HD1  LEU  14          HD11      LEU  14   2.504  10.324  10.324
   93   2HD1  LEU  14          HD12      LEU  14   1.332   9.768   9.768
   94   3HD1  LEU  14          HD13      LEU  14   2.968   9.129   9.129
   95   1HD2  LEU  14          HD21      LEU  14   3.425  11.284  11.284
   96   2HD2  LEU  14          HD22      LEU  14   3.477   9.654   9.654
   97   3HD2  LEU  14          HD23      LEU  14   1.937  10.380  10.380
   98    H    PHE  15           HN       PHE  15   0.607  14.054  14.054
   99    HA   PHE  15           HA       PHE  15   0.112  16.585  16.585
  100   1HB   PHE  15           HB1      PHE  15   0.951  16.451  16.451
  101   2HB   PHE  15           HB2      PHE  15  -0.190  15.162  15.162
  102    HD1  PHE  15           HD1      PHE  15  -2.329  15.660  15.660
  103    HD2  PHE  15           HD2      PHE  15   0.363  18.801  18.801
  104    HE1  PHE  15           HE1      PHE  15  -3.635  17.221  17.221
  105    HE2  PHE  15           HE2      PHE  15  -0.952  20.365  20.365
  106    HZ   PHE  15           HZ       PHE  15  -2.948  19.572  19.572
  107    H    CYS  16           HN       MER  16  -2.327  14.545  14.545
  108    HA   CYS  16           HA       MER  16  -4.626  15.999  15.999
  109   1HB   CYS  16           HB1      MER  16  -4.693  13.836  13.836
  110   2HB   CYS  16           HB2      MER  16  -4.268  12.993  12.993
  111    H    SER  17           HN       SER  17  -3.276  13.598  13.598
  112    HA   SER  17           HA       SER  17  -5.016  13.733  13.733
  113   1HB   SER  17           HB1      SER  17  -2.912  12.282  12.282
  114   2HB   SER  17           HB2      SER  17  -2.020  13.520  13.520
  115    HG   SER  17           HG       SER  17  -2.849  12.743  12.743
  116    H    GLU  18           HN       GLU  18  -2.032  15.502  15.502
  117    HA   GLU  18           HA       GLU  18  -1.839  17.102  17.102
  118   1HB   GLU  18           HB1      GLU  18  -0.333  17.116  17.116
  119   2HB   GLU  18           HB2      GLU  18  -1.509  18.111  18.111
  120   1HG   GLU  18           HG1      GLU  18  -1.295  19.940  19.940
  121   2HG   GLU  18           HG2      GLU  18  -0.313  18.987  18.987
  122    H    TYR  19           HN       TYR  19  -3.993  17.787  17.787
  123    HA   TYR  19           HA       TYR  19  -5.532  19.515  19.515
  124   1HB   TYR  19           HB1      TYR  19  -5.694  21.294  21.294
  125   2HB   TYR  19           HB2      TYR  19  -3.973  20.877  20.877
  126    HD1  TYR  19           HD1      TYR  19  -3.367  18.825  18.825
  127    HD2  TYR  19           HD2      TYR  19  -6.211  21.976  21.976
  128    HE1  TYR  19           HE1      TYR  19  -3.228  18.752  18.752
  129    HE2  TYR  19           HE2      TYR  19  -6.074  21.903  21.903
  130    HH   TYR  19           HH       TYR  19  -3.961  21.005  21.005
  131    H    ARG  20           HN       ARG  20  -6.208  16.952  16.952
  132    HA   ARG  20           HA       ARG  20  -8.281  16.934  16.934
  133   1HB   ARG  20           HB1      ARG  20  -7.370  14.781  14.781
  134   2HB   ARG  20           HB2      ARG  20  -7.671  15.053  15.053
  135   1HG   ARG  20           HG1      ARG  20 -10.137  15.045  15.045
  136   2HG   ARG  20           HG2      ARG  20  -9.809  14.786  14.786
  137   1HD   ARG  20           HD1      ARG  20 -10.426  12.678  12.678
  138   2HD   ARG  20           HD2      ARG  20  -8.786  12.584  12.584
  139    HE   ARG  20           HE       ARG  20  -9.312  13.306  13.306
  140   1HH1  ARG  20          HH11      ARG  20  -8.955  10.512  10.512
  141   2HH1  ARG  20          HH12      ARG  20  -7.464  10.009  10.009
  142   1HH2  ARG  20          HH21      ARG  20  -6.911  13.123  13.123
  143   2HH2  ARG  20          HH22      ARG  20  -6.280  11.526  11.526
  144    HA   PRO  21           HA       PRO  21 -11.192  17.450  17.450
  145   1HB   PRO  21           HB1      PRO  21  -9.410  18.992  18.992
  146   2HB   PRO  21           HB2      PRO  21 -10.607  17.743  17.743
  147   1HG   PRO  21           HG1      PRO  21  -8.028  17.043  17.043
  148   2HG   PRO  21           HG2      PRO  21  -9.144  15.967  15.967
  149   1HD   PRO  21           HD1      PRO  21  -7.420  18.194  18.194
  150   2HD   PRO  21           HD2      PRO  21  -7.453  16.482  16.482
  151    H    LYS  22           HN       LYS  22  -8.854  19.857  19.857
  152    HA   LYS  22           HA       LYS  22 -10.544  22.166  22.166
  153   1HB   LYS  22           HB1      LYS  22  -7.812  21.584  21.584
  154   2HB   LYS  22           HB2      LYS  22  -8.563  23.072  23.072
  155   1HG   LYS  22           HG1      LYS  22  -8.916  23.846  23.846
  156   2HG   LYS  22           HG2      LYS  22  -8.410  22.316  22.316
  157   1HD   LYS  22           HD1      LYS  22  -6.536  23.984  23.984
  158   2HD   LYS  22           HD2      LYS  22  -6.704  24.281  24.281
  159   1HE   LYS  22           HE1      LYS  22  -6.034  21.943  21.943
  160   2HE   LYS  22           HE2      LYS  22  -5.901  21.598  21.598
  161   1HZ   LYS  22           HZ1      LYS  22  -4.416  23.894  23.894
  162   2HZ   LYS  22           HZ2      LYS  22  -4.008  22.730  22.730
  163   3HZ   LYS  22           HZ3      LYS  22  -3.862  22.363  22.363
  164    H    ILE  23           HN       ILE  23  -9.982  20.031  20.031
  165    HA   ILE  23           HA       ILE  23 -11.402  22.023  22.023
  166    HB   ILE  23           HB       ILE  23 -11.189  20.201  20.201
  167   1HG1  ILE  23          HG11      ILE  23  -9.199  18.867  18.867
  168   2HG1  ILE  23          HG12      ILE  23 -10.839  18.272  18.272
  169   1HG2  ILE  23          HG21      ILE  23  -9.650  22.111  22.111
  170   2HG2  ILE  23          HG22      ILE  23  -8.643  21.251  21.251
  171   3HG2  ILE  23          HG23      ILE  23  -8.762  20.690  20.690
  172   1HD1  ILE  23          HD11      ILE  23 -10.505  17.999  17.999
  173   2HD1  ILE  23          HD12      ILE  23  -8.844  18.544  18.544
  174   3HD1  ILE  23          HD13      ILE  23  -9.365  17.060  17.060
  175    H    LYS  24           HN       LYS  24 -11.778  19.062  19.062
  176    HA   LYS  24           HA       LYS  24 -14.330  18.243  18.243
  177   1HB   LYS  24           HB1      LYS  24 -12.522  16.937  16.937
  178   2HB   LYS  24           HB2      LYS  24 -12.777  17.779  17.779
  179   1HG   LYS  24           HG1      LYS  24 -15.049  16.913  16.913
  180   2HG   LYS  24           HG2      LYS  24 -15.014  16.167  16.167
  181   1HD   LYS  24           HD1      LYS  24 -13.159  15.427  15.427
  182   2HD   LYS  24           HD2      LYS  24 -14.606  14.540  14.540
  183   1HE   LYS  24           HE1      LYS  24 -12.230  14.949  14.949
  184   2HE   LYS  24           HE2      LYS  24 -12.581  13.486  13.486
  185   1HZ   LYS  24           HZ1      LYS  24 -14.912  14.223  14.223
  186   2HZ   LYS  24           HZ2      LYS  24 -13.646  14.321  14.321
  187   3HZ   LYS  24           HZ3      LYS  24 -13.931  12.870  12.870
  188    H    GLY  25           HN       GLY  25 -13.155  20.439  20.439
  189   1HA   GLY  25           HA1      GLY  25 -15.574  20.777  20.777
  190   2HA   GLY  25           HA2      GLY  25 -14.137  21.810  21.810
  191    H    GLU  26           HN       GLU  26 -13.934  22.557  22.557
  192    HA   GLU  26           HA       GLU  26 -15.871  24.665  24.665
  193   1HB   GLU  26           HB1      GLU  26 -13.779  23.675  23.675
  194   2HB   GLU  26           HB2      GLU  26 -14.624  25.203  25.203
  195   1HG   GLU  26           HG1      GLU  26 -12.999  24.504  24.504
  196   2HG   GLU  26           HG2      GLU  26 -12.246  25.222  25.222
  197    H    HIS  27           HN       HIS  27 -15.254  21.733  21.733
  198    HA   HIS  27           HA       HIS  27 -17.918  21.893  21.893
  199   1HB   HIS  27           HB1      HIS  27 -15.405  20.597  20.597
  200   2HB   HIS  27           HB2      HIS  27 -16.911  20.945  20.945
  201    HD1  HIS  27           HD1      HIS  27 -17.430  23.697  23.697
  202    HD2  HIS  27           HD2      HIS  27 -13.524  22.579  22.579
  203    HE1  HIS  27           HE1      HIS  27 -16.069  25.700  25.700
  204    HA   PRO  28           HA       PRO  28 -17.999  17.869  17.869
  205   1HB   PRO  28           HB1      PRO  28 -20.036  18.343  18.343
  206   2HB   PRO  28           HB2      PRO  28 -18.430  18.967  18.967
  207   1HG   PRO  28           HG1      PRO  28 -20.737  20.448  20.448
  208   2HG   PRO  28           HG2      PRO  28 -19.804  20.973  20.973
  209   1HD   PRO  28           HD1      PRO  28 -19.134  21.785  21.785
  210   2HD   PRO  28           HD2      PRO  28 -17.887  21.546  21.546
  211    H    GLY  29           HN       GLY  29 -18.672  18.587  18.587
  212   1HA   GLY  29           HA1      GLY  29 -21.338  17.409  17.409
  213   2HA   GLY  29           HA2      GLY  29 -20.744  18.776  18.776
  214    H    LEU  30           HN       LEU  30 -17.967  17.316  17.316
  215    HA   LEU  30           HA       LEU  30 -17.995  15.941  15.941
  216   1HB   LEU  30           HB1      LEU  30 -15.779  16.132  16.132
  217   2HB   LEU  30           HB2      LEU  30 -15.559  15.740  15.740
  218    HG   LEU  30           HG       LEU  30 -16.392  18.377  18.377
  219   1HD1  LEU  30          HD11      LEU  30 -13.884  17.556  17.556
  220   2HD1  LEU  30          HD12      LEU  30 -14.233  19.190  19.190
  221   3HD1  LEU  30          HD13      LEU  30 -14.012  17.911  17.911
  222   1HD2  LEU  30          HD21      LEU  30 -16.059  17.757  17.757
  223   2HD2  LEU  30          HD22      LEU  30 -17.579  18.118  18.118
  224   3HD2  LEU  30          HD23      LEU  30 -16.333  19.344  19.344
  225    H    SER  31           HN       SER  31 -16.867  13.889  13.889
  226    HA   SER  31           HA       SER  31 -17.647  11.893  11.893
  227   1HB   SER  31           HB1      SER  31 -17.943  10.293  10.293
  228   2HB   SER  31           HB2      SER  31 -18.914  11.731  11.731
  229    HG   SER  31           HG       SER  31 -17.696  12.102  12.102
  230    H    ILE  32           HN       ILE  32 -16.214   9.817   9.817
  231    HA   ILE  32           HA       ILE  32 -13.486  10.669  10.669
  232    HB   ILE  32           HB       ILE  32 -14.636   8.737   8.737
  233   1HG1  ILE  32          HG11      ILE  32 -12.810   7.085   7.085
  234   2HG1  ILE  32          HG12      ILE  32 -12.209   7.773   7.773
  235   1HG2  ILE  32          HG21      ILE  32 -14.501   7.435   7.435
  236   2HG2  ILE  32          HG22      ILE  32 -14.964   6.601   6.601
  237   3HG2  ILE  32          HG23      ILE  32 -15.959   7.905   7.905
  238   1HD1  ILE  32          HD11      ILE  32 -12.283   9.190   9.190
  239   2HD1  ILE  32          HD12      ILE  32 -10.846   8.549   8.549
  240   3HD1  ILE  32          HD13      ILE  32 -11.689   9.913   9.913
  241    H    GLY  33           HN       GLY  33 -15.194  10.657  10.657
  242   1HA   GLY  33           HA1      GLY  33 -13.118   9.816   9.816
  243   2HA   GLY  33           HA2      GLY  33 -14.850   9.943   9.943
  244    H    ASP  34           HN       ASP  34 -14.686  12.482  12.482
  245    HA   ASP  34           HA       ASP  34 -13.931  14.300  14.300
  246   1HB   ASP  34           HB1      ASP  34 -15.816  14.464  14.464
  247   2HB   ASP  34           HB2      ASP  34 -15.326  15.956  15.956
  248    H    VAL  35           HN       VAL  35 -13.703  13.847  13.847
  249    HA   VAL  35           HA       VAL  35 -11.836  15.943  15.943
  250    HB   VAL  35           HB       VAL  35 -12.358  13.205  13.205
  251   1HG1  VAL  35          HG11      VAL  35 -10.881  15.610  15.610
  252   2HG1  VAL  35          HG12      VAL  35 -11.252  14.133  14.133
  253   3HG1  VAL  35          HG13      VAL  35 -10.118  14.100  14.100
  254   1HG2  VAL  35          HG21      VAL  35 -13.365  15.968  15.968
  255   2HG2  VAL  35          HG22      VAL  35 -14.303  14.671  14.671
  256   3HG2  VAL  35          HG23      VAL  35 -13.661  14.490  14.490
  257    H    ALA  36           HN       ALA  36 -11.633  12.812  12.812
  258    HA   ALA  36           HA       ALA  36  -8.774  12.545  12.545
  259   1HB   ALA  36           HB1      ALA  36 -10.982  11.027  11.027
  260   2HB   ALA  36           HB2      ALA  36  -9.316  10.455  10.455
  261   3HB   ALA  36           HB3      ALA  36 -10.293  10.625  10.625
  262    H    LYS  37           HN       LYS  37 -11.251  13.344  13.344
  263    HA   LYS  37           HA       LYS  37  -9.265  13.513  13.513
  264   1HB   LYS  37           HB1      LYS  37 -12.096  13.633  13.633
  265   2HB   LYS  37           HB2      LYS  37 -11.619  15.204  15.204
  266   1HG   LYS  37           HG1      LYS  37 -10.074  14.027  14.027
  267   2HG   LYS  37           HG2      LYS  37 -10.756  12.505  12.505
  268   1HD   LYS  37           HD1      LYS  37 -12.984  13.138  13.138
  269   2HD   LYS  37           HD2      LYS  37 -12.418  14.740  14.740
  270   1HE   LYS  37           HE1      LYS  37 -10.832  13.713  13.713
  271   2HE   LYS  37           HE2      LYS  37 -11.423  12.115  12.115
  272   1HZ   LYS  37           HZ1      LYS  37 -13.617  13.735  13.735
  273   2HZ   LYS  37           HZ2      LYS  37 -12.460  13.891  13.891
  274   3HZ   LYS  37           HZ3      LYS  37 -13.044  12.356  12.356
  275    H    LYS  38           HN       LYS  38 -10.658  15.905  15.905
  276    HA   LYS  38           HA       LYS  38  -9.630  18.238  18.238
  277   1HB   LYS  38           HB1      LYS  38 -10.736  17.473  17.473
  278   2HB   LYS  38           HB2      LYS  38  -9.716  18.890  18.890
  279   1HG   LYS  38           HG1      LYS  38 -11.956  19.651  19.651
  280   2HG   LYS  38           HG2      LYS  38 -11.098  19.829  19.829
  281   1HD   LYS  38           HD1      LYS  38 -12.122  17.679  17.679
  282   2HD   LYS  38           HD2      LYS  38 -13.025  17.568  17.568
  283   1HE   LYS  38           HE1      LYS  38 -14.110  19.747  19.747
  284   2HE   LYS  38           HE2      LYS  38 -13.235  19.863  19.863
  285   1HZ   LYS  38           HZ1      LYS  38 -14.500  17.368  17.368
  286   2HZ   LYS  38           HZ2      LYS  38 -15.636  18.567  18.567
  287   3HZ   LYS  38           HZ3      LYS  38 -14.778  18.659  18.659
  288    H    LEU  39           HN       LEU  39  -8.468  16.321  16.321
  289    HA   LEU  39           HA       LEU  39  -5.964  17.722  17.722
  290   1HB   LEU  39           HB1      LEU  39  -6.853  14.979  14.979
  291   2HB   LEU  39           HB2      LEU  39  -5.260  15.624  15.624
  292    HG   LEU  39           HG       LEU  39  -7.814  17.056  17.056
  293   1HD1  LEU  39          HD11      LEU  39  -6.223  15.296  15.296
  294   2HD1  LEU  39          HD12      LEU  39  -7.595  16.224  16.224
  295   3HD1  LEU  39          HD13      LEU  39  -7.824  14.885  14.885
  296   1HD2  LEU  39          HD21      LEU  39  -5.699  18.436  18.436
  297   2HD2  LEU  39          HD22      LEU  39  -6.432  18.294  18.294
  298   3HD2  LEU  39          HD23      LEU  39  -5.057  17.292  17.292
  299    H    GLY  40           HN       GLY  40  -6.987  14.769  14.769
  300   1HA   GLY  40           HA1      GLY  40  -4.562  13.838  13.838
  301   2HA   GLY  40           HA2      GLY  40  -6.099  13.572  13.572
  302    H    GLU  41           HN       GLU  41  -6.342  16.645  16.645
  303    HA   GLU  41           HA       GLU  41  -4.830  16.985  16.985
  304   1HB   GLU  41           HB1      GLU  41  -7.159  18.375  18.375
  305   2HB   GLU  41           HB2      GLU  41  -6.367  19.067  19.067
  306   1HG   GLU  41           HG1      GLU  41  -7.598  16.270  16.270
  307   2HG   GLU  41           HG2      GLU  41  -8.388  17.682  17.682
  308    H    MET  42           HN       MET  42  -5.613  18.844  18.844
  309    HA   MET  42           HA       MET  42  -3.867  20.983  20.983
  310   1HB   MET  42           HB1      MET  42  -4.639  19.584  19.584
  311   2HB   MET  42           HB2      MET  42  -3.787  21.125  21.125
  312   1HG   MET  42           HG1      MET  42  -5.707  21.902  21.902
  313   2HG   MET  42           HG2      MET  42  -6.569  20.499  20.499
  314   1HE   MET  42           HE1      MET  42  -6.923  19.919  19.919
  315   2HE   MET  42           HE2      MET  42  -7.804  21.103  21.103
  316   3HE   MET  42           HE3      MET  42  -8.404  20.653  20.653
  317    H    TRP  43           HN       TRP  43  -3.251  17.860  17.860
  318    HA   TRP  43           HA       TRP  43  -0.636  18.091  18.091
  319   1HB   TRP  43           HB1      TRP  43  -1.963  16.183  16.183
  320   2HB   TRP  43           HB2      TRP  43  -2.260  15.831  15.831
  321    HD1  TRP  43           HD1      TRP  43  -0.660  14.247  14.247
  322    HE1  TRP  43           HE1      TRP  43   1.580  13.362  13.362
  323    HE3  TRP  43           HE3      TRP  43   0.121  16.885  16.885
  324    HZ2  TRP  43           HZ2      TRP  43   3.598  13.669  13.669
  325    HZ3  TRP  43           HZ3      TRP  43   2.139  16.606  16.606
  326    HH2  TRP  43           HH2      TRP  43   3.889  14.987  14.987
  327    H    ASN  44           HN       ASN  44  -1.880  17.307  17.307
  328    HA   ASN  44           HA       ASN  44   0.682  16.859  16.859
  329   1HB   ASN  44           HB1      ASN  44  -1.965  17.602  17.602
  330   2HB   ASN  44           HB2      ASN  44  -0.512  17.105  17.105
  331   1HD2  ASN  44          HD21      ASN  44  -2.839  14.179  14.179
  332   2HD2  ASN  44          HD22      ASN  44  -3.235  15.735  15.735
  333    H    ASN  45           HN       ASN  45  -0.567  19.641  19.641
  334    HA   ASN  45           HA       ASN  45   1.367  21.336  21.336
  335   1HB   ASN  45           HB1      ASN  45  -0.390  23.061  23.061
  336   2HB   ASN  45           HB2      ASN  45  -0.739  21.568  21.568
  337   1HD2  ASN  45          HD21      ASN  45  -3.880  21.217  21.217
  338   2HD2  ASN  45          HD22      ASN  45  -2.838  20.754  20.754
  339    H    THR  46           HN       THR  46   1.413  20.344  20.344
  340    HA   THR  46           HA       THR  46   0.368  22.440  22.440
  341    HB   THR  46           HB       THR  46   0.541  20.094  20.094
  342    HG1  THR  46           HG1      THR  46   2.444  21.238  21.238
  343   1HG2  THR  46          HG21      THR  46   2.739  19.328  19.328
  344   2HG2  THR  46          HG22      THR  46   3.608  20.410  20.410
  345   3HG2  THR  46          HG23      THR  46   2.684  19.082  19.082
  346    H    ALA  47           HN       ALA  47   3.576  21.328  21.328
  347    HA   ALA  47           HA       ALA  47   4.620  24.013  24.013
  348   1HB   ALA  47           HB1      ALA  47   5.707  22.203  22.203
  349   2HB   ALA  47           HB2      ALA  47   6.410  23.738  23.738
  350   3HB   ALA  47           HB3      ALA  47   4.825  23.696  23.696
  351    H    ALA  48           HN       ALA  48   5.519  20.762  20.762
  352    HA   ALA  48           HA       ALA  48   6.394  19.109  19.109
  353   1HB   ALA  48           HB1      ALA  48   6.453  20.649  20.649
  354   2HB   ALA  48           HB2      ALA  48   7.907  21.400  21.400
  355   3HB   ALA  48           HB3      ALA  48   7.918  19.703  19.703
  356    H    ASP  49           HN       ASP  49   7.644  21.766  21.766
  357    HA   ASP  49           HA       ASP  49  10.165  20.468  20.468
  358   1HB   ASP  49           HB1      ASP  49   9.256  23.360  23.360
  359   2HB   ASP  49           HB2      ASP  49  10.879  22.751  22.751
  360    H    ASP  50           HN       ASP  50   7.092  20.456  20.456
  361    HA   ASP  50           HA       ASP  50   7.637  20.473  20.473
  362   1HB   ASP  50           HB1      ASP  50   6.099  22.375  22.375
  363   2HB   ASP  50           HB2      ASP  50   4.945  21.100  21.100
  364    H    LYS  51           HN       LYS  51   7.018  18.758  18.758
  365    HA   LYS  51           HA       LYS  51   5.240  16.722  16.722
  366   1HB   LYS  51           HB1      LYS  51   6.772  16.694  16.694
  367   2HB   LYS  51           HB2      LYS  51   5.465  15.622  15.622
  368   1HG   LYS  51           HG1      LYS  51   3.915  17.499  17.499
  369   2HG   LYS  51           HG2      LYS  51   5.189  18.646  18.646
  370   1HD   LYS  51           HD1      LYS  51   4.076  18.366  18.366
  371   2HD   LYS  51           HD2      LYS  51   5.498  17.346  17.346
  372   1HE   LYS  51           HE1      LYS  51   2.903  16.254  16.254
  373   2HE   LYS  51           HE2      LYS  51   3.308  16.364  16.364
  374   1HZ   LYS  51           HZ1      LYS  51   5.477  15.226  15.226
  375   2HZ   LYS  51           HZ2      LYS  51   4.074  14.393  14.393
  376   3HZ   LYS  51           HZ3      LYS  51   4.479  14.517  14.517
  377    H    GLN  52           HN       GLN  52   8.472  16.981  16.981
  378    HA   GLN  52           HA       GLN  52   9.764  14.750  14.750
  379   1HB   GLN  52           HB1      GLN  52  10.535  17.446  17.446
  380   2HB   GLN  52           HB2      GLN  52  11.200  16.861  16.861
  381   1HG   GLN  52           HG1      GLN  52  12.890  16.604  16.604
  382   2HG   GLN  52           HG2      GLN  52  12.351  15.004  15.004
  383   1HE2  GLN  52          HE21      GLN  52  10.328  15.658  15.658
  384   2HE2  GLN  52          HE22      GLN  52   9.847  16.273  16.273
  385    HA   PRO  53           HA       PRO  53  10.214  14.558  14.558
  386   1HB   PRO  53           HB1      PRO  53   8.187  15.894  15.894
  387   2HB   PRO  53           HB2      PRO  53   9.804  16.533  16.533
  388   1HG   PRO  53           HG1      PRO  53   7.330  16.951  16.951
  389   2HG   PRO  53           HG2      PRO  53   8.380  18.194  18.194
  390   1HD   PRO  53           HD1      PRO  53   8.888  17.471  17.471
  391   2HD   PRO  53           HD2      PRO  53  10.269  17.495  17.495
  392    H    TYR  54           HN       TYR  54   6.895  15.060  15.060
  393    HA   TYR  54           HA       TYR  54   5.772  12.809  12.809
  394   1HB   TYR  54           HB1      TYR  54   4.711  14.325  14.325
  395   2HB   TYR  54           HB2      TYR  54   3.766  13.258  13.258
  396    HD1  TYR  54           HD1      TYR  54   4.699  14.035  14.035
  397    HD2  TYR  54           HD2      TYR  54   3.914  16.472  16.472
  398    HE1  TYR  54           HE1      TYR  54   4.280  15.956  15.956
  399    HE2  TYR  54           HE2      TYR  54   3.497  18.383  18.383
  400    HH   TYR  54           HH       TYR  54   4.452  18.591  18.591
  401    H    GLU  55           HN       GLU  55   6.581  13.436  13.436
  402    HA   GLU  55           HA       GLU  55   5.864  10.928  10.928
  403   1HB   GLU  55           HB1      GLU  55   6.767  13.311  13.311
  404   2HB   GLU  55           HB2      GLU  55   8.245  12.380  12.380
  405   1HG   GLU  55           HG1      GLU  55   5.534  11.420  11.420
  406   2HG   GLU  55           HG2      GLU  55   6.655  12.245  12.245
  407    H    LYS  56           HN       LYS  56   9.097  11.946  11.946
  408    HA   LYS  56           HA       LYS  56  10.519   9.634   9.634
  409   1HB   LYS  56           HB1      LYS  56  11.718  11.501  11.501
  410   2HB   LYS  56           HB2      LYS  56  10.627  11.625  11.625
  411   1HG   LYS  56           HG1      LYS  56  11.478   9.487   9.487
  412   2HG   LYS  56           HG2      LYS  56  12.515   9.260   9.260
  413   1HD   LYS  56           HD1      LYS  56  12.738  11.674  11.674
  414   2HD   LYS  56           HD2      LYS  56  13.582  10.177  10.177
  415   1HE   LYS  56           HE1      LYS  56  14.688  10.340  10.340
  416   2HE   LYS  56           HE2      LYS  56  13.915  11.905  11.905
  417   1HZ   LYS  56           HZ1      LYS  56  15.143  11.912  11.912
  418   2HZ   LYS  56           HZ2      LYS  56  16.263  11.303  11.303
  419   3HZ   LYS  56           HZ3      LYS  56  15.547  12.821  12.821
  420    H    LYS  57           HN       LYS  57   8.294  10.366  10.366
  421    HA   LYS  57           HA       LYS  57   8.651   8.030   8.030
  422   1HB   LYS  57           HB1      LYS  57   7.129  10.339  10.339
  423   2HB   LYS  57           HB2      LYS  57   5.866   9.184   9.184
  424   1HG   LYS  57           HG1      LYS  57   5.931   9.025   9.025
  425   2HG   LYS  57           HG2      LYS  57   6.990   7.712   7.712
  426   1HD   LYS  57           HD1      LYS  57   8.496   8.712   8.712
  427   2HD   LYS  57           HD2      LYS  57   8.812   9.795   9.795
  428   1HE   LYS  57           HE1      LYS  57   6.869  10.287  10.287
  429   2HE   LYS  57           HE2      LYS  57   8.380  11.125  11.125
  430   1HZ   LYS  57           HZ1      LYS  57   6.808  11.370  11.370
  431   2HZ   LYS  57           HZ2      LYS  57   5.849  11.754  11.754
  432   3HZ   LYS  57           HZ3      LYS  57   7.308  12.577  12.577
  433    H    ALA  58           HN       ALA  58   6.063   8.841   8.841
  434    HA   ALA  58           HA       ALA  58   4.729   6.459   6.459
  435   1HB   ALA  58           HB1      ALA  58   5.440   8.337   8.337
  436   2HB   ALA  58           HB2      ALA  58   4.181   7.113   7.113
  437   3HB   ALA  58           HB3      ALA  58   4.060   8.473   8.473
  438    H    ALA  59           HN       ALA  59   7.469   7.403   7.403
  439    HA   ALA  59           HA       ALA  59   7.849   5.117   5.117
  440   1HB   ALA  59           HB1      ALA  59   9.163   7.245   7.245
  441   2HB   ALA  59           HB2      ALA  59  10.011   6.924   6.924
  442   3HB   ALA  59           HB3      ALA  59  10.248   5.872   5.872
  443    H    LYS  60           HN       LYS  60   9.551   5.838   5.838
  444    HA   LYS  60           HA       LYS  60  10.876   3.477   3.477
  445   1HB   LYS  60           HB1      LYS  60  10.824   5.647   5.647
  446   2HB   LYS  60           HB2      LYS  60   9.425   4.998   4.998
  447   1HG   LYS  60           HG1      LYS  60  10.786   2.953   2.953
  448   2HG   LYS  60           HG2      LYS  60  12.184   3.708   3.708
  449   1HD   LYS  60           HD1      LYS  60  10.617   4.782   4.782
  450   2HD   LYS  60           HD2      LYS  60  12.200   4.037   4.037
  451   1HE   LYS  60           HE1      LYS  60  13.114   5.900   5.900
  452   2HE   LYS  60           HE2      LYS  60  11.538   6.678   6.678
  453   1HZ   LYS  60           HZ1      LYS  60  12.275   6.017   6.017
  454   2HZ   LYS  60           HZ2      LYS  60  13.572   6.828   6.828
  455   3HZ   LYS  60           HZ3      LYS  60  12.036   7.551   7.551
  456    H    LEU  61           HN       LEU  61   7.527   4.167   4.167
  457    HA   LEU  61           HA       LEU  61   7.088   1.542   1.542
  458   1HB   LEU  61           HB1      LEU  61   5.005   3.457   3.457
  459   2HB   LEU  61           HB2      LEU  61   4.732   2.199   2.199
  460    HG   LEU  61           HG       LEU  61   6.456   4.694   4.694
  461   1HD1  LEU  61          HD11      LEU  61   4.081   5.083   5.083
  462   2HD1  LEU  61          HD12      LEU  61   3.927   3.800   3.800
  463   3HD1  LEU  61          HD13      LEU  61   4.851   5.252   5.252
  464   1HD2  LEU  61          HD21      LEU  61   6.106   2.394   2.394
  465   2HD2  LEU  61          HD22      LEU  61   7.598   2.820   2.820
  466   3HD2  LEU  61          HD23      LEU  61   6.908   3.921   3.921
  467    H    LYS  62           HN       LYS  62   5.925   2.847   2.847
  468    HA   LYS  62           HA       LYS  62   4.768   0.557   0.557
  469   1HB   LYS  62           HB1      LYS  62   4.821   2.772   2.772
  470   2HB   LYS  62           HB2      LYS  62   6.539   2.639   2.639
  471   1HG   LYS  62           HG1      LYS  62   6.061   0.593   0.593
  472   2HG   LYS  62           HG2      LYS  62   4.348   0.800   0.800
  473   1HD   LYS  62           HD1      LYS  62   6.111   2.884   2.884
  474   2HD   LYS  62           HD2      LYS  62   5.177   1.702   1.702
  475   1HE   LYS  62           HE1      LYS  62   3.815   3.684   3.684
  476   2HE   LYS  62           HE2      LYS  62   3.098   2.615   2.615
  477   1HZ   LYS  62           HZ1      LYS  62   5.093   4.151   4.151
  478   2HZ   LYS  62           HZ2      LYS  62   4.071   5.186   5.186
  479   3HZ   LYS  62           HZ3      LYS  62   3.417   4.127   4.127
  480    H    GLU  63           HN       GLU  63   8.141   1.494   1.494
  481    HA   GLU  63           HA       GLU  63   9.274  -0.688  -0.688
  482   1HB   GLU  63           HB1      GLU  63  10.492   1.439   1.439
  483   2HB   GLU  63           HB2      GLU  63  10.372   1.175   1.175
  484   1HG   GLU  63           HG1      GLU  63  11.886  -0.769  -0.769
  485   2HG   GLU  63           HG2      GLU  63  11.966  -0.595  -0.595
  486    H    LYS  64           HN       LYS  64   8.909  -0.135  -0.135
  487    HA   LYS  64           HA       LYS  64  10.012  -2.514  -2.514
  488   1HB   LYS  64           HB1      LYS  64   9.095  -0.693  -0.693
  489   2HB   LYS  64           HB2      LYS  64   7.464  -1.182  -1.182
  490   1HG   LYS  64           HG1      LYS  64   8.000  -3.511  -3.511
  491   2HG   LYS  64           HG2      LYS  64   9.548  -2.890  -2.890
  492   1HD   LYS  64           HD1      LYS  64   8.050  -2.842  -2.842
  493   2HD   LYS  64           HD2      LYS  64   8.324  -1.182  -1.182
  494   1HE   LYS  64           HE1      LYS  64   6.146  -1.153  -1.153
  495   2HE   LYS  64           HE2      LYS  64   5.887  -2.847  -2.847
  496   1HZ   LYS  64           HZ1      LYS  64   6.458  -1.461  -1.461
  497   2HZ   LYS  64           HZ2      LYS  64   5.273  -0.594  -0.594
  498   3HZ   LYS  64           HZ3      LYS  64   5.014  -2.228  -2.228
  499    H    TYR  65           HN       TYR  65   6.673  -1.939  -1.939
  500    HA   TYR  65           HA       TYR  65   5.556  -4.466  -4.466
  501   1HB   TYR  65           HB1      TYR  65   4.056  -2.751  -2.751
  502   2HB   TYR  65           HB2      TYR  65   5.076  -2.147  -2.147
  503    HD1  TYR  65           HD1      TYR  65   3.829  -5.661  -5.661
  504    HD2  TYR  65           HD2      TYR  65   3.550  -2.042  -2.042
  505    HE1  TYR  65           HE1      TYR  65   2.413  -6.779  -6.779
  506    HE2  TYR  65           HE2      TYR  65   2.132  -3.162  -3.162
  507    HH   TYR  65           HH       TYR  65   0.471  -5.400  -5.400
  508    H    GLU  66           HN       GLU  66   6.675  -3.255  -3.255
  509    HA   GLU  66           HA       GLU  66   6.586  -5.471  -5.471
  510   1HB   GLU  66           HB1      GLU  66   8.862  -3.501  -3.501
  511   2HB   GLU  66           HB2      GLU  66   8.545  -4.539  -4.539
  512   1HG   GLU  66           HG1      GLU  66   6.269  -2.796  -2.796
  513   2HG   GLU  66           HG2      GLU  66   7.565  -1.995  -1.995
  514    H    LYS  67           HN       LYS  67   9.036  -4.890  -4.890
  515    HA   LYS  67           HA       LYS  67  10.660  -7.165  -7.165
  516   1HB   LYS  67           HB1      LYS  67  10.821  -5.089  -5.089
  517   2HB   LYS  67           HB2      LYS  67  11.738  -6.560  -6.560
  518   1HG   LYS  67           HG1      LYS  67  13.165  -4.948  -4.948
  519   2HG   LYS  67           HG2      LYS  67  12.840  -6.213  -6.213
  520   1HD   LYS  67           HD1      LYS  67  11.130  -4.696  -4.696
  521   2HD   LYS  67           HD2      LYS  67  11.537  -3.454  -3.454
  522   1HE   LYS  67           HE1      LYS  67  12.772  -3.076  -3.076
  523   2HE   LYS  67           HE2      LYS  67  13.882  -3.433  -3.433
  524   1HZ   LYS  67           HZ1      LYS  67  13.113  -5.846  -5.846
  525   2HZ   LYS  67           HZ2      LYS  67  13.596  -4.773  -4.773
  526   3HZ   LYS  67           HZ3      LYS  67  14.651  -5.131  -5.131
  527    H    ASP  68           HN       ASP  68   8.426  -6.483  -6.483
  528    HA   ASP  68           HA       ASP  68   8.783  -8.912  -8.912
  529   1HB   ASP  68           HB1      ASP  68   6.746  -6.705  -6.705
  530   2HB   ASP  68           HB2      ASP  68   6.590  -8.123  -8.123
  531    H    ILE  69           HN       ILE  69   6.974  -7.861  -7.861
  532    HA   ILE  69           HA       ILE  69   5.101 -10.115 -10.115
  533    HB   ILE  69           HB       ILE  69   4.211  -7.944  -7.944
  534   1HG1  ILE  69          HG11      ILE  69   3.062  -8.675  -8.675
  535   2HG1  ILE  69          HG12      ILE  69   4.338  -9.816  -9.816
  536   1HG2  ILE  69          HG21      ILE  69   6.269  -7.187  -7.187
  537   2HG2  ILE  69          HG22      ILE  69   6.013  -8.338  -8.338
  538   3HG2  ILE  69          HG23      ILE  69   4.860  -7.041  -7.041
  539   1HD1  ILE  69          HD11      ILE  69   2.634  -9.996  -9.996
  540   2HD1  ILE  69          HD12      ILE  69   2.404 -10.972 -10.972
  541   3HD1  ILE  69          HD13      ILE  69   3.855 -11.155 -11.155
  542    H    ALA  70           HN       ALA  70   7.619  -8.957  -8.957
  543    HA   ALA  70           HA       ALA  70   7.746 -11.121 -11.121
  544   1HB   ALA  70           HB1      ALA  70  10.065  -9.434  -9.434
  545   2HB   ALA  70           HB2      ALA  70  10.138 -10.420 -10.420
  546   3HB   ALA  70           HB3      ALA  70   9.089  -9.016  -9.016
  547    H    ALA  71           HN       ALA  71   8.867 -10.644 -10.644
  548    HA   ALA  71           HA       ALA  71  10.391 -13.117 -13.117
  549   1HB   ALA  71           HB1      ALA  71   9.448 -11.211 -11.211
  550   2HB   ALA  71           HB2      ALA  71  10.598 -12.519 -12.519
  551   3HB   ALA  71           HB3      ALA  71  11.012 -11.163 -11.163
  552    H    TYR  72           HN       TYR  72   7.298 -11.882 -11.882
  553    HA   TYR  72           HA       TYR  72   6.312 -14.041 -14.041
  554   1HB   TYR  72           HB1      TYR  72   5.203 -11.890 -11.890
  555   2HB   TYR  72           HB2      TYR  72   4.845 -12.208 -12.208
  556    HD1  TYR  72           HD1      TYR  72   4.391 -14.987 -14.987
  557    HD2  TYR  72           HD2      TYR  72   2.542 -11.668 -11.668
  558    HE1  TYR  72           HE1      TYR  72   2.180 -15.868 -15.868
  559    HE2  TYR  72           HE2      TYR  72   0.338 -12.544 -12.544
  560    HH   TYR  72           HH       TYR  72  -0.371 -15.432 -15.432
  561    H    ARG  73           HN       ARG  73   6.070 -13.483 -13.483
  562    HA   ARG  73           HA       ARG  73   4.691 -15.916 -15.916
  563   1HB   ARG  73           HB1      ARG  73   6.181 -13.850 -13.850
  564   2HB   ARG  73           HB2      ARG  73   5.405 -15.225 -15.225
  565   1HG   ARG  73           HG1      ARG  73   3.696 -13.636 -13.636
  566   2HG   ARG  73           HG2      ARG  73   4.151 -12.825 -12.825
  567   1HD   ARG  73           HD1      ARG  73   1.989 -14.085 -14.085
  568   2HD   ARG  73           HD2      ARG  73   3.214 -14.651 -14.651
  569    HE   ARG  73           HE       ARG  73   2.493 -16.065 -16.065
  570   1HH1  ARG  73          HH11      ARG  73   2.258 -16.345 -16.345
  571   2HH1  ARG  73          HH12      ARG  73   3.013 -17.897 -17.897
  572   1HH2  ARG  73          HH21      ARG  73   4.056 -17.884 -17.884
  573   2HH2  ARG  73          HH22      ARG  73   4.053 -18.789 -18.789
  574    H    ALA  74           HN       ALA  74   7.906 -14.856 -14.856
  575    HA   ALA  74           HA       ALA  74   8.997 -17.396 -17.396
  576   1HB   ALA  74           HB1      ALA  74   9.943 -15.285 -15.285
  577   2HB   ALA  74           HB2      ALA  74  10.351 -14.835 -14.835
  578   3HB   ALA  74           HB3      ALA  74  11.167 -16.191 -16.191
  579    H    LYS  75           HN       LYS  75   7.586 -17.345 -17.345
  580    HA   LYS  75           HA       LYS  75   7.657 -18.167 -18.167
  581   1HB   LYS  75           HB1      LYS  75   8.775 -20.116 -20.116
  582   2HB   LYS  75           HB2      LYS  75  10.327 -19.415 -19.415
  583   1HG   LYS  75           HG1      LYS  75   9.699 -19.585 -19.585
  584   2HG   LYS  75           HG2      LYS  75   8.163 -20.273 -20.273
  585   1HD   LYS  75           HD1      LYS  75   9.595 -22.066 -22.066
  586   2HD   LYS  75           HD2      LYS  75   9.370 -22.230 -22.230
  587   1HE   LYS  75           HE1      LYS  75  11.810 -20.848 -20.848
  588   2HE   LYS  75           HE2      LYS  75  11.767 -22.566 -22.566
  589   1HZ   LYS  75           HZ1      LYS  75  10.860 -21.225 -21.225
  590   2HZ   LYS  75           HZ2      LYS  75  12.284 -20.458 -20.458
  591   3HZ   LYS  75           HZ3      LYS  75  12.283 -22.124 -22.124
  592    H    GLY  76           HN       GLY  76   7.981 -15.899 -15.899
  593   1HA   GLY  76           HA1      GLY  76  10.629 -15.078 -15.078
  594   2HA   GLY  76           HA2      GLY  76   9.230 -14.025 -14.025
  595    H    LYS  77           HN       LYS  77   7.343 -14.847 -14.847
  596    HA   LYS  77           HA       LYS  77   6.398 -14.466 -14.466
  597   1HB   LYS  77           HB1      LYS  77   7.582 -17.239 -17.239
  598   2HB   LYS  77           HB2      LYS  77   6.215 -16.644 -16.644
  599   1HG   LYS  77           HG1      LYS  77   4.881 -16.345 -16.345
  600   2HG   LYS  77           HG2      LYS  77   6.260 -16.703 -16.703
  601   1HD   LYS  77           HD1      LYS  77   4.855 -18.678 -18.678
  602   2HD   LYS  77           HD2      LYS  77   6.358 -19.013 -19.013
  603   1HE   LYS  77           HE1      LYS  77   5.239 -18.618 -18.618
  604   2HE   LYS  77           HE2      LYS  77   3.733 -18.249 -18.249
  605   1HZ   LYS  77           HZ1      LYS  77   4.702 -20.694 -20.694
  606   2HZ   LYS  77           HZ2      LYS  77   4.744 -20.734 -20.734
  607   3HZ   LYS  77           HZ3      LYS  77   3.288 -20.383 -20.383
  608    HA   PRO  78           HA       PRO  78   9.095 -13.266 -13.266
  609   1HB   PRO  78           HB1      PRO  78   7.327 -12.405 -12.405
  610   2HB   PRO  78           HB2      PRO  78   7.360 -11.642 -11.642
  611   1HG   PRO  78           HG1      PRO  78   5.537 -13.919 -13.919
  612   2HG   PRO  78           HG2      PRO  78   5.060 -12.385 -12.385
  613   1HD   PRO  78           HD1      PRO  78   5.383 -14.656 -14.656
  614   2HD   PRO  78           HD2      PRO  78   5.767 -13.042 -13.042
  615    H    ASP  79           HN       ASP  79   8.512 -16.066 -16.066
  616    HA   ASP  79           HA       ASP  79   8.954 -16.996 -16.996
  617   1HB   ASP  79           HB1      ASP  79   7.305 -18.463 -18.463
  618   2HB   ASP  79           HB2      ASP  79   7.589 -19.043 -19.043
  619    H    ALA  80           HN       ALA  80   9.990 -16.738 -16.738
  620    HA   ALA  80           HA       ALA  80  11.959 -18.989 -18.989
  621   1HB   ALA  80           HB1      ALA  80  10.839 -17.665 -17.665
  622   2HB   ALA  80           HB2      ALA  80  12.025 -18.963 -18.963
  623   3HB   ALA  80           HB3      ALA  80  10.388 -19.253 -19.253
  624    H    ALA  81           HN       ALA  81  11.528 -15.833 -15.833
  625    HA   ALA  81           HA       ALA  81  14.286 -15.061 -15.061
  626   1HB   ALA  81           HB1      ALA  81  12.888 -14.486 -14.486
  627   2HB   ALA  81           HB2      ALA  81  14.485 -13.899 -13.899
  628   3HB   ALA  81           HB3      ALA  81  14.210 -15.619 -15.619
  629   1H1   BME  16           HE1      MER  16  -7.453  11.614  11.614
  630   2H1   BME  16           HE2      MER  16  -7.271   9.853   9.853
  631   1H2   BME  16           HZ1      MER  16  -8.261  10.589  10.589
  632   2H2   BME  16           HZ2      MER  16  -6.688   9.840   9.840
  633    HO1  BME  16           HH       MER  16  -5.216  10.164  10.164

  Start of MODEL    3
    1    H    ASN   3           HN       ASN   3   1.333 -10.050 -10.050
    2    HA   ASN   3           HA       ASN   3   0.937 -12.103 -12.103
    3   1HB   ASN   3           HB1      ASN   3  -2.005 -11.894 -11.894
    4   2HB   ASN   3           HB2      ASN   3  -1.356 -13.106 -13.106
    5   1HD2  ASN   3          HD21      ASN   3   0.752 -13.972 -13.972
    6   2HD2  ASN   3          HD22      ASN   3   1.211 -12.874 -12.874
    7    H    ALA   4           HN       ALA   4   1.478 -10.759 -10.759
    8    HA   ALA   4           HA       ALA   4   1.173  -9.951  -9.951
    9   1HB   ALA   4           HB1      ALA   4  -0.937 -11.272 -11.272
   10   2HB   ALA   4           HB2      ALA   4  -1.850  -9.972  -9.972
   11   3HB   ALA   4           HB3      ALA   4  -1.058  -9.707  -9.707
   12    HA   PRO   5           HA       PRO   5   0.936  -5.691  -5.691
   13   1HB   PRO   5           HB1      PRO   5   3.474  -5.560  -5.560
   14   2HB   PRO   5           HB2      PRO   5   3.152  -4.987  -4.987
   15   1HG   PRO   5           HG1      PRO   5   4.645  -7.209  -7.209
   16   2HG   PRO   5           HG2      PRO   5   3.420  -7.169  -7.169
   17   1HD   PRO   5           HD1      PRO   5   3.115  -8.358  -8.358
   18   2HD   PRO   5           HD2      PRO   5   2.785  -9.140  -9.140
   19    H    LYS   6           HN       LYS   6  -0.582  -4.850  -4.850
   20    HA   LYS   6           HA       LYS   6  -0.977  -5.294  -5.294
   21   1HB   LYS   6           HB1      LYS   6  -2.705  -4.716  -4.716
   22   2HB   LYS   6           HB2      LYS   6  -2.179  -3.064  -3.064
   23   1HG   LYS   6           HG1      LYS   6  -4.223  -3.324  -3.324
   24   2HG   LYS   6           HG2      LYS   6  -2.959  -3.149  -3.149
   25   1HD   LYS   6           HD1      LYS   6  -2.957  -5.523  -5.523
   26   2HD   LYS   6           HD2      LYS   6  -3.948  -5.886  -5.886
   27   1HE   LYS   6           HE1      LYS   6  -5.357  -5.927  -5.927
   28   2HE   LYS   6           HE2      LYS   6  -5.816  -4.561  -4.561
   29   1HZ   LYS   6           HZ1      LYS   6  -3.788  -3.691  -3.691
   30   2HZ   LYS   6           HZ2      LYS   6  -4.890  -4.554  -4.554
   31   3HZ   LYS   6           HZ3      LYS   6  -5.430  -3.251  -3.251
   32    H    ARG   7           HN       ARG   7  -1.315  -2.995  -2.995
   33    HA   ARG   7           HA       ARG   7   1.392  -1.955  -1.955
   34   1HB   ARG   7           HB1      ARG   7  -1.029  -1.233  -1.233
   35   2HB   ARG   7           HB2      ARG   7   0.579  -0.583  -0.583
   36   1HG   ARG   7           HG1      ARG   7   1.411  -3.005  -3.005
   37   2HG   ARG   7           HG2      ARG   7  -0.266  -3.510  -3.510
   38   1HD   ARG   7           HD1      ARG   7   0.571  -3.316  -3.316
   39   2HD   ARG   7           HD2      ARG   7  -0.681  -2.112  -2.112
   40    HE   ARG   7           HE       ARG   7   1.147  -0.436  -0.436
   41   1HH1  ARG   7          HH11      ARG   7   3.613  -1.509  -1.509
   42   2HH1  ARG   7          HH12      ARG   7   4.280  -1.783  -1.783
   43   1HH2  ARG   7          HH21      ARG   7   1.147  -1.627  -1.627
   44   2HH2  ARG   7          HH22      ARG   7   2.846  -1.853  -1.853
   45    HA   PRO   8           HA       PRO   8   0.372   1.087   1.087
   46   1HB   PRO   8           HB1      PRO   8   2.712   2.579   2.579
   47   2HB   PRO   8           HB2      PRO   8   2.619   0.970   0.970
   48   1HG   PRO   8           HG1      PRO   8   3.399   1.723   1.723
   49   2HG   PRO   8           HG2      PRO   8   4.305   0.759   0.759
   50   1HD   PRO   8           HD1      PRO   8   2.792  -0.489  -0.489
   51   2HD   PRO   8           HD2      PRO   8   2.739  -1.085  -1.085
   52    HA   PRO   9           HA       PRO   9  -0.953   5.259   5.259
   53   1HB   PRO   9           HB1      PRO   9   1.403   6.730   6.730
   54   2HB   PRO   9           HB2      PRO   9  -0.121   6.549   6.549
   55   1HG   PRO   9           HG1      PRO   9   2.382   4.845   4.845
   56   2HG   PRO   9           HG2      PRO   9   1.320   5.424   5.424
   57   1HD   PRO   9           HD1      PRO   9   1.001   2.919   2.919
   58   2HD   PRO   9           HD2      PRO   9  -0.473   3.906   3.906
   59    H    SER  10           HN       SER  10  -0.226   7.282   7.282
   60    HA   SER  10           HA       SER  10   1.117   6.487   6.487
   61   1HB   SER  10           HB1      SER  10  -0.986   8.627   8.627
   62   2HB   SER  10           HB2      SER  10  -0.288   8.197   8.197
   63    HG   SER  10           HG       SER  10  -2.187   6.921   6.921
   64    H    ALA  11           HN       ALA  11   0.790   9.150   9.150
   65    HA   ALA  11           HA       ALA  11   3.123  10.250  10.250
   66   1HB   ALA  11           HB1      ALA  11   2.448  11.260  11.260
   67   2HB   ALA  11           HB2      ALA  11   3.724  11.897  11.897
   68   3HB   ALA  11           HB3      ALA  11   3.871  10.294  10.294
   69    H    PHE  12           HN       PHE  12   0.450  10.867  10.867
   70    HA   PHE  12           HA       PHE  12  -0.542  13.364  13.364
   71   1HB   PHE  12           HB1      PHE  12  -1.234  12.569  12.569
   72   2HB   PHE  12           HB2      PHE  12  -1.601  10.947  10.947
   73    HD1  PHE  12           HD1      PHE  12  -2.669  14.479  14.479
   74    HD2  PHE  12           HD2      PHE  12  -3.826  10.440  10.440
   75    HE1  PHE  12           HE1      PHE  12  -5.026  15.113  15.113
   76    HE2  PHE  12           HE2      PHE  12  -6.164  11.062  11.062
   77    HZ   PHE  12           HZ       PHE  12  -6.783  13.400  13.400
   78    H    PHE  13           HN       PHE  13  -0.549  10.235  10.235
   79    HA   PHE  13           HA       PHE  13  -2.941  10.448  10.448
   80   1HB   PHE  13           HB1      PHE  13  -1.613   8.334   8.334
   81   2HB   PHE  13           HB2      PHE  13  -0.582   8.701   8.701
   82    HD1  PHE  13           HD1      PHE  13  -4.086   8.040   8.040
   83    HD2  PHE  13           HD2      PHE  13  -1.358   8.198   8.198
   84    HE1  PHE  13           HE1      PHE  13  -5.787   7.052   7.052
   85    HE2  PHE  13           HE2      PHE  13  -3.066   7.210   7.210
   86    HZ   PHE  13           HZ       PHE  13  -5.281   6.636   6.636
   87    H    LEU  14           HN       LEU  14   0.546  10.710  10.710
   88    HA   LEU  14           HA       LEU  14   0.361  11.421  11.421
   89   1HB   LEU  14           HB1      LEU  14   2.285  12.673  12.673
   90   2HB   LEU  14           HB2      LEU  14   2.525  12.646  12.646
   91    HG   LEU  14           HG       LEU  14   4.010  11.074  11.074
   92   1HD1  LEU  14          HD11      LEU  14   2.782   9.978   9.978
   93   2HD1  LEU  14          HD12      LEU  14   1.627   9.312   9.312
   94   3HD1  LEU  14          HD13      LEU  14   3.306   8.801   8.801
   95   1HD2  LEU  14          HD21      LEU  14   3.492  10.977  10.977
   96   2HD2  LEU  14          HD22      LEU  14   3.708   9.353   9.353
   97   3HD2  LEU  14          HD23      LEU  14   2.094   9.946   9.946
   98    H    PHE  15           HN       PHE  15   0.506  13.532  13.532
   99    HA   PHE  15           HA       PHE  15  -0.063  16.011  16.011
  100   1HB   PHE  15           HB1      PHE  15   1.020  16.134  16.134
  101   2HB   PHE  15           HB2      PHE  15   0.123  14.748  14.748
  102    HD1  PHE  15           HD1      PHE  15  -2.149  15.088  15.088
  103    HD2  PHE  15           HD2      PHE  15   0.440  18.346  18.346
  104    HE1  PHE  15           HE1      PHE  15  -3.418  16.539  16.539
  105    HE2  PHE  15           HE2      PHE  15  -0.855  19.798  19.798
  106    HZ   PHE  15           HZ       PHE  15  -2.784  18.883  18.883
  107    H    CYS  16           HN       MER  16  -2.355  13.853  13.853
  108    HA   CYS  16           HA       MER  16  -4.639  15.456  15.456
  109   1HB   CYS  16           HB1      MER  16  -4.923  13.518  13.518
  110   2HB   CYS  16           HB2      MER  16  -4.335  12.438  12.438
  111    H    SER  17           HN       SER  17  -3.253  12.975  12.975
  112    HA   SER  17           HA       SER  17  -5.188  13.077  13.077
  113   1HB   SER  17           HB1      SER  17  -2.179  12.552  12.552
  114   2HB   SER  17           HB2      SER  17  -3.368  12.227  12.227
  115    HG   SER  17           HG       SER  17  -3.858  10.494  10.494
  116    H    GLU  18           HN       GLU  18  -2.119  14.764  14.764
  117    HA   GLU  18           HA       GLU  18  -1.966  16.295  16.295
  118   1HB   GLU  18           HB1      GLU  18  -0.391  16.367  16.367
  119   2HB   GLU  18           HB2      GLU  18  -1.539  17.315  17.315
  120   1HG   GLU  18           HG1      GLU  18  -1.411  19.183  19.183
  121   2HG   GLU  18           HG2      GLU  18  -0.451  18.256  18.256
  122    H    TYR  19           HN       TYR  19  -4.033  17.179  17.179
  123    HA   TYR  19           HA       TYR  19  -5.573  18.885  18.885
  124   1HB   TYR  19           HB1      TYR  19  -5.608  20.692  20.692
  125   2HB   TYR  19           HB2      TYR  19  -3.914  20.170  20.170
  126    HD1  TYR  19           HD1      TYR  19  -2.891  18.736  18.736
  127    HD2  TYR  19           HD2      TYR  19  -6.660  20.689  20.689
  128    HE1  TYR  19           HE1      TYR  19  -2.804  18.555  18.555
  129    HE2  TYR  19           HE2      TYR  19  -6.570  20.513  20.513
  130    HH   TYR  19           HH       TYR  19  -4.265  20.260  20.260
  131    H    ARG  20           HN       ARG  20  -6.301  16.289  16.289
  132    HA   ARG  20           HA       ARG  20  -8.324  16.402  16.402
  133   1HB   ARG  20           HB1      ARG  20  -7.659  14.191  14.191
  134   2HB   ARG  20           HB2      ARG  20  -7.711  14.423  14.423
  135   1HG   ARG  20           HG1      ARG  20 -10.207  14.513  14.513
  136   2HG   ARG  20           HG2      ARG  20 -10.157  14.391  14.391
  137   1HD   ARG  20           HD1      ARG  20 -10.695  12.214  12.214
  138   2HD   ARG  20           HD2      ARG  20  -9.194  12.122  12.122
  139    HE   ARG  20           HE       ARG  20  -9.216  12.544  12.544
  140   1HH1  ARG  20          HH11      ARG  20  -6.865  12.417  12.417
  141   2HH1  ARG  20          HH12      ARG  20  -6.194  10.871  10.871
  142   1HH2  ARG  20          HH21      ARG  20  -9.007   9.950   9.950
  143   2HH2  ARG  20          HH22      ARG  20  -7.454   9.430   9.430
  144    HA   PRO  21           HA       PRO  21 -11.351  17.020  17.020
  145   1HB   PRO  21           HB1      PRO  21  -9.538  18.318  18.318
  146   2HB   PRO  21           HB2      PRO  21 -10.820  17.126  17.126
  147   1HG   PRO  21           HG1      PRO  21  -8.279  16.283  16.283
  148   2HG   PRO  21           HG2      PRO  21  -9.433  15.304  15.304
  149   1HD   PRO  21           HD1      PRO  21  -7.534  17.445  17.445
  150   2HD   PRO  21           HD2      PRO  21  -7.694  15.755  15.755
  151    H    LYS  22           HN       LYS  22  -8.719  19.302  19.302
  152    HA   LYS  22           HA       LYS  22 -10.103  21.722  21.722
  153   1HB   LYS  22           HB1      LYS  22  -7.545  21.251  21.251
  154   2HB   LYS  22           HB2      LYS  22  -7.938  21.448  21.448
  155   1HG   LYS  22           HG1      LYS  22  -9.078  23.683  23.683
  156   2HG   LYS  22           HG2      LYS  22  -8.354  23.453  23.453
  157   1HD   LYS  22           HD1      LYS  22  -6.081  23.320  23.320
  158   2HD   LYS  22           HD2      LYS  22  -6.897  23.777  23.777
  159   1HE   LYS  22           HE1      LYS  22  -6.024  25.828  25.828
  160   2HE   LYS  22           HE2      LYS  22  -7.774  25.846  25.846
  161   1HZ   LYS  22           HZ1      LYS  22  -6.722  24.507  24.507
  162   2HZ   LYS  22           HZ2      LYS  22  -5.819  25.929  25.929
  163   3HZ   LYS  22           HZ3      LYS  22  -7.509  26.011  26.011
  164    H    ILE  23           HN       ILE  23 -10.040  19.638  19.638
  165    HA   ILE  23           HA       ILE  23 -11.298  21.726  21.726
  166    HB   ILE  23           HB       ILE  23 -11.263  18.730  18.730
  167   1HG1  ILE  23          HG11      ILE  23  -9.109  20.734  20.734
  168   2HG1  ILE  23          HG12      ILE  23  -8.919  19.582  19.582
  169   1HG2  ILE  23          HG21      ILE  23 -12.761  20.204  20.204
  170   2HG2  ILE  23          HG22      ILE  23 -11.399  21.232  21.232
  171   3HG2  ILE  23          HG23      ILE  23 -11.465  19.583  19.583
  172   1HD1  ILE  23          HD11      ILE  23  -9.344  17.706  17.706
  173   2HD1  ILE  23          HD12      ILE  23  -9.507  18.833  18.833
  174   3HD1  ILE  23          HD13      ILE  23  -7.968  18.664  18.664
  175    H    LYS  24           HN       LYS  24 -12.047  18.691  18.691
  176    HA   LYS  24           HA       LYS  24 -14.699  18.279  18.279
  177   1HB   LYS  24           HB1      LYS  24 -12.968  16.848  16.848
  178   2HB   LYS  24           HB2      LYS  24 -13.064  17.799  17.799
  179   1HG   LYS  24           HG1      LYS  24 -15.489  17.198  17.198
  180   2HG   LYS  24           HG2      LYS  24 -15.393  16.152  16.152
  181   1HD   LYS  24           HD1      LYS  24 -13.655  15.864  15.864
  182   2HD   LYS  24           HD2      LYS  24 -15.110  14.940  14.940
  183   1HE   LYS  24           HE1      LYS  24 -12.669  14.900  14.900
  184   2HE   LYS  24           HE2      LYS  24 -13.036  13.679  13.679
  185   1HZ   LYS  24           HZ1      LYS  24 -15.315  14.096  14.096
  186   2HZ   LYS  24           HZ2      LYS  24 -13.977  13.885  13.885
  187   3HZ   LYS  24           HZ3      LYS  24 -14.351  12.705  12.705
  188    H    GLY  25           HN       GLY  25 -13.276  20.391  20.391
  189   1HA   GLY  25           HA1      GLY  25 -15.679  21.043  21.043
  190   2HA   GLY  25           HA2      GLY  25 -14.114  21.845  21.845
  191    H    GLU  26           HN       GLU  26 -13.708  22.705  22.705
  192    HA   GLU  26           HA       GLU  26 -15.321  25.069  25.069
  193   1HB   GLU  26           HB1      GLU  26 -13.355  23.893  23.893
  194   2HB   GLU  26           HB2      GLU  26 -13.940  25.544  25.544
  195   1HG   GLU  26           HG1      GLU  26 -12.520  24.390  24.390
  196   2HG   GLU  26           HG2      GLU  26 -11.618  25.087  25.087
  197    H    HIS  27           HN       HIS  27 -15.254  22.105  22.105
  198    HA   HIS  27           HA       HIS  27 -17.770  22.761  22.761
  199   1HB   HIS  27           HB1      HIS  27 -15.412  21.209  21.209
  200   2HB   HIS  27           HB2      HIS  27 -16.846  21.784  21.784
  201    HD1  HIS  27           HD1      HIS  27 -17.044  24.565  24.565
  202    HD2  HIS  27           HD2      HIS  27 -13.306  22.936  22.936
  203    HE1  HIS  27           HE1      HIS  27 -15.453  26.415  26.415
  204    HA   PRO  28           HA       PRO  28 -18.517  18.685  18.685
  205   1HB   PRO  28           HB1      PRO  28 -20.767  20.038  20.038
  206   2HB   PRO  28           HB2      PRO  28 -19.448  19.095  19.095
  207   1HG   PRO  28           HG1      PRO  28 -19.641  21.828  21.828
  208   2HG   PRO  28           HG2      PRO  28 -18.095  20.971  20.971
  209   1HD   PRO  28           HD1      PRO  28 -19.290  22.544  22.544
  210   2HD   PRO  28           HD2      PRO  28 -17.658  22.440  22.440
  211    H    GLY  29           HN       GLY  29 -18.945  19.846  19.846
  212   1HA   GLY  29           HA1      GLY  29 -21.689  19.041  19.041
  213   2HA   GLY  29           HA2      GLY  29 -20.852  20.391  20.391
  214    H    LEU  30           HN       LEU  30 -18.367  18.518  18.518
  215    HA   LEU  30           HA       LEU  30 -18.401  17.286  17.286
  216   1HB   LEU  30           HB1      LEU  30 -16.238  17.356  17.356
  217   2HB   LEU  30           HB2      LEU  30 -15.969  16.927  16.927
  218    HG   LEU  30           HG       LEU  30 -16.709  19.613  19.613
  219   1HD1  LEU  30          HD11      LEU  30 -14.199  18.617  18.617
  220   2HD1  LEU  30          HD12      LEU  30 -14.464  20.283  20.283
  221   3HD1  LEU  30          HD13      LEU  30 -14.356  19.027  19.027
  222   1HD2  LEU  30          HD21      LEU  30 -17.830  19.359  19.359
  223   2HD2  LEU  30          HD22      LEU  30 -16.529  20.529  20.529
  224   3HD2  LEU  30          HD23      LEU  30 -16.297  18.916  18.916
  225    H    SER  31           HN       SER  31 -17.453  15.166  15.166
  226    HA   SER  31           HA       SER  31 -18.414  13.193  13.193
  227   1HB   SER  31           HB1      SER  31 -17.992  12.860  12.860
  228   2HB   SER  31           HB2      SER  31 -18.670  11.637  11.637
  229    HG   SER  31           HG       SER  31 -19.872  13.739  13.739
  230    H    ILE  32           HN       ILE  32 -17.041  11.067  11.067
  231    HA   ILE  32           HA       ILE  32 -14.301  11.775  11.775
  232    HB   ILE  32           HB       ILE  32 -15.957   9.809   9.809
  233   1HG1  ILE  32          HG11      ILE  32 -13.835  10.056  10.056
  234   2HG1  ILE  32          HG12      ILE  32 -14.133   8.386   8.386
  235   1HG2  ILE  32          HG21      ILE  32 -16.275   8.808   8.808
  236   2HG2  ILE  32          HG22      ILE  32 -14.556   8.473   8.473
  237   3HG2  ILE  32          HG23      ILE  32 -15.511   7.641   7.641
  238   1HD1  ILE  32          HD11      ILE  32 -12.534   8.542   8.542
  239   2HD1  ILE  32          HD12      ILE  32 -12.230  10.230  10.230
  240   3HD1  ILE  32          HD13      ILE  32 -11.775   8.966   8.966
  241    H    GLY  33           HN       GLY  33 -15.846  11.738  11.738
  242   1HA   GLY  33           HA1      GLY  33 -13.584  10.866  10.866
  243   2HA   GLY  33           HA2      GLY  33 -15.278  10.896  10.896
  244    H    ASP  34           HN       ASP  34 -15.164  13.506  13.506
  245    HA   ASP  34           HA       ASP  34 -14.496  15.319  15.319
  246   1HB   ASP  34           HB1      ASP  34 -16.123  15.582  15.582
  247   2HB   ASP  34           HB2      ASP  34 -15.886  16.977  16.977
  248    H    VAL  35           HN       VAL  35 -14.305  14.944  14.944
  249    HA   VAL  35           HA       VAL  35 -12.438  17.000  17.000
  250    HB   VAL  35           HB       VAL  35 -12.923  14.265  14.265
  251   1HG1  VAL  35          HG11      VAL  35 -11.423  16.692  16.692
  252   2HG1  VAL  35          HG12      VAL  35 -11.755  15.215  15.215
  253   3HG1  VAL  35          HG13      VAL  35 -10.656  15.187  15.187
  254   1HG2  VAL  35          HG21      VAL  35 -13.894  17.041  17.041
  255   2HG2  VAL  35          HG22      VAL  35 -14.867  15.745  15.745
  256   3HG2  VAL  35          HG23      VAL  35 -14.187  15.577  15.577
  257    H    ALA  36           HN       ALA  36 -12.221  13.782  13.782
  258    HA   ALA  36           HA       ALA  36  -9.392  13.469  13.469
  259   1HB   ALA  36           HB1      ALA  36 -11.603  11.983  11.983
  260   2HB   ALA  36           HB2      ALA  36  -9.962  11.360  11.360
  261   3HB   ALA  36           HB3      ALA  36 -10.951  11.617  11.617
  262    H    LYS  37           HN       LYS  37 -11.639  14.079  14.079
  263    HA   LYS  37           HA       LYS  37  -9.322  14.255  14.255
  264   1HB   LYS  37           HB1      LYS  37 -10.902  14.728  14.728
  265   2HB   LYS  37           HB2      LYS  37 -11.573  13.478  13.478
  266   1HG   LYS  37           HG1      LYS  37 -12.963  15.103  15.103
  267   2HG   LYS  37           HG2      LYS  37 -12.313  16.411  16.411
  268   1HD   LYS  37           HD1      LYS  37 -13.252  15.606  15.606
  269   2HD   LYS  37           HD2      LYS  37 -13.547  14.004  14.004
  270   1HE   LYS  37           HE1      LYS  37 -15.288  14.837  14.837
  271   2HE   LYS  37           HE2      LYS  37 -14.991  16.506  16.506
  272   1HZ   LYS  37           HZ1      LYS  37 -15.351  14.978  14.978
  273   2HZ   LYS  37           HZ2      LYS  37 -16.599  14.567  14.567
  274   3HZ   LYS  37           HZ3      LYS  37 -16.369  16.190  16.190
  275    H    LYS  38           HN       LYS  38 -10.914  16.434  16.434
  276    HA   LYS  38           HA       LYS  38 -10.194  18.833  18.833
  277   1HB   LYS  38           HB1      LYS  38 -12.223  18.662  18.662
  278   2HB   LYS  38           HB2      LYS  38 -11.070  18.559  18.559
  279   1HG   LYS  38           HG1      LYS  38 -11.712  20.853  20.853
  280   2HG   LYS  38           HG2      LYS  38 -10.105  20.797  20.797
  281   1HD   LYS  38           HD1      LYS  38 -11.241  20.579  20.579
  282   2HD   LYS  38           HD2      LYS  38 -12.757  20.882  20.882
  283   1HE   LYS  38           HE1      LYS  38 -10.368  22.756  22.756
  284   2HE   LYS  38           HE2      LYS  38 -11.846  22.961  22.961
  285   1HZ   LYS  38           HZ1      LYS  38 -12.517  22.565  22.565
  286   2HZ   LYS  38           HZ2      LYS  38 -11.338  23.783  23.783
  287   3HZ   LYS  38           HZ3      LYS  38 -12.786  23.927  23.927
  288    H    LEU  39           HN       LEU  39  -9.219  17.249  17.249
  289    HA   LEU  39           HA       LEU  39  -6.874  18.950  18.950
  290   1HB   LEU  39           HB1      LEU  39  -7.078  18.278  18.278
  291   2HB   LEU  39           HB2      LEU  39  -8.503  17.396  17.396
  292    HG   LEU  39           HG       LEU  39  -6.743  15.551  15.551
  293   1HD1  LEU  39          HD11      LEU  39  -4.930  17.192  17.192
  294   2HD1  LEU  39          HD12      LEU  39  -5.482  17.044  17.044
  295   3HD1  LEU  39          HD13      LEU  39  -4.805  15.641  15.641
  296   1HD2  LEU  39          HD21      LEU  39  -8.521  15.227  15.227
  297   2HD2  LEU  39          HD22      LEU  39  -6.977  14.530  14.530
  298   3HD2  LEU  39          HD23      LEU  39  -7.482  16.038  16.038
  299    H    GLY  40           HN       GLY  40  -7.787  16.105  16.105
  300   1HA   GLY  40           HA1      GLY  40  -5.147  14.883  14.883
  301   2HA   GLY  40           HA2      GLY  40  -6.550  14.507  14.507
  302    H    GLU  41           HN       GLU  41  -6.999  17.332  17.332
  303    HA   GLU  41           HA       GLU  41  -5.303  17.596  17.596
  304   1HB   GLU  41           HB1      GLU  41  -7.657  18.283  18.283
  305   2HB   GLU  41           HB2      GLU  41  -7.299  19.487  19.487
  306   1HG   GLU  41           HG1      GLU  41  -5.677  20.531  20.531
  307   2HG   GLU  41           HG2      GLU  41  -6.251  19.399  19.399
  308    H    MET  42           HN       MET  42  -5.909  19.415  19.415
  309    HA   MET  42           HA       MET  42  -3.968  21.372  21.372
  310   1HB   MET  42           HB1      MET  42  -4.709  19.519  19.519
  311   2HB   MET  42           HB2      MET  42  -3.739  20.968  20.968
  312   1HG   MET  42           HG1      MET  42  -6.548  20.873  20.873
  313   2HG   MET  42           HG2      MET  42  -6.234  21.317  21.317
  314   1HE   MET  42           HE1      MET  42  -5.750  22.255  22.255
  315   2HE   MET  42           HE2      MET  42  -7.391  22.549  22.549
  316   3HE   MET  42           HE3      MET  42  -6.374  23.888  23.888
  317    H    TRP  43           HN       TRP  43  -3.551  18.082  18.082
  318    HA   TRP  43           HA       TRP  43  -0.822  17.921  17.921
  319   1HB   TRP  43           HB1      TRP  43  -2.368  16.119  16.119
  320   2HB   TRP  43           HB2      TRP  43  -2.720  15.888  15.888
  321    HD1  TRP  43           HD1      TRP  43  -1.255  14.173  14.173
  322    HE1  TRP  43           HE1      TRP  43   0.915  13.122  13.122
  323    HE3  TRP  43           HE3      TRP  43  -0.149  16.617  16.617
  324    HZ2  TRP  43           HZ2      TRP  43   3.004  13.227  13.227
  325    HZ3  TRP  43           HZ3      TRP  43   1.899  16.154  16.154
  326    HH2  TRP  43           HH2      TRP  43   3.503  14.447  14.447
  327    H    ASN  44           HN       ASN  44  -2.490  17.168  17.168
  328    HA   ASN  44           HA       ASN  44  -0.294  16.573  16.573
  329   1HB   ASN  44           HB1      ASN  44  -1.943  16.342  16.342
  330   2HB   ASN  44           HB2      ASN  44  -3.088  16.952  16.952
  331   1HD2  ASN  44          HD21      ASN  44  -3.851  19.746  19.746
  332   2HD2  ASN  44          HD22      ASN  44  -4.250  18.721  18.721
  333    H    ASN  45           HN       ASN  45  -1.562  19.665  19.665
  334    HA   ASN  45           HA       ASN  45   0.813  21.053  21.053
  335   1HB   ASN  45           HB1      ASN  45  -0.685  23.033  23.033
  336   2HB   ASN  45           HB2      ASN  45  -1.328  21.649  21.649
  337   1HD2  ASN  45          HD21      ASN  45  -4.307  21.617  21.617
  338   2HD2  ASN  45          HD22      ASN  45  -3.498  21.058  21.058
  339    H    THR  46           HN       THR  46   0.961  20.014  20.014
  340    HA   THR  46           HA       THR  46   0.319  22.097  22.097
  341    HB   THR  46           HB       THR  46   0.665  19.786  19.786
  342    HG1  THR  46           HG1      THR  46   1.451  20.709  20.709
  343   1HG2  THR  46          HG21      THR  46   3.664  20.052  20.052
  344   2HG2  THR  46          HG22      THR  46   2.882  18.758  18.758
  345   3HG2  THR  46          HG23      THR  46   2.576  18.972  18.972
  346    H    ALA  47           HN       ALA  47   3.316  21.091  21.091
  347    HA   ALA  47           HA       ALA  47   4.385  23.701  23.701
  348   1HB   ALA  47           HB1      ALA  47   4.840  23.573  23.573
  349   2HB   ALA  47           HB2      ALA  47   5.722  22.084  22.084
  350   3HB   ALA  47           HB3      ALA  47   6.321  23.591  23.591
  351    H    ALA  48           HN       ALA  48   5.106  20.508  20.508
  352    HA   ALA  48           HA       ALA  48   5.682  18.633  18.633
  353   1HB   ALA  48           HB1      ALA  48   5.875  19.970  19.970
  354   2HB   ALA  48           HB2      ALA  48   7.415  20.609  20.609
  355   3HB   ALA  48           HB3      ALA  48   7.230  18.889  18.889
  356    H    ASP  49           HN       ASP  49   7.525  21.391  21.391
  357    HA   ASP  49           HA       ASP  49   9.824  19.866  19.866
  358   1HB   ASP  49           HB1      ASP  49   9.256  22.858  22.858
  359   2HB   ASP  49           HB2      ASP  49  10.830  22.079  22.079
  360    H    ASP  50           HN       ASP  50   6.960  19.952  19.952
  361    HA   ASP  50           HA       ASP  50   7.448  20.314  20.314
  362   1HB   ASP  50           HB1      ASP  50   5.847  22.055  22.055
  363   2HB   ASP  50           HB2      ASP  50   4.876  20.812  20.812
  364    H    LYS  51           HN       LYS  51   6.477  18.412  18.412
  365    HA   LYS  51           HA       LYS  51   5.008  16.406  16.406
  366   1HB   LYS  51           HB1      LYS  51   6.230  16.176  16.176
  367   2HB   LYS  51           HB2      LYS  51   5.194  14.987  14.987
  368   1HG   LYS  51           HG1      LYS  51   3.478  16.910  16.910
  369   2HG   LYS  51           HG2      LYS  51   4.482  17.742  17.742
  370   1HD   LYS  51           HD1      LYS  51   4.072  14.986  14.986
  371   2HD   LYS  51           HD2      LYS  51   2.548  15.660  15.660
  372   1HE   LYS  51           HE1      LYS  51   2.705  16.019  16.019
  373   2HE   LYS  51           HE2      LYS  51   2.800  17.569  17.569
  374   1HZ   LYS  51           HZ1      LYS  51   5.396  16.545  16.545
  375   2HZ   LYS  51           HZ2      LYS  51   4.605  16.467  16.467
  376   3HZ   LYS  51           HZ3      LYS  51   4.714  17.946  17.946
  377    H    GLN  52           HN       GLN  52   8.068  16.663  16.663
  378    HA   GLN  52           HA       GLN  52   9.483  14.514  14.514
  379   1HB   GLN  52           HB1      GLN  52  10.172  17.181  17.181
  380   2HB   GLN  52           HB2      GLN  52  10.911  16.839  16.839
  381   1HG   GLN  52           HG1      GLN  52  12.557  16.416  16.416
  382   2HG   GLN  52           HG2      GLN  52  12.099  14.878  14.878
  383   1HE2  GLN  52          HE21      GLN  52   9.952  14.953  14.953
  384   2HE2  GLN  52          HE22      GLN  52   9.480  15.746  15.746
  385    HA   PRO  53           HA       PRO  53  10.364  14.642  14.642
  386   1HB   PRO  53           HB1      PRO  53   8.396  15.989  15.989
  387   2HB   PRO  53           HB2      PRO  53   9.964  16.672  16.672
  388   1HG   PRO  53           HG1      PRO  53   7.356  16.865  16.865
  389   2HG   PRO  53           HG2      PRO  53   8.383  18.207  18.207
  390   1HD   PRO  53           HD1      PRO  53   8.734  17.360  17.360
  391   2HD   PRO  53           HD2      PRO  53  10.197  17.498  17.498
  392    H    TYR  54           HN       TYR  54   6.899  15.015  15.015
  393    HA   TYR  54           HA       TYR  54   6.012  12.780  12.780
  394   1HB   TYR  54           HB1      TYR  54   4.742  14.098  14.098
  395   2HB   TYR  54           HB2      TYR  54   3.913  12.967  12.967
  396    HD1  TYR  54           HD1      TYR  54   4.345  13.697  13.697
  397    HD2  TYR  54           HD2      TYR  54   4.281  16.325  16.325
  398    HE1  TYR  54           HE1      TYR  54   3.824  15.578  15.578
  399    HE2  TYR  54           HE2      TYR  54   3.766  18.204  18.204
  400    HH   TYR  54           HH       TYR  54   4.253  18.260  18.260
  401    H    GLU  55           HN       GLU  55   6.656  13.201  13.201
  402    HA   GLU  55           HA       GLU  55   6.099  10.630  10.630
  403   1HB   GLU  55           HB1      GLU  55   7.320  13.075  13.075
  404   2HB   GLU  55           HB2      GLU  55   8.398  11.803  11.803
  405   1HG   GLU  55           HG1      GLU  55   6.353  10.629  10.629
  406   2HG   GLU  55           HG2      GLU  55   5.397  12.026  12.026
  407    H    LYS  56           HN       LYS  56   9.295  11.803  11.803
  408    HA   LYS  56           HA       LYS  56  10.817   9.543   9.543
  409   1HB   LYS  56           HB1      LYS  56  11.579  11.825  11.825
  410   2HB   LYS  56           HB2      LYS  56  10.961  11.395  11.395
  411   1HG   LYS  56           HG1      LYS  56  12.511   9.317   9.317
  412   2HG   LYS  56           HG2      LYS  56  13.206  10.040  10.040
  413   1HD   LYS  56           HD1      LYS  56  13.188  11.278  11.278
  414   2HD   LYS  56           HD2      LYS  56  14.564  10.544  10.544
  415   1HE   LYS  56           HE1      LYS  56  14.466  12.288  12.288
  416   2HE   LYS  56           HE2      LYS  56  13.130  13.053  13.053
  417   1HZ   LYS  56           HZ1      LYS  56  15.158  12.647  12.647
  418   2HZ   LYS  56           HZ2      LYS  56  15.871  13.324  13.324
  419   3HZ   LYS  56           HZ3      LYS  56  14.575  14.116  14.116
  420    H    LYS  57           HN       LYS  57   8.587  10.282  10.282
  421    HA   LYS  57           HA       LYS  57   9.229   8.024   8.024
  422   1HB   LYS  57           HB1      LYS  57   6.582   9.561   9.561
  423   2HB   LYS  57           HB2      LYS  57   7.026   8.439   8.439
  424   1HG   LYS  57           HG1      LYS  57   8.897   9.862   9.862
  425   2HG   LYS  57           HG2      LYS  57   8.611  10.962  10.962
  426   1HD   LYS  57           HD1      LYS  57   7.660  11.890  11.890
  427   2HD   LYS  57           HD2      LYS  57   6.373  11.530  11.530
  428   1HE   LYS  57           HE1      LYS  57   5.836   9.441   9.441
  429   2HE   LYS  57           HE2      LYS  57   7.219   9.654   9.654
  430   1HZ   LYS  57           HZ1      LYS  57   5.669  11.975  11.975
  431   2HZ   LYS  57           HZ2      LYS  57   4.631  10.644  10.644
  432   3HZ   LYS  57           HZ3      LYS  57   5.957  10.840  10.840
  433    H    ALA  58           HN       ALA  58   6.491   8.633   8.633
  434    HA   ALA  58           HA       ALA  58   5.198   6.208   6.208
  435   1HB   ALA  58           HB1      ALA  58   4.517   8.139   8.139
  436   2HB   ALA  58           HB2      ALA  58   5.893   7.844   7.844
  437   3HB   ALA  58           HB3      ALA  58   4.601   6.665   6.665
  438    H    ALA  59           HN       ALA  59   7.950   7.033   7.033
  439    HA   ALA  59           HA       ALA  59   8.411   4.567   4.567
  440   1HB   ALA  59           HB1      ALA  59   9.643   6.674   6.674
  441   2HB   ALA  59           HB2      ALA  59  10.502   6.596   6.596
  442   3HB   ALA  59           HB3      ALA  59  10.776   5.367   5.367
  443    H    LYS  60           HN       LYS  60  10.124   5.723   5.723
  444    HA   LYS  60           HA       LYS  60  11.551   3.502   3.502
  445   1HB   LYS  60           HB1      LYS  60  11.559   5.739   5.739
  446   2HB   LYS  60           HB2      LYS  60  10.047   5.363   5.363
  447   1HG   LYS  60           HG1      LYS  60  11.064   3.493   3.493
  448   2HG   LYS  60           HG2      LYS  60  12.563   3.673   3.673
  449   1HD   LYS  60           HD1      LYS  60  11.390   5.806   5.806
  450   2HD   LYS  60           HD2      LYS  60  12.635   4.666   4.666
  451   1HE   LYS  60           HE1      LYS  60  14.124   5.566   5.566
  452   2HE   LYS  60           HE2      LYS  60  12.894   6.765   6.765
  453   1HZ   LYS  60           HZ1      LYS  60  13.333   6.867   6.867
  454   2HZ   LYS  60           HZ2      LYS  60  14.855   6.846   6.846
  455   3HZ   LYS  60           HZ3      LYS  60  13.714   8.032   8.032
  456    H    LEU  61           HN       LEU  61   8.148   4.082   4.082
  457    HA   LEU  61           HA       LEU  61   7.878   1.607   1.607
  458   1HB   LEU  61           HB1      LEU  61   5.704   3.217   3.217
  459   2HB   LEU  61           HB2      LEU  61   5.476   2.109   2.109
  460    HG   LEU  61           HG       LEU  61   7.036   4.735   4.735
  461   1HD1  LEU  61          HD11      LEU  61   4.577   3.827   3.827
  462   2HD1  LEU  61          HD12      LEU  61   5.395   5.375   5.375
  463   3HD1  LEU  61          HD13      LEU  61   4.643   4.982   4.982
  464   1HD2  LEU  61          HD21      LEU  61   6.850   2.687   2.687
  465   2HD2  LEU  61          HD22      LEU  61   8.306   3.087   3.087
  466   3HD2  LEU  61          HD23      LEU  61   7.563   4.290   4.290
  467    H    LYS  62           HN       LYS  62   6.720   2.431   2.431
  468    HA   LYS  62           HA       LYS  62   5.800  -0.067  -0.067
  469   1HB   LYS  62           HB1      LYS  62   5.766   2.045   2.045
  470   2HB   LYS  62           HB2      LYS  62   7.494   1.894   1.894
  471   1HG   LYS  62           HG1      LYS  62   7.276   0.051   0.051
  472   2HG   LYS  62           HG2      LYS  62   5.721  -0.433  -0.433
  473   1HD   LYS  62           HD1      LYS  62   5.416   0.576   0.576
  474   2HD   LYS  62           HD2      LYS  62   4.643   1.557   1.557
  475   1HE   LYS  62           HE1      LYS  62   6.781   3.031   3.031
  476   2HE   LYS  62           HE2      LYS  62   7.263   2.129   2.129
  477   1HZ   LYS  62           HZ1      LYS  62   4.628   2.887   2.887
  478   2HZ   LYS  62           HZ2      LYS  62   5.446   4.248   4.248
  479   3HZ   LYS  62           HZ3      LYS  62   6.005   3.468   3.468
  480    H    GLU  63           HN       GLU  63   9.099   1.102   1.102
  481    HA   GLU  63           HA       GLU  63  10.480  -1.087  -1.087
  482   1HB   GLU  63           HB1      GLU  63  11.316   1.323   1.323
  483   2HB   GLU  63           HB2      GLU  63  11.499   0.661   0.661
  484   1HG   GLU  63           HG1      GLU  63  13.109  -1.073  -1.073
  485   2HG   GLU  63           HG2      GLU  63  13.005  -0.245  -0.245
  486    H    LYS  64           HN       LYS  64   9.868  -0.322  -0.322
  487    HA   LYS  64           HA       LYS  64  10.931  -2.662  -2.662
  488   1HB   LYS  64           HB1      LYS  64   8.689  -0.804  -0.804
  489   2HB   LYS  64           HB2      LYS  64   8.921  -2.289  -2.289
  490   1HG   LYS  64           HG1      LYS  64  11.306  -1.716  -1.716
  491   2HG   LYS  64           HG2      LYS  64  11.100  -0.234  -0.234
  492   1HD   LYS  64           HD1      LYS  64   9.596   0.688   0.688
  493   2HD   LYS  64           HD2      LYS  64   9.439  -0.858  -0.858
  494   1HE   LYS  64           HE1      LYS  64  10.987   0.667   0.667
  495   2HE   LYS  64           HE2      LYS  64  11.812  -0.785  -0.785
  496   1HZ   LYS  64           HZ1      LYS  64  11.993   1.155   1.155
  497   2HZ   LYS  64           HZ2      LYS  64  12.446   1.863   1.863
  498   3HZ   LYS  64           HZ3      LYS  64  13.233   0.459   0.459
  499    H    TYR  65           HN       TYR  65   7.655  -2.114  -2.114
  500    HA   TYR  65           HA       TYR  65   6.468  -4.583  -4.583
  501   1HB   TYR  65           HB1      TYR  65   5.006  -2.931  -2.931
  502   2HB   TYR  65           HB2      TYR  65   6.114  -2.394  -2.394
  503    HD1  TYR  65           HD1      TYR  65   4.779  -5.877  -5.877
  504    HD2  TYR  65           HD2      TYR  65   4.732  -2.367  -2.367
  505    HE1  TYR  65           HE1      TYR  65   3.463  -7.045  -7.045
  506    HE2  TYR  65           HE2      TYR  65   3.420  -3.542  -3.542
  507    HH   TYR  65           HH       TYR  65   1.679  -5.864  -5.864
  508    H    GLU  66           HN       GLU  66   7.905  -3.639  -3.639
  509    HA   GLU  66           HA       GLU  66   7.786  -5.957  -5.957
  510   1HB   GLU  66           HB1      GLU  66  10.164  -4.136  -4.136
  511   2HB   GLU  66           HB2      GLU  66   9.866  -5.281  -5.281
  512   1HG   GLU  66           HG1      GLU  66   7.580  -3.427  -3.427
  513   2HG   GLU  66           HG2      GLU  66   9.013  -2.620  -2.620
  514    H    LYS  67           HN       LYS  67  10.018  -5.324  -5.324
  515    HA   LYS  67           HA       LYS  67  11.579  -7.736  -7.736
  516   1HB   LYS  67           HB1      LYS  67  11.797  -6.228  -6.228
  517   2HB   LYS  67           HB2      LYS  67  13.061  -7.045  -7.045
  518   1HG   LYS  67           HG1      LYS  67  11.765  -4.381  -4.381
  519   2HG   LYS  67           HG2      LYS  67  13.420  -4.662  -4.662
  520   1HD   LYS  67           HD1      LYS  67  12.180  -5.606  -5.606
  521   2HD   LYS  67           HD2      LYS  67  13.148  -4.170  -4.170
  522   1HE   LYS  67           HE1      LYS  67  15.064  -5.594  -5.594
  523   2HE   LYS  67           HE2      LYS  67  14.084  -7.029  -7.029
  524   1HZ   LYS  67           HZ1      LYS  67  14.039  -5.502  -5.502
  525   2HZ   LYS  67           HZ2      LYS  67  15.654  -5.661  -5.661
  526   3HZ   LYS  67           HZ3      LYS  67  14.702  -7.045  -7.045
  527    H    ASP  68           HN       ASP  68   9.004  -6.913  -6.913
  528    HA   ASP  68           HA       ASP  68   9.255  -9.273  -9.273
  529   1HB   ASP  68           HB1      ASP  68   7.123  -7.128  -7.128
  530   2HB   ASP  68           HB2      ASP  68   7.157  -8.421  -8.421
  531    H    ILE  69           HN       ILE  69   7.710  -8.186  -8.186
  532    HA   ILE  69           HA       ILE  69   5.725 -10.359 -10.359
  533    HB   ILE  69           HB       ILE  69   5.084  -8.185  -8.185
  534   1HG1  ILE  69          HG11      ILE  69   4.120  -8.939  -8.939
  535   2HG1  ILE  69          HG12      ILE  69   5.371 -10.155 -10.155
  536   1HG2  ILE  69          HG21      ILE  69   7.297  -7.579  -7.579
  537   2HG2  ILE  69          HG22      ILE  69   7.201  -8.786  -8.786
  538   3HG2  ILE  69          HG23      ILE  69   6.090  -7.425  -7.425
  539   1HD1  ILE  69          HD11      ILE  69   3.381 -10.162 -10.162
  540   2HD1  ILE  69          HD12      ILE  69   3.265 -11.159 -11.159
  541   3HD1  ILE  69          HD13      ILE  69   4.590 -11.387 -11.387
  542    H    ALA  70           HN       ALA  70   8.588  -9.423  -9.423
  543    HA   ALA  70           HA       ALA  70   8.901 -11.620 -11.620
  544   1HB   ALA  70           HB1      ALA  70  11.110 -10.109 -10.109
  545   2HB   ALA  70           HB2      ALA  70  11.370 -11.092 -11.092
  546   3HB   ALA  70           HB3      ALA  70  10.441  -9.612  -9.612
  547    H    ALA  71           HN       ALA  71   9.515 -11.172 -11.172
  548    HA   ALA  71           HA       ALA  71  10.755 -13.749 -13.749
  549   1HB   ALA  71           HB1      ALA  71   9.556 -11.737 -11.737
  550   2HB   ALA  71           HB2      ALA  71  10.529 -13.128 -13.128
  551   3HB   ALA  71           HB3      ALA  71  11.243 -11.822 -11.822
  552    H    TYR  72           HN       TYR  72   7.624 -12.279 -12.279
  553    HA   TYR  72           HA       TYR  72   6.183 -14.302 -14.302
  554   1HB   TYR  72           HB1      TYR  72   5.455 -11.991 -11.991
  555   2HB   TYR  72           HB2      TYR  72   5.217 -12.444 -12.444
  556    HD1  TYR  72           HD1      TYR  72   4.127 -13.491 -13.491
  557    HD2  TYR  72           HD2      TYR  72   3.104 -13.055 -13.055
  558    HE1  TYR  72           HE1      TYR  72   1.828 -14.164 -14.164
  559    HE2  TYR  72           HE2      TYR  72   0.803 -13.728 -13.728
  560    HH   TYR  72           HH       TYR  72  -0.566 -13.638 -13.638
  561    H    ARG  73           HN       ARG  73   6.580 -13.776 -13.776
  562    HA   ARG  73           HA       ARG  73   5.120 -16.073 -16.073
  563   1HB   ARG  73           HB1      ARG  73   7.054 -14.158 -14.158
  564   2HB   ARG  73           HB2      ARG  73   6.246 -15.437 -15.437
  565   1HG   ARG  73           HG1      ARG  73   4.382 -13.801 -13.801
  566   2HG   ARG  73           HG2      ARG  73   5.238 -12.848 -12.848
  567   1HD   ARG  73           HD1      ARG  73   3.687 -15.404 -15.404
  568   2HD   ARG  73           HD2      ARG  73   3.075 -13.770 -13.770
  569    HE   ARG  73           HE       ARG  73   5.094 -13.460 -13.460
  570   1HH1  ARG  73          HH11      ARG  73   5.429 -16.581 -16.581
  571   2HH1  ARG  73          HH12      ARG  73   5.194 -17.272 -17.272
  572   1HH2  ARG  73          HH21      ARG  73   4.027 -14.283 -14.283
  573   2HH2  ARG  73          HH22      ARG  73   4.378 -15.950 -15.950
  574    H    ALA  74           HN       ALA  74   8.319 -15.342 -15.342
  575    HA   ALA  74           HA       ALA  74   9.441 -17.820 -17.820
  576   1HB   ALA  74           HB1      ALA  74  10.651 -15.592 -15.592
  577   2HB   ALA  74           HB2      ALA  74  11.572 -16.910 -16.910
  578   3HB   ALA  74           HB3      ALA  74  10.741 -15.764 -15.764
  579    H    LYS  75           HN       LYS  75   7.388 -18.111 -18.111
  580    HA   LYS  75           HA       LYS  75   6.810 -19.468 -19.468
  581   1HB   LYS  75           HB1      LYS  75   8.709 -20.931 -20.931
  582   2HB   LYS  75           HB2      LYS  75   9.778 -20.285 -20.285
  583   1HG   LYS  75           HG1      LYS  75   9.168 -22.118 -22.118
  584   2HG   LYS  75           HG2      LYS  75   7.794 -21.144 -21.144
  585   1HD   LYS  75           HD1      LYS  75   7.852 -23.112 -23.112
  586   2HD   LYS  75           HD2      LYS  75   7.132 -23.430 -23.430
  587   1HE   LYS  75           HE1      LYS  75   5.524 -21.540 -21.540
  588   2HE   LYS  75           HE2      LYS  75   6.209 -21.326 -21.326
  589   1HZ   LYS  75           HZ1      LYS  75   5.612 -24.036 -24.036
  590   2HZ   LYS  75           HZ2      LYS  75   4.247 -23.112 -23.112
  591   3HZ   LYS  75           HZ3      LYS  75   4.965 -22.949 -22.949
  592    H    GLY  76           HN       GLY  76   7.007 -16.958 -16.958
  593   1HA   GLY  76           HA1      GLY  76   8.474 -16.676 -16.676
  594   2HA   GLY  76           HA2      GLY  76   8.197 -15.336 -15.336
  595    H    LYS  77           HN       LYS  77   6.295 -17.900 -17.900
  596    HA   LYS  77           HA       LYS  77   4.126 -15.968 -15.968
  597   1HB   LYS  77           HB1      LYS  77   3.750 -18.969 -18.969
  598   2HB   LYS  77           HB2      LYS  77   2.580 -17.704 -17.704
  599   1HG   LYS  77           HG1      LYS  77   2.979 -17.317 -17.317
  600   2HG   LYS  77           HG2      LYS  77   4.609 -17.977 -17.977
  601   1HD   LYS  77           HD1      LYS  77   3.788 -20.198 -20.198
  602   2HD   LYS  77           HD2      LYS  77   2.129 -19.637 -19.637
  603   1HE   LYS  77           HE1      LYS  77   3.937 -19.526 -19.526
  604   2HE   LYS  77           HE2      LYS  77   2.595 -20.636 -20.636
  605   1HZ   LYS  77           HZ1      LYS  77   1.643 -18.049 -18.049
  606   2HZ   LYS  77           HZ2      LYS  77   2.544 -18.041 -18.041
  607   3HZ   LYS  77           HZ3      LYS  77   1.255 -19.130 -19.130
  608    HA   PRO  78           HA       PRO  78   4.248 -18.573 -18.573
  609   1HB   PRO  78           HB1      PRO  78   6.817 -20.162 -20.162
  610   2HB   PRO  78           HB2      PRO  78   5.185 -20.726 -20.726
  611   1HG   PRO  78           HG1      PRO  78   6.253 -21.392 -21.392
  612   2HG   PRO  78           HG2      PRO  78   4.571 -20.859 -20.859
  613   1HD   PRO  78           HD1      PRO  78   7.036 -19.131 -19.131
  614   2HD   PRO  78           HD2      PRO  78   5.649 -19.354 -19.354
  615    H    ASP  79           HN       ASP  79   7.172 -17.461 -17.461
  616    HA   ASP  79           HA       ASP  79   7.750 -15.935 -15.935
  617   1HB   ASP  79           HB1      ASP  79   9.429 -17.761 -17.761
  618   2HB   ASP  79           HB2      ASP  79   9.832 -17.071 -17.071
  619    H    ALA  80           HN       ALA  80   6.194 -14.604 -14.604
  620    HA   ALA  80           HA       ALA  80   6.196 -13.112 -13.112
  621   1HB   ALA  80           HB1      ALA  80   4.983 -12.422 -12.422
  622   2HB   ALA  80           HB2      ALA  80   6.456 -11.778 -11.778
  623   3HB   ALA  80           HB3      ALA  80   5.764 -11.031 -11.031
  624    H    ALA  81           HN       ALA  81   8.442 -11.852 -11.852
  625    HA   ALA  81           HA       ALA  81  10.433 -11.224 -11.224
  626   1HB   ALA  81           HB1      ALA  81   9.150  -9.163  -9.163
  627   2HB   ALA  81           HB2      ALA  81   9.546  -9.365  -9.365
  628   3HB   ALA  81           HB3      ALA  81  10.817  -9.020  -9.020
  629   1H1   BME  16           HE1      MER  16  -9.016   9.666   9.666
  630   2H1   BME  16           HE2      MER  16  -7.757   8.682   8.682
  631   1H2   BME  16           HZ1      MER  16  -6.111   9.490   9.490
  632   2H2   BME  16           HZ2      MER  16  -7.393  10.419  10.419
  633    HO1  BME  16           HH       MER  16  -8.094   7.280   7.280

  Start of MODEL    4
    1    H    ASN   3           HN       ASN   3   1.218 -12.421 -12.421
    2    HA   ASN   3           HA       ASN   3   2.768 -12.102 -12.102
    3   1HB   ASN   3           HB1      ASN   3   0.846 -13.219 -13.219
    4   2HB   ASN   3           HB2      ASN   3   1.251 -14.034 -14.034
    5   1HD2  ASN   3          HD21      ASN   3  -2.009 -13.622 -13.622
    6   2HD2  ASN   3          HD22      ASN   3  -0.535 -14.462 -14.462
    7    H    ALA   4           HN       ALA   4   2.301 -11.094 -11.094
    8    HA   ALA   4           HA       ALA   4   2.018  -9.055  -9.055
    9   1HB   ALA   4           HB1      ALA   4   0.062 -10.429 -10.429
   10   2HB   ALA   4           HB2      ALA   4  -0.832  -9.807  -9.807
   11   3HB   ALA   4           HB3      ALA   4  -0.386  -8.731  -8.731
   12    HA   PRO   5           HA       PRO   5   1.856  -6.274  -6.274
   13   1HB   PRO   5           HB1      PRO   5   3.985  -4.956  -4.956
   14   2HB   PRO   5           HB2      PRO   5   3.937  -5.226  -5.226
   15   1HG   PRO   5           HG1      PRO   5   5.442  -6.884  -6.884
   16   2HG   PRO   5           HG2      PRO   5   4.476  -7.548  -7.548
   17   1HD   PRO   5           HD1      PRO   5   3.824  -7.575  -7.575
   18   2HD   PRO   5           HD2      PRO   5   3.671  -8.861  -8.861
   19    H    LYS   6           HN       LYS   6   0.812  -6.148  -6.148
   20    HA   LYS   6           HA       LYS   6  -0.848  -4.969  -4.969
   21   1HB   LYS   6           HB1      LYS   6  -1.612  -4.543  -4.543
   22   2HB   LYS   6           HB2      LYS   6  -0.804  -2.991  -2.991
   23   1HG   LYS   6           HG1      LYS   6  -2.281  -2.172  -2.172
   24   2HG   LYS   6           HG2      LYS   6  -2.890  -3.777  -3.777
   25   1HD   LYS   6           HD1      LYS   6  -3.937  -3.869  -3.869
   26   2HD   LYS   6           HD2      LYS   6  -3.288  -2.281  -2.281
   27   1HE   LYS   6           HE1      LYS   6  -5.659  -2.125  -2.125
   28   2HE   LYS   6           HE2      LYS   6  -4.618  -1.302  -1.302
   29   1HZ   LYS   6           HZ1      LYS   6  -4.834  -3.994  -3.994
   30   2HZ   LYS   6           HZ2      LYS   6  -6.393  -3.381  -3.381
   31   3HZ   LYS   6           HZ3      LYS   6  -5.359  -2.613  -2.613
   32    H    ARG   7           HN       ARG   7  -1.303  -2.660  -2.660
   33    HA   ARG   7           HA       ARG   7   1.257  -1.655  -1.655
   34   1HB   ARG   7           HB1      ARG   7  -0.232  -0.393  -0.393
   35   2HB   ARG   7           HB2      ARG   7  -0.461  -2.125  -2.125
   36   1HG   ARG   7           HG1      ARG   7  -2.493  -1.840  -1.840
   37   2HG   ARG   7           HG2      ARG   7  -2.284  -0.106  -0.106
   38   1HD   ARG   7           HD1      ARG   7  -2.761  -1.950  -1.950
   39   2HD   ARG   7           HD2      ARG   7  -3.974  -0.935  -0.935
   40    HE   ARG   7           HE       ARG   7  -1.533   0.165   0.165
   41   1HH1  ARG   7          HH11      ARG   7  -2.188   2.496   2.496
   42   2HH1  ARG   7          HH12      ARG   7  -3.660   3.030   3.030
   43   1HH2  ARG   7          HH21      ARG   7  -4.565  -0.204  -0.204
   44   2HH2  ARG   7          HH22      ARG   7  -5.042   1.462   1.462
   45    HA   PRO   8           HA       PRO   8   0.975   1.425   1.425
   46   1HB   PRO   8           HB1      PRO   8   3.198   2.914   2.914
   47   2HB   PRO   8           HB2      PRO   8   3.335   1.291   1.291
   48   1HG   PRO   8           HG1      PRO   8   3.277   2.108   2.108
   49   2HG   PRO   8           HG2      PRO   8   4.505   1.189   1.189
   50   1HD   PRO   8           HD1      PRO   8   2.603  -0.125  -0.125
   51   2HD   PRO   8           HD2      PRO   8   3.064  -0.739  -0.739
   52    HA   PRO   9           HA       PRO   9  -0.876   5.261   5.261
   53   1HB   PRO   9           HB1      PRO   9   0.979   7.238   7.238
   54   2HB   PRO   9           HB2      PRO   9  -0.229   6.500   6.500
   55   1HG   PRO   9           HG1      PRO   9   2.655   5.576   5.576
   56   2HG   PRO   9           HG2      PRO   9   1.838   5.994   5.994
   57   1HD   PRO   9           HD1      PRO   9   1.880   3.425   3.425
   58   2HD   PRO   9           HD2      PRO   9   0.285   4.091   4.091
   59    H    SER  10           HN       SER  10  -0.264   7.378   7.378
   60    HA   SER  10           HA       SER  10   1.113   6.588   6.588
   61   1HB   SER  10           HB1      SER  10  -0.359   8.408   8.408
   62   2HB   SER  10           HB2      SER  10  -1.266   7.075   7.075
   63    HG   SER  10           HG       SER  10  -1.194   9.639   9.639
   64    H    ALA  11           HN       ALA  11   1.035   8.991   8.991
   65    HA   ALA  11           HA       ALA  11   3.284  10.128  10.128
   66   1HB   ALA  11           HB1      ALA  11   2.533  11.291  11.291
   67   2HB   ALA  11           HB2      ALA  11   3.850  11.858  11.858
   68   3HB   ALA  11           HB3      ALA  11   3.953  10.284  10.284
   69    H    PHE  12           HN       PHE  12   0.646  11.068  11.068
   70    HA   PHE  12           HA       PHE  12  -0.181  13.507  13.507
   71   1HB   PHE  12           HB1      PHE  12  -1.057  13.003  13.003
   72   2HB   PHE  12           HB2      PHE  12  -1.299  11.288  11.288
   73    HD1  PHE  12           HD1      PHE  12  -3.049  13.424  13.424
   74    HD2  PHE  12           HD2      PHE  12  -3.169  11.726  11.726
   75    HE1  PHE  12           HE1      PHE  12  -5.490  13.662  13.662
   76    HE2  PHE  12           HE2      PHE  12  -5.604  11.984  11.984
   77    HZ   PHE  12           HZ       PHE  12  -6.772  12.945  12.945
   78    H    PHE  13           HN       PHE  13  -1.138  10.157  10.157
   79    HA   PHE  13           HA       PHE  13  -3.061  10.332  10.332
   80   1HB   PHE  13           HB1      PHE  13  -1.572   8.317   8.317
   81   2HB   PHE  13           HB2      PHE  13  -0.888   8.405   8.405
   82    HD1  PHE  13           HD1      PHE  13  -2.563   8.380   8.380
   83    HD2  PHE  13           HD2      PHE  13  -3.696   7.363   7.363
   84    HE1  PHE  13           HE1      PHE  13  -4.599   7.302   7.302
   85    HE2  PHE  13           HE2      PHE  13  -5.730   6.287   6.287
   86    HZ   PHE  13           HZ       PHE  13  -6.187   6.257   6.257
   87    H    LEU  14           HN       LEU  14   0.360  10.991  10.991
   88    HA   LEU  14           HA       LEU  14  -0.023  11.066  11.066
   89   1HB   LEU  14           HB1      LEU  14   2.104  12.402  12.402
   90   2HB   LEU  14           HB2      LEU  14   2.159  12.287  12.287
   91    HG   LEU  14           HG       LEU  14   3.605  10.646  10.646
   92   1HD1  LEU  14          HD11      LEU  14   2.062   9.559   9.559
   93   2HD1  LEU  14          HD12      LEU  14   1.024   9.050   9.050
   94   3HD1  LEU  14          HD13      LEU  14   2.651   8.405   8.405
   95   1HD2  LEU  14          HD21      LEU  14   3.285  10.719  10.719
   96   2HD2  LEU  14          HD22      LEU  14   3.320   9.047   9.047
   97   3HD2  LEU  14          HD23      LEU  14   1.788   9.798   9.798
   98    H    PHE  15           HN       PHE  15   0.415  13.720  13.720
   99    HA   PHE  15           HA       PHE  15  -0.289  15.768  15.768
  100   1HB   PHE  15           HB1      PHE  15   0.565  17.013  17.013
  101   2HB   PHE  15           HB2      PHE  15   0.713  15.513  15.513
  102    HD1  PHE  15           HD1      PHE  15  -1.343  14.838  14.838
  103    HD2  PHE  15           HD2      PHE  15  -0.647  18.792  18.792
  104    HE1  PHE  15           HE1      PHE  15  -2.814  15.698  15.698
  105    HE2  PHE  15           HE2      PHE  15  -2.132  19.667  19.667
  106    HZ   PHE  15           HZ       PHE  15  -3.213  18.112  18.112
  107    H    CYS  16           HN       MER  16  -2.183  13.755  13.755
  108    HA   CYS  16           HA       MER  16  -4.692  15.009  15.009
  109   1HB   CYS  16           HB1      MER  16  -5.502  13.028  13.028
  110   2HB   CYS  16           HB2      MER  16  -3.811  12.663  12.663
  111    H    SER  17           HN       SER  17  -3.430  12.649  12.649
  112    HA   SER  17           HA       SER  17  -5.659  12.698  12.698
  113   1HB   SER  17           HB1      SER  17  -4.103  11.778  11.778
  114   2HB   SER  17           HB2      SER  17  -3.752  11.038  11.038
  115    HG   SER  17           HG       SER  17  -1.860  11.893  11.893
  116    H    GLU  18           HN       GLU  18  -2.788  14.677  14.677
  117    HA   GLU  18           HA       GLU  18  -3.402  16.319  16.319
  118   1HB   GLU  18           HB1      GLU  18  -1.112  15.863  15.863
  119   2HB   GLU  18           HB2      GLU  18  -1.506  16.790  16.790
  120   1HG   GLU  18           HG1      GLU  18  -1.808  18.839  18.839
  121   2HG   GLU  18           HG2      GLU  18  -1.503  17.920  17.920
  122    H    TYR  19           HN       TYR  19  -4.858  16.147  16.147
  123    HA   TYR  19           HA       TYR  19  -5.523  19.045  19.045
  124   1HB   TYR  19           HB1      TYR  19  -5.171  16.880  16.880
  125   2HB   TYR  19           HB2      TYR  19  -6.585  17.926  17.926
  126    HD1  TYR  19           HD1      TYR  19  -3.099  18.421  18.421
  127    HD2  TYR  19           HD2      TYR  19  -6.110  19.679  19.679
  128    HE1  TYR  19           HE1      TYR  19  -1.603  20.161  20.161
  129    HE2  TYR  19           HE2      TYR  19  -4.616  21.414  21.414
  130    HH   TYR  19           HH       TYR  19  -2.571  22.273  22.273
  131    H    ARG  20           HN       ARG  20  -6.919  15.873  15.873
  132    HA   ARG  20           HA       ARG  20  -9.571  16.146  16.146
  133   1HB   ARG  20           HB1      ARG  20  -8.236  14.807  14.807
  134   2HB   ARG  20           HB2      ARG  20  -9.961  14.668  14.668
  135   1HG   ARG  20           HG1      ARG  20  -9.186  13.975  13.975
  136   2HG   ARG  20           HG2      ARG  20  -7.615  13.762  13.762
  137   1HD   ARG  20           HD1      ARG  20  -8.462  12.100  12.100
  138   2HD   ARG  20           HD2      ARG  20 -10.119  12.369  12.369
  139    HE   ARG  20           HE       ARG  20  -7.928  11.260  11.260
  140   1HH1  ARG  20          HH11      ARG  20 -11.114  12.365  12.365
  141   2HH1  ARG  20          HH12      ARG  20 -11.747  10.977  10.977
  142   1HH2  ARG  20          HH21      ARG  20  -8.746   9.197   9.197
  143   2HH2  ARG  20          HH22      ARG  20 -10.374   9.134   9.134
  144    HA   PRO  21           HA       PRO  21 -10.868  18.161  18.161
  145   1HB   PRO  21           HB1      PRO  21  -8.934  19.443  19.443
  146   2HB   PRO  21           HB2      PRO  21  -9.389  17.746  17.746
  147   1HG   PRO  21           HG1      PRO  21  -7.136  18.839  18.839
  148   2HG   PRO  21           HG2      PRO  21  -7.006  17.645  17.645
  149   1HD   PRO  21           HD1      PRO  21  -7.253  16.734  16.734
  150   2HD   PRO  21           HD2      PRO  21  -8.329  16.016  16.016
  151    H    LYS  22           HN       LYS  22  -8.532  19.560  19.560
  152    HA   LYS  22           HA       LYS  22  -9.274  22.348  22.348
  153   1HB   LYS  22           HB1      LYS  22  -6.976  21.444  21.444
  154   2HB   LYS  22           HB2      LYS  22  -7.689  21.105  21.105
  155   1HG   LYS  22           HG1      LYS  22  -8.380  23.597  23.597
  156   2HG   LYS  22           HG2      LYS  22  -7.296  23.813  23.813
  157   1HD   LYS  22           HD1      LYS  22  -5.442  22.748  22.748
  158   2HD   LYS  22           HD2      LYS  22  -6.551  22.710  22.710
  159   1HE   LYS  22           HE1      LYS  22  -5.586  25.218  25.218
  160   2HE   LYS  22           HE2      LYS  22  -5.138  24.699  24.699
  161   1HZ   LYS  22           HZ1      LYS  22  -7.926  24.772  24.772
  162   2HZ   LYS  22           HZ2      LYS  22  -7.325  26.226  26.226
  163   3HZ   LYS  22           HZ3      LYS  22  -6.891  25.740  25.740
  164    H    ILE  23           HN       ILE  23 -10.079  19.819  19.819
  165    HA   ILE  23           HA       ILE  23 -11.672  21.772  21.772
  166    HB   ILE  23           HB       ILE  23 -11.889  19.003  19.003
  167   1HG1  ILE  23          HG11      ILE  23  -9.051  20.087  20.087
  168   2HG1  ILE  23          HG12      ILE  23  -9.714  18.656  18.656
  169   1HG2  ILE  23          HG21      ILE  23 -12.342  21.076  21.076
  170   2HG2  ILE  23          HG22      ILE  23 -10.649  21.532  21.532
  171   3HG2  ILE  23          HG23      ILE  23 -11.122  20.117  20.117
  172   1HD1  ILE  23          HD11      ILE  23 -10.124  17.642  17.642
  173   2HD1  ILE  23          HD12      ILE  23  -9.372  19.019  19.019
  174   3HD1  ILE  23          HD13      ILE  23  -8.423  17.994  17.994
  175    H    LYS  24           HN       LYS  24 -11.815  19.230  19.230
  176    HA   LYS  24           HA       LYS  24 -14.651  18.667  18.667
  177   1HB   LYS  24           HB1      LYS  24 -12.784  17.084  17.084
  178   2HB   LYS  24           HB2      LYS  24 -12.530  17.900  17.900
  179   1HG   LYS  24           HG1      LYS  24 -14.732  17.314  17.314
  180   2HG   LYS  24           HG2      LYS  24 -15.191  16.573  16.573
  181   1HD   LYS  24           HD1      LYS  24 -12.828  15.651  15.651
  182   2HD   LYS  24           HD2      LYS  24 -14.423  14.935  14.935
  183   1HE   LYS  24           HE1      LYS  24 -12.756  15.031  15.031
  184   2HE   LYS  24           HE2      LYS  24 -12.878  13.639  13.639
  185   1HZ   LYS  24           HZ1      LYS  24 -15.465  14.536  14.536
  186   2HZ   LYS  24           HZ2      LYS  24 -14.619  14.433  14.433
  187   3HZ   LYS  24           HZ3      LYS  24 -14.729  13.076  13.076
  188    H    GLY  25           HN       GLY  25 -12.607  20.863  20.863
  189   1HA   GLY  25           HA1      GLY  25 -14.432  21.562  21.562
  190   2HA   GLY  25           HA2      GLY  25 -12.803  22.187  22.187
  191    H    GLU  26           HN       GLU  26 -13.186  22.732  22.732
  192    HA   GLU  26           HA       GLU  26 -14.647  25.277  25.277
  193   1HB   GLU  26           HB1      GLU  26 -12.764  24.199  24.199
  194   2HB   GLU  26           HB2      GLU  26 -13.447  25.809  25.809
  195   1HG   GLU  26           HG1      GLU  26 -11.739  24.736  24.736
  196   2HG   GLU  26           HG2      GLU  26 -11.072  25.630  25.630
  197    H    HIS  27           HN       HIS  27 -14.502  22.364  22.364
  198    HA   HIS  27           HA       HIS  27 -17.195  22.923  22.923
  199   1HB   HIS  27           HB1      HIS  27 -14.917  21.490  21.490
  200   2HB   HIS  27           HB2      HIS  27 -16.454  22.006  22.006
  201    HD1  HIS  27           HD1      HIS  27 -16.770  24.761  24.761
  202    HD2  HIS  27           HD2      HIS  27 -12.931  23.365  23.365
  203    HE1  HIS  27           HE1      HIS  27 -15.327  26.707  26.707
  204    HA   PRO  28           HA       PRO  28 -17.542  18.762  18.762
  205   1HB   PRO  28           HB1      PRO  28 -19.441  19.320  19.320
  206   2HB   PRO  28           HB2      PRO  28 -17.753  19.721  19.721
  207   1HG   PRO  28           HG1      PRO  28 -19.938  21.553  21.553
  208   2HG   PRO  28           HG2      PRO  28 -18.883  21.861  21.861
  209   1HD   PRO  28           HD1      PRO  28 -18.258  22.807  22.807
  210   2HD   PRO  28           HD2      PRO  28 -16.967  22.305  22.305
  211    H    GLY  29           HN       GLY  29 -18.287  19.644  19.644
  212   1HA   GLY  29           HA1      GLY  29 -21.073  18.755  18.755
  213   2HA   GLY  29           HA2      GLY  29 -20.386  20.088  20.088
  214    H    LEU  30           HN       LEU  30 -17.809  18.193  18.193
  215    HA   LEU  30           HA       LEU  30 -18.099  16.936  16.936
  216   1HB   LEU  30           HB1      LEU  30 -15.754  17.058  17.058
  217   2HB   LEU  30           HB2      LEU  30 -15.635  16.533  16.533
  218    HG   LEU  30           HG       LEU  30 -16.141  19.286  19.286
  219   1HD1  LEU  30          HD11      LEU  30 -14.010  18.179  18.179
  220   2HD1  LEU  30          HD12      LEU  30 -14.121  19.858  19.858
  221   3HD1  LEU  30          HD13      LEU  30 -13.810  18.606  18.606
  222   1HD2  LEU  30          HD21      LEU  30 -17.723  19.038  19.038
  223   2HD2  LEU  30          HD22      LEU  30 -16.431  20.146  20.146
  224   3HD2  LEU  30          HD23      LEU  30 -16.407  18.510  18.510
  225    H    SER  31           HN       SER  31 -17.101  14.890  14.890
  226    HA   SER  31           HA       SER  31 -17.904  12.816  12.816
  227   1HB   SER  31           HB1      SER  31 -18.305  11.333  11.333
  228   2HB   SER  31           HB2      SER  31 -19.215  12.829  12.829
  229    HG   SER  31           HG       SER  31 -16.769  13.294  13.294
  230    H    ILE  32           HN       ILE  32 -16.640  10.689  10.689
  231    HA   ILE  32           HA       ILE  32 -13.842  11.280  11.280
  232    HB   ILE  32           HB       ILE  32 -15.084   9.390   9.390
  233   1HG1  ILE  32          HG11      ILE  32 -13.460   7.570   7.570
  234   2HG1  ILE  32          HG12      ILE  32 -12.891   8.277   8.277
  235   1HG2  ILE  32          HG21      ILE  32 -15.271   8.280   8.280
  236   2HG2  ILE  32          HG22      ILE  32 -15.717   7.394   7.394
  237   3HG2  ILE  32          HG23      ILE  32 -16.605   8.833   8.833
  238   1HD1  ILE  32          HD11      ILE  32 -12.594   9.503   9.503
  239   2HD1  ILE  32          HD12      ILE  32 -11.324   8.746   8.746
  240   3HD1  ILE  32          HD13      ILE  32 -12.028  10.255  10.255
  241    H    GLY  33           HN       GLY  33 -15.655  11.378  11.378
  242   1HA   GLY  33           HA1      GLY  33 -13.544  10.582  10.582
  243   2HA   GLY  33           HA2      GLY  33 -15.271  10.679  10.679
  244    H    ASP  34           HN       ASP  34 -14.992  13.169  13.169
  245    HA   ASP  34           HA       ASP  34 -14.400  15.082  15.082
  246   1HB   ASP  34           HB1      ASP  34 -15.894  15.252  15.252
  247   2HB   ASP  34           HB2      ASP  34 -15.753  16.669  16.669
  248    H    VAL  35           HN       VAL  35 -13.995  14.527  14.527
  249    HA   VAL  35           HA       VAL  35 -12.096  16.557  16.557
  250    HB   VAL  35           HB       VAL  35 -12.642  13.775  13.775
  251   1HG1  VAL  35          HG11      VAL  35 -10.282  14.388  14.388
  252   2HG1  VAL  35          HG12      VAL  35 -10.848  15.909  15.909
  253   3HG1  VAL  35          HG13      VAL  35 -11.307  14.406  14.406
  254   1HG2  VAL  35          HG21      VAL  35 -13.292  16.563  16.563
  255   2HG2  VAL  35          HG22      VAL  35 -14.423  15.431  15.431
  256   3HG2  VAL  35          HG23      VAL  35 -13.677  15.060  15.060
  257    H    ALA  36           HN       ALA  36 -11.973  13.424  13.424
  258    HA   ALA  36           HA       ALA  36  -9.122  13.177  13.177
  259   1HB   ALA  36           HB1      ALA  36 -11.406  11.655  11.655
  260   2HB   ALA  36           HB2      ALA  36  -9.742  11.074  11.074
  261   3HB   ALA  36           HB3      ALA  36 -10.618  11.252  11.252
  262    H    LYS  37           HN       LYS  37 -11.612  13.846  13.846
  263    HA   LYS  37           HA       LYS  37  -9.501  14.082  14.082
  264   1HB   LYS  37           HB1      LYS  37 -12.462  14.398  14.398
  265   2HB   LYS  37           HB2      LYS  37 -11.617  15.334  15.334
  266   1HG   LYS  37           HG1      LYS  37 -10.419  13.256  13.256
  267   2HG   LYS  37           HG2      LYS  37 -11.357  12.326  12.326
  268   1HD   LYS  37           HD1      LYS  37 -13.425  12.819  12.819
  269   2HD   LYS  37           HD2      LYS  37 -12.664  14.051  14.051
  270   1HE   LYS  37           HE1      LYS  37 -11.258  12.317  12.317
  271   2HE   LYS  37           HE2      LYS  37 -12.000  11.072  11.072
  272   1HZ   LYS  37           HZ1      LYS  37 -14.039  12.549  12.549
  273   2HZ   LYS  37           HZ2      LYS  37 -12.909  12.164  12.164
  274   3HZ   LYS  37           HZ3      LYS  37 -13.610  10.929  10.929
  275    H    LYS  38           HN       LYS  38 -11.145  16.345  16.345
  276    HA   LYS  38           HA       LYS  38 -10.283  18.679  18.679
  277   1HB   LYS  38           HB1      LYS  38 -12.226  18.456  18.456
  278   2HB   LYS  38           HB2      LYS  38 -10.972  18.474  18.474
  279   1HG   LYS  38           HG1      LYS  38 -11.745  20.742  20.742
  280   2HG   LYS  38           HG2      LYS  38 -10.152  20.673  20.673
  281   1HD   LYS  38           HD1      LYS  38 -12.020  19.964  19.964
  282   2HD   LYS  38           HD2      LYS  38 -12.722  21.320  21.320
  283   1HE   LYS  38           HE1      LYS  38  -9.893  21.265  21.265
  284   2HE   LYS  38           HE2      LYS  38 -11.271  22.061  22.061
  285   1HZ   LYS  38           HZ1      LYS  38 -11.112  22.884  22.884
  286   2HZ   LYS  38           HZ2      LYS  38  -9.574  23.051  23.051
  287   3HZ   LYS  38           HZ3      LYS  38 -10.917  23.810  23.810
  288    H    LEU  39           HN       LEU  39  -9.155  17.072  17.072
  289    HA   LEU  39           HA       LEU  39  -6.788  18.772  18.772
  290   1HB   LEU  39           HB1      LEU  39  -6.802  18.112  18.112
  291   2HB   LEU  39           HB2      LEU  39  -8.326  17.360  17.360
  292    HG   LEU  39           HG       LEU  39  -6.875  15.293  15.293
  293   1HD1  LEU  39          HD11      LEU  39  -5.003  16.992  16.992
  294   2HD1  LEU  39          HD12      LEU  39  -4.696  15.319  15.319
  295   3HD1  LEU  39          HD13      LEU  39  -4.745  16.499  16.499
  296   1HD2  LEU  39          HD21      LEU  39  -8.346  15.468  15.468
  297   2HD2  LEU  39          HD22      LEU  39  -6.857  14.601  14.601
  298   3HD2  LEU  39          HD23      LEU  39  -7.016  16.273  16.273
  299    H    GLY  40           HN       GLY  40  -7.613  15.621  15.621
  300   1HA   GLY  40           HA1      GLY  40  -4.956  14.681  14.681
  301   2HA   GLY  40           HA2      GLY  40  -6.332  14.136  14.136
  302    H    GLU  41           HN       GLU  41  -6.802  17.027  17.027
  303    HA   GLU  41           HA       GLU  41  -4.943  17.079  17.079
  304   1HB   GLU  41           HB1      GLU  41  -7.408  18.579  18.579
  305   2HB   GLU  41           HB2      GLU  41  -6.453  19.182  19.182
  306   1HG   GLU  41           HG1      GLU  41  -8.532  17.518  17.518
  307   2HG   GLU  41           HG2      GLU  41  -7.144  17.557  17.557
  308    H    MET  42           HN       MET  42  -5.816  19.000  19.000
  309    HA   MET  42           HA       MET  42  -4.057  21.171  21.171
  310   1HB   MET  42           HB1      MET  42  -4.701  19.605  19.605
  311   2HB   MET  42           HB2      MET  42  -3.851  21.146  21.146
  312   1HG   MET  42           HG1      MET  42  -6.616  20.719  20.719
  313   2HG   MET  42           HG2      MET  42  -6.358  21.316  21.316
  314   1HE   MET  42           HE1      MET  42  -5.987  21.847  21.847
  315   2HE   MET  42           HE2      MET  42  -7.618  22.314  22.314
  316   3HE   MET  42           HE3      MET  42  -6.510  23.509  23.509
  317    H    TRP  43           HN       TRP  43  -3.511  18.007  18.007
  318    HA   TRP  43           HA       TRP  43  -0.869  17.986  17.986
  319   1HB   TRP  43           HB1      TRP  43  -2.338  16.090  16.090
  320   2HB   TRP  43           HB2      TRP  43  -2.538  15.927  15.927
  321    HD1  TRP  43           HD1      TRP  43  -1.067  14.248  14.248
  322    HE1  TRP  43           HE1      TRP  43   1.111  13.221  13.221
  323    HE3  TRP  43           HE3      TRP  43  -0.074  16.639  16.639
  324    HZ2  TRP  43           HZ2      TRP  43   3.135  13.271  13.271
  325    HZ3  TRP  43           HZ3      TRP  43   1.951  16.134  16.134
  326    HH2  TRP  43           HH2      TRP  43   3.573  14.446  14.446
  327    H    ASN  44           HN       ASN  44  -2.156  17.335  17.335
  328    HA   ASN  44           HA       ASN  44   0.344  16.940  16.940
  329   1HB   ASN  44           HB1      ASN  44  -2.291  17.882  17.882
  330   2HB   ASN  44           HB2      ASN  44  -0.914  17.226  17.226
  331   1HD2  ASN  44          HD21      ASN  44  -3.527  14.597  14.597
  332   2HD2  ASN  44          HD22      ASN  44  -3.846  16.203  16.203
  333    H    ASN  45           HN       ASN  45  -1.063  19.707  19.707
  334    HA   ASN  45           HA       ASN  45   0.876  21.507  21.507
  335   1HB   ASN  45           HB1      ASN  45  -1.856  22.504  22.504
  336   2HB   ASN  45           HB2      ASN  45  -0.792  23.175  23.175
  337   1HD2  ASN  45          HD21      ASN  45  -3.662  20.597  20.597
  338   2HD2  ASN  45          HD22      ASN  45  -3.534  21.341  21.341
  339    H    THR  46           HN       THR  46   1.152  20.134  20.134
  340    HA   THR  46           HA       THR  46   0.615  22.118  22.118
  341    HB   THR  46           HB       THR  46   0.643  19.608  19.608
  342    HG1  THR  46           HG1      THR  46   1.124  20.420  20.420
  343   1HG2  THR  46          HG21      THR  46   2.800  19.035  19.035
  344   2HG2  THR  46          HG22      THR  46   3.702  19.925  19.925
  345   3HG2  THR  46          HG23      THR  46   2.808  18.498  18.498
  346    H    ALA  47           HN       ALA  47   3.082  21.379  21.379
  347    HA   ALA  47           HA       ALA  47   4.636  23.523  23.523
  348   1HB   ALA  47           HB1      ALA  47   5.779  22.114  22.114
  349   2HB   ALA  47           HB2      ALA  47   6.539  23.432  23.432
  350   3HB   ALA  47           HB3      ALA  47   5.084  23.724  23.724
  351    H    ALA  48           HN       ALA  48   5.105  20.397  20.397
  352    HA   ALA  48           HA       ALA  48   5.660  18.370  18.370
  353   1HB   ALA  48           HB1      ALA  48   6.224  19.546  19.546
  354   2HB   ALA  48           HB2      ALA  48   7.724  20.116  20.116
  355   3HB   ALA  48           HB3      ALA  48   7.443  18.396  18.396
  356    H    ASP  49           HN       ASP  49   7.557  21.098  21.098
  357    HA   ASP  49           HA       ASP  49   9.731  19.664  19.664
  358   1HB   ASP  49           HB1      ASP  49   8.920  22.602  22.602
  359   2HB   ASP  49           HB2      ASP  49  10.477  21.941  21.941
  360    H    ASP  50           HN       ASP  50   6.595  20.318  20.318
  361    HA   ASP  50           HA       ASP  50   6.945  20.252  20.252
  362   1HB   ASP  50           HB1      ASP  50   4.943  21.496  21.496
  363   2HB   ASP  50           HB2      ASP  50   4.191  20.610  20.610
  364    H    LYS  51           HN       LYS  51   6.505  18.363  18.363
  365    HA   LYS  51           HA       LYS  51   4.713  16.371  16.371
  366   1HB   LYS  51           HB1      LYS  51   6.354  16.136  16.136
  367   2HB   LYS  51           HB2      LYS  51   5.218  14.946  14.946
  368   1HG   LYS  51           HG1      LYS  51   3.362  16.534  16.534
  369   2HG   LYS  51           HG2      LYS  51   4.509  17.746  17.746
  370   1HD   LYS  51           HD1      LYS  51   5.201  16.281  16.281
  371   2HD   LYS  51           HD2      LYS  51   4.112  15.023  15.023
  372   1HE   LYS  51           HE1      LYS  51   2.175  16.393  16.393
  373   2HE   LYS  51           HE2      LYS  51   3.166  17.804  17.804
  374   1HZ   LYS  51           HZ1      LYS  51   3.996  15.655  15.655
  375   2HZ   LYS  51           HZ2      LYS  51   2.307  15.794  15.794
  376   3HZ   LYS  51           HZ3      LYS  51   3.298  17.129  17.129
  377    H    GLN  52           HN       GLN  52   7.982  16.753  16.753
  378    HA   GLN  52           HA       GLN  52   9.458  14.678  14.678
  379   1HB   GLN  52           HB1      GLN  52   9.953  17.571  17.571
  380   2HB   GLN  52           HB2      GLN  52  11.035  16.522  16.522
  381   1HG   GLN  52           HG1      GLN  52  12.046  16.993  16.993
  382   2HG   GLN  52           HG2      GLN  52  11.551  15.313  15.313
  383   1HE2  GLN  52          HE21      GLN  52   8.989  15.828  15.828
  384   2HE2  GLN  52          HE22      GLN  52   9.450  14.819  14.819
  385    HA   PRO  53           HA       PRO  53   9.724  15.039  15.039
  386   1HB   PRO  53           HB1      PRO  53   7.391  16.210  16.210
  387   2HB   PRO  53           HB2      PRO  53   8.964  16.997  16.997
  388   1HG   PRO  53           HG1      PRO  53   6.660  17.025  17.025
  389   2HG   PRO  53           HG2      PRO  53   7.546  18.410  18.410
  390   1HD   PRO  53           HD1      PRO  53   8.313  17.519  17.519
  391   2HD   PRO  53           HD2      PRO  53   9.601  17.745  17.745
  392    H    TYR  54           HN       TYR  54   6.513  14.906  14.906
  393    HA   TYR  54           HA       TYR  54   5.644  12.585  12.585
  394   1HB   TYR  54           HB1      TYR  54   4.423  13.969  13.969
  395   2HB   TYR  54           HB2      TYR  54   3.605  12.774  12.774
  396    HD1  TYR  54           HD1      TYR  54   4.014  13.420  13.420
  397    HD2  TYR  54           HD2      TYR  54   3.808  16.156  16.156
  398    HE1  TYR  54           HE1      TYR  54   3.376  15.212  15.212
  399    HE2  TYR  54           HE2      TYR  54   3.175  17.948  17.948
  400    HH   TYR  54           HH       TYR  54   2.061  18.111  18.111
  401    H    GLU  55           HN       GLU  55   6.493  13.238  13.238
  402    HA   GLU  55           HA       GLU  55   6.081  10.709  10.709
  403   1HB   GLU  55           HB1      GLU  55   7.306  13.199  13.199
  404   2HB   GLU  55           HB2      GLU  55   8.531  11.990  11.990
  405   1HG   GLU  55           HG1      GLU  55   6.824  10.675  10.675
  406   2HG   GLU  55           HG2      GLU  55   5.667  11.968  11.968
  407    H    LYS  56           HN       LYS  56   9.037  11.955  11.955
  408    HA   LYS  56           HA       LYS  56  10.755   9.826   9.826
  409   1HB   LYS  56           HB1      LYS  56  10.199  11.751  11.751
  410   2HB   LYS  56           HB2      LYS  56  11.471  10.573  10.573
  411   1HG   LYS  56           HG1      LYS  56  11.408  12.517  12.517
  412   2HG   LYS  56           HG2      LYS  56  12.093  12.966  12.966
  413   1HD   LYS  56           HD1      LYS  56  13.498  10.752  10.752
  414   2HD   LYS  56           HD2      LYS  56  13.000  10.797  10.797
  415   1HE   LYS  56           HE1      LYS  56  14.437  13.063  13.063
  416   2HE   LYS  56           HE2      LYS  56  15.209  11.938  11.938
  417   1HZ   LYS  56           HZ1      LYS  56  12.951  13.039  13.039
  418   2HZ   LYS  56           HZ2      LYS  56  13.884  14.300  14.300
  419   3HZ   LYS  56           HZ3      LYS  56  14.589  13.193  13.193
  420    H    LYS  57           HN       LYS  57   8.093  10.253  10.253
  421    HA   LYS  57           HA       LYS  57   8.567   7.860   7.860
  422   1HB   LYS  57           HB1      LYS  57   6.581  10.007  10.007
  423   2HB   LYS  57           HB2      LYS  57   5.728   8.480   8.480
  424   1HG   LYS  57           HG1      LYS  57   6.146   9.086   9.086
  425   2HG   LYS  57           HG2      LYS  57   7.253   7.778   7.778
  426   1HD   LYS  57           HD1      LYS  57   9.000   9.627   9.627
  427   2HD   LYS  57           HD2      LYS  57   7.867  10.758  10.758
  428   1HE   LYS  57           HE1      LYS  57   9.462  10.086  10.086
  429   2HE   LYS  57           HE2      LYS  57   7.905   9.369   9.369
  430   1HZ   LYS  57           HZ1      LYS  57   9.246   7.601   7.601
  431   2HZ   LYS  57           HZ2      LYS  57  10.336   8.089   8.089
  432   3HZ   LYS  57           HZ3      LYS  57   8.842   7.405   7.405
  433    H    ALA  58           HN       ALA  58   6.109   8.602   8.602
  434    HA   ALA  58           HA       ALA  58   4.991   6.121   6.121
  435   1HB   ALA  58           HB1      ALA  58   4.335   8.160   8.160
  436   2HB   ALA  58           HB2      ALA  58   5.831   8.072   8.072
  437   3HB   ALA  58           HB3      ALA  58   4.617   6.814   6.814
  438    H    ALA  59           HN       ALA  59   7.915   7.280   7.280
  439    HA   ALA  59           HA       ALA  59   8.641   4.986   4.986
  440   1HB   ALA  59           HB1      ALA  59   9.748   7.199   7.199
  441   2HB   ALA  59           HB2      ALA  59  10.466   7.045   7.045
  442   3HB   ALA  59           HB3      ALA  59  10.944   5.951   5.951
  443    H    LYS  60           HN       LYS  60   9.961   5.956   5.956
  444    HA   LYS  60           HA       LYS  60  11.435   3.730   3.730
  445   1HB   LYS  60           HB1      LYS  60  11.220   5.877   5.877
  446   2HB   LYS  60           HB2      LYS  60   9.681   5.312   5.312
  447   1HG   LYS  60           HG1      LYS  60  10.884   3.253   3.253
  448   2HG   LYS  60           HG2      LYS  60  12.394   3.979   3.979
  449   1HD   LYS  60           HD1      LYS  60  11.924   5.954   5.954
  450   2HD   LYS  60           HD2      LYS  60  10.440   5.181   5.181
  451   1HE   LYS  60           HE1      LYS  60  11.805   3.228   3.228
  452   2HE   LYS  60           HE2      LYS  60  13.267   4.090   4.090
  453   1HZ   LYS  60           HZ1      LYS  60  11.675   5.802   5.802
  454   2HZ   LYS  60           HZ2      LYS  60  11.817   4.316   4.316
  455   3HZ   LYS  60           HZ3      LYS  60  13.209   5.175   5.175
  456    H    LEU  61           HN       LEU  61   7.990   4.191   4.191
  457    HA   LEU  61           HA       LEU  61   7.597   1.640   1.640
  458   1HB   LEU  61           HB1      LEU  61   5.593   3.355   3.355
  459   2HB   LEU  61           HB2      LEU  61   5.195   2.116   2.116
  460    HG   LEU  61           HG       LEU  61   6.734   4.703   4.703
  461   1HD1  LEU  61          HD11      LEU  61   4.348   4.964   4.964
  462   2HD1  LEU  61          HD12      LEU  61   4.062   3.711   3.711
  463   3HD1  LEU  61          HD13      LEU  61   4.834   5.231   5.231
  464   1HD2  LEU  61          HD21      LEU  61   6.199   2.440   2.440
  465   2HD2  LEU  61          HD22      LEU  61   7.773   2.937   2.937
  466   3HD2  LEU  61          HD23      LEU  61   6.856   4.022   4.022
  467    H    LYS  62           HN       LYS  62   6.804   2.636   2.636
  468    HA   LYS  62           HA       LYS  62   6.021   0.120   0.120
  469   1HB   LYS  62           HB1      LYS  62   6.324   2.475   2.475
  470   2HB   LYS  62           HB2      LYS  62   7.911   1.828   1.828
  471   1HG   LYS  62           HG1      LYS  62   6.807  -0.258  -0.258
  472   2HG   LYS  62           HG2      LYS  62   5.235   0.446   0.446
  473   1HD   LYS  62           HD1      LYS  62   5.951   2.402   2.402
  474   2HD   LYS  62           HD2      LYS  62   7.319   1.409   1.409
  475   1HE   LYS  62           HE1      LYS  62   4.383   0.631   0.631
  476   2HE   LYS  62           HE2      LYS  62   5.432   1.119   1.119
  477   1HZ   LYS  62           HZ1      LYS  62   6.686  -0.955  -0.955
  478   2HZ   LYS  62           HZ2      LYS  62   5.085  -1.420  -1.420
  479   3HZ   LYS  62           HZ3      LYS  62   6.100  -0.957  -0.957
  480    H    GLU  63           HN       GLU  63   9.294   1.445   1.445
  481    HA   GLU  63           HA       GLU  63  10.794  -0.679  -0.679
  482   1HB   GLU  63           HB1      GLU  63  11.527   1.748   1.748
  483   2HB   GLU  63           HB2      GLU  63  11.630   0.958   0.958
  484   1HG   GLU  63           HG1      GLU  63  13.329  -0.649  -0.649
  485   2HG   GLU  63           HG2      GLU  63  13.258   0.187   0.187
  486    H    LYS  64           HN       LYS  64   9.713  -0.133  -0.133
  487    HA   LYS  64           HA       LYS  64  10.867  -2.477  -2.477
  488   1HB   LYS  64           HB1      LYS  64   9.808  -0.502  -0.502
  489   2HB   LYS  64           HB2      LYS  64   8.232  -1.184  -1.184
  490   1HG   LYS  64           HG1      LYS  64   8.837  -3.271  -3.271
  491   2HG   LYS  64           HG2      LYS  64  10.425  -2.622  -2.622
  492   1HD   LYS  64           HD1      LYS  64   7.772  -1.450  -1.450
  493   2HD   LYS  64           HD2      LYS  64   8.897  -2.367  -2.367
  494   1HE   LYS  64           HE1      LYS  64  10.647  -0.593  -0.593
  495   2HE   LYS  64           HE2      LYS  64   9.463   0.351   0.351
  496   1HZ   LYS  64           HZ1      LYS  64   8.325  -0.390  -0.390
  497   2HZ   LYS  64           HZ2      LYS  64   9.860   0.268   0.268
  498   3HZ   LYS  64           HZ3      LYS  64   8.712   1.160   1.160
  499    H    TYR  65           HN       TYR  65   7.590  -1.943  -1.943
  500    HA   TYR  65           HA       TYR  65   6.484  -4.500  -4.500
  501   1HB   TYR  65           HB1      TYR  65   4.979  -2.791  -2.791
  502   2HB   TYR  65           HB2      TYR  65   6.037  -2.140  -2.140
  503    HD1  TYR  65           HD1      TYR  65   4.075  -5.306  -5.306
  504    HD2  TYR  65           HD2      TYR  65   5.343  -2.396  -2.396
  505    HE1  TYR  65           HE1      TYR  65   2.768  -6.425  -6.425
  506    HE2  TYR  65           HE2      TYR  65   4.041  -3.519  -3.519
  507    HH   TYR  65           HH       TYR  65   3.146  -6.299  -6.299
  508    H    GLU  66           HN       GLU  66   7.937  -3.148  -3.148
  509    HA   GLU  66           HA       GLU  66   7.914  -5.224  -5.224
  510   1HB   GLU  66           HB1      GLU  66  10.033  -3.159  -3.159
  511   2HB   GLU  66           HB2      GLU  66   9.914  -4.149  -4.149
  512   1HG   GLU  66           HG1      GLU  66   7.517  -2.534  -2.534
  513   2HG   GLU  66           HG2      GLU  66   8.774  -1.719  -1.719
  514    H    LYS  67           HN       LYS  67  10.038  -4.893  -4.893
  515    HA   LYS  67           HA       LYS  67  11.813  -7.014  -7.014
  516   1HB   LYS  67           HB1      LYS  67  11.885  -5.017  -5.017
  517   2HB   LYS  67           HB2      LYS  67  12.750  -6.515  -6.515
  518   1HG   LYS  67           HG1      LYS  67  14.270  -4.957  -4.957
  519   2HG   LYS  67           HG2      LYS  67  13.935  -6.225  -6.225
  520   1HD   LYS  67           HD1      LYS  67  12.171  -4.574  -4.574
  521   2HD   LYS  67           HD2      LYS  67  12.941  -3.361  -3.361
  522   1HE   LYS  67           HE1      LYS  67  15.103  -3.757  -3.757
  523   2HE   LYS  67           HE2      LYS  67  14.400  -5.052  -5.052
  524   1HZ   LYS  67           HZ1      LYS  67  12.806  -2.790  -2.790
  525   2HZ   LYS  67           HZ2      LYS  67  14.421  -2.315  -2.315
  526   3HZ   LYS  67           HZ3      LYS  67  13.773  -3.578  -3.578
  527    H    ASP  68           HN       ASP  68   9.334  -6.580  -6.580
  528    HA   ASP  68           HA       ASP  68   9.658  -9.194  -9.194
  529   1HB   ASP  68           HB1      ASP  68   7.750  -6.893  -6.893
  530   2HB   ASP  68           HB2      ASP  68   7.558  -8.415  -8.415
  531    H    ILE  69           HN       ILE  69   8.097  -7.780  -7.780
  532    HA   ILE  69           HA       ILE  69   6.003  -9.871  -9.871
  533    HB   ILE  69           HB       ILE  69   5.436  -7.429  -7.429
  534   1HG1  ILE  69          HG11      ILE  69   4.007  -7.878  -7.878
  535   2HG1  ILE  69          HG12      ILE  69   5.134  -8.942  -8.942
  536   1HG2  ILE  69          HG21      ILE  69   7.591  -7.004  -7.004
  537   2HG2  ILE  69          HG22      ILE  69   7.084  -7.994  -7.994
  538   3HG2  ILE  69          HG23      ILE  69   6.201  -6.524  -6.524
  539   1HD1  ILE  69          HD11      ILE  69   3.714  -9.608  -9.608
  540   2HD1  ILE  69          HD12      ILE  69   3.269 -10.208 -10.208
  541   3HD1  ILE  69          HD13      ILE  69   4.805 -10.650 -10.650
  542    H    ALA  70           HN       ALA  70   8.759  -8.647  -8.647
  543    HA   ALA  70           HA       ALA  70   8.965 -10.535 -10.535
  544   1HB   ALA  70           HB1      ALA  70  11.237  -9.061  -9.061
  545   2HB   ALA  70           HB2      ALA  70  11.402  -9.909  -9.909
  546   3HB   ALA  70           HB3      ALA  70  10.394  -8.485  -8.485
  547    H    ALA  71           HN       ALA  71   9.792 -10.500 -10.500
  548    HA   ALA  71           HA       ALA  71  11.245 -13.034 -13.034
  549   1HB   ALA  71           HB1      ALA  71  10.269 -11.329 -11.329
  550   2HB   ALA  71           HB2      ALA  71  11.351 -12.707 -12.707
  551   3HB   ALA  71           HB3      ALA  71  11.875 -11.264 -11.264
  552    H    TYR  72           HN       TYR  72   8.075 -11.798 -11.798
  553    HA   TYR  72           HA       TYR  72   6.994 -14.143 -14.143
  554   1HB   TYR  72           HB1      TYR  72   5.867 -12.059 -12.059
  555   2HB   TYR  72           HB2      TYR  72   5.712 -11.834 -11.834
  556    HD1  TYR  72           HD1      TYR  72   4.871 -14.431 -14.431
  557    HD2  TYR  72           HD2      TYR  72   3.582 -12.270 -12.270
  558    HE1  TYR  72           HE1      TYR  72   2.719 -15.592 -15.592
  559    HE2  TYR  72           HE2      TYR  72   1.429 -13.430 -13.430
  560    HH   TYR  72           HH       TYR  72   0.401 -15.238 -15.238
  561    H    ARG  73           HN       ARG  73   7.011 -13.051 -13.051
  562    HA   ARG  73           HA       ARG  73   5.511 -15.343 -15.343
  563   1HB   ARG  73           HB1      ARG  73   6.908 -13.018 -13.018
  564   2HB   ARG  73           HB2      ARG  73   5.879 -14.186 -14.186
  565   1HG   ARG  73           HG1      ARG  73   3.935 -13.474 -13.474
  566   2HG   ARG  73           HG2      ARG  73   4.933 -12.438 -12.438
  567   1HD   ARG  73           HD1      ARG  73   3.698 -11.152 -11.152
  568   2HD   ARG  73           HD2      ARG  73   5.444 -10.986 -10.986
  569    HE   ARG  73           HE       ARG  73   5.315 -12.702 -12.702
  570   1HH1  ARG  73          HH11      ARG  73   3.465 -14.006 -14.006
  571   2HH1  ARG  73          HH12      ARG  73   2.172 -13.047 -13.047
  572   1HH2  ARG  73          HH21      ARG  73   3.268 -10.137 -10.137
  573   2HH2  ARG  73          HH22      ARG  73   2.060 -10.801 -10.801
  574    H    ALA  74           HN       ALA  74   8.692 -14.421 -14.421
  575    HA   ALA  74           HA       ALA  74   9.785 -16.422 -16.422
  576   1HB   ALA  74           HB1      ALA  74  11.172 -14.649 -14.649
  577   2HB   ALA  74           HB2      ALA  74  12.000 -15.671 -15.671
  578   3HB   ALA  74           HB3      ALA  74  11.013 -14.339 -14.339
  579    H    LYS  75           HN       LYS  75   8.937 -16.170 -16.170
  580    HA   LYS  75           HA       LYS  75   9.860 -18.976 -18.976
  581   1HB   LYS  75           HB1      LYS  75  11.607 -17.425 -17.425
  582   2HB   LYS  75           HB2      LYS  75  10.419 -16.713 -16.713
  583   1HG   LYS  75           HG1      LYS  75  10.084 -18.921 -18.921
  584   2HG   LYS  75           HG2      LYS  75  11.194 -19.673 -19.673
  585   1HD   LYS  75           HD1      LYS  75  12.761 -19.288 -19.288
  586   2HD   LYS  75           HD2      LYS  75  12.794 -17.661 -17.661
  587   1HE   LYS  75           HE1      LYS  75  11.080 -18.604 -18.604
  588   2HE   LYS  75           HE2      LYS  75  12.542 -17.643 -17.643
  589   1HZ   LYS  75           HZ1      LYS  75  10.801 -16.368 -16.368
  590   2HZ   LYS  75           HZ2      LYS  75   9.933 -16.772 -16.772
  591   3HZ   LYS  75           HZ3      LYS  75  11.351 -15.844 -15.844
  592    H    GLY  76           HN       GLY  76   8.294 -16.392 -16.392
  593   1HA   GLY  76           HA1      GLY  76   6.847 -17.050 -17.050
  594   2HA   GLY  76           HA2      GLY  76   5.956 -16.344 -16.344
  595    H    LYS  77           HN       LYS  77   4.526 -17.501 -17.501
  596    HA   LYS  77           HA       LYS  77   2.860 -19.105 -19.105
  597   1HB   LYS  77           HB1      LYS  77   5.139 -21.050 -21.050
  598   2HB   LYS  77           HB2      LYS  77   3.752 -21.406 -21.406
  599   1HG   LYS  77           HG1      LYS  77   4.439 -19.667 -19.667
  600   2HG   LYS  77           HG2      LYS  77   5.829 -19.265 -19.265
  601   1HD   LYS  77           HD1      LYS  77   6.635 -21.650 -21.650
  602   2HD   LYS  77           HD2      LYS  77   5.311 -21.949 -21.949
  603   1HE   LYS  77           HE1      LYS  77   7.482 -19.841 -19.841
  604   2HE   LYS  77           HE2      LYS  77   7.407 -21.381 -21.381
  605   1HZ   LYS  77           HZ1      LYS  77   4.940 -20.097 -20.097
  606   2HZ   LYS  77           HZ2      LYS  77   6.166 -18.981 -18.981
  607   3HZ   LYS  77           HZ3      LYS  77   6.094 -20.470 -20.470
  608    HA   PRO  78           HA       PRO  78   1.591 -20.801 -20.801
  609   1HB   PRO  78           HB1      PRO  78  -0.086 -22.820 -22.820
  610   2HB   PRO  78           HB2      PRO  78  -0.513 -21.161 -21.161
  611   1HG   PRO  78           HG1      PRO  78   0.866 -23.260 -23.260
  612   2HG   PRO  78           HG2      PRO  78  -0.607 -22.354 -22.354
  613   1HD   PRO  78           HD1      PRO  78   1.822 -21.478 -21.478
  614   2HD   PRO  78           HD2      PRO  78   0.590 -20.311 -20.311
  615    H    ASP  79           HN       ASP  79   4.025 -21.278 -21.278
  616    HA   ASP  79           HA       ASP  79   5.869 -22.698 -22.698
  617   1HB   ASP  79           HB1      ASP  79   3.749 -24.223 -24.223
  618   2HB   ASP  79           HB2      ASP  79   5.480 -24.460 -24.460
  619    H    ALA  80           HN       ALA  80   5.274 -23.013 -23.013
  620    HA   ALA  80           HA       ALA  80   4.649 -24.396 -24.396
  621   1HB   ALA  80           HB1      ALA  80   7.086 -24.227 -24.227
  622   2HB   ALA  80           HB2      ALA  80   7.118 -25.613 -25.613
  623   3HB   ALA  80           HB3      ALA  80   6.661 -25.821 -25.821
  624    H    ALA  81           HN       ALA  81   2.691 -25.233 -25.233
  625    HA   ALA  81           HA       ALA  81   2.822 -28.189 -28.189
  626   1HB   ALA  81           HB1      ALA  81   0.760 -26.163 -26.163
  627   2HB   ALA  81           HB2      ALA  81   0.715 -27.889 -27.889
  628   3HB   ALA  81           HB3      ALA  81   2.008 -26.899 -26.899
  629   1H1   BME  16           HE1      MER  16  -8.196   9.980   9.980
  630   2H1   BME  16           HE2      MER  16  -8.550  11.413  11.413
  631   1H2   BME  16           HZ1      MER  16  -6.705   9.147   9.147
  632   2H2   BME  16           HZ2      MER  16  -6.158  10.654  10.654
  633    HO1  BME  16           HH       MER  16  -9.509   8.922   8.922

  Start of MODEL    5
    1    H    ASN   3           HN       ASN   3   1.322  -8.957  -8.957
    2    HA   ASN   3           HA       ASN   3   1.564 -10.789 -10.789
    3   1HB   ASN   3           HB1      ASN   3  -1.026 -11.971 -11.971
    4   2HB   ASN   3           HB2      ASN   3  -0.025 -12.706 -12.706
    5   1HD2  ASN   3          HD21      ASN   3   0.954 -13.305 -13.305
    6   2HD2  ASN   3          HD22      ASN   3  -0.536 -12.654 -12.654
    7    H    ALA   4           HN       ALA   4   0.709 -10.887 -10.887
    8    HA   ALA   4           HA       ALA   4  -0.702 -10.602 -10.602
    9   1HB   ALA   4           HB1      ALA   4  -2.800 -10.450 -10.450
   10   2HB   ALA   4           HB2      ALA   4  -2.424  -8.747  -8.747
   11   3HB   ALA   4           HB3      ALA   4  -2.789  -9.292  -9.292
   12    HA   PRO   5           HA       PRO   5   1.210  -6.732  -6.732
   13   1HB   PRO   5           HB1      PRO   5  -0.057  -6.206  -6.206
   14   2HB   PRO   5           HB2      PRO   5   1.193  -7.439  -7.439
   15   1HG   PRO   5           HG1      PRO   5  -1.843  -7.806  -7.806
   16   2HG   PRO   5           HG2      PRO   5  -0.658  -8.668  -8.668
   17   1HD   PRO   5           HD1      PRO   5  -1.431  -9.746  -9.746
   18   2HD   PRO   5           HD2      PRO   5   0.242  -9.875  -9.875
   19    H    LYS   6           HN       LYS   6   0.553  -5.477  -5.477
   20    HA   LYS   6           HA       LYS   6  -2.131  -4.346  -4.346
   21   1HB   LYS   6           HB1      LYS   6   0.359  -4.421  -4.421
   22   2HB   LYS   6           HB2      LYS   6  -0.390  -2.861  -2.861
   23   1HG   LYS   6           HG1      LYS   6  -1.895  -5.484  -5.484
   24   2HG   LYS   6           HG2      LYS   6  -1.087  -4.619  -4.619
   25   1HD   LYS   6           HD1      LYS   6  -3.111  -3.145  -3.145
   26   2HD   LYS   6           HD2      LYS   6  -3.687  -4.218  -4.218
   27   1HE   LYS   6           HE1      LYS   6  -3.550  -2.021  -2.021
   28   2HE   LYS   6           HE2      LYS   6  -2.192  -2.916  -2.916
   29   1HZ   LYS   6           HZ1      LYS   6  -1.428  -1.635  -1.635
   30   2HZ   LYS   6           HZ2      LYS   6  -2.154  -0.514  -0.514
   31   3HZ   LYS   6           HZ3      LYS   6  -0.826  -1.424  -1.424
   32    H    ARG   7           HN       ARG   7  -2.230  -1.909  -1.909
   33    HA   ARG   7           HA       ARG   7  -0.621  -0.588  -0.588
   34   1HB   ARG   7           HB1      ARG   7  -2.716   0.693   0.693
   35   2HB   ARG   7           HB2      ARG   7  -2.747  -1.003  -1.003
   36   1HG   ARG   7           HG1      ARG   7  -3.845  -0.356  -0.356
   37   2HG   ARG   7           HG2      ARG   7  -4.751   0.320   0.320
   38   1HD   ARG   7           HD1      ARG   7  -4.010  -2.635  -2.635
   39   2HD   ARG   7           HD2      ARG   7  -5.546  -1.964  -1.964
   40    HE   ARG   7           HE       ARG   7  -5.787  -1.150  -1.150
   41   1HH1  ARG   7          HH11      ARG   7  -3.087  -2.511  -2.511
   42   2HH1  ARG   7          HH12      ARG   7  -3.656  -3.936  -3.936
   43   1HH2  ARG   7          HH21      ARG   7  -6.931  -3.555  -3.555
   44   2HH2  ARG   7          HH22      ARG   7  -5.873  -4.541  -4.541
   45    HA   PRO   8           HA       PRO   8  -0.070   1.915   1.915
   46   1HB   PRO   8           HB1      PRO   8   2.530   2.362   2.362
   47   2HB   PRO   8           HB2      PRO   8   2.297   2.034   2.034
   48   1HG   PRO   8           HG1      PRO   8   3.154   0.032   0.032
   49   2HG   PRO   8           HG2      PRO   8   1.826  -0.286  -0.286
   50   1HD   PRO   8           HD1      PRO   8   1.614   0.324   0.324
   51   2HD   PRO   8           HD2      PRO   8   0.919  -1.036  -1.036
   52    HA   PRO   9           HA       PRO   9  -1.024   6.030   6.030
   53   1HB   PRO   9           HB1      PRO   9   1.288   7.560   7.560
   54   2HB   PRO   9           HB2      PRO   9  -0.016   7.197   7.197
   55   1HG   PRO   9           HG1      PRO   9   2.563   5.626   5.626
   56   2HG   PRO   9           HG2      PRO   9   1.866   6.228   6.228
   57   1HD   PRO   9           HD1      PRO   9   1.377   3.707   3.707
   58   2HD   PRO   9           HD2      PRO   9  -0.038   4.687   4.687
   59    H    SER  10           HN       SER  10  -0.264   7.895   7.895
   60    HA   SER  10           HA       SER  10   0.915   6.759   6.759
   61   1HB   SER  10           HB1      SER  10  -0.353   8.662   8.662
   62   2HB   SER  10           HB2      SER  10  -1.416   7.569   7.569
   63    HG   SER  10           HG       SER  10  -0.928  10.168  10.168
   64    H    ALA  11           HN       ALA  11   0.773   9.741   9.741
   65    HA   ALA  11           HA       ALA  11   3.291  10.534  10.534
   66   1HB   ALA  11           HB1      ALA  11   2.549  11.519  11.519
   67   2HB   ALA  11           HB2      ALA  11   3.939  12.024  12.024
   68   3HB   ALA  11           HB3      ALA  11   3.870  10.401  10.401
   69    H    PHE  12           HN       PHE  12   0.253  11.377  11.377
   70    HA   PHE  12           HA       PHE  12   0.184  13.983  13.983
   71   1HB   PHE  12           HB1      PHE  12  -1.241  14.599  14.599
   72   2HB   PHE  12           HB2      PHE  12  -0.657  13.136  13.136
   73    HD1  PHE  12           HD1      PHE  12  -3.437  14.109  14.109
   74    HD2  PHE  12           HD2      PHE  12  -2.163  11.944  11.944
   75    HE1  PHE  12           HE1      PHE  12  -5.749  13.438  13.438
   76    HE2  PHE  12           HE2      PHE  12  -4.481  11.276  11.276
   77    HZ   PHE  12           HZ       PHE  12  -6.286  12.011  12.011
   78    H    PHE  13           HN       PHE  13  -0.403  10.819  10.819
   79    HA   PHE  13           HA       PHE  13  -2.894  10.968  10.968
   80   1HB   PHE  13           HB1      PHE  13  -1.743   8.852   8.852
   81   2HB   PHE  13           HB2      PHE  13  -0.583   9.091   9.091
   82    HD1  PHE  13           HD1      PHE  13  -1.547   9.252   9.252
   83    HD2  PHE  13           HD2      PHE  13  -3.830   7.858   7.858
   84    HE1  PHE  13           HE1      PHE  13  -3.178   8.250   8.250
   85    HE2  PHE  13           HE2      PHE  13  -5.456   6.855   6.855
   86    HZ   PHE  13           HZ       PHE  13  -5.126   7.037   7.037
   87    H    LEU  14           HN       LEU  14   0.544  11.410  11.410
   88    HA   LEU  14           HA       LEU  14   0.193  11.824  11.824
   89   1HB   LEU  14           HB1      LEU  14   2.311  13.036  13.036
   90   2HB   LEU  14           HB2      LEU  14   2.426  12.972  12.972
   91    HG   LEU  14           HG       LEU  14   3.855  11.291  11.291
   92   1HD1  LEU  14          HD11      LEU  14   2.478  10.397  10.397
   93   2HD1  LEU  14          HD12      LEU  14   1.287   9.798   9.798
   94   3HD1  LEU  14          HD13      LEU  14   2.903   9.116   9.116
   95   1HD2  LEU  14          HD21      LEU  14   3.293  11.182  11.182
   96   2HD2  LEU  14          HD22      LEU  14   3.408   9.569   9.569
   97   3HD2  LEU  14          HD23      LEU  14   1.837  10.258  10.258
   98    H    PHE  15           HN       PHE  15   0.704  14.086  14.086
   99    HA   PHE  15           HA       PHE  15   0.142  16.558  16.558
  100   1HB   PHE  15           HB1      PHE  15   0.927  16.508  16.508
  101   2HB   PHE  15           HB2      PHE  15  -0.236  15.247  15.247
  102    HD1  PHE  15           HD1      PHE  15  -0.051  18.915  18.915
  103    HD2  PHE  15           HD2      PHE  15  -2.072  15.763  15.763
  104    HE1  PHE  15           HE1      PHE  15  -1.462  20.560  20.560
  105    HE2  PHE  15           HE2      PHE  15  -3.476  17.405  17.405
  106    HZ   PHE  15           HZ       PHE  15  -3.172  19.805  19.805
  107    H    CYS  16           HN       MER  16  -2.167  14.337  14.337
  108    HA   CYS  16           HA       MER  16  -4.576  15.677  15.677
  109   1HB   CYS  16           HB1      MER  16  -4.415  13.625  13.625
  110   2HB   CYS  16           HB2      MER  16  -4.068  12.683  12.683
  111    H    SER  17           HN       SER  17  -2.963  13.369  13.369
  112    HA   SER  17           HA       SER  17  -4.906  13.325  13.325
  113   1HB   SER  17           HB1      SER  17  -3.141  12.538  12.538
  114   2HB   SER  17           HB2      SER  17  -2.759  11.909  11.909
  115    HG   SER  17           HG       SER  17  -1.363  13.574  13.574
  116    H    GLU  18           HN       GLU  18  -2.328  15.573  15.573
  117    HA   GLU  18           HA       GLU  18  -2.644  17.177  17.177
  118   1HB   GLU  18           HB1      GLU  18  -0.650  17.017  17.017
  119   2HB   GLU  18           HB2      GLU  18  -1.537  18.014  18.014
  120   1HG   GLU  18           HG1      GLU  18  -1.690  19.843  19.843
  121   2HG   GLU  18           HG2      GLU  18  -0.864  18.859  18.859
  122    H    TYR  19           HN       TYR  19  -4.324  16.935  16.935
  123    HA   TYR  19           HA       TYR  19  -5.730  19.527  19.527
  124   1HB   TYR  19           HB1      TYR  19  -5.314  17.488  17.488
  125   2HB   TYR  19           HB2      TYR  19  -6.887  18.326  18.326
  126    HD1  TYR  19           HD1      TYR  19  -3.268  19.038  19.038
  127    HD2  TYR  19           HD2      TYR  19  -6.995  20.395  20.395
  128    HE1  TYR  19           HE1      TYR  19  -2.149  20.974  20.974
  129    HE2  TYR  19           HE2      TYR  19  -5.875  22.333  22.333
  130    HH   TYR  19           HH       TYR  19  -3.768  23.128  23.128
  131    H    ARG  20           HN       ARG  20  -6.413  16.174  16.174
  132    HA   ARG  20           HA       ARG  20  -8.990  15.670  15.670
  133   1HB   ARG  20           HB1      ARG  20  -6.913  14.598  14.598
  134   2HB   ARG  20           HB2      ARG  20  -8.194  14.938  14.938
  135   1HG   ARG  20           HG1      ARG  20  -9.841  13.762  13.762
  136   2HG   ARG  20           HG2      ARG  20  -8.554  13.372  13.372
  137   1HD   ARG  20           HD1      ARG  20  -8.414  12.513  12.513
  138   2HD   ARG  20           HD2      ARG  20  -9.245  11.532  11.532
  139    HE   ARG  20           HE       ARG  20  -6.967  11.627  11.627
  140   1HH1  ARG  20          HH11      ARG  20  -7.513  11.170  11.170
  141   2HH1  ARG  20          HH12      ARG  20  -5.892  10.652  10.652
  142   1HH2  ARG  20          HH21      ARG  20  -4.837  11.165  11.165
  143   2HH2  ARG  20          HH22      ARG  20  -4.361  10.645  10.645
  144    HA   PRO  21           HA       PRO  21 -10.572  17.932  17.932
  145   1HB   PRO  21           HB1      PRO  21  -8.924  19.824  19.824
  146   2HB   PRO  21           HB2      PRO  21  -8.926  18.124  18.124
  147   1HG   PRO  21           HG1      PRO  21  -7.084  19.460  19.460
  148   2HG   PRO  21           HG2      PRO  21  -6.624  18.507  18.507
  149   1HD   PRO  21           HD1      PRO  21  -6.765  17.268  17.268
  150   2HD   PRO  21           HD2      PRO  21  -7.500  16.471  16.471
  151    H    LYS  22           HN       LYS  22  -8.291  19.974  19.974
  152    HA   LYS  22           HA       LYS  22  -9.692  22.340  22.340
  153   1HB   LYS  22           HB1      LYS  22  -7.291  21.769  21.769
  154   2HB   LYS  22           HB2      LYS  22  -7.954  21.241  21.241
  155   1HG   LYS  22           HG1      LYS  22  -9.056  23.536  23.536
  156   2HG   LYS  22           HG2      LYS  22  -8.178  24.031  24.031
  157   1HD   LYS  22           HD1      LYS  22  -7.005  23.184  23.184
  158   2HD   LYS  22           HD2      LYS  22  -6.996  24.791  24.791
  159   1HE   LYS  22           HE1      LYS  22  -4.792  23.981  23.981
  160   2HE   LYS  22           HE2      LYS  22  -5.593  23.784  23.784
  161   1HZ   LYS  22           HZ1      LYS  22  -6.041  21.484  21.484
  162   2HZ   LYS  22           HZ2      LYS  22  -4.385  21.840  21.840
  163   3HZ   LYS  22           HZ3      LYS  22  -5.162  21.641  21.641
  164    H    ILE  23           HN       ILE  23 -10.085  19.564  19.564
  165    HA   ILE  23           HA       ILE  23 -11.957  21.189  21.189
  166    HB   ILE  23           HB       ILE  23 -12.103  18.743  18.743
  167   1HG1  ILE  23          HG11      ILE  23  -9.225  18.824  18.824
  168   2HG1  ILE  23          HG12      ILE  23 -10.419  17.794  17.794
  169   1HG2  ILE  23          HG21      ILE  23 -11.556  20.878  20.878
  170   2HG2  ILE  23          HG22      ILE  23  -9.934  20.826  20.826
  171   3HG2  ILE  23          HG23      ILE  23 -10.423  19.654  19.654
  172   1HD1  ILE  23          HD11      ILE  23 -10.905  16.757  16.757
  173   2HD1  ILE  23          HD12      ILE  23  -9.660  17.743  17.743
  174   3HD1  ILE  23          HD13      ILE  23  -9.222  16.550  16.550
  175    H    LYS  24           HN       LYS  24 -11.853  18.920  18.920
  176    HA   LYS  24           HA       LYS  24 -14.605  18.000  18.000
  177   1HB   LYS  24           HB1      LYS  24 -12.723  16.656  16.656
  178   2HB   LYS  24           HB2      LYS  24 -12.504  17.692  17.692
  179   1HG   LYS  24           HG1      LYS  24 -14.376  16.917  16.917
  180   2HG   LYS  24           HG2      LYS  24 -15.310  16.629  16.629
  181   1HD   LYS  24           HD1      LYS  24 -14.856  14.528  14.528
  182   2HD   LYS  24           HD2      LYS  24 -14.052  14.562  14.562
  183   1HE   LYS  24           HE1      LYS  24 -11.890  15.046  15.046
  184   2HE   LYS  24           HE2      LYS  24 -12.682  15.133  15.133
  185   1HZ   LYS  24           HZ1      LYS  24 -13.429  12.735  12.735
  186   2HZ   LYS  24           HZ2      LYS  24 -11.745  12.878  12.878
  187   3HZ   LYS  24           HZ3      LYS  24 -12.469  12.967  12.967
  188    H    GLY  25           HN       GLY  25 -13.040  20.622  20.622
  189   1HA   GLY  25           HA1      GLY  25 -15.053  21.347  21.347
  190   2HA   GLY  25           HA2      GLY  25 -13.498  22.145  22.145
  191    H    GLU  26           HN       GLU  26 -13.776  22.238  22.238
  192    HA   GLU  26           HA       GLU  26 -15.578  24.561  24.561
  193   1HB   GLU  26           HB1      GLU  26 -13.408  23.545  23.545
  194   2HB   GLU  26           HB2      GLU  26 -14.281  25.056  25.056
  195   1HG   GLU  26           HG1      GLU  26 -13.414  25.848  25.848
  196   2HG   GLU  26           HG2      GLU  26 -12.538  24.360  24.360
  197    H    HIS  27           HN       HIS  27 -14.873  21.496  21.496
  198    HA   HIS  27           HA       HIS  27 -17.460  21.550  21.550
  199   1HB   HIS  27           HB1      HIS  27 -14.857  20.254  20.254
  200   2HB   HIS  27           HB2      HIS  27 -16.352  20.463  20.463
  201    HD1  HIS  27           HD1      HIS  27 -16.968  23.065  23.065
  202    HD2  HIS  27           HD2      HIS  27 -13.152  22.422  22.422
  203    HE1  HIS  27           HE1      HIS  27 -15.713  25.136  25.136
  204    HA   PRO  28           HA       PRO  28 -17.414  17.730  17.730
  205   1HB   PRO  28           HB1      PRO  28 -19.521  18.239  18.239
  206   2HB   PRO  28           HB2      PRO  28 -17.966  19.015  19.015
  207   1HG   PRO  28           HG1      PRO  28 -20.330  20.170  20.170
  208   2HG   PRO  28           HG2      PRO  28 -19.490  20.901  20.901
  209   1HD   PRO  28           HD1      PRO  28 -18.760  21.506  21.506
  210   2HD   PRO  28           HD2      PRO  28 -17.543  21.433  21.433
  211    H    GLY  29           HN       GLY  29 -18.193  18.216  18.216
  212   1HA   GLY  29           HA1      GLY  29 -20.597  16.527  16.527
  213   2HA   GLY  29           HA2      GLY  29 -20.476  18.007  18.007
  214    H    LEU  30           HN       LEU  30 -17.496  16.309  16.309
  215    HA   LEU  30           HA       LEU  30 -17.482  15.452  15.452
  216   1HB   LEU  30           HB1      LEU  30 -15.184  15.669  15.669
  217   2HB   LEU  30           HB2      LEU  30 -15.021  15.404  15.404
  218    HG   LEU  30           HG       LEU  30 -15.767  17.876  17.876
  219   1HD1  LEU  30          HD11      LEU  30 -13.656  17.282  17.282
  220   2HD1  LEU  30          HD12      LEU  30 -13.907  18.854  18.854
  221   3HD1  LEU  30          HD13      LEU  30 -13.415  17.488  17.488
  222   1HD2  LEU  30          HD21      LEU  30 -17.445  17.791  17.791
  223   2HD2  LEU  30          HD22      LEU  30 -16.276  19.059  19.059
  224   3HD2  LEU  30          HD23      LEU  30 -16.164  17.556  17.556
  225    H    SER  31           HN       SER  31 -16.470  13.484  13.484
  226    HA   SER  31           HA       SER  31 -16.816  11.282  11.282
  227   1HB   SER  31           HB1      SER  31 -17.451   9.841   9.841
  228   2HB   SER  31           HB2      SER  31 -18.488  11.274  11.274
  229    HG   SER  31           HG       SER  31 -17.611  11.829  11.829
  230    H    ILE  32           HN       ILE  32 -15.552   9.289   9.289
  231    HA   ILE  32           HA       ILE  32 -12.782  10.080  10.080
  232    HB   ILE  32           HB       ILE  32 -13.710   7.943   7.943
  233   1HG1  ILE  32          HG11      ILE  32 -12.006   6.386   6.386
  234   2HG1  ILE  32          HG12      ILE  32 -11.739   7.294   7.294
  235   1HG2  ILE  32          HG21      ILE  32 -14.183   7.248   7.248
  236   2HG2  ILE  32          HG22      ILE  32 -14.354   6.111   6.111
  237   3HG2  ILE  32          HG23      ILE  32 -15.419   7.499   7.499
  238   1HD1  ILE  32          HD11      ILE  32 -11.103   8.241   8.241
  239   2HD1  ILE  32          HD12      ILE  32  -9.932   7.736   7.736
  240   3HD1  ILE  32          HD13      ILE  32 -10.854   9.204   9.204
  241    H    GLY  33           HN       GLY  33 -14.884  10.452  10.452
  242   1HA   GLY  33           HA1      GLY  33 -13.095  10.061  10.061
  243   2HA   GLY  33           HA2      GLY  33 -14.848  10.246  10.246
  244    H    ASP  34           HN       ASP  34 -14.476  12.408  12.408
  245    HA   ASP  34           HA       ASP  34 -13.969  14.614  14.614
  246   1HB   ASP  34           HB1      ASP  34 -15.481  14.391  14.391
  247   2HB   ASP  34           HB2      ASP  34 -15.208  15.959  15.959
  248    H    VAL  35           HN       VAL  35 -13.287  13.523  13.523
  249    HA   VAL  35           HA       VAL  35 -11.406  15.565  15.565
  250    HB   VAL  35           HB       VAL  35 -11.896  12.688  12.688
  251   1HG1  VAL  35          HG11      VAL  35 -10.172  14.781  14.781
  252   2HG1  VAL  35          HG12      VAL  35 -10.621  13.232  13.232
  253   3HG1  VAL  35          HG13      VAL  35  -9.591  13.295  13.295
  254   1HG2  VAL  35          HG21      VAL  35 -12.751  15.320  15.320
  255   2HG2  VAL  35          HG22      VAL  35 -13.780  14.150  14.150
  256   3HG2  VAL  35          HG23      VAL  35 -13.012  13.729  13.729
  257    H    ALA  36           HN       ALA  36 -11.342  12.694  12.694
  258    HA   ALA  36           HA       ALA  36  -8.444  12.497  12.497
  259   1HB   ALA  36           HB1      ALA  36  -9.857  10.495  10.495
  260   2HB   ALA  36           HB2      ALA  36 -10.664  10.984  10.984
  261   3HB   ALA  36           HB3      ALA  36  -8.970  10.500  10.500
  262    H    LYS  37           HN       LYS  37 -11.141  13.445  13.445
  263    HA   LYS  37           HA       LYS  37  -9.458  13.855  13.855
  264   1HB   LYS  37           HB1      LYS  37 -11.775  13.264  13.264
  265   2HB   LYS  37           HB2      LYS  37 -12.271  14.732  14.732
  266   1HG   LYS  37           HG1      LYS  37 -11.486  16.071  16.071
  267   2HG   LYS  37           HG2      LYS  37 -10.763  14.680  14.680
  268   1HD   LYS  37           HD1      LYS  37 -13.749  15.026  15.026
  269   2HD   LYS  37           HD2      LYS  37 -13.005  15.370  15.370
  270   1HE   LYS  37           HE1      LYS  37 -12.239  12.948  12.948
  271   2HE   LYS  37           HE2      LYS  37 -13.125  12.637  12.637
  272   1HZ   LYS  37           HZ1      LYS  37 -14.844  13.932  13.932
  273   2HZ   LYS  37           HZ2      LYS  37 -14.092  12.650  12.650
  274   3HZ   LYS  37           HZ3      LYS  37 -14.932  12.355  12.355
  275    H    LYS  38           HN       LYS  38 -10.646  15.952  15.952
  276    HA   LYS  38           HA       LYS  38  -9.845  18.424  18.424
  277   1HB   LYS  38           HB1      LYS  38 -11.576  18.065  18.065
  278   2HB   LYS  38           HB2      LYS  38 -10.283  17.654  17.654
  279   1HG   LYS  38           HG1      LYS  38 -10.436  20.332  20.332
  280   2HG   LYS  38           HG2      LYS  38 -11.205  20.046  20.046
  281   1HD   LYS  38           HD1      LYS  38  -8.950  19.435  19.435
  282   2HD   LYS  38           HD2      LYS  38  -8.211  19.890  19.890
  283   1HE   LYS  38           HE1      LYS  38  -9.115  22.183  22.183
  284   2HE   LYS  38           HE2      LYS  38  -9.876  21.757  21.757
  285   1HZ   LYS  38           HZ1      LYS  38  -7.171  21.034  21.034
  286   2HZ   LYS  38           HZ2      LYS  38  -7.283  22.633  22.633
  287   3HZ   LYS  38           HZ3      LYS  38  -8.003  22.198  22.198
  288    H    LEU  39           HN       LEU  39  -8.427  16.340  16.340
  289    HA   LEU  39           HA       LEU  39  -5.977  17.863  17.863
  290   1HB   LEU  39           HB1      LEU  39  -6.760  15.100  15.100
  291   2HB   LEU  39           HB2      LEU  39  -5.137  15.731  15.731
  292    HG   LEU  39           HG       LEU  39  -7.675  17.134  17.134
  293   1HD1  LEU  39          HD11      LEU  39  -5.945  15.325  15.325
  294   2HD1  LEU  39          HD12      LEU  39  -7.239  16.287  16.287
  295   3HD1  LEU  39          HD13      LEU  39  -7.603  14.987  14.987
  296   1HD2  LEU  39          HD21      LEU  39  -5.581  18.581  18.581
  297   2HD2  LEU  39          HD22      LEU  39  -6.240  18.394  18.394
  298   3HD2  LEU  39          HD23      LEU  39  -4.859  17.435  17.435
  299    H    GLY  40           HN       GLY  40  -6.948  14.916  14.916
  300   1HA   GLY  40           HA1      GLY  40  -4.579  14.069  14.069
  301   2HA   GLY  40           HA2      GLY  40  -6.133  13.885  13.885
  302    H    GLU  41           HN       GLU  41  -6.502  16.855  16.855
  303    HA   GLU  41           HA       GLU  41  -5.073  17.463  17.463
  304   1HB   GLU  41           HB1      GLU  41  -7.218  18.815  18.815
  305   2HB   GLU  41           HB2      GLU  41  -6.486  19.591  19.591
  306   1HG   GLU  41           HG1      GLU  41  -7.211  17.800  17.800
  307   2HG   GLU  41           HG2      GLU  41  -7.815  16.847  16.847
  308    H    MET  42           HN       MET  42  -5.725  19.164  19.164
  309    HA   MET  42           HA       MET  42  -3.956  21.273  21.273
  310   1HB   MET  42           HB1      MET  42  -4.622  19.529  19.529
  311   2HB   MET  42           HB2      MET  42  -3.834  21.100  21.100
  312   1HG   MET  42           HG1      MET  42  -6.542  20.645  20.645
  313   2HG   MET  42           HG2      MET  42  -6.343  21.166  21.166
  314   1HE   MET  42           HE1      MET  42  -5.788  21.923  21.923
  315   2HE   MET  42           HE2      MET  42  -7.469  22.302  22.302
  316   3HE   MET  42           HE3      MET  42  -6.363  23.571  23.571
  317    H    TRP  43           HN       TRP  43  -3.270  18.060  18.060
  318    HA   TRP  43           HA       TRP  43  -0.674  18.218  18.218
  319   1HB   TRP  43           HB1      TRP  43  -2.023  16.292  16.292
  320   2HB   TRP  43           HB2      TRP  43  -2.273  16.092  16.092
  321    HD1  TRP  43           HD1      TRP  43  -0.716  14.521  14.521
  322    HE1  TRP  43           HE1      TRP  43   1.515  13.576  13.576
  323    HE3  TRP  43           HE3      TRP  43   0.121  16.934  16.934
  324    HZ2  TRP  43           HZ2      TRP  43   3.528  13.728  13.728
  325    HZ3  TRP  43           HZ3      TRP  43   2.141  16.534  16.534
  326    HH2  TRP  43           HH2      TRP  43   3.860  14.919  14.919
  327    H    ASN  44           HN       ASN  44  -1.843  17.639  17.639
  328    HA   ASN  44           HA       ASN  44   0.910  17.500  17.500
  329   1HB   ASN  44           HB1      ASN  44  -0.027  17.145  17.145
  330   2HB   ASN  44           HB2      ASN  44  -0.933  16.206  16.206
  331   1HD2  ASN  44          HD21      ASN  44  -3.954  17.491  17.491
  332   2HD2  ASN  44          HD22      ASN  44  -3.089  16.223  16.223
  333    H    ASN  45           HN       ASN  45  -0.593  19.941  19.941
  334    HA   ASN  45           HA       ASN  45   0.805  22.030  22.030
  335   1HB   ASN  45           HB1      ASN  45  -2.031  22.510  22.510
  336   2HB   ASN  45           HB2      ASN  45  -1.118  23.471  23.471
  337   1HD2  ASN  45          HD21      ASN  45  -3.630  20.661  20.661
  338   2HD2  ASN  45          HD22      ASN  45  -3.539  21.265  21.265
  339    H    THR  46           HN       THR  46   1.265  20.618  20.618
  340    HA   THR  46           HA       THR  46   0.426  22.577  22.577
  341    HB   THR  46           HB       THR  46   0.542  20.152  20.152
  342    HG1  THR  46           HG1      THR  46   1.064  20.938  20.938
  343   1HG2  THR  46          HG21      THR  46   2.652  19.443  19.443
  344   2HG2  THR  46          HG22      THR  46   3.614  20.402  20.402
  345   3HG2  THR  46          HG23      THR  46   2.701  19.035  19.035
  346    H    ALA  47           HN       ALA  47   3.446  21.505  21.505
  347    HA   ALA  47           HA       ALA  47   4.599  24.090  24.090
  348   1HB   ALA  47           HB1      ALA  47   4.814  23.868  23.868
  349   2HB   ALA  47           HB2      ALA  47   5.686  22.365  22.365
  350   3HB   ALA  47           HB3      ALA  47   6.384  23.883  23.883
  351    H    ALA  48           HN       ALA  48   5.397  20.814  20.814
  352    HA   ALA  48           HA       ALA  48   6.295  19.116  19.116
  353   1HB   ALA  48           HB1      ALA  48   6.363  20.638  20.638
  354   2HB   ALA  48           HB2      ALA  48   7.839  21.366  21.366
  355   3HB   ALA  48           HB3      ALA  48   7.809  19.664  19.664
  356    H    ASP  49           HN       ASP  49   7.463  21.746  21.746
  357    HA   ASP  49           HA       ASP  49   9.978  20.490  20.490
  358   1HB   ASP  49           HB1      ASP  49  10.142  22.783  22.783
  359   2HB   ASP  49           HB2      ASP  49   8.946  23.371  23.371
  360    H    ASP  50           HN       ASP  50   6.849  20.493  20.493
  361    HA   ASP  50           HA       ASP  50   7.163  20.478  20.478
  362   1HB   ASP  50           HB1      ASP  50   5.586  22.291  22.291
  363   2HB   ASP  50           HB2      ASP  50   4.706  21.152  21.152
  364    H    LYS  51           HN       LYS  51   6.643  18.819  18.819
  365    HA   LYS  51           HA       LYS  51   4.975  16.680  16.680
  366   1HB   LYS  51           HB1      LYS  51   6.647  16.768  16.768
  367   2HB   LYS  51           HB2      LYS  51   5.382  15.608  15.608
  368   1HG   LYS  51           HG1      LYS  51   3.725  17.415  17.415
  369   2HG   LYS  51           HG2      LYS  51   4.969  18.620  18.620
  370   1HD   LYS  51           HD1      LYS  51   4.066  18.450  18.450
  371   2HD   LYS  51           HD2      LYS  51   5.400  17.316  17.316
  372   1HE   LYS  51           HE1      LYS  51   2.648  16.445  16.445
  373   2HE   LYS  51           HE2      LYS  51   3.201  16.567  16.567
  374   1HZ   LYS  51           HZ1      LYS  51   5.123  15.189  15.189
  375   2HZ   LYS  51           HZ2      LYS  51   3.612  14.473  14.473
  376   3HZ   LYS  51           HZ3      LYS  51   4.181  14.623  14.623
  377    H    GLN  52           HN       GLN  52   8.277  17.041  17.041
  378    HA   GLN  52           HA       GLN  52   9.626  14.858  14.858
  379   1HB   GLN  52           HB1      GLN  52  10.306  17.594  17.594
  380   2HB   GLN  52           HB2      GLN  52  10.952  17.009  17.009
  381   1HG   GLN  52           HG1      GLN  52  12.672  16.793  16.793
  382   2HG   GLN  52           HG2      GLN  52  12.163  15.194  15.194
  383   1HE2  GLN  52          HE21      GLN  52  10.214  15.642  15.642
  384   2HE2  GLN  52          HE22      GLN  52   9.647  16.243  16.243
  385    HA   PRO  53           HA       PRO  53  10.052  14.947  14.947
  386   1HB   PRO  53           HB1      PRO  53   7.956  16.233  16.233
  387   2HB   PRO  53           HB2      PRO  53   9.527  16.948  16.948
  388   1HG   PRO  53           HG1      PRO  53   7.022  17.119  17.119
  389   2HG   PRO  53           HG2      PRO  53   8.004  18.460  18.460
  390   1HD   PRO  53           HD1      PRO  53   8.533  17.639  17.639
  391   2HD   PRO  53           HD2      PRO  53   9.923  17.787  17.787
  392    H    TYR  54           HN       TYR  54   6.791  15.140  15.140
  393    HA   TYR  54           HA       TYR  54   5.775  12.875  12.875
  394   1HB   TYR  54           HB1      TYR  54   4.622  14.330  14.330
  395   2HB   TYR  54           HB2      TYR  54   3.739  13.214  13.214
  396    HD1  TYR  54           HD1      TYR  54   4.399  13.962  13.962
  397    HD2  TYR  54           HD2      TYR  54   3.938  16.522  16.522
  398    HE1  TYR  54           HE1      TYR  54   3.862  15.827  15.827
  399    HE2  TYR  54           HE2      TYR  54   3.398  18.387  18.387
  400    HH   TYR  54           HH       TYR  54   2.341  18.437  18.437
  401    H    GLU  55           HN       GLU  55   6.541  13.509  13.509
  402    HA   GLU  55           HA       GLU  55   5.996  11.033  11.033
  403   1HB   GLU  55           HB1      GLU  55   7.351  13.450  13.450
  404   2HB   GLU  55           HB2      GLU  55   8.505  12.179  12.179
  405   1HG   GLU  55           HG1      GLU  55   6.725  10.993  10.993
  406   2HG   GLU  55           HG2      GLU  55   5.652  12.350  12.350
  407    H    LYS  56           HN       LYS  56   9.126  12.028  12.028
  408    HA   LYS  56           HA       LYS  56  10.553   9.695   9.695
  409   1HB   LYS  56           HB1      LYS  56  10.637  11.823  11.823
  410   2HB   LYS  56           HB2      LYS  56  11.849  10.562  10.562
  411   1HG   LYS  56           HG1      LYS  56  11.184  12.329  12.329
  412   2HG   LYS  56           HG2      LYS  56  12.361  12.830  12.830
  413   1HD   LYS  56           HD1      LYS  56  12.545  10.142  10.142
  414   2HD   LYS  56           HD2      LYS  56  13.246  11.602  11.602
  415   1HE   LYS  56           HE1      LYS  56  13.939  10.493  10.493
  416   2HE   LYS  56           HE2      LYS  56  14.894  10.229  10.229
  417   1HZ   LYS  56           HZ1      LYS  56  14.385  12.962  12.962
  418   2HZ   LYS  56           HZ2      LYS  56  14.920  12.429  12.429
  419   3HZ   LYS  56           HZ3      LYS  56  15.866  12.147  12.147
  420    H    LYS  57           HN       LYS  57   8.192  10.473  10.473
  421    HA   LYS  57           HA       LYS  57   8.758   8.149   8.149
  422   1HB   LYS  57           HB1      LYS  57   6.288   9.948   9.948
  423   2HB   LYS  57           HB2      LYS  57   6.377   8.575   8.575
  424   1HG   LYS  57           HG1      LYS  57   8.386   9.563   9.563
  425   2HG   LYS  57           HG2      LYS  57   8.253  10.965  10.965
  426   1HD   LYS  57           HD1      LYS  57   6.031  11.497  11.497
  427   2HD   LYS  57           HD2      LYS  57   5.990   9.998   9.998
  428   1HE   LYS  57           HE1      LYS  57   6.559  11.857  11.857
  429   2HE   LYS  57           HE2      LYS  57   7.938  10.779  10.779
  430   1HZ   LYS  57           HZ1      LYS  57   8.113  12.693  12.693
  431   2HZ   LYS  57           HZ2      LYS  57   7.814  13.495  13.495
  432   3HZ   LYS  57           HZ3      LYS  57   9.144  12.451  12.451
  433    H    ALA  58           HN       ALA  58   6.112   8.966   8.966
  434    HA   ALA  58           HA       ALA  58   4.701   6.602   6.602
  435   1HB   ALA  58           HB1      ALA  58   4.131   8.625   8.625
  436   2HB   ALA  58           HB2      ALA  58   5.490   8.339   8.339
  437   3HB   ALA  58           HB3      ALA  58   4.154   7.203   7.203
  438    H    ALA  59           HN       ALA  59   7.560   7.407   7.407
  439    HA   ALA  59           HA       ALA  59   7.957   5.033   5.033
  440   1HB   ALA  59           HB1      ALA  59   9.303   7.105   7.105
  441   2HB   ALA  59           HB2      ALA  59  10.084   6.874   6.874
  442   3HB   ALA  59           HB3      ALA  59  10.370   5.735   5.735
  443    H    LYS  60           HN       LYS  60   9.647   5.812   5.812
  444    HA   LYS  60           HA       LYS  60  10.842   3.393   3.393
  445   1HB   LYS  60           HB1      LYS  60  10.937   5.564   5.564
  446   2HB   LYS  60           HB2      LYS  60   9.466   5.037   5.037
  447   1HG   LYS  60           HG1      LYS  60  10.813   2.771   2.771
  448   2HG   LYS  60           HG2      LYS  60  12.213   3.739   3.739
  449   1HD   LYS  60           HD1      LYS  60  11.621   5.326   5.326
  450   2HD   LYS  60           HD2      LYS  60  10.265   4.284   4.284
  451   1HE   LYS  60           HE1      LYS  60  11.932   2.357   2.357
  452   2HE   LYS  60           HE2      LYS  60  13.215   3.543   3.543
  453   1HZ   LYS  60           HZ1      LYS  60  11.427   4.513   4.513
  454   2HZ   LYS  60           HZ2      LYS  60  11.770   2.896   2.896
  455   3HZ   LYS  60           HZ3      LYS  60  13.038   4.014   4.014
  456    H    LEU  61           HN       LEU  61   7.498   4.246   4.246
  457    HA   LEU  61           HA       LEU  61   6.945   1.689   1.689
  458   1HB   LEU  61           HB1      LEU  61   4.965   3.686   3.686
  459   2HB   LEU  61           HB2      LEU  61   4.620   2.496   2.496
  460    HG   LEU  61           HG       LEU  61   6.483   4.906   4.906
  461   1HD1  LEU  61          HD11      LEU  61   3.942   4.191   4.191
  462   2HD1  LEU  61          HD12      LEU  61   4.955   5.595   5.595
  463   3HD1  LEU  61          HD13      LEU  61   4.134   5.437   5.437
  464   1HD2  LEU  61          HD21      LEU  61   6.055   2.715   2.715
  465   2HD2  LEU  61          HD22      LEU  61   7.550   3.019   3.019
  466   3HD2  LEU  61          HD23      LEU  61   6.943   4.211   4.211
  467    H    LYS  62           HN       LYS  62   5.894   3.002   3.002
  468    HA   LYS  62           HA       LYS  62   4.673   0.817   0.817
  469   1HB   LYS  62           HB1      LYS  62   4.942   2.993   2.993
  470   2HB   LYS  62           HB2      LYS  62   6.670   2.814   2.814
  471   1HG   LYS  62           HG1      LYS  62   4.924   0.728   0.728
  472   2HG   LYS  62           HG2      LYS  62   5.093   2.280   2.280
  473   1HD   LYS  62           HD1      LYS  62   7.627   1.974   1.974
  474   2HD   LYS  62           HD2      LYS  62   7.356   0.346   0.346
  475   1HE   LYS  62           HE1      LYS  62   6.260   1.407   1.407
  476   2HE   LYS  62           HE2      LYS  62   7.704   0.419   0.419
  477   1HZ   LYS  62           HZ1      LYS  62   5.633  -0.845  -0.845
  478   2HZ   LYS  62           HZ2      LYS  62   5.053  -0.407  -0.407
  479   3HZ   LYS  62           HZ3      LYS  62   6.451  -1.359  -1.359
  480    H    GLU  63           HN       GLU  63   8.100   1.456   1.456
  481    HA   GLU  63           HA       GLU  63   9.152  -0.843  -0.843
  482   1HB   GLU  63           HB1      GLU  63  10.436   1.254   1.254
  483   2HB   GLU  63           HB2      GLU  63  10.297   0.869   0.869
  484   1HG   GLU  63           HG1      GLU  63  11.615  -1.260  -1.260
  485   2HG   GLU  63           HG2      GLU  63  11.806  -0.769  -0.769
  486    H    LYS  64           HN       LYS  64   8.505  -0.232  -0.232
  487    HA   LYS  64           HA       LYS  64   9.364  -2.750  -2.750
  488   1HB   LYS  64           HB1      LYS  64   8.497  -2.119  -2.119
  489   2HB   LYS  64           HB2      LYS  64   8.368  -0.550  -0.550
  490   1HG   LYS  64           HG1      LYS  64   5.926  -1.072  -1.072
  491   2HG   LYS  64           HG2      LYS  64   6.110  -2.580  -2.580
  492   1HD   LYS  64           HD1      LYS  64   6.570   0.122   0.122
  493   2HD   LYS  64           HD2      LYS  64   5.030  -0.706  -0.706
  494   1HE   LYS  64           HE1      LYS  64   6.070  -1.265  -1.265
  495   2HE   LYS  64           HE2      LYS  64   6.234  -2.700  -2.700
  496   1HZ   LYS  64           HZ1      LYS  64   8.444  -1.033  -1.033
  497   2HZ   LYS  64           HZ2      LYS  64   8.230  -1.222  -1.222
  498   3HZ   LYS  64           HZ3      LYS  64   8.396  -2.592  -2.592
  499    H    TYR  65           HN       TYR  65   6.272  -1.776  -1.776
  500    HA   TYR  65           HA       TYR  65   4.679  -4.045  -4.045
  501   1HB   TYR  65           HB1      TYR  65   3.442  -2.302  -2.302
  502   2HB   TYR  65           HB2      TYR  65   4.763  -1.748  -1.748
  503    HD1  TYR  65           HD1      TYR  65   3.573  -5.228  -5.228
  504    HD2  TYR  65           HD2      TYR  65   3.024  -1.117  -1.117
  505    HE1  TYR  65           HE1      TYR  65   2.342  -5.834  -5.834
  506    HE2  TYR  65           HE2      TYR  65   1.790  -1.744  -1.744
  507    HH   TYR  65           HH       TYR  65   0.376  -3.947  -3.947
  508    H    GLU  66           HN       GLU  66   6.457  -3.190  -3.190
  509    HA   GLU  66           HA       GLU  66   6.240  -5.540  -5.540
  510   1HB   GLU  66           HB1      GLU  66   8.713  -3.837  -3.837
  511   2HB   GLU  66           HB2      GLU  66   8.315  -4.893  -4.893
  512   1HG   GLU  66           HG1      GLU  66   6.423  -2.661  -2.661
  513   2HG   GLU  66           HG2      GLU  66   7.757  -2.312  -2.312
  514    H    LYS  67           HN       LYS  67   8.315  -5.034  -5.034
  515    HA   LYS  67           HA       LYS  67   9.715  -7.572  -7.572
  516   1HB   LYS  67           HB1      LYS  67  10.148  -6.119  -6.119
  517   2HB   LYS  67           HB2      LYS  67  11.317  -6.971  -6.971
  518   1HG   LYS  67           HG1      LYS  67  10.187  -4.209  -4.209
  519   2HG   LYS  67           HG2      LYS  67  11.827  -4.615  -4.615
  520   1HD   LYS  67           HD1      LYS  67  10.556  -5.336  -5.336
  521   2HD   LYS  67           HD2      LYS  67  11.511  -3.904  -3.904
  522   1HE   LYS  67           HE1      LYS  67  12.977  -5.536  -5.536
  523   2HE   LYS  67           HE2      LYS  67  13.429  -5.410  -5.410
  524   1HZ   LYS  67           HZ1      LYS  67  11.439  -7.362  -7.362
  525   2HZ   LYS  67           HZ2      LYS  67  12.648  -7.669  -7.669
  526   3HZ   LYS  67           HZ3      LYS  67  13.051  -7.545  -7.545
  527    H    ASP  68           HN       ASP  68   7.023  -6.594  -6.594
  528    HA   ASP  68           HA       ASP  68   6.949  -8.685  -8.685
  529   1HB   ASP  68           HB1      ASP  68   6.157  -6.259  -6.259
  530   2HB   ASP  68           HB2      ASP  68   4.768  -6.695  -6.695
  531    H    ILE  69           HN       ILE  69   5.848  -7.783  -7.783
  532    HA   ILE  69           HA       ILE  69   3.926 -10.019 -10.019
  533    HB   ILE  69           HB       ILE  69   3.271  -7.970  -7.970
  534   1HG1  ILE  69          HG11      ILE  69   2.815  -8.825  -8.825
  535   2HG1  ILE  69          HG12      ILE  69   4.212  -9.888  -9.888
  536   1HG2  ILE  69          HG21      ILE  69   5.486  -7.082  -7.082
  537   2HG2  ILE  69          HG22      ILE  69   5.799  -8.279  -8.279
  538   3HG2  ILE  69          HG23      ILE  69   4.532  -7.077  -7.077
  539   1HD1  ILE  69          HD11      ILE  69   1.888 -10.109 -10.109
  540   2HD1  ILE  69          HD12      ILE  69   2.086 -11.104 -11.104
  541   3HD1  ILE  69          HD13      ILE  69   3.225 -11.227 -11.227
  542    H    ALA  70           HN       ALA  70   6.954  -8.929  -8.929
  543    HA   ALA  70           HA       ALA  70   7.604 -11.202 -11.202
  544   1HB   ALA  70           HB1      ALA  70   9.528  -9.478  -9.478
  545   2HB   ALA  70           HB2      ALA  70  10.009 -10.550 -10.550
  546   3HB   ALA  70           HB3      ALA  70   9.033  -9.135  -9.135
  547    H    ALA  71           HN       ALA  71   7.712 -10.567 -10.567
  548    HA   ALA  71           HA       ALA  71   9.097 -13.041 -13.041
  549   1HB   ALA  71           HB1      ALA  71   7.584 -11.067 -11.067
  550   2HB   ALA  71           HB2      ALA  71   8.573 -12.395 -12.395
  551   3HB   ALA  71           HB3      ALA  71   9.320 -11.075 -11.075
  552    H    TYR  72           HN       TYR  72   5.794 -11.796 -11.796
  553    HA   TYR  72           HA       TYR  72   4.421 -13.913 -13.913
  554   1HB   TYR  72           HB1      TYR  72   3.347 -11.837 -11.837
  555   2HB   TYR  72           HB2      TYR  72   3.627 -12.083 -12.083
  556    HD1  TYR  72           HD1      TYR  72   2.288 -14.564 -14.564
  557    HD2  TYR  72           HD2      TYR  72   1.494 -12.092 -12.092
  558    HE1  TYR  72           HE1      TYR  72   0.088 -15.610 -15.610
  559    HE2  TYR  72           HE2      TYR  72  -0.696 -13.139 -13.139
  560    HH   TYR  72           HH       TYR  72  -2.262 -14.708 -14.708
  561    H    ARG  73           HN       ARG  73   5.256 -13.477 -13.477
  562    HA   ARG  73           HA       ARG  73   4.140 -15.957 -15.957
  563   1HB   ARG  73           HB1      ARG  73   5.950 -13.816 -13.816
  564   2HB   ARG  73           HB2      ARG  73   5.682 -15.293 -15.293
  565   1HG   ARG  73           HG1      ARG  73   3.224 -13.859 -13.859
  566   2HG   ARG  73           HG2      ARG  73   4.109 -13.077 -13.077
  567   1HD   ARG  73           HD1      ARG  73   3.153 -15.982 -15.982
  568   2HD   ARG  73           HD2      ARG  73   2.333 -14.625 -14.625
  569    HE   ARG  73           HE       ARG  73   5.157 -15.383 -15.383
  570   1HH1  ARG  73          HH11      ARG  73   2.975 -13.110 -13.110
  571   2HH1  ARG  73          HH12      ARG  73   2.883 -13.543 -13.543
  572   1HH2  ARG  73          HH21      ARG  73   4.642 -16.536 -16.536
  573   2HH2  ARG  73          HH22      ARG  73   3.852 -15.536 -15.536
  574    H    ALA  74           HN       ALA  74   7.095 -14.827 -14.827
  575    HA   ALA  74           HA       ALA  74   8.450 -17.410 -17.410
  576   1HB   ALA  74           HB1      ALA  74   9.554 -15.369 -15.369
  577   2HB   ALA  74           HB2      ALA  74   9.564 -14.735 -14.735
  578   3HB   ALA  74           HB3      ALA  74  10.536 -16.143 -16.143
  579    H    LYS  75           HN       LYS  75   6.490 -17.247 -17.247
  580    HA   LYS  75           HA       LYS  75   6.088 -18.108 -18.108
  581   1HB   LYS  75           HB1      LYS  75   7.915 -19.717 -19.717
  582   2HB   LYS  75           HB2      LYS  75   9.133 -18.588 -18.588
  583   1HG   LYS  75           HG1      LYS  75   8.647 -18.836 -18.836
  584   2HG   LYS  75           HG2      LYS  75   6.964 -19.225 -19.225
  585   1HD   LYS  75           HD1      LYS  75   8.314 -21.182 -21.182
  586   2HD   LYS  75           HD2      LYS  75   7.519 -21.477 -21.477
  587   1HE   LYS  75           HE1      LYS  75   9.846 -22.332 -22.332
  588   2HE   LYS  75           HE2      LYS  75   9.665 -21.056 -21.056
  589   1HZ   LYS  75           HZ1      LYS  75  10.389 -19.893 -19.893
  590   2HZ   LYS  75           HZ2      LYS  75  11.437 -21.197 -21.197
  591   3HZ   LYS  75           HZ3      LYS  75  11.271 -19.961 -19.961
  592    H    GLY  76           HN       GLY  76   5.483 -15.955 -15.955
  593   1HA   GLY  76           HA1      GLY  76   7.163 -14.335 -14.335
  594   2HA   GLY  76           HA2      GLY  76   5.828 -13.705 -13.705
  595    H    LYS  77           HN       LYS  77   6.154 -16.525 -16.525
  596    HA   LYS  77           HA       LYS  77   3.892 -15.710 -15.710
  597   1HB   LYS  77           HB1      LYS  77   4.600 -18.356 -18.356
  598   2HB   LYS  77           HB2      LYS  77   3.622 -18.323 -18.323
  599   1HG   LYS  77           HG1      LYS  77   2.571 -16.399 -16.399
  600   2HG   LYS  77           HG2      LYS  77   2.769 -17.968 -17.968
  601   1HD   LYS  77           HD1      LYS  77   0.597 -18.068 -18.068
  602   2HD   LYS  77           HD2      LYS  77   1.625 -18.959 -18.959
  603   1HE   LYS  77           HE1      LYS  77   0.219 -17.512 -17.512
  604   2HE   LYS  77           HE2      LYS  77   1.842 -16.846 -16.846
  605   1HZ   LYS  77           HZ1      LYS  77   0.543 -15.785 -15.785
  606   2HZ   LYS  77           HZ2      LYS  77  -0.493 -15.626 -15.626
  607   3HZ   LYS  77           HZ3      LYS  77   1.077 -14.979 -14.979
  608    HA   PRO  78           HA       PRO  78   7.039 -17.499 -17.499
  609   1HB   PRO  78           HB1      PRO  78   9.546 -16.566 -16.566
  610   2HB   PRO  78           HB2      PRO  78   9.045 -17.826 -17.826
  611   1HG   PRO  78           HG1      PRO  78   9.092 -14.797 -14.797
  612   2HG   PRO  78           HG2      PRO  78   9.803 -16.063 -16.063
  613   1HD   PRO  78           HD1      PRO  78   7.294 -15.016 -15.016
  614   2HD   PRO  78           HD2      PRO  78   7.707 -16.702 -16.702
  615    H    ASP  79           HN       ASP  79   5.214 -15.789 -15.789
  616    HA   ASP  79           HA       ASP  79   4.448 -13.684 -13.684
  617   1HB   ASP  79           HB1      ASP  79   4.562 -15.293 -15.293
  618   2HB   ASP  79           HB2      ASP  79   6.197 -14.779 -14.779
  619    H    ALA  80           HN       ALA  80   5.422 -12.186 -12.186
  620    HA   ALA  80           HA       ALA  80   7.880 -10.805 -10.805
  621   1HB   ALA  80           HB1      ALA  80   6.322 -10.554 -10.554
  622   2HB   ALA  80           HB2      ALA  80   7.830  -9.727  -9.727
  623   3HB   ALA  80           HB3      ALA  80   7.801 -11.476 -11.476
  624    H    ALA  81           HN       ALA  81   5.870 -10.609 -10.609
  625    HA   ALA  81           HA       ALA  81   4.756  -7.854  -7.854
  626   1HB   ALA  81           HB1      ALA  81   2.979  -9.585  -9.585
  627   2HB   ALA  81           HB2      ALA  81   3.483 -10.261 -10.261
  628   3HB   ALA  81           HB3      ALA  81   2.791  -8.645  -8.645
  629   1H1   BME  16           HE1      MER  16  -7.382   8.516   8.516
  630   2H1   BME  16           HE2      MER  16  -8.247   9.879   9.879
  631   1H2   BME  16           HZ1      MER  16  -5.712  10.103  10.103
  632   2H2   BME  16           HZ2      MER  16  -7.344  10.475  10.475
  633    HO1  BME  16           HH       MER  16  -6.842   9.742   9.742

  Start of MODEL    6
    1    H    ASN   3           HN       ASN   3  -4.310 -10.358 -10.358
    2    HA   ASN   3           HA       ASN   3  -1.464 -11.151 -11.151
    3   1HB   ASN   3           HB1      ASN   3  -1.851 -12.990 -12.990
    4   2HB   ASN   3           HB2      ASN   3  -3.031 -13.137 -13.137
    5   1HD2  ASN   3          HD21      ASN   3  -4.320 -12.967 -12.967
    6   2HD2  ASN   3          HD22      ASN   3  -2.742 -13.365 -13.365
    7    H    ALA   4           HN       ALA   4  -0.703 -11.408 -11.408
    8    HA   ALA   4           HA       ALA   4   0.166 -10.058 -10.058
    9   1HB   ALA   4           HB1      ALA   4  -1.881 -11.000 -11.000
   10   2HB   ALA   4           HB2      ALA   4  -2.832  -9.666  -9.666
   11   3HB   ALA   4           HB3      ALA   4  -1.628  -9.376  -9.376
   12    HA   PRO   5           HA       PRO   5   0.170  -6.246  -6.246
   13   1HB   PRO   5           HB1      PRO   5   2.794  -6.346  -6.346
   14   2HB   PRO   5           HB2      PRO   5   2.454  -5.707  -5.707
   15   1HG   PRO   5           HG1      PRO   5   3.405  -8.173  -8.173
   16   2HG   PRO   5           HG2      PRO   5   1.965  -7.944  -7.944
   17   1HD   PRO   5           HD1      PRO   5   2.123  -8.996  -8.996
   18   2HD   PRO   5           HD2      PRO   5   1.183  -9.637  -9.637
   19    H    LYS   6           HN       LYS   6  -1.497  -5.305  -5.305
   20    HA   LYS   6           HA       LYS   6  -1.712  -4.327  -4.327
   21   1HB   LYS   6           HB1      LYS   6  -2.663  -3.150  -3.150
   22   2HB   LYS   6           HB2      LYS   6  -3.131  -2.440  -2.440
   23   1HG   LYS   6           HG1      LYS   6  -4.323  -4.423  -4.423
   24   2HG   LYS   6           HG2      LYS   6  -3.658  -5.369  -5.369
   25   1HD   LYS   6           HD1      LYS   6  -4.873  -4.072  -4.072
   26   2HD   LYS   6           HD2      LYS   6  -5.345  -2.867  -2.867
   27   1HE   LYS   6           HE1      LYS   6  -6.234  -5.774  -5.774
   28   2HE   LYS   6           HE2      LYS   6  -7.168  -4.538  -4.538
   29   1HZ   LYS   6           HZ1      LYS   6  -6.437  -3.550  -3.550
   30   2HZ   LYS   6           HZ2      LYS   6  -7.089  -5.103  -5.103
   31   3HZ   LYS   6           HZ3      LYS   6  -7.987  -3.910  -3.910
   32    H    ARG   7           HN       ARG   7  -1.608  -2.097  -2.097
   33    HA   ARG   7           HA       ARG   7   1.066  -1.242  -1.242
   34   1HB   ARG   7           HB1      ARG   7   0.393   0.656   0.656
   35   2HB   ARG   7           HB2      ARG   7   0.200  -0.985  -0.985
   36   1HG   ARG   7           HG1      ARG   7  -2.248  -0.890  -0.890
   37   2HG   ARG   7           HG2      ARG   7  -2.028   0.779   0.779
   38   1HD   ARG   7           HD1      ARG   7  -1.440   1.447   1.447
   39   2HD   ARG   7           HD2      ARG   7  -1.401  -0.231  -0.231
   40    HE   ARG   7           HE       ARG   7  -3.854  -0.330  -0.330
   41   1HH1  ARG   7          HH11      ARG   7  -5.363   1.328   1.328
   42   2HH1  ARG   7          HH12      ARG   7  -5.503   2.781   2.781
   43   1HH2  ARG   7          HH21      ARG   7  -2.606   2.094   2.094
   44   2HH2  ARG   7          HH22      ARG   7  -3.894   3.227   3.227
   45    HA   PRO   8           HA       PRO   8   0.317   1.627   1.627
   46   1HB   PRO   8           HB1      PRO   8   2.831   2.847   2.847
   47   2HB   PRO   8           HB2      PRO   8   2.572   1.227   1.227
   48   1HG   PRO   8           HG1      PRO   8   3.363   2.099   2.099
   49   2HG   PRO   8           HG2      PRO   8   4.198   0.958   0.958
   50   1HD   PRO   8           HD1      PRO   8   2.545   0.051   0.051
   51   2HD   PRO   8           HD2      PRO   8   2.487  -0.710  -0.710
   52    HA   PRO   9           HA       PRO   9  -0.457   5.995   5.995
   53   1HB   PRO   9           HB1      PRO   9   2.427   6.382   6.382
   54   2HB   PRO   9           HB2      PRO   9   1.124   7.574   7.574
   55   1HG   PRO   9           HG1      PRO   9   1.503   6.211   6.211
   56   2HG   PRO   9           HG2      PRO   9  -0.155   6.284   6.284
   57   1HD   PRO   9           HD1      PRO   9   1.803   4.009   4.009
   58   2HD   PRO   9           HD2      PRO   9   0.048   3.925   3.925
   59    H    SER  10           HN       SER  10   0.303   7.706   7.706
   60    HA   SER  10           HA       SER  10   1.409   6.469   6.469
   61   1HB   SER  10           HB1      SER  10  -0.932   7.027   7.027
   62   2HB   SER  10           HB2      SER  10  -0.637   8.682   8.682
   63    HG   SER  10           HG       SER  10  -0.349   7.656   7.656
   64    H    ALA  11           HN       ALA  11   1.160   9.564   9.564
   65    HA   ALA  11           HA       ALA  11   3.621  10.697  10.697
   66   1HB   ALA  11           HB1      ALA  11   3.930  10.278  10.278
   67   2HB   ALA  11           HB2      ALA  11   2.507  11.258  11.258
   68   3HB   ALA  11           HB3      ALA  11   3.951  11.975  11.975
   69    H    PHE  12           HN       PHE  12   0.712  10.834  10.834
   70    HA   PHE  12           HA       PHE  12  -0.320  13.409  13.409
   71   1HB   PHE  12           HB1      PHE  12  -1.017  12.478  12.478
   72   2HB   PHE  12           HB2      PHE  12  -1.398  10.912  10.912
   73    HD1  PHE  12           HD1      PHE  12  -2.453  14.519  14.519
   74    HD2  PHE  12           HD2      PHE  12  -3.515  10.475  10.475
   75    HE1  PHE  12           HE1      PHE  12  -4.784  15.201  15.201
   76    HE2  PHE  12           HE2      PHE  12  -5.828  11.149  11.149
   77    HZ   PHE  12           HZ       PHE  12  -6.472  13.515  13.515
   78    H    PHE  13           HN       PHE  13  -0.556  10.092  10.092
   79    HA   PHE  13           HA       PHE  13  -2.836  10.370  10.370
   80   1HB   PHE  13           HB1      PHE  13  -1.570   8.231   8.231
   81   2HB   PHE  13           HB2      PHE  13  -0.525   8.561   8.561
   82    HD1  PHE  13           HD1      PHE  13  -4.009   7.909   7.909
   83    HD2  PHE  13           HD2      PHE  13  -1.344   8.161   8.161
   84    HE1  PHE  13           HE1      PHE  13  -5.733   6.946   6.946
   85    HE2  PHE  13           HE2      PHE  13  -3.071   7.196   7.196
   86    HZ   PHE  13           HZ       PHE  13  -5.268   6.589   6.589
   87    H    LEU  14           HN       LEU  14   0.548  11.089  11.089
   88    HA   LEU  14           HA       LEU  14   0.517  11.405  11.405
   89   1HB   LEU  14           HB1      LEU  14   2.212  12.781  12.781
   90   2HB   LEU  14           HB2      LEU  14   2.516  12.908  12.908
   91    HG   LEU  14           HG       LEU  14   4.058  11.320  11.320
   92   1HD1  LEU  14          HD11      LEU  14   3.455  10.831  10.831
   93   2HD1  LEU  14          HD12      LEU  14   2.094   9.845   9.845
   94   3HD1  LEU  14          HD13      LEU  14   3.741   9.360   9.360
   95   1HD2  LEU  14          HD21      LEU  14   2.626  10.585  10.585
   96   2HD2  LEU  14          HD22      LEU  14   3.319   9.216   9.216
   97   3HD2  LEU  14          HD23      LEU  14   1.642   9.643   9.643
   98    H    PHE  15           HN       PHE  15   0.592  13.994  13.994
   99    HA   PHE  15           HA       PHE  15  -0.224  15.991  15.991
  100   1HB   PHE  15           HB1      PHE  15   0.688  17.244  17.244
  101   2HB   PHE  15           HB2      PHE  15   0.869  15.758  15.758
  102    HD1  PHE  15           HD1      PHE  15  -1.314  15.089  15.089
  103    HD2  PHE  15           HD2      PHE  15  -0.301  19.036  19.036
  104    HE1  PHE  15           HE1      PHE  15  -2.700  16.016  16.016
  105    HE2  PHE  15           HE2      PHE  15  -1.703  19.961  19.961
  106    HZ   PHE  15           HZ       PHE  15  -2.902  18.440  18.440
  107    H    CYS  16           HN       MER  16  -2.047  13.967  13.967
  108    HA   CYS  16           HA       MER  16  -4.547  15.281  15.281
  109   1HB   CYS  16           HB1      MER  16  -4.299  13.564  13.564
  110   2HB   CYS  16           HB2      MER  16  -3.953  12.350  12.350
  111    H    SER  17           HN       SER  17  -3.110  12.647  12.647
  112    HA   SER  17           HA       SER  17  -5.336  12.160  12.160
  113   1HB   SER  17           HB1      SER  17  -2.357  12.027  12.027
  114   2HB   SER  17           HB2      SER  17  -3.629  11.354  11.354
  115    HG   SER  17           HG       SER  17  -2.566  10.313  10.313
  116    H    GLU  18           HN       GLU  18  -2.674  14.369  14.369
  117    HA   GLU  18           HA       GLU  18  -3.576  15.504  15.504
  118   1HB   GLU  18           HB1      GLU  18  -1.285  15.624  15.624
  119   2HB   GLU  18           HB2      GLU  18  -1.839  16.679  16.679
  120   1HG   GLU  18           HG1      GLU  18  -2.506  18.401  18.401
  121   2HG   GLU  18           HG2      GLU  18  -2.104  17.340  17.340
  122    H    TYR  19           HN       TYR  19  -4.453  16.082  16.082
  123    HA   TYR  19           HA       TYR  19  -5.836  18.628  18.628
  124   1HB   TYR  19           HB1      TYR  19  -5.186  16.889  16.889
  125   2HB   TYR  19           HB2      TYR  19  -6.592  17.973  17.973
  126    HD1  TYR  19           HD1      TYR  19  -3.203  18.245  18.245
  127    HD2  TYR  19           HD2      TYR  19  -6.032  19.935  19.935
  128    HE1  TYR  19           HE1      TYR  19  -1.666  20.097  20.097
  129    HE2  TYR  19           HE2      TYR  19  -4.497  21.789  21.789
  130    HH   TYR  19           HH       TYR  19  -2.183  22.340  22.340
  131    H    ARG  20           HN       ARG  20  -6.927  15.388  15.388
  132    HA   ARG  20           HA       ARG  20  -9.508  15.490  15.490
  133   1HB   ARG  20           HB1      ARG  20  -8.339  13.412  13.412
  134   2HB   ARG  20           HB2      ARG  20  -8.383  13.743  13.743
  135   1HG   ARG  20           HG1      ARG  20 -10.989  13.920  13.920
  136   2HG   ARG  20           HG2      ARG  20 -10.698  13.182  13.182
  137   1HD   ARG  20           HD1      ARG  20 -11.292  11.451  11.451
  138   2HD   ARG  20           HD2      ARG  20  -9.578  11.252  11.252
  139    HE   ARG  20           HE       ARG  20  -9.071  12.437  12.437
  140   1HH1  ARG  20          HH11      ARG  20 -11.453  10.157  10.157
  141   2HH1  ARG  20          HH12      ARG  20 -12.242  10.626  10.626
  142   1HH2  ARG  20          HH21      ARG  20 -10.389  13.586  13.586
  143   2HH2  ARG  20          HH22      ARG  20 -11.625  12.621  12.621
  144    HA   PRO  21           HA       PRO  21 -11.429  16.481  16.481
  145   1HB   PRO  21           HB1      PRO  21  -9.923  17.121  17.121
  146   2HB   PRO  21           HB2      PRO  21 -10.141  15.434  15.434
  147   1HG   PRO  21           HG1      PRO  21  -7.850  17.302  17.302
  148   2HG   PRO  21           HG2      PRO  21  -7.718  15.757  15.757
  149   1HD   PRO  21           HD1      PRO  21  -7.499  15.729  15.729
  150   2HD   PRO  21           HD2      PRO  21  -8.553  14.522  14.522
  151    H    LYS  22           HN       LYS  22  -8.636  18.258  18.258
  152    HA   LYS  22           HA       LYS  22  -9.445  20.879  20.879
  153   1HB   LYS  22           HB1      LYS  22  -7.084  19.687  19.687
  154   2HB   LYS  22           HB2      LYS  22  -7.489  20.741  20.741
  155   1HG   LYS  22           HG1      LYS  22  -6.146  22.089  22.089
  156   2HG   LYS  22           HG2      LYS  22  -7.773  22.606  22.606
  157   1HD   LYS  22           HD1      LYS  22  -7.769  21.126  21.126
  158   2HD   LYS  22           HD2      LYS  22  -6.185  20.513  20.513
  159   1HE   LYS  22           HE1      LYS  22  -5.281  22.870  22.870
  160   2HE   LYS  22           HE2      LYS  22  -6.857  23.377  23.377
  161   1HZ   LYS  22           HZ1      LYS  22  -6.060  21.115  21.115
  162   2HZ   LYS  22           HZ2      LYS  22  -4.764  22.211  22.211
  163   3HZ   LYS  22           HZ3      LYS  22  -6.282  22.703  22.703
  164    H    ILE  23           HN       ILE  23  -9.883  19.103  19.103
  165    HA   ILE  23           HA       ILE  23 -10.807  21.493  21.493
  166    HB   ILE  23           HB       ILE  23 -10.958  18.562  18.562
  167   1HG1  ILE  23          HG11      ILE  23  -8.803  20.575  20.575
  168   2HG1  ILE  23          HG12      ILE  23  -8.570  19.363  19.363
  169   1HG2  ILE  23          HG21      ILE  23 -12.424  20.173  20.173
  170   2HG2  ILE  23          HG22      ILE  23 -11.015  21.166  21.166
  171   3HG2  ILE  23          HG23      ILE  23 -11.157  19.564  19.564
  172   1HD1  ILE  23          HD11      ILE  23  -9.328  18.735  18.735
  173   2HD1  ILE  23          HD12      ILE  23  -7.737  18.557  18.557
  174   3HD1  ILE  23          HD13      ILE  23  -9.062  17.562  17.562
  175    H    LYS  24           HN       LYS  24 -11.877  18.422  18.422
  176    HA   LYS  24           HA       LYS  24 -14.619  18.507  18.507
  177   1HB   LYS  24           HB1      LYS  24 -13.130  16.645  16.645
  178   2HB   LYS  24           HB2      LYS  24 -13.048  17.323  17.323
  179   1HG   LYS  24           HG1      LYS  24 -15.560  17.098  17.098
  180   2HG   LYS  24           HG2      LYS  24 -15.626  16.359  16.359
  181   1HD   LYS  24           HD1      LYS  24 -14.271  15.274  15.274
  182   2HD   LYS  24           HD2      LYS  24 -15.686  14.605  14.605
  183   1HE   LYS  24           HE1      LYS  24 -12.840  14.645  14.645
  184   2HE   LYS  24           HE2      LYS  24 -13.753  13.237  13.237
  185   1HZ   LYS  24           HZ1      LYS  24 -15.257  14.538  14.538
  186   2HZ   LYS  24           HZ2      LYS  24 -13.662  14.439  14.439
  187   3HZ   LYS  24           HZ3      LYS  24 -14.482  13.032  13.032
  188    H    GLY  25           HN       GLY  25 -12.634  19.829  19.829
  189   1HA   GLY  25           HA1      GLY  25 -14.573  20.667  20.667
  190   2HA   GLY  25           HA2      GLY  25 -12.950  21.343  21.343
  191    H    GLU  26           HN       GLU  26 -12.904  22.428  22.428
  192    HA   GLU  26           HA       GLU  26 -14.309  24.891  24.891
  193   1HB   GLU  26           HB1      GLU  26 -12.806  23.669  23.669
  194   2HB   GLU  26           HB2      GLU  26 -13.289  25.349  25.349
  195   1HG   GLU  26           HG1      GLU  26 -11.699  24.253  24.253
  196   2HG   GLU  26           HG2      GLU  26 -10.850  24.490  24.490
  197    H    HIS  27           HN       HIS  27 -14.614  22.245  22.245
  198    HA   HIS  27           HA       HIS  27 -17.313  23.039  23.039
  199   1HB   HIS  27           HB1      HIS  27 -15.327  21.464  21.464
  200   2HB   HIS  27           HB2      HIS  27 -16.752  22.356  22.356
  201    HD1  HIS  27           HD1      HIS  27 -16.460  25.054  25.054
  202    HD2  HIS  27           HD2      HIS  27 -12.984  22.903  22.903
  203    HE1  HIS  27           HE1      HIS  27 -14.638  26.682  26.682
  204    HA   PRO  28           HA       PRO  28 -17.975  18.780  18.780
  205   1HB   PRO  28           HB1      PRO  28 -19.762  19.338  19.338
  206   2HB   PRO  28           HB2      PRO  28 -18.040  19.592  19.592
  207   1HG   PRO  28           HG1      PRO  28 -20.104  21.663  21.663
  208   2HG   PRO  28           HG2      PRO  28 -19.003  21.778  21.778
  209   1HD   PRO  28           HD1      PRO  28 -18.354  22.866  22.866
  210   2HD   PRO  28           HD2      PRO  28 -17.101  22.206  22.206
  211    H    GLY  29           HN       GLY  29 -18.601  19.888  19.888
  212   1HA   GLY  29           HA1      GLY  29 -21.501  19.502  19.502
  213   2HA   GLY  29           HA2      GLY  29 -20.603  20.760  20.760
  214    H    LEU  30           HN       LEU  30 -18.251  18.846  18.846
  215    HA   LEU  30           HA       LEU  30 -19.157  17.495  17.495
  216   1HB   LEU  30           HB1      LEU  30 -16.338  17.103  17.103
  217   2HB   LEU  30           HB2      LEU  30 -17.139  17.985  17.985
  218    HG   LEU  30           HG       LEU  30 -16.466  19.242  19.242
  219   1HD1  LEU  30          HD11      LEU  30 -14.410  18.429  18.429
  220   2HD1  LEU  30          HD12      LEU  30 -14.913  19.296  19.296
  221   3HD1  LEU  30          HD13      LEU  30 -14.489  20.179  20.179
  222   1HD2  LEU  30          HD21      LEU  30 -17.097  20.398  20.398
  223   2HD2  LEU  30          HD22      LEU  30 -18.207  20.427  20.427
  224   3HD2  LEU  30          HD23      LEU  30 -16.706  21.333  21.333
  225    H    SER  31           HN       SER  31 -17.678  15.447  15.447
  226    HA   SER  31           HA       SER  31 -18.149  13.548  13.548
  227   1HB   SER  31           HB1      SER  31 -18.154  13.053  13.053
  228   2HB   SER  31           HB2      SER  31 -18.410  11.812  11.812
  229    HG   SER  31           HG       SER  31 -20.366  12.482  12.482
  230    H    ILE  32           HN       ILE  32 -16.745  11.487  11.487
  231    HA   ILE  32           HA       ILE  32 -14.019  12.294  12.294
  232    HB   ILE  32           HB       ILE  32 -15.193  10.344  10.344
  233   1HG1  ILE  32          HG11      ILE  32 -13.295   8.726   8.726
  234   2HG1  ILE  32          HG12      ILE  32 -12.678   9.502   9.502
  235   1HG2  ILE  32          HG21      ILE  32 -16.433   9.511   9.511
  236   2HG2  ILE  32          HG22      ILE  32 -14.938   9.061   9.061
  237   3HG2  ILE  32          HG23      ILE  32 -15.441   8.222   8.222
  238   1HD1  ILE  32          HD11      ILE  32 -12.842  10.813  10.813
  239   2HD1  ILE  32          HD12      ILE  32 -11.390  10.203  10.203
  240   3HD1  ILE  32          HD13      ILE  32 -12.213  11.594  11.594
  241    H    GLY  33           HN       GLY  33 -15.750  12.060  12.060
  242   1HA   GLY  33           HA1      GLY  33 -13.518  11.265  11.265
  243   2HA   GLY  33           HA2      GLY  33 -15.219  11.331  11.331
  244    H    ASP  34           HN       ASP  34 -15.046  13.953  13.953
  245    HA   ASP  34           HA       ASP  34 -14.356  15.745  15.745
  246   1HB   ASP  34           HB1      ASP  34 -16.098  15.969  15.969
  247   2HB   ASP  34           HB2      ASP  34 -15.791  17.368  17.368
  248    H    VAL  35           HN       VAL  35 -13.967  15.118  15.118
  249    HA   VAL  35           HA       VAL  35 -12.145  17.295  17.295
  250    HB   VAL  35           HB       VAL  35 -12.828  14.667  14.667
  251   1HG1  VAL  35          HG11      VAL  35 -11.201  16.996  16.996
  252   2HG1  VAL  35          HG12      VAL  35 -11.728  15.623  15.623
  253   3HG1  VAL  35          HG13      VAL  35 -10.572  15.392  15.392
  254   1HG2  VAL  35          HG21      VAL  35 -14.699  16.296  16.296
  255   2HG2  VAL  35          HG22      VAL  35 -14.097  16.071  16.071
  256   3HG2  VAL  35          HG23      VAL  35 -13.665  17.515  17.515
  257    H    ALA  36           HN       ALA  36 -11.997  14.115  14.115
  258    HA   ALA  36           HA       ALA  36  -9.097  13.879  13.879
  259   1HB   ALA  36           HB1      ALA  36 -10.523  11.925  11.925
  260   2HB   ALA  36           HB2      ALA  36 -11.175  12.074  12.074
  261   3HB   ALA  36           HB3      ALA  36  -9.488  11.629  11.629
  262    H    LYS  37           HN       LYS  37 -11.573  14.355  14.355
  263    HA   LYS  37           HA       LYS  37  -9.590  14.235  14.235
  264   1HB   LYS  37           HB1      LYS  37 -11.930  13.614  13.614
  265   2HB   LYS  37           HB2      LYS  37 -12.448  15.257  15.257
  266   1HG   LYS  37           HG1      LYS  37 -11.336  16.134  16.134
  267   2HG   LYS  37           HG2      LYS  37 -10.449  14.636  14.636
  268   1HD   LYS  37           HD1      LYS  37 -12.660  13.491  13.491
  269   2HD   LYS  37           HD2      LYS  37 -13.474  15.032  15.032
  270   1HE   LYS  37           HE1      LYS  37 -13.052  14.525  14.525
  271   2HE   LYS  37           HE2      LYS  37 -12.168  15.964  15.964
  272   1HZ   LYS  37           HZ1      LYS  37 -10.567  13.724  13.724
  273   2HZ   LYS  37           HZ2      LYS  37 -11.172  13.591  13.591
  274   3HZ   LYS  37           HZ3      LYS  37 -10.310  14.980  14.980
  275    H    LYS  38           HN       LYS  38 -11.178  16.763  16.763
  276    HA   LYS  38           HA       LYS  38 -10.253  18.977  18.977
  277   1HB   LYS  38           HB1      LYS  38 -12.077  19.095  19.095
  278   2HB   LYS  38           HB2      LYS  38 -10.833  18.851  18.851
  279   1HG   LYS  38           HG1      LYS  38 -11.273  21.209  21.209
  280   2HG   LYS  38           HG2      LYS  38  -9.717  20.981  20.981
  281   1HD   LYS  38           HD1      LYS  38 -10.860  20.976  20.976
  282   2HD   LYS  38           HD2      LYS  38 -12.397  21.226  21.226
  283   1HE   LYS  38           HE1      LYS  38 -11.523  23.364  23.364
  284   2HE   LYS  38           HE2      LYS  38 -11.518  23.375  23.375
  285   1HZ   LYS  38           HZ1      LYS  38  -9.090  22.301  22.301
  286   2HZ   LYS  38           HZ2      LYS  38  -9.368  23.741  23.741
  287   3HZ   LYS  38           HZ3      LYS  38  -9.364  23.748  23.748
  288    H    LEU  39           HN       LEU  39  -9.011  17.524  17.524
  289    HA   LEU  39           HA       LEU  39  -6.592  19.097  19.097
  290   1HB   LEU  39           HB1      LEU  39  -6.578  18.475  18.475
  291   2HB   LEU  39           HB2      LEU  39  -8.076  17.651  17.651
  292    HG   LEU  39           HG       LEU  39  -6.670  15.667  15.667
  293   1HD1  LEU  39          HD11      LEU  39  -4.562  16.955  16.955
  294   2HD1  LEU  39          HD12      LEU  39  -4.744  17.252  17.252
  295   3HD1  LEU  39          HD13      LEU  39  -4.478  15.616  15.616
  296   1HD2  LEU  39          HD21      LEU  39  -6.713  16.608  16.608
  297   2HD2  LEU  39          HD22      LEU  39  -8.040  15.752  15.752
  298   3HD2  LEU  39          HD23      LEU  39  -6.509  14.964  14.964
  299    H    GLY  40           HN       GLY  40  -7.681  16.043  16.043
  300   1HA   GLY  40           HA1      GLY  40  -5.203  14.787  14.787
  301   2HA   GLY  40           HA2      GLY  40  -6.718  14.456  14.456
  302    H    GLU  41           HN       GLU  41  -6.768  17.483  17.483
  303    HA   GLU  41           HA       GLU  41  -5.280  17.385  17.385
  304   1HB   GLU  41           HB1      GLU  41  -7.363  19.161  19.161
  305   2HB   GLU  41           HB2      GLU  41  -6.611  19.551  19.551
  306   1HG   GLU  41           HG1      GLU  41  -7.493  17.565  17.565
  307   2HG   GLU  41           HG2      GLU  41  -8.029  16.877  16.877
  308    H    MET  42           HN       MET  42  -5.800  19.386  19.386
  309    HA   MET  42           HA       MET  42  -3.929  21.418  21.418
  310   1HB   MET  42           HB1      MET  42  -4.478  19.913  19.913
  311   2HB   MET  42           HB2      MET  42  -3.599  21.440  21.440
  312   1HG   MET  42           HG1      MET  42  -6.504  20.957  20.957
  313   2HG   MET  42           HG2      MET  42  -5.969  21.852  21.852
  314   1HE   MET  42           HE1      MET  42  -7.398  21.855  21.855
  315   2HE   MET  42           HE2      MET  42  -6.938  23.324  23.324
  316   3HE   MET  42           HE3      MET  42  -5.823  21.964  21.964
  317    H    TRP  43           HN       TRP  43  -3.480  18.289  18.289
  318    HA   TRP  43           HA       TRP  43  -0.835  18.126  18.126
  319   1HB   TRP  43           HB1      TRP  43  -2.406  16.363  16.363
  320   2HB   TRP  43           HB2      TRP  43  -2.666  16.143  16.143
  321    HD1  TRP  43           HD1      TRP  43  -1.306  14.290  14.290
  322    HE1  TRP  43           HE1      TRP  43   0.873  13.239  13.239
  323    HE3  TRP  43           HE3      TRP  43  -0.011  16.922  16.922
  324    HZ2  TRP  43           HZ2      TRP  43   2.984  13.366  13.366
  325    HZ3  TRP  43           HZ3      TRP  43   2.059  16.418  16.418
  326    HH2  TRP  43           HH2      TRP  43   3.576  14.641  14.641
  327    H    ASN  44           HN       ASN  44  -2.240  17.411  17.411
  328    HA   ASN  44           HA       ASN  44   0.145  16.866  16.866
  329   1HB   ASN  44           HB1      ASN  44  -2.402  18.166  18.166
  330   2HB   ASN  44           HB2      ASN  44  -1.075  17.597  17.597
  331   1HD2  ASN  44          HD21      ASN  44  -2.897  14.585  14.585
  332   2HD2  ASN  44          HD22      ASN  44  -2.417  15.979  15.979
  333    H    ASN  45           HN       ASN  45  -1.462  19.837  19.837
  334    HA   ASN  45           HA       ASN  45   0.820  21.423  21.423
  335   1HB   ASN  45           HB1      ASN  45  -1.803  22.718  22.718
  336   2HB   ASN  45           HB2      ASN  45  -0.707  23.118  23.118
  337   1HD2  ASN  45          HD21      ASN  45  -3.818  20.629  20.629
  338   2HD2  ASN  45          HD22      ASN  45  -3.529  21.478  21.478
  339    H    THR  46           HN       THR  46   1.199  20.187  20.187
  340    HA   THR  46           HA       THR  46   0.697  22.205  22.205
  341    HB   THR  46           HB       THR  46   0.783  19.746  19.746
  342    HG1  THR  46           HG1      THR  46   1.479  20.593  20.593
  343   1HG2  THR  46          HG21      THR  46   3.818  19.960  19.960
  344   2HG2  THR  46          HG22      THR  46   2.961  18.603  18.603
  345   3HG2  THR  46          HG23      THR  46   2.741  19.017  19.017
  346    H    ALA  47           HN       ALA  47   3.128  21.215  21.215
  347    HA   ALA  47           HA       ALA  47   4.658  23.420  23.420
  348   1HB   ALA  47           HB1      ALA  47   5.312  23.528  23.528
  349   2HB   ALA  47           HB2      ALA  47   5.973  21.910  21.910
  350   3HB   ALA  47           HB3      ALA  47   6.675  23.249  23.249
  351    H    ALA  48           HN       ALA  48   5.046  20.221  20.221
  352    HA   ALA  48           HA       ALA  48   5.382  18.202  18.202
  353   1HB   ALA  48           HB1      ALA  48   5.693  19.385  19.385
  354   2HB   ALA  48           HB2      ALA  48   7.313  19.842  19.842
  355   3HB   ALA  48           HB3      ALA  48   6.892  18.152  18.152
  356    H    ASP  49           HN       ASP  49   7.601  20.801  20.801
  357    HA   ASP  49           HA       ASP  49   9.760  19.129  19.129
  358   1HB   ASP  49           HB1      ASP  49   9.971  21.320  21.320
  359   2HB   ASP  49           HB2      ASP  49   9.488  22.169  22.169
  360    H    ASP  50           HN       ASP  50   6.873  20.104  20.104
  361    HA   ASP  50           HA       ASP  50   7.633  20.343  20.343
  362   1HB   ASP  50           HB1      ASP  50   6.248  22.223  22.223
  363   2HB   ASP  50           HB2      ASP  50   5.004  21.064  21.064
  364    H    LYS  51           HN       LYS  51   6.676  18.260  18.260
  365    HA   LYS  51           HA       LYS  51   4.891  16.534  16.534
  366   1HB   LYS  51           HB1      LYS  51   6.232  16.038  16.038
  367   2HB   LYS  51           HB2      LYS  51   5.142  14.919  14.919
  368   1HG   LYS  51           HG1      LYS  51   3.314  16.589  16.589
  369   2HG   LYS  51           HG2      LYS  51   4.446  17.705  17.705
  370   1HD   LYS  51           HD1      LYS  51   4.879  16.047  16.047
  371   2HD   LYS  51           HD2      LYS  51   3.712  14.953  14.953
  372   1HE   LYS  51           HE1      LYS  51   1.902  16.435  16.435
  373   2HE   LYS  51           HE2      LYS  51   2.961  17.774  17.774
  374   1HZ   LYS  51           HZ1      LYS  51   3.530  15.540  15.540
  375   2HZ   LYS  51           HZ2      LYS  51   1.855  15.820  15.820
  376   3HZ   LYS  51           HZ3      LYS  51   2.930  17.061  17.061
  377    H    GLN  52           HN       GLN  52   7.976  16.623  16.623
  378    HA   GLN  52           HA       GLN  52   9.429  14.525  14.525
  379   1HB   GLN  52           HB1      GLN  52  10.075  17.174  17.174
  380   2HB   GLN  52           HB2      GLN  52  10.766  16.982  16.982
  381   1HG   GLN  52           HG1      GLN  52  12.484  16.468  16.468
  382   2HG   GLN  52           HG2      GLN  52  12.033  14.979  14.979
  383   1HE2  GLN  52          HE21      GLN  52  10.025  14.779  14.779
  384   2HE2  GLN  52          HE22      GLN  52   9.499  15.697  15.697
  385    HA   PRO  53           HA       PRO  53  10.294  15.164  15.164
  386   1HB   PRO  53           HB1      PRO  53   8.222  16.533  16.533
  387   2HB   PRO  53           HB2      PRO  53   9.768  17.236  17.236
  388   1HG   PRO  53           HG1      PRO  53   7.182  17.191  17.191
  389   2HG   PRO  53           HG2      PRO  53   8.165  18.601  18.601
  390   1HD   PRO  53           HD1      PRO  53   8.587  17.532  17.532
  391   2HD   PRO  53           HD2      PRO  53  10.029  17.798  17.798
  392    H    TYR  54           HN       TYR  54   6.888  15.195  15.195
  393    HA   TYR  54           HA       TYR  54   6.093  13.095  13.095
  394   1HB   TYR  54           HB1      TYR  54   4.739  14.219  14.219
  395   2HB   TYR  54           HB2      TYR  54   3.979  13.086  13.086
  396    HD1  TYR  54           HD1      TYR  54   4.369  13.937  13.937
  397    HD2  TYR  54           HD2      TYR  54   4.127  16.434  16.434
  398    HE1  TYR  54           HE1      TYR  54   3.712  15.827  15.827
  399    HE2  TYR  54           HE2      TYR  54   3.474  18.324  18.324
  400    HH   TYR  54           HH       TYR  54   3.073  19.034  19.034
  401    H    GLU  55           HN       GLU  55   6.642  13.268  13.268
  402    HA   GLU  55           HA       GLU  55   6.084  10.605  10.605
  403   1HB   GLU  55           HB1      GLU  55   6.918  12.849  12.849
  404   2HB   GLU  55           HB2      GLU  55   8.382  11.895  11.895
  405   1HG   GLU  55           HG1      GLU  55   5.610  11.036  11.036
  406   2HG   GLU  55           HG2      GLU  55   6.923  11.422  11.422
  407    H    LYS  56           HN       LYS  56   9.298  11.916  11.916
  408    HA   LYS  56           HA       LYS  56  10.826   9.623   9.623
  409   1HB   LYS  56           HB1      LYS  56  10.998  12.000  12.000
  410   2HB   LYS  56           HB2      LYS  56  12.246  10.766  10.766
  411   1HG   LYS  56           HG1      LYS  56  12.719  11.242  11.242
  412   2HG   LYS  56           HG2      LYS  56  11.326  12.281  12.281
  413   1HD   LYS  56           HD1      LYS  56  13.357  13.642  13.642
  414   2HD   LYS  56           HD2      LYS  56  12.355  13.891  13.891
  415   1HE   LYS  56           HE1      LYS  56  13.783  12.303  12.303
  416   2HE   LYS  56           HE2      LYS  56  14.765  12.021  12.021
  417   1HZ   LYS  56           HZ1      LYS  56  14.581  14.776  14.776
  418   2HZ   LYS  56           HZ2      LYS  56  14.988  14.055  14.055
  419   3HZ   LYS  56           HZ3      LYS  56  15.948  13.776  13.776
  420    H    LYS  57           HN       LYS  57   8.625  10.574  10.574
  421    HA   LYS  57           HA       LYS  57   9.472   8.484   8.484
  422   1HB   LYS  57           HB1      LYS  57   8.348  10.626  10.626
  423   2HB   LYS  57           HB2      LYS  57   6.885  10.102  10.102
  424   1HG   LYS  57           HG1      LYS  57   6.504   8.282   8.282
  425   2HG   LYS  57           HG2      LYS  57   8.152   8.255   8.255
  426   1HD   LYS  57           HD1      LYS  57   6.635  10.794  10.794
  427   2HD   LYS  57           HD2      LYS  57   6.043   9.380   9.380
  428   1HE   LYS  57           HE1      LYS  57   7.753  10.609  10.609
  429   2HE   LYS  57           HE2      LYS  57   8.281   8.977   8.977
  430   1HZ   LYS  57           HZ1      LYS  57   9.143  10.686  10.686
  431   2HZ   LYS  57           HZ2      LYS  57   9.570  11.372  11.372
  432   3HZ   LYS  57           HZ3      LYS  57  10.069   9.796   9.796
  433    H    ALA  58           HN       ALA  58   6.615   9.042   9.042
  434    HA   ALA  58           HA       ALA  58   5.181   6.698   6.698
  435   1HB   ALA  58           HB1      ALA  58   4.565   8.511   8.511
  436   2HB   ALA  58           HB2      ALA  58   5.870   7.994   7.994
  437   3HB   ALA  58           HB3      ALA  58   4.518   6.925   6.925
  438    H    ALA  59           HN       ALA  59   7.938   7.222   7.222
  439    HA   ALA  59           HA       ALA  59   8.343   4.692   4.692
  440   1HB   ALA  59           HB1      ALA  59   9.716   6.703   6.703
  441   2HB   ALA  59           HB2      ALA  59  10.519   6.618   6.618
  442   3HB   ALA  59           HB3      ALA  59  10.744   5.333   5.333
  443    H    LYS  60           HN       LYS  60  10.070   5.875   5.875
  444    HA   LYS  60           HA       LYS  60  11.288   3.627   3.627
  445   1HB   LYS  60           HB1      LYS  60  11.285   5.934   5.934
  446   2HB   LYS  60           HB2      LYS  60   9.743   5.556   5.556
  447   1HG   LYS  60           HG1      LYS  60  10.773   3.633   3.633
  448   2HG   LYS  60           HG2      LYS  60  12.313   3.989   3.989
  449   1HD   LYS  60           HD1      LYS  60  12.274   6.272   6.272
  450   2HD   LYS  60           HD2      LYS  60  10.763   5.863   5.863
  451   1HE   LYS  60           HE1      LYS  60  12.644   5.524   5.524
  452   2HE   LYS  60           HE2      LYS  60  11.923   3.966   3.966
  453   1HZ   LYS  60           HZ1      LYS  60  13.892   4.530   4.530
  454   2HZ   LYS  60           HZ2      LYS  60  14.555   4.782   4.782
  455   3HZ   LYS  60           HZ3      LYS  60  13.855   3.284   3.284
  456    H    LEU  61           HN       LEU  61   7.921   4.408   4.408
  457    HA   LEU  61           HA       LEU  61   7.323   2.068   2.068
  458   1HB   LEU  61           HB1      LEU  61   5.375   3.654   3.654
  459   2HB   LEU  61           HB2      LEU  61   4.984   2.716   2.716
  460    HG   LEU  61           HG       LEU  61   6.680   5.248   5.248
  461   1HD1  LEU  61          HD11      LEU  61   4.296   5.606   5.606
  462   2HD1  LEU  61          HD12      LEU  61   4.019   4.656   4.656
  463   3HD1  LEU  61          HD13      LEU  61   4.899   6.183   6.183
  464   1HD2  LEU  61          HD21      LEU  61   6.102   3.485   3.485
  465   2HD2  LEU  61          HD22      LEU  61   7.674   3.710   3.710
  466   3HD2  LEU  61          HD23      LEU  61   6.895   5.056   5.056
  467    H    LYS  62           HN       LYS  62   6.560   2.832   2.832
  468    HA   LYS  62           HA       LYS  62   5.480   0.472   0.472
  469   1HB   LYS  62           HB1      LYS  62   6.514   2.819   2.819
  470   2HB   LYS  62           HB2      LYS  62   7.624   1.629   1.629
  471   1HG   LYS  62           HG1      LYS  62   5.699   0.316   0.316
  472   2HG   LYS  62           HG2      LYS  62   4.595   1.541   1.541
  473   1HD   LYS  62           HD1      LYS  62   6.791   1.962   1.962
  474   2HD   LYS  62           HD2      LYS  62   5.074   1.900   1.900
  475   1HE   LYS  62           HE1      LYS  62   6.481   4.064   4.064
  476   2HE   LYS  62           HE2      LYS  62   5.826   4.242   4.242
  477   1HZ   LYS  62           HZ1      LYS  62   3.807   3.213   3.213
  478   2HZ   LYS  62           HZ2      LYS  62   4.511   4.524   4.524
  479   3HZ   LYS  62           HZ3      LYS  62   3.891   4.734   4.734
  480    H    GLU  63           HN       GLU  63   8.815   1.338   1.338
  481    HA   GLU  63           HA       GLU  63  10.219  -0.911  -0.911
  482   1HB   GLU  63           HB1      GLU  63  10.941   1.558   1.558
  483   2HB   GLU  63           HB2      GLU  63  11.114   0.702   0.702
  484   1HG   GLU  63           HG1      GLU  63  12.646  -0.013  -0.013
  485   2HG   GLU  63           HG2      GLU  63  13.240   0.955   0.955
  486    H    LYS  64           HN       LYS  64   9.156  -0.068  -0.068
  487    HA   LYS  64           HA       LYS  64   9.955  -2.342  -2.342
  488   1HB   LYS  64           HB1      LYS  64   8.596  -0.158  -0.158
  489   2HB   LYS  64           HB2      LYS  64   7.191  -1.169  -1.169
  490   1HG   LYS  64           HG1      LYS  64   7.637  -1.493  -1.493
  491   2HG   LYS  64           HG2      LYS  64   8.356  -2.909  -2.909
  492   1HD   LYS  64           HD1      LYS  64  10.593  -1.818  -1.818
  493   2HD   LYS  64           HD2      LYS  64   9.885  -0.352  -0.352
  494   1HE   LYS  64           HE1      LYS  64   9.124  -1.700  -1.700
  495   2HE   LYS  64           HE2      LYS  64  10.031  -3.064  -3.064
  496   1HZ   LYS  64           HZ1      LYS  64  11.685  -0.814  -0.814
  497   2HZ   LYS  64           HZ2      LYS  64  10.973  -0.909  -0.909
  498   3HZ   LYS  64           HZ3      LYS  64  11.847  -2.230  -2.230
  499    H    TYR  65           HN       TYR  65   6.906  -1.851  -1.851
  500    HA   TYR  65           HA       TYR  65   5.663  -4.344  -4.344
  501   1HB   TYR  65           HB1      TYR  65   4.266  -2.660  -2.660
  502   2HB   TYR  65           HB2      TYR  65   5.483  -2.065  -2.065
  503    HD1  TYR  65           HD1      TYR  65   4.399  -5.643  -5.643
  504    HD2  TYR  65           HD2      TYR  65   3.874  -1.750  -1.750
  505    HE1  TYR  65           HE1      TYR  65   3.174  -6.594  -6.594
  506    HE2  TYR  65           HE2      TYR  65   2.649  -2.705  -2.705
  507    HH   TYR  65           HH       TYR  65   1.377  -5.722  -5.722
  508    H    GLU  66           HN       GLU  66   7.459  -3.274  -3.274
  509    HA   GLU  66           HA       GLU  66   7.456  -5.533  -5.533
  510   1HB   GLU  66           HB1      GLU  66   9.754  -3.663  -3.663
  511   2HB   GLU  66           HB2      GLU  66   9.595  -4.734  -4.734
  512   1HG   GLU  66           HG1      GLU  66   7.381  -2.749  -2.749
  513   2HG   GLU  66           HG2      GLU  66   8.733  -2.241  -2.241
  514    H    LYS  67           HN       LYS  67   9.365  -5.101  -5.101
  515    HA   LYS  67           HA       LYS  67  10.917  -7.549  -7.549
  516   1HB   LYS  67           HB1      LYS  67  11.172  -5.987  -5.987
  517   2HB   LYS  67           HB2      LYS  67  12.402  -6.925  -6.925
  518   1HG   LYS  67           HG1      LYS  67  11.282  -4.224  -4.224
  519   2HG   LYS  67           HG2      LYS  67  12.914  -4.578  -4.578
  520   1HD   LYS  67           HD1      LYS  67  11.911  -5.991  -5.991
  521   2HD   LYS  67           HD2      LYS  67  12.135  -4.287  -4.287
  522   1HE   LYS  67           HE1      LYS  67  14.212  -5.478  -5.478
  523   2HE   LYS  67           HE2      LYS  67  14.506  -4.566  -4.566
  524   1HZ   LYS  67           HZ1      LYS  67  13.541  -7.091  -7.091
  525   2HZ   LYS  67           HZ2      LYS  67  14.790  -7.302  -7.302
  526   3HZ   LYS  67           HZ3      LYS  67  15.074  -6.420  -6.420
  527    H    ASP  68           HN       ASP  68   8.189  -6.630  -6.630
  528    HA   ASP  68           HA       ASP  68   8.161  -8.855  -8.855
  529   1HB   ASP  68           HB1      ASP  68   7.382  -6.479  -6.479
  530   2HB   ASP  68           HB2      ASP  68   5.962  -6.856  -6.856
  531    H    ILE  69           HN       ILE  69   7.073  -7.865  -7.865
  532    HA   ILE  69           HA       ILE  69   5.079 -10.030 -10.030
  533    HB   ILE  69           HB       ILE  69   4.490  -7.914  -7.914
  534   1HG1  ILE  69          HG11      ILE  69   3.988  -8.698  -8.698
  535   2HG1  ILE  69          HG12      ILE  69   5.310  -9.858  -9.858
  536   1HG2  ILE  69          HG21      ILE  69   6.786  -7.164  -7.164
  537   2HG2  ILE  69          HG22      ILE  69   6.947  -8.336  -8.336
  538   3HG2  ILE  69          HG23      ILE  69   5.775  -7.041  -7.041
  539   1HD1  ILE  69          HD11      ILE  69   2.909  -9.936  -9.936
  540   2HD1  ILE  69          HD12      ILE  69   3.154 -10.956 -10.956
  541   3HD1  ILE  69          HD13      ILE  69   4.209 -11.120 -11.120
  542    H    ALA  70           HN       ALA  70   8.074  -8.999  -8.999
  543    HA   ALA  70           HA       ALA  70   8.666 -11.228 -11.228
  544   1HB   ALA  70           HB1      ALA  70  10.650  -9.568  -9.568
  545   2HB   ALA  70           HB2      ALA  70  11.096 -10.614 -10.614
  546   3HB   ALA  70           HB3      ALA  70  10.137  -9.178  -9.178
  547    H    ALA  71           HN       ALA  71   8.893 -10.626 -10.626
  548    HA   ALA  71           HA       ALA  71  10.197 -13.135 -13.135
  549   1HB   ALA  71           HB1      ALA  71   8.677 -11.189 -11.189
  550   2HB   ALA  71           HB2      ALA  71   9.656 -12.528 -12.528
  551   3HB   ALA  71           HB3      ALA  71  10.413 -11.196 -11.196
  552    H    TYR  72           HN       TYR  72   6.917 -11.839 -11.839
  553    HA   TYR  72           HA       TYR  72   5.506 -13.971 -13.971
  554   1HB   TYR  72           HB1      TYR  72   4.507 -11.812 -11.812
  555   2HB   TYR  72           HB2      TYR  72   4.713 -11.996 -11.996
  556    HD1  TYR  72           HD1      TYR  72   3.453 -14.860 -14.860
  557    HD2  TYR  72           HD2      TYR  72   2.390 -11.451 -11.451
  558    HE1  TYR  72           HE1      TYR  72   1.175 -15.721 -15.721
  559    HE2  TYR  72           HE2      TYR  72   0.115 -12.313 -12.313
  560    HH   TYR  72           HH       TYR  72  -0.903 -14.868 -14.868
  561    H    ARG  73           HN       ARG  73   6.197 -13.445 -13.445
  562    HA   ARG  73           HA       ARG  73   4.901 -15.872 -15.872
  563   1HB   ARG  73           HB1      ARG  73   5.709 -15.296 -15.296
  564   2HB   ARG  73           HB2      ARG  73   5.223 -13.817 -13.817
  565   1HG   ARG  73           HG1      ARG  73   7.345 -12.991 -12.991
  566   2HG   ARG  73           HG2      ARG  73   8.129 -14.560 -14.560
  567   1HD   ARG  73           HD1      ARG  73   7.665 -14.709 -14.709
  568   2HD   ARG  73           HD2      ARG  73   6.611 -13.302 -13.302
  569    HE   ARG  73           HE       ARG  73   9.547 -13.137 -13.137
  570   1HH1  ARG  73          HH11      ARG  73   7.238 -11.002 -11.002
  571   2HH1  ARG  73          HH12      ARG  73   7.618 -10.011 -10.011
  572   1HH2  ARG  73          HH21      ARG  73   9.832 -12.401 -12.401
  573   2HH2  ARG  73          HH22      ARG  73   9.142 -10.834 -10.834
  574    H    ALA  74           HN       ALA  74   7.958 -14.880 -14.880
  575    HA   ALA  74           HA       ALA  74   9.264 -17.434 -17.434
  576   1HB   ALA  74           HB1      ALA  74  10.450 -15.320 -15.320
  577   2HB   ALA  74           HB2      ALA  74  10.359 -14.900 -14.900
  578   3HB   ALA  74           HB3      ALA  74  11.336 -16.262 -16.262
  579    H    LYS  75           HN       LYS  75   7.159 -17.363 -17.363
  580    HA   LYS  75           HA       LYS  75   6.637 -18.302 -18.302
  581   1HB   LYS  75           HB1      LYS  75   7.780 -20.251 -20.251
  582   2HB   LYS  75           HB2      LYS  75   9.171 -19.534 -19.534
  583   1HG   LYS  75           HG1      LYS  75  10.083 -19.067 -19.067
  584   2HG   LYS  75           HG2      LYS  75   8.671 -19.844 -19.844
  585   1HD   LYS  75           HD1      LYS  75   9.281 -21.923 -21.923
  586   2HD   LYS  75           HD2      LYS  75  10.683 -21.074 -21.074
  587   1HE   LYS  75           HE1      LYS  75  10.168 -21.674 -21.674
  588   2HE   LYS  75           HE2      LYS  75  11.302 -22.522 -22.522
  589   1HZ   LYS  75           HZ1      LYS  75  11.835 -19.785 -19.785
  590   2HZ   LYS  75           HZ2      LYS  75  11.712 -20.174 -20.174
  591   3HZ   LYS  75           HZ3      LYS  75  12.808 -21.012 -21.012
  592    H    GLY  76           HN       GLY  76   6.678 -15.905 -15.905
  593   1HA   GLY  76           HA1      GLY  76   8.383 -14.954 -14.954
  594   2HA   GLY  76           HA2      GLY  76   7.642 -13.896 -13.896
  595    H    LYS  77           HN       LYS  77   6.741 -16.465 -16.465
  596    HA   LYS  77           HA       LYS  77   4.277 -15.030 -15.030
  597   1HB   LYS  77           HB1      LYS  77   4.938 -17.861 -17.861
  598   2HB   LYS  77           HB2      LYS  77   3.918 -17.665 -17.665
  599   1HG   LYS  77           HG1      LYS  77   3.283 -16.269 -16.269
  600   2HG   LYS  77           HG2      LYS  77   2.866 -17.952 -17.952
  601   1HD   LYS  77           HD1      LYS  77   0.922 -16.757 -16.757
  602   2HD   LYS  77           HD2      LYS  77   1.705 -17.272 -17.272
  603   1HE   LYS  77           HE1      LYS  77   0.846 -14.974 -14.974
  604   2HE   LYS  77           HE2      LYS  77   2.574 -15.002 -15.002
  605   1HZ   LYS  77           HZ1      LYS  77   1.977 -14.751 -14.751
  606   2HZ   LYS  77           HZ2      LYS  77   1.112 -13.581 -13.581
  607   3HZ   LYS  77           HZ3      LYS  77   2.804 -13.662 -13.662
  608    HA   PRO  78           HA       PRO  78   5.990 -16.479 -16.479
  609   1HB   PRO  78           HB1      PRO  78   8.899 -16.939 -16.939
  610   2HB   PRO  78           HB2      PRO  78   7.935 -17.794 -17.794
  611   1HG   PRO  78           HG1      PRO  78   8.355 -19.018 -19.018
  612   2HG   PRO  78           HG2      PRO  78   6.708 -19.018 -19.018
  613   1HD   PRO  78           HD1      PRO  78   7.901 -17.099 -17.099
  614   2HD   PRO  78           HD2      PRO  78   6.422 -18.066 -18.066
  615    H    ASP  79           HN       ASP  79   7.078 -14.409 -14.409
  616    HA   ASP  79           HA       ASP  79   7.834 -12.381 -12.381
  617   1HB   ASP  79           HB1      ASP  79   9.170 -12.772 -12.772
  618   2HB   ASP  79           HB2      ASP  79   9.530 -11.446 -11.446
  619    H    ALA  80           HN       ALA  80   5.370 -12.943 -12.943
  620    HA   ALA  80           HA       ALA  80   4.756 -10.227 -10.227
  621   1HB   ALA  80           HB1      ALA  80   3.837 -12.887 -12.887
  622   2HB   ALA  80           HB2      ALA  80   3.278 -11.314 -11.314
  623   3HB   ALA  80           HB3      ALA  80   4.967 -11.777 -11.777
  624    H    ALA  81           HN       ALA  81   3.626 -13.216 -13.216
  625    HA   ALA  81           HA       ALA  81   1.090 -11.992 -11.992
  626   1HB   ALA  81           HB1      ALA  81   1.095 -14.302 -14.302
  627   2HB   ALA  81           HB2      ALA  81   2.173 -14.816 -14.816
  628   3HB   ALA  81           HB3      ALA  81   0.533 -14.313 -14.313
  629   1H1   BME  16           HE1      MER  16  -7.274   8.596   8.596
  630   2H1   BME  16           HE2      MER  16  -7.947   8.041   8.041
  631   1H2   BME  16           HZ1      MER  16  -5.898   9.463   9.463
  632   2H2   BME  16           HZ2      MER  16  -7.363  10.149  10.149
  633    HO1  BME  16           HH       MER  16  -9.643   9.143   9.143

  Start of MODEL    7
    1    H    ASN   3           HN       ASN   3  -4.520  -8.203  -8.203
    2    HA   ASN   3           HA       ASN   3  -4.082 -10.871 -10.871
    3   1HB   ASN   3           HB1      ASN   3  -6.280 -10.740 -10.740
    4   2HB   ASN   3           HB2      ASN   3  -6.728  -9.356  -9.356
    5   1HD2  ASN   3          HD21      ASN   3  -7.912 -11.410 -11.410
    6   2HD2  ASN   3          HD22      ASN   3  -7.942  -9.903  -9.903
    7    H    ALA   4           HN       ALA   4  -2.452  -9.529  -9.529
    8    HA   ALA   4           HA       ALA   4  -1.828  -9.116  -9.116
    9   1HB   ALA   4           HB1      ALA   4  -4.092  -9.542  -9.542
   10   2HB   ALA   4           HB2      ALA   4  -4.587  -7.911  -7.911
   11   3HB   ALA   4           HB3      ALA   4  -3.310  -8.148  -8.148
   12    HA   PRO   5           HA       PRO   5  -1.065  -4.675  -4.675
   13   1HB   PRO   5           HB1      PRO   5   1.064  -4.423  -4.423
   14   2HB   PRO   5           HB2      PRO   5   1.211  -5.275  -5.275
   15   1HG   PRO   5           HG1      PRO   5   0.691  -6.570  -6.570
   16   2HG   PRO   5           HG2      PRO   5   2.006  -6.940  -6.940
   17   1HD   PRO   5           HD1      PRO   5  -0.307  -8.399  -8.399
   18   2HD   PRO   5           HD2      PRO   5   0.495  -8.007  -8.007
   19    H    LYS   6           HN       LYS   6  -2.755  -3.769  -3.769
   20    HA   LYS   6           HA       LYS   6  -3.319  -4.099  -4.099
   21   1HB   LYS   6           HB1      LYS   6  -5.205  -4.343  -4.343
   22   2HB   LYS   6           HB2      LYS   6  -5.015  -2.642  -2.642
   23   1HG   LYS   6           HG1      LYS   6  -5.271  -2.454  -2.454
   24   2HG   LYS   6           HG2      LYS   6  -6.082  -3.982  -3.982
   25   1HD   LYS   6           HD1      LYS   6  -7.942  -2.719  -2.719
   26   2HD   LYS   6           HD2      LYS   6  -7.288  -2.476  -2.476
   27   1HE   LYS   6           HE1      LYS   6  -7.072  -0.618  -0.618
   28   2HE   LYS   6           HE2      LYS   6  -7.809  -0.281  -0.281
   29   1HZ   LYS   6           HZ1      LYS   6  -5.138  -0.986  -0.986
   30   2HZ   LYS   6           HZ2      LYS   6  -5.188   0.197   0.197
   31   3HZ   LYS   6           HZ3      LYS   6  -5.902   0.497   0.497
   32    H    ARG   7           HN       ARG   7  -2.229  -2.775  -2.775
   33    HA   ARG   7           HA       ARG   7  -0.661  -0.916  -0.916
   34   1HB   ARG   7           HB1      ARG   7  -2.282  -1.362  -1.362
   35   2HB   ARG   7           HB2      ARG   7  -3.407  -0.234  -0.234
   36   1HG   ARG   7           HG1      ARG   7  -1.989   1.652   1.652
   37   2HG   ARG   7           HG2      ARG   7  -0.594   0.639   0.639
   38   1HD   ARG   7           HD1      ARG   7  -1.790  -0.260  -0.260
   39   2HD   ARG   7           HD2      ARG   7  -3.128   0.836   0.836
   40    HE   ARG   7           HE       ARG   7  -0.353   1.859   1.859
   41   1HH1  ARG   7          HH11      ARG   7  -2.834   3.558   3.558
   42   2HH1  ARG   7          HH12      ARG   7  -3.228   4.170   4.170
   43   1HH2  ARG   7          HH21      ARG   7  -1.198   1.826   1.826
   44   2HH2  ARG   7          HH22      ARG   7  -2.275   3.162   3.162
   45    HA   PRO   8           HA       PRO   8  -1.850   1.880   1.880
   46   1HB   PRO   8           HB1      PRO   8   0.673   2.326   2.326
   47   2HB   PRO   8           HB2      PRO   8  -0.142   0.780   0.780
   48   1HG   PRO   8           HG1      PRO   8   1.841   1.535   1.535
   49   2HG   PRO   8           HG2      PRO   8   1.922   0.164   0.164
   50   1HD   PRO   8           HD1      PRO   8   0.871  -0.101  -0.101
   51   2HD   PRO   8           HD2      PRO   8   0.179  -1.024  -1.024
   52    HA   PRO   9           HA       PRO   9  -1.359   6.247   6.247
   53   1HB   PRO   9           HB1      PRO   9   1.271   6.618   6.618
   54   2HB   PRO   9           HB2      PRO   9  -0.272   7.350   7.350
   55   1HG   PRO   9           HG1      PRO   9   0.935   4.870   4.870
   56   2HG   PRO   9           HG2      PRO   9  -0.293   5.933   5.933
   57   1HD   PRO   9           HD1      PRO   9  -1.012   3.491   3.491
   58   2HD   PRO   9           HD2      PRO   9  -2.053   4.874   4.874
   59    H    SER  10           HN       SER  10  -0.544   7.671   7.671
   60    HA   SER  10           HA       SER  10   1.220   6.766   6.766
   61   1HB   SER  10           HB1      SER  10  -0.919   8.962   8.962
   62   2HB   SER  10           HB2      SER  10  -0.022   8.516   8.516
   63    HG   SER  10           HG       SER  10  -1.368   6.947   6.947
   64    H    ALA  11           HN       ALA  11   0.923   9.886   9.886
   65    HA   ALA  11           HA       ALA  11   3.310  10.618  10.618
   66   1HB   ALA  11           HB1      ALA  11   3.826  10.448  10.448
   67   2HB   ALA  11           HB2      ALA  11   2.538  11.598  11.598
   68   3HB   ALA  11           HB3      ALA  11   3.957  12.105  12.105
   69    H    PHE  12           HN       PHE  12   0.327  11.639  11.639
   70    HA   PHE  12           HA       PHE  12   0.349  14.135  14.135
   71   1HB   PHE  12           HB1      PHE  12  -1.265  14.841  14.841
   72   2HB   PHE  12           HB2      PHE  12  -0.518  13.582  13.582
   73    HD1  PHE  12           HD1      PHE  12  -3.396  14.206  14.206
   74    HD2  PHE  12           HD2      PHE  12  -1.845  12.024  12.024
   75    HE1  PHE  12           HE1      PHE  12  -5.625  13.307  13.307
   76    HE2  PHE  12           HE2      PHE  12  -4.079  11.125  11.125
   77    HZ   PHE  12           HZ       PHE  12  -5.983  11.754  11.754
   78    H    PHE  13           HN       PHE  13  -0.161  11.014  11.014
   79    HA   PHE  13           HA       PHE  13  -2.701  11.105  11.105
   80   1HB   PHE  13           HB1      PHE  13  -1.396   9.018   9.018
   81   2HB   PHE  13           HB2      PHE  13  -0.357   9.402   9.402
   82    HD1  PHE  13           HD1      PHE  13  -3.841   8.698   8.698
   83    HD2  PHE  13           HD2      PHE  13  -1.155   9.003   9.003
   84    HE1  PHE  13           HE1      PHE  13  -5.554   7.751   7.751
   85    HE2  PHE  13           HE2      PHE  13  -2.871   8.056   8.056
   86    HZ   PHE  13           HZ       PHE  13  -5.069   7.427   7.427
   87    H    LEU  14           HN       LEU  14   0.681  11.559  11.559
   88    HA   LEU  14           HA       LEU  14   0.397  12.150  12.150
   89   1HB   LEU  14           HB1      LEU  14   2.420  13.351  13.351
   90   2HB   LEU  14           HB2      LEU  14   2.629  13.261  13.261
   91    HG   LEU  14           HG       LEU  14   4.029  11.576  11.576
   92   1HD1  LEU  14          HD11      LEU  14   2.664  10.496  10.496
   93   2HD1  LEU  14          HD12      LEU  14   1.514   9.954   9.954
   94   3HD1  LEU  14          HD13      LEU  14   3.161   9.348   9.348
   95   1HD2  LEU  14          HD21      LEU  14   2.117  10.697  10.697
   96   2HD2  LEU  14          HD22      LEU  14   3.608  11.598  11.598
   97   3HD2  LEU  14          HD23      LEU  14   3.650   9.950   9.950
   98    H    PHE  15           HN       PHE  15   0.740  14.315  14.315
   99    HA   PHE  15           HA       PHE  15   0.158  16.819  16.819
  100   1HB   PHE  15           HB1      PHE  15   1.010  16.784  16.784
  101   2HB   PHE  15           HB2      PHE  15  -0.035  15.426  15.426
  102    HD1  PHE  15           HD1      PHE  15  -2.264  15.821  15.821
  103    HD2  PHE  15           HD2      PHE  15   0.345  19.058  19.058
  104    HE1  PHE  15           HE1      PHE  15  -3.652  17.328  17.328
  105    HE2  PHE  15           HE2      PHE  15  -1.047  20.564  20.564
  106    HZ   PHE  15           HZ       PHE  15  -3.038  19.697  19.697
  107    H    CYS  16           HN       MER  16  -2.147  14.675  14.675
  108    HA   CYS  16           HA       MER  16  -4.538  15.987  15.987
  109   1HB   CYS  16           HB1      MER  16  -4.462  13.843  13.843
  110   2HB   CYS  16           HB2      MER  16  -3.885  13.006  13.006
  111    H    SER  17           HN       SER  17  -3.142  13.637  13.637
  112    HA   SER  17           HA       SER  17  -4.974  13.848  13.848
  113   1HB   SER  17           HB1      SER  17  -1.954  13.397  13.397
  114   2HB   SER  17           HB2      SER  17  -3.160  13.044  13.044
  115    HG   SER  17           HG       SER  17  -2.546  11.660  11.660
  116    H    GLU  18           HN       GLU  18  -1.947  15.554  15.554
  117    HA   GLU  18           HA       GLU  18  -1.702  17.152  17.152
  118   1HB   GLU  18           HB1      GLU  18  -0.290  17.116  17.116
  119   2HB   GLU  18           HB2      GLU  18  -1.445  18.231  18.231
  120   1HG   GLU  18           HG1      GLU  18  -1.002  19.942  19.942
  121   2HG   GLU  18           HG2      GLU  18   0.007  18.861  18.861
  122    H    TYR  19           HN       TYR  19  -3.898  17.936  17.936
  123    HA   TYR  19           HA       TYR  19  -5.363  19.678  19.678
  124   1HB   TYR  19           HB1      TYR  19  -5.524  21.453  21.453
  125   2HB   TYR  19           HB2      TYR  19  -3.809  20.992  20.992
  126    HD1  TYR  19           HD1      TYR  19  -3.076  19.137  19.137
  127    HD2  TYR  19           HD2      TYR  19  -6.338  21.859  21.859
  128    HE1  TYR  19           HE1      TYR  19  -3.032  18.980  18.980
  129    HE2  TYR  19           HE2      TYR  19  -6.296  21.699  21.699
  130    HH   TYR  19           HH       TYR  19  -4.295  21.116  21.116
  131    H    ARG  20           HN       ARG  20  -6.072  17.119  17.119
  132    HA   ARG  20           HA       ARG  20  -8.155  17.092  17.092
  133   1HB   ARG  20           HB1      ARG  20  -7.250  14.988  14.988
  134   2HB   ARG  20           HB2      ARG  20  -7.312  15.228  15.228
  135   1HG   ARG  20           HG1      ARG  20  -9.835  15.004  15.004
  136   2HG   ARG  20           HG2      ARG  20  -8.996  13.579  13.579
  137   1HD   ARG  20           HD1      ARG  20 -10.274  15.719  15.719
  138   2HD   ARG  20           HD2      ARG  20 -10.818  14.079  14.079
  139    HE   ARG  20           HE       ARG  20  -8.176  14.701  14.701
  140   1HH1  ARG  20          HH11      ARG  20  -8.900  11.885  11.885
  141   2HH1  ARG  20          HH12      ARG  20  -9.510  11.250  11.250
  142   1HH2  ARG  20          HH21      ARG  20  -9.905  14.429  14.429
  143   2HH2  ARG  20          HH22      ARG  20 -10.096  12.730  12.730
  144    HA   PRO  21           HA       PRO  21 -11.014  17.588  17.588
  145   1HB   PRO  21           HB1      PRO  21  -9.181  19.312  19.312
  146   2HB   PRO  21           HB2      PRO  21 -10.387  18.128  18.128
  147   1HG   PRO  21           HG1      PRO  21  -7.837  17.366  17.366
  148   2HG   PRO  21           HG2      PRO  21  -8.999  16.255  16.255
  149   1HD   PRO  21           HD1      PRO  21  -7.218  18.309  18.309
  150   2HD   PRO  21           HD2      PRO  21  -7.364  16.577  16.577
  151    H    LYS  22           HN       LYS  22  -8.778  20.064  20.064
  152    HA   LYS  22           HA       LYS  22 -10.369  22.378  22.378
  153   1HB   LYS  22           HB1      LYS  22  -7.745  21.858  21.858
  154   2HB   LYS  22           HB2      LYS  22  -8.283  22.193  22.193
  155   1HG   LYS  22           HG1      LYS  22  -7.480  24.267  24.267
  156   2HG   LYS  22           HG2      LYS  22  -9.226  24.402  24.402
  157   1HD   LYS  22           HD1      LYS  22  -9.478  23.997  23.997
  158   2HD   LYS  22           HD2      LYS  22  -7.834  23.414  23.414
  159   1HE   LYS  22           HE1      LYS  22  -8.596  26.282  26.282
  160   2HE   LYS  22           HE2      LYS  22  -8.112  25.718  25.718
  161   1HZ   LYS  22           HZ1      LYS  22  -6.198  24.865  24.865
  162   2HZ   LYS  22           HZ2      LYS  22  -6.482  26.518  26.518
  163   3HZ   LYS  22           HZ3      LYS  22  -6.022  25.961  25.961
  164    H    ILE  23           HN       ILE  23  -9.894  20.240  20.240
  165    HA   ILE  23           HA       ILE  23 -11.670  21.984  21.984
  166    HB   ILE  23           HB       ILE  23 -11.306  20.249  20.249
  167   1HG1  ILE  23          HG11      ILE  23  -9.165  19.052  19.052
  168   2HG1  ILE  23          HG12      ILE  23 -10.746  18.310  18.310
  169   1HG2  ILE  23          HG21      ILE  23  -9.932  22.279  22.279
  170   2HG2  ILE  23          HG22      ILE  23  -8.829  21.485  21.485
  171   3HG2  ILE  23          HG23      ILE  23  -8.940  20.947  20.947
  172   1HD1  ILE  23          HD11      ILE  23 -10.453  18.143  18.143
  173   2HD1  ILE  23          HD12      ILE  23  -8.835  18.812  18.812
  174   3HD1  ILE  23          HD13      ILE  23  -9.223  17.266  17.266
  175    H    LYS  24           HN       LYS  24 -11.634  18.996  18.996
  176    HA   LYS  24           HA       LYS  24 -14.039  17.817  17.817
  177   1HB   LYS  24           HB1      LYS  24 -12.139  16.838  16.838
  178   2HB   LYS  24           HB2      LYS  24 -12.478  17.820  17.820
  179   1HG   LYS  24           HG1      LYS  24 -14.967  16.561  16.561
  180   2HG   LYS  24           HG2      LYS  24 -13.878  15.338  15.338
  181   1HD   LYS  24           HD1      LYS  24 -14.195  14.907  14.907
  182   2HD   LYS  24           HD2      LYS  24 -12.556  15.488  15.488
  183   1HE   LYS  24           HE1      LYS  24 -13.587  16.617  16.617
  184   2HE   LYS  24           HE2      LYS  24 -13.316  17.804  17.804
  185   1HZ   LYS  24           HZ1      LYS  24 -15.836  16.681  16.681
  186   2HZ   LYS  24           HZ2      LYS  24 -15.718  17.101  17.101
  187   3HZ   LYS  24           HZ3      LYS  24 -15.441  18.271  18.271
  188    H    GLY  25           HN       GLY  25 -13.195  20.281  20.281
  189   1HA   GLY  25           HA1      GLY  25 -15.651  20.544  20.544
  190   2HA   GLY  25           HA2      GLY  25 -14.348  21.739  21.739
  191    H    GLU  26           HN       GLU  26 -14.174  22.275  22.275
  192    HA   GLU  26           HA       GLU  26 -16.292  24.108  24.108
  193   1HB   GLU  26           HB1      GLU  26 -14.188  22.971  22.971
  194   2HB   GLU  26           HB2      GLU  26 -15.139  24.399  24.399
  195   1HG   GLU  26           HG1      GLU  26 -13.411  24.185  24.185
  196   2HG   GLU  26           HG2      GLU  26 -12.747  24.735  24.735
  197    H    HIS  27           HN       HIS  27 -15.496  21.047  21.047
  198    HA   HIS  27           HA       HIS  27 -18.161  20.759  20.759
  199   1HB   HIS  27           HB1      HIS  27 -15.535  19.484  19.484
  200   2HB   HIS  27           HB2      HIS  27 -17.055  19.522  19.522
  201    HD1  HIS  27           HD1      HIS  27 -17.800  22.153  22.153
  202    HD2  HIS  27           HD2      HIS  27 -13.830  21.511  21.511
  203    HE1  HIS  27           HE1      HIS  27 -16.605  24.126  24.126
  204    HA   PRO  28           HA       PRO  28 -17.970  17.113  17.113
  205   1HB   PRO  28           HB1      PRO  28 -20.071  17.640  17.640
  206   2HB   PRO  28           HB2      PRO  28 -18.536  18.470  18.470
  207   1HG   PRO  28           HG1      PRO  28 -20.951  19.502  19.502
  208   2HG   PRO  28           HG2      PRO  28 -20.080  20.321  20.321
  209   1HD   PRO  28           HD1      PRO  28 -19.448  20.775  20.775
  210   2HD   PRO  28           HD2      PRO  28 -18.236  20.881  20.881
  211    H    GLY  29           HN       GLY  29 -18.667  17.478  17.478
  212   1HA   GLY  29           HA1      GLY  29 -21.150  15.908  15.908
  213   2HA   GLY  29           HA2      GLY  29 -20.882  17.302  17.302
  214    H    LEU  30           HN       LEU  30 -17.879  15.862  15.862
  215    HA   LEU  30           HA       LEU  30 -18.084  14.480  14.480
  216   1HB   LEU  30           HB1      LEU  30 -15.426  14.623  14.623
  217   2HB   LEU  30           HB2      LEU  30 -16.333  15.915  15.915
  218    HG   LEU  30           HG       LEU  30 -16.416  17.061  17.061
  219   1HD1  LEU  30          HD11      LEU  30 -14.948  14.680  14.680
  220   2HD1  LEU  30          HD12      LEU  30 -15.085  16.235  16.235
  221   3HD1  LEU  30          HD13      LEU  30 -16.509  15.278  15.278
  222   1HD2  LEU  30          HD21      LEU  30 -13.630  16.209  16.209
  223   2HD2  LEU  30          HD22      LEU  30 -14.565  17.553  17.553
  224   3HD2  LEU  30          HD23      LEU  30 -13.981  17.584  17.584
  225    H    SER  31           HN       SER  31 -16.640  12.677  12.677
  226    HA   SER  31           HA       SER  31 -16.579  10.762  10.762
  227   1HB   SER  31           HB1      SER  31 -17.127  10.237  10.237
  228   2HB   SER  31           HB2      SER  31 -17.052   8.990   8.990
  229    HG   SER  31           HG       SER  31 -19.042  10.679  10.679
  230    H    ILE  32           HN       ILE  32 -15.136   8.813   8.813
  231    HA   ILE  32           HA       ILE  32 -12.468   9.804   9.804
  232    HB   ILE  32           HB       ILE  32 -13.295   7.720   7.720
  233   1HG1  ILE  32          HG11      ILE  32 -11.464   6.190   6.190
  234   2HG1  ILE  32          HG12      ILE  32 -11.150   7.009   7.009
  235   1HG2  ILE  32          HG21      ILE  32 -14.877   7.008   7.008
  236   2HG2  ILE  32          HG22      ILE  32 -13.562   6.715   6.715
  237   3HG2  ILE  32          HG23      ILE  32 -13.743   5.711   5.711
  238   1HD1  ILE  32          HD11      ILE  32 -10.783   8.212   8.212
  239   2HD1  ILE  32          HD12      ILE  32  -9.497   7.681   7.681
  240   3HD1  ILE  32          HD13      ILE  32 -10.477   9.067   9.067
  241    H    GLY  33           HN       GLY  33 -14.401   9.915   9.915
  242   1HA   GLY  33           HA1      GLY  33 -12.401   9.459   9.459
  243   2HA   GLY  33           HA2      GLY  33 -14.149   9.391   9.391
  244    H    ASP  34           HN       ASP  34 -14.117  11.769  11.769
  245    HA   ASP  34           HA       ASP  34 -13.833  13.842  13.842
  246   1HB   ASP  34           HB1      ASP  34 -15.343  13.663  13.663
  247   2HB   ASP  34           HB2      ASP  34 -15.419  15.122  15.122
  248    H    VAL  35           HN       VAL  35 -13.236  13.135  13.135
  249    HA   VAL  35           HA       VAL  35 -11.558  15.364  15.364
  250    HB   VAL  35           HB       VAL  35 -11.608  12.470  12.470
  251   1HG1  VAL  35          HG11      VAL  35 -10.462  14.995  14.995
  252   2HG1  VAL  35          HG12      VAL  35 -10.537  13.418  13.418
  253   3HG1  VAL  35          HG13      VAL  35  -9.505  13.660  13.660
  254   1HG2  VAL  35          HG21      VAL  35 -13.767  13.652  13.652
  255   2HG2  VAL  35          HG22      VAL  35 -12.979  13.317  13.317
  256   3HG2  VAL  35          HG23      VAL  35 -12.927  14.933  14.933
  257    H    ALA  36           HN       ALA  36 -11.148  12.276  12.276
  258    HA   ALA  36           HA       ALA  36  -8.311  12.230  12.230
  259   1HB   ALA  36           HB1      ALA  36 -10.507  10.704  10.704
  260   2HB   ALA  36           HB2      ALA  36  -8.805  10.250  10.250
  261   3HB   ALA  36           HB3      ALA  36  -9.657  10.204  10.204
  262    H    LYS  37           HN       LYS  37 -10.882  13.059  13.059
  263    HA   LYS  37           HA       LYS  37  -8.826  13.549  13.549
  264   1HB   LYS  37           HB1      LYS  37 -11.784  14.199  14.199
  265   2HB   LYS  37           HB2      LYS  37 -10.766  14.624  14.624
  266   1HG   LYS  37           HG1      LYS  37 -10.030  12.237  12.237
  267   2HG   LYS  37           HG2      LYS  37 -11.087  11.802  11.802
  268   1HD   LYS  37           HD1      LYS  37 -12.306  11.245  11.245
  269   2HD   LYS  37           HD2      LYS  37 -13.027  12.743  12.743
  270   1HE   LYS  37           HE1      LYS  37 -12.574  12.817  12.817
  271   2HE   LYS  37           HE2      LYS  37 -11.612  14.031  14.031
  272   1HZ   LYS  37           HZ1      LYS  37 -10.198  11.606  11.606
  273   2HZ   LYS  37           HZ2      LYS  37 -10.735  11.953  11.953
  274   3HZ   LYS  37           HZ3      LYS  37  -9.791  13.085  13.085
  275    H    LYS  38           HN       LYS  38 -10.548  15.598  15.598
  276    HA   LYS  38           HA       LYS  38  -9.747  18.082  18.082
  277   1HB   LYS  38           HB1      LYS  38 -10.534  17.164  17.164
  278   2HB   LYS  38           HB2      LYS  38  -9.993  18.811  18.811
  279   1HG   LYS  38           HG1      LYS  38 -11.749  19.113  19.113
  280   2HG   LYS  38           HG2      LYS  38 -12.312  17.471  17.471
  281   1HD   LYS  38           HD1      LYS  38 -12.916  18.007  18.007
  282   2HD   LYS  38           HD2      LYS  38 -12.191  19.600  19.600
  283   1HE   LYS  38           HE1      LYS  38 -13.854  20.216  20.216
  284   2HE   LYS  38           HE2      LYS  38 -14.596  18.629  18.629
  285   1HZ   LYS  38           HZ1      LYS  38 -14.393  19.741  19.741
  286   2HZ   LYS  38           HZ2      LYS  38 -15.066  20.911  20.911
  287   3HZ   LYS  38           HZ3      LYS  38 -15.790  19.383  19.383
  288    H    LEU  39           HN       LEU  39  -8.385  16.126  16.126
  289    HA   LEU  39           HA       LEU  39  -6.012  17.729  17.729
  290   1HB   LEU  39           HB1      LEU  39  -6.711  14.925  14.925
  291   2HB   LEU  39           HB2      LEU  39  -5.165  15.667  15.667
  292    HG   LEU  39           HG       LEU  39  -7.823  16.902  16.902
  293   1HD1  LEU  39          HD11      LEU  39  -6.157  15.208  15.208
  294   2HD1  LEU  39          HD12      LEU  39  -7.596  16.032  16.032
  295   3HD1  LEU  39          HD13      LEU  39  -7.719  14.729  14.729
  296   1HD2  LEU  39          HD21      LEU  39  -5.112  17.368  17.368
  297   2HD2  LEU  39          HD22      LEU  39  -5.873  18.450  18.450
  298   3HD2  LEU  39          HD23      LEU  39  -6.578  18.231  18.231
  299    H    GLY  40           HN       GLY  40  -6.821  14.741  14.741
  300   1HA   GLY  40           HA1      GLY  40  -4.410  13.898  13.898
  301   2HA   GLY  40           HA2      GLY  40  -5.928  13.693  13.693
  302    H    GLU  41           HN       GLU  41  -6.350  16.591  16.591
  303    HA   GLU  41           HA       GLU  41  -4.729  17.212  17.212
  304   1HB   GLU  41           HB1      GLU  41  -7.171  18.417  18.417
  305   2HB   GLU  41           HB2      GLU  41  -6.404  19.144  19.144
  306   1HG   GLU  41           HG1      GLU  41  -6.811  17.157  17.157
  307   2HG   GLU  41           HG2      GLU  41  -7.374  16.243  16.243
  308    H    MET  42           HN       MET  42  -5.827  18.950  18.950
  309    HA   MET  42           HA       MET  42  -4.291  21.229  21.229
  310   1HB   MET  42           HB1      MET  42  -4.843  19.418  19.418
  311   2HB   MET  42           HB2      MET  42  -4.213  21.051  21.051
  312   1HG   MET  42           HG1      MET  42  -6.838  20.369  20.369
  313   2HG   MET  42           HG2      MET  42  -6.745  20.843  20.843
  314   1HE   MET  42           HE1      MET  42  -8.636  21.894  21.894
  315   2HE   MET  42           HE2      MET  42  -8.128  23.358  23.358
  316   3HE   MET  42           HE3      MET  42  -7.376  21.835  21.835
  317    H    TRP  43           HN       TRP  43  -3.337  18.085  18.085
  318    HA   TRP  43           HA       TRP  43  -0.778  18.441  18.441
  319   1HB   TRP  43           HB1      TRP  43  -1.946  16.417  16.417
  320   2HB   TRP  43           HB2      TRP  43  -2.209  16.217  16.217
  321    HD1  TRP  43           HD1      TRP  43  -0.601  14.736  14.736
  322    HE1  TRP  43           HE1      TRP  43   1.708  13.919  13.919
  323    HE3  TRP  43           HE3      TRP  43   0.218  17.175  17.175
  324    HZ2  TRP  43           HZ2      TRP  43   3.759  14.163  14.163
  325    HZ3  TRP  43           HZ3      TRP  43   2.287  16.881  16.881
  326    HH2  TRP  43           HH2      TRP  43   4.072  15.365  15.365
  327    H    ASN  44           HN       ASN  44  -1.835  17.647  17.647
  328    HA   ASN  44           HA       ASN  44   0.770  17.565  17.565
  329   1HB   ASN  44           HB1      ASN  44  -1.927  18.138  18.138
  330   2HB   ASN  44           HB2      ASN  44  -0.437  17.902  17.902
  331   1HD2  ASN  44          HD21      ASN  44  -2.379  14.639  14.639
  332   2HD2  ASN  44          HD22      ASN  44  -3.032  16.166  16.166
  333    H    ASN  45           HN       ASN  45  -1.017  20.111  20.111
  334    HA   ASN  45           HA       ASN  45   0.771  22.137  22.137
  335   1HB   ASN  45           HB1      ASN  45  -2.083  22.733  22.733
  336   2HB   ASN  45           HB2      ASN  45  -1.083  23.628  23.628
  337   1HD2  ASN  45          HD21      ASN  45  -3.481  20.679  20.679
  338   2HD2  ASN  45          HD22      ASN  45  -3.486  21.293  21.293
  339    H    THR  46           HN       THR  46   1.389  20.807  20.807
  340    HA   THR  46           HA       THR  46   0.563  22.647  22.647
  341    HB   THR  46           HB       THR  46   0.715  20.115  20.115
  342    HG1  THR  46           HG1      THR  46   1.045  20.887  20.887
  343   1HG2  THR  46          HG21      THR  46   2.995  19.682  19.682
  344   2HG2  THR  46          HG22      THR  46   3.760  20.618  20.618
  345   3HG2  THR  46          HG23      THR  46   2.921  19.139  19.139
  346    H    ALA  47           HN       ALA  47   3.514  21.577  21.577
  347    HA   ALA  47           HA       ALA  47   4.818  24.037  24.037
  348   1HB   ALA  47           HB1      ALA  47   5.673  22.576  22.576
  349   2HB   ALA  47           HB2      ALA  47   6.492  23.971  23.971
  350   3HB   ALA  47           HB3      ALA  47   4.896  24.148  24.148
  351    H    ALA  48           HN       ALA  48   5.144  20.629  20.629
  352    HA   ALA  48           HA       ALA  48   6.582  18.997  18.997
  353   1HB   ALA  48           HB1      ALA  48   5.819  19.945  19.945
  354   2HB   ALA  48           HB2      ALA  48   7.129  21.118  21.118
  355   3HB   ALA  48           HB3      ALA  48   7.497  19.404  19.404
  356    H    ASP  49           HN       ASP  49   7.320  21.268  21.268
  357    HA   ASP  49           HA       ASP  49  10.233  21.008  21.008
  358   1HB   ASP  49           HB1      ASP  49   9.771  23.254  23.254
  359   2HB   ASP  49           HB2      ASP  49   8.505  23.537  23.537
  360    H    ASP  50           HN       ASP  50   7.056  21.129  21.129
  361    HA   ASP  50           HA       ASP  50   7.702  20.720  20.720
  362   1HB   ASP  50           HB1      ASP  50   6.146  22.717  22.717
  363   2HB   ASP  50           HB2      ASP  50   4.982  21.458  21.458
  364    H    LYS  51           HN       LYS  51   7.340  19.113  19.113
  365    HA   LYS  51           HA       LYS  51   5.386  17.084  17.084
  366   1HB   LYS  51           HB1      LYS  51   6.950  17.388  17.388
  367   2HB   LYS  51           HB2      LYS  51   6.068  15.928  15.928
  368   1HG   LYS  51           HG1      LYS  51   3.980  17.380  17.380
  369   2HG   LYS  51           HG2      LYS  51   4.930  18.692  18.692
  370   1HD   LYS  51           HD1      LYS  51   5.411  17.346  17.346
  371   2HD   LYS  51           HD2      LYS  51   4.568  15.973  15.973
  372   1HE   LYS  51           HE1      LYS  51   2.473  17.186  17.186
  373   2HE   LYS  51           HE2      LYS  51   3.256  18.625  18.625
  374   1HZ   LYS  51           HZ1      LYS  51   3.907  16.438  16.438
  375   2HZ   LYS  51           HZ2      LYS  51   2.228  16.427  16.427
  376   3HZ   LYS  51           HZ3      LYS  51   2.979  17.808  17.808
  377    H    GLN  52           HN       GLN  52   8.707  17.496  17.496
  378    HA   GLN  52           HA       GLN  52   9.962  15.171  15.171
  379   1HB   GLN  52           HB1      GLN  52  10.696  17.874  17.874
  380   2HB   GLN  52           HB2      GLN  52  11.724  16.553  16.553
  381   1HG   GLN  52           HG1      GLN  52  12.605  17.525  17.525
  382   2HG   GLN  52           HG2      GLN  52  11.993  15.923  15.923
  383   1HE2  GLN  52          HE21      GLN  52   9.391  17.102  17.102
  384   2HE2  GLN  52          HE22      GLN  52  10.064  15.767  15.767
  385    HA   PRO  53           HA       PRO  53  10.233  14.772  14.772
  386   1HB   PRO  53           HB1      PRO  53   8.144  16.044  16.044
  387   2HB   PRO  53           HB2      PRO  53   9.769  16.695  16.695
  388   1HG   PRO  53           HG1      PRO  53   7.338  17.182  17.182
  389   2HG   PRO  53           HG2      PRO  53   8.391  18.387  18.387
  390   1HD   PRO  53           HD1      PRO  53   8.901  17.730  17.730
  391   2HD   PRO  53           HD2      PRO  53  10.290  17.724  17.724
  392    H    TYR  54           HN       TYR  54   7.102  15.150  15.150
  393    HA   TYR  54           HA       TYR  54   5.885  12.846  12.846
  394   1HB   TYR  54           HB1      TYR  54   4.898  14.596  14.596
  395   2HB   TYR  54           HB2      TYR  54   3.915  13.469  13.469
  396    HD1  TYR  54           HD1      TYR  54   4.675  14.074  14.074
  397    HD2  TYR  54           HD2      TYR  54   4.160  16.725  16.725
  398    HE1  TYR  54           HE1      TYR  54   4.145  15.900  15.900
  399    HE2  TYR  54           HE2      TYR  54   3.634  18.547  18.547
  400    HH   TYR  54           HH       TYR  54   4.314  18.968  18.968
  401    H    GLU  55           HN       GLU  55   6.796  13.671  13.671
  402    HA   GLU  55           HA       GLU  55   6.045  11.269  11.269
  403   1HB   GLU  55           HB1      GLU  55   7.439  13.702  13.702
  404   2HB   GLU  55           HB2      GLU  55   8.481  12.407  12.407
  405   1HG   GLU  55           HG1      GLU  55   6.500  11.425  11.425
  406   2HG   GLU  55           HG2      GLU  55   5.540  12.794  12.794
  407    H    LYS  56           HN       LYS  56   9.165  12.144  12.144
  408    HA   LYS  56           HA       LYS  56  10.639   9.895   9.895
  409   1HB   LYS  56           HB1      LYS  56  11.339  12.071  12.071
  410   2HB   LYS  56           HB2      LYS  56  10.703  11.382  11.382
  411   1HG   LYS  56           HG1      LYS  56  12.329   9.412   9.412
  412   2HG   LYS  56           HG2      LYS  56  13.038  10.390  10.390
  413   1HD   LYS  56           HD1      LYS  56  13.284  12.268  12.268
  414   2HD   LYS  56           HD2      LYS  56  12.876  11.046  11.046
  415   1HE   LYS  56           HE1      LYS  56  15.297  11.159  11.159
  416   2HE   LYS  56           HE2      LYS  56  14.813   9.646   9.646
  417   1HZ   LYS  56           HZ1      LYS  56  14.790  11.658  11.658
  418   2HZ   LYS  56           HZ2      LYS  56  16.266  11.741  11.741
  419   3HZ   LYS  56           HZ3      LYS  56  15.788  10.287  10.287
  420    H    LYS  57           HN       LYS  57   8.316  10.484  10.484
  421    HA   LYS  57           HA       LYS  57   8.591   8.097   8.097
  422   1HB   LYS  57           HB1      LYS  57   6.933  10.452  10.452
  423   2HB   LYS  57           HB2      LYS  57   5.819   9.106   9.106
  424   1HG   LYS  57           HG1      LYS  57   6.166   9.636   9.636
  425   2HG   LYS  57           HG2      LYS  57   7.086   8.169   8.169
  426   1HD   LYS  57           HD1      LYS  57   9.176   9.483   9.483
  427   2HD   LYS  57           HD2      LYS  57   8.279  10.985  10.985
  428   1HE   LYS  57           HE1      LYS  57   7.528  10.345  10.345
  429   2HE   LYS  57           HE2      LYS  57   8.470   8.864   8.864
  430   1HZ   LYS  57           HZ1      LYS  57  10.114  11.021  11.021
  431   2HZ   LYS  57           HZ2      LYS  57   9.315  11.407  11.407
  432   3HZ   LYS  57           HZ3      LYS  57  10.229   9.981   9.981
  433    H    ALA  58           HN       ALA  58   6.217   9.019   9.019
  434    HA   ALA  58           HA       ALA  58   4.705   6.797   6.797
  435   1HB   ALA  58           HB1      ALA  58   4.564   8.885   8.885
  436   2HB   ALA  58           HB2      ALA  58   5.968   8.357   8.357
  437   3HB   ALA  58           HB3      ALA  58   4.493   7.421   7.421
  438    H    ALA  59           HN       ALA  59   7.759   7.321   7.321
  439    HA   ALA  59           HA       ALA  59   8.042   4.919   4.919
  440   1HB   ALA  59           HB1      ALA  59   9.651   6.847   6.847
  441   2HB   ALA  59           HB2      ALA  59  10.253   6.495   6.495
  442   3HB   ALA  59           HB3      ALA  59  10.528   5.355   5.355
  443    H    LYS  60           HN       LYS  60   9.469   5.541   5.541
  444    HA   LYS  60           HA       LYS  60  10.366   2.956   2.956
  445   1HB   LYS  60           HB1      LYS  60  10.890   5.018   5.018
  446   2HB   LYS  60           HB2      LYS  60   9.265   5.042   5.042
  447   1HG   LYS  60           HG1      LYS  60   9.553   2.973   2.973
  448   2HG   LYS  60           HG2      LYS  60  11.057   2.607   2.607
  449   1HD   LYS  60           HD1      LYS  60  10.688   5.007   5.007
  450   2HD   LYS  60           HD2      LYS  60  11.298   3.457   3.457
  451   1HE   LYS  60           HE1      LYS  60  13.176   3.633   3.633
  452   2HE   LYS  60           HE2      LYS  60  12.593   5.213   5.213
  453   1HZ   LYS  60           HZ1      LYS  60  12.816   5.177   5.177
  454   2HZ   LYS  60           HZ2      LYS  60  14.259   4.577   4.577
  455   3HZ   LYS  60           HZ3      LYS  60  13.683   6.104   6.104
  456    H    LEU  61           HN       LEU  61   7.231   4.388   4.388
  457    HA   LEU  61           HA       LEU  61   6.079   2.203   2.203
  458   1HB   LEU  61           HB1      LEU  61   4.777   4.227   4.227
  459   2HB   LEU  61           HB2      LEU  61   3.889   3.159   3.159
  460    HG   LEU  61           HG       LEU  61   5.143   5.724   5.724
  461   1HD1  LEU  61          HD11      LEU  61   2.890   5.024   5.024
  462   2HD1  LEU  61          HD12      LEU  61   3.526   3.762   3.762
  463   3HD1  LEU  61          HD13      LEU  61   3.779   5.455   5.455
  464   1HD2  LEU  61          HD21      LEU  61   6.085   3.485   3.485
  465   2HD2  LEU  61          HD22      LEU  61   7.146   4.480   4.480
  466   3HD2  LEU  61          HD23      LEU  61   6.223   5.201   5.201
  467    H    LYS  62           HN       LYS  62   5.665   2.881   2.881
  468    HA   LYS  62           HA       LYS  62   4.343   0.509   0.509
  469   1HB   LYS  62           HB1      LYS  62   6.568   1.845   1.845
  470   2HB   LYS  62           HB2      LYS  62   5.502   0.580   0.580
  471   1HG   LYS  62           HG1      LYS  62   3.531   2.095   2.095
  472   2HG   LYS  62           HG2      LYS  62   4.646   3.354   3.354
  473   1HD   LYS  62           HD1      LYS  62   4.037   3.656   3.656
  474   2HD   LYS  62           HD2      LYS  62   5.746   3.283   3.283
  475   1HE   LYS  62           HE1      LYS  62   5.357   0.944   0.944
  476   2HE   LYS  62           HE2      LYS  62   3.615   1.191   1.191
  477   1HZ   LYS  62           HZ1      LYS  62   4.764   3.136   3.136
  478   2HZ   LYS  62           HZ2      LYS  62   5.427   1.633   1.633
  479   3HZ   LYS  62           HZ3      LYS  62   3.745   1.850   1.850
  480    H    GLU  63           HN       GLU  63   7.813   1.035   1.035
  481    HA   GLU  63           HA       GLU  63   8.783  -1.454  -1.454
  482   1HB   GLU  63           HB1      GLU  63  10.006   0.841   0.841
  483   2HB   GLU  63           HB2      GLU  63   9.999   0.296   0.296
  484   1HG   GLU  63           HG1      GLU  63  11.361  -1.717  -1.717
  485   2HG   GLU  63           HG2      GLU  63  11.373  -1.143  -1.143
  486    H    LYS  64           HN       LYS  64   8.071  -0.330  -0.330
  487    HA   LYS  64           HA       LYS  64   8.689  -2.693  -2.693
  488   1HB   LYS  64           HB1      LYS  64   8.249  -0.591  -0.591
  489   2HB   LYS  64           HB2      LYS  64   6.615  -0.513  -0.513
  490   1HG   LYS  64           HG1      LYS  64   5.930  -2.419  -2.419
  491   2HG   LYS  64           HG2      LYS  64   7.580  -2.709  -2.709
  492   1HD   LYS  64           HD1      LYS  64   7.642  -0.570  -0.570
  493   2HD   LYS  64           HD2      LYS  64   6.092  -0.091  -0.091
  494   1HE   LYS  64           HE1      LYS  64   6.495  -2.505  -2.505
  495   2HE   LYS  64           HE2      LYS  64   5.911  -0.938  -0.938
  496   1HZ   LYS  64           HZ1      LYS  64   4.410  -1.696  -1.696
  497   2HZ   LYS  64           HZ2      LYS  64   4.464  -3.024  -3.024
  498   3HZ   LYS  64           HZ3      LYS  64   3.898  -1.517  -1.517
  499    H    TYR  65           HN       TYR  65   5.557  -1.644  -1.644
  500    HA   TYR  65           HA       TYR  65   3.972  -3.848  -3.848
  501   1HB   TYR  65           HB1      TYR  65   2.806  -2.012  -2.012
  502   2HB   TYR  65           HB2      TYR  65   3.977  -1.756  -1.756
  503    HD1  TYR  65           HD1      TYR  65   2.044  -4.867  -4.867
  504    HD2  TYR  65           HD2      TYR  65   2.664  -1.703  -1.703
  505    HE1  TYR  65           HE1      TYR  65   0.553  -5.970  -5.970
  506    HE2  TYR  65           HE2      TYR  65   1.170  -2.807  -2.807
  507    HH   TYR  65           HH       TYR  65  -0.958  -5.132  -5.132
  508    H    GLU  66           HN       GLU  66   5.548  -3.327  -3.327
  509    HA   GLU  66           HA       GLU  66   4.973  -5.686  -5.686
  510   1HB   GLU  66           HB1      GLU  66   7.537  -4.130  -4.130
  511   2HB   GLU  66           HB2      GLU  66   7.070  -5.303  -5.303
  512   1HG   GLU  66           HG1      GLU  66   5.050  -3.129  -3.129
  513   2HG   GLU  66           HG2      GLU  66   6.488  -2.622  -2.622
  514    H    LYS  67           HN       LYS  67   7.326  -5.274  -5.274
  515    HA   LYS  67           HA       LYS  67   8.596  -7.850  -7.850
  516   1HB   LYS  67           HB1      LYS  67   9.049  -5.569  -5.569
  517   2HB   LYS  67           HB2      LYS  67   9.584  -7.127  -7.127
  518   1HG   LYS  67           HG1      LYS  67  11.431  -6.175  -6.175
  519   2HG   LYS  67           HG2      LYS  67  10.844  -7.411  -7.411
  520   1HD   LYS  67           HD1      LYS  67   9.682  -5.604  -5.604
  521   2HD   LYS  67           HD2      LYS  67  10.377  -4.412  -4.412
  522   1HE   LYS  67           HE1      LYS  67  12.673  -5.178  -5.178
  523   2HE   LYS  67           HE2      LYS  67  11.980  -6.331  -6.331
  524   1HZ   LYS  67           HZ1      LYS  67  10.871  -3.822  -3.822
  525   2HZ   LYS  67           HZ2      LYS  67  12.558  -3.642  -3.642
  526   3HZ   LYS  67           HZ3      LYS  67  11.892  -4.760  -4.760
  527    H    ASP  68           HN       ASP  68   6.268  -6.650  -6.650
  528    HA   ASP  68           HA       ASP  68   6.214  -8.978  -8.978
  529   1HB   ASP  68           HB1      ASP  68   4.390  -6.570  -6.570
  530   2HB   ASP  68           HB2      ASP  68   4.299  -7.812  -7.812
  531    H    ILE  69           HN       ILE  69   4.717  -7.730  -7.730
  532    HA   ILE  69           HA       ILE  69   2.475  -9.595  -9.595
  533    HB   ILE  69           HB       ILE  69   2.093  -7.431  -7.431
  534   1HG1  ILE  69          HG11      ILE  69   0.886  -8.195  -8.195
  535   2HG1  ILE  69          HG12      ILE  69   1.996  -9.531  -9.531
  536   1HG2  ILE  69          HG21      ILE  69   4.345  -7.209  -7.209
  537   2HG2  ILE  69          HG22      ILE  69   3.989  -8.434  -8.434
  538   3HG2  ILE  69          HG23      ILE  69   3.098  -6.918  -6.918
  539   1HD1  ILE  69          HD11      ILE  69   0.154  -9.286  -9.286
  540   2HD1  ILE  69          HD12      ILE  69  -0.111 -10.330 -10.330
  541   3HD1  ILE  69          HD13      ILE  69   1.222 -10.639 -10.639
  542    H    ALA  70           HN       ALA  70   5.356  -9.185  -9.185
  543    HA   ALA  70           HA       ALA  70   5.312 -11.482 -11.482
  544   1HB   ALA  70           HB1      ALA  70   7.747 -10.197 -10.197
  545   2HB   ALA  70           HB2      ALA  70   7.807 -11.305 -11.305
  546   3HB   ALA  70           HB3      ALA  70   7.081  -9.722  -9.722
  547    H    ALA  71           HN       ALA  71   6.156 -10.965 -10.965
  548    HA   ALA  71           HA       ALA  71   7.124 -13.628 -13.628
  549   1HB   ALA  71           HB1      ALA  71   6.177 -11.405 -11.405
  550   2HB   ALA  71           HB2      ALA  71   7.015 -12.857 -12.857
  551   3HB   ALA  71           HB3      ALA  71   7.835 -11.692 -11.692
  552    H    TYR  72           HN       TYR  72   4.152 -11.828 -11.828
  553    HA   TYR  72           HA       TYR  72   2.571 -13.666 -13.666
  554   1HB   TYR  72           HB1      TYR  72   2.136 -11.326 -11.326
  555   2HB   TYR  72           HB2      TYR  72   0.888 -12.544 -12.544
  556    HD1  TYR  72           HD1      TYR  72   2.603 -11.047 -11.047
  557    HD2  TYR  72           HD2      TYR  72  -1.004 -12.552 -12.552
  558    HE1  TYR  72           HE1      TYR  72   1.399 -10.445 -10.445
  559    HE2  TYR  72           HE2      TYR  72  -2.211 -11.946 -11.946
  560    HH   TYR  72           HH       TYR  72  -1.440  -9.895  -9.895
  561    H    ARG  73           HN       ARG  73   2.975 -13.299 -13.299
  562    HA   ARG  73           HA       ARG  73   1.417 -15.602 -15.602
  563   1HB   ARG  73           HB1      ARG  73   3.181 -13.695 -13.695
  564   2HB   ARG  73           HB2      ARG  73   2.398 -15.071 -15.071
  565   1HG   ARG  73           HG1      ARG  73   0.196 -14.089 -14.089
  566   2HG   ARG  73           HG2      ARG  73   1.152 -12.618 -12.618
  567   1HD   ARG  73           HD1      ARG  73   1.409 -12.430 -12.430
  568   2HD   ARG  73           HD2      ARG  73   0.936 -14.103 -14.103
  569    HE   ARG  73           HE       ARG  73  -1.378 -13.444 -13.444
  570   1HH1  ARG  73          HH11      ARG  73   0.317 -11.789 -11.789
  571   2HH1  ARG  73          HH12      ARG  73  -0.652 -10.354 -10.354
  572   1HH2  ARG  73          HH21      ARG  73  -2.390 -11.350 -11.350
  573   2HH2  ARG  73          HH22      ARG  73  -2.224 -10.098 -10.098
  574    H    ALA  74           HN       ALA  74   4.543 -15.118 -15.118
  575    HA   ALA  74           HA       ALA  74   5.703 -17.374 -17.374
  576   1HB   ALA  74           HB1      ALA  74   6.792 -15.752 -15.752
  577   2HB   ALA  74           HB2      ALA  74   7.720 -16.905 -16.905
  578   3HB   ALA  74           HB3      ALA  74   7.109 -15.450 -15.450
  579    H    LYS  75           HN       LYS  75   3.377 -17.801 -17.801
  580    HA   LYS  75           HA       LYS  75   2.282 -19.308 -19.308
  581   1HB   LYS  75           HB1      LYS  75   3.913 -20.889 -20.889
  582   2HB   LYS  75           HB2      LYS  75   4.928 -20.844 -20.844
  583   1HG   LYS  75           HG1      LYS  75   3.010 -21.644 -21.644
  584   2HG   LYS  75           HG2      LYS  75   1.959 -21.599 -21.599
  585   1HD   LYS  75           HD1      LYS  75   3.563 -23.273 -23.273
  586   2HD   LYS  75           HD2      LYS  75   4.392 -23.396 -23.396
  587   1HE   LYS  75           HE1      LYS  75   2.754 -25.220 -25.220
  588   2HE   LYS  75           HE2      LYS  75   2.202 -24.099 -24.099
  589   1HZ   LYS  75           HZ1      LYS  75   1.215 -23.237 -23.237
  590   2HZ   LYS  75           HZ2      LYS  75   0.889 -24.894 -24.894
  591   3HZ   LYS  75           HZ3      LYS  75   0.348 -23.810 -23.810
  592    H    GLY  76           HN       GLY  76   2.542 -17.324 -17.324
  593   1HA   GLY  76           HA1      GLY  76   3.799 -17.823 -17.823
  594   2HA   GLY  76           HA2      GLY  76   3.397 -16.220 -16.220
  595    H    LYS  77           HN       LYS  77   1.061 -16.486 -16.486
  596    HA   LYS  77           HA       LYS  77  -1.200 -16.271 -16.271
  597   1HB   LYS  77           HB1      LYS  77  -0.615 -19.031 -19.031
  598   2HB   LYS  77           HB2      LYS  77  -2.231 -18.497 -18.497
  599   1HG   LYS  77           HG1      LYS  77  -1.189 -18.026 -18.026
  600   2HG   LYS  77           HG2      LYS  77   0.076 -19.110 -19.110
  601   1HD   LYS  77           HD1      LYS  77  -2.891 -19.805 -19.805
  602   2HD   LYS  77           HD2      LYS  77  -1.717 -20.303 -20.303
  603   1HE   LYS  77           HE1      LYS  77  -1.612 -21.089 -21.089
  604   2HE   LYS  77           HE2      LYS  77  -2.206 -22.112 -22.112
  605   1HZ   LYS  77           HZ1      LYS  77   0.325 -21.151 -21.151
  606   2HZ   LYS  77           HZ2      LYS  77   0.400 -21.774 -21.774
  607   3HZ   LYS  77           HZ3      LYS  77  -0.166 -22.747 -22.747
  608    HA   PRO  78           HA       PRO  78  -2.064 -15.104 -15.104
  609   1HB   PRO  78           HB1      PRO  78  -4.701 -16.528 -16.528
  610   2HB   PRO  78           HB2      PRO  78  -4.380 -14.801 -14.801
  611   1HG   PRO  78           HG1      PRO  78  -5.415 -15.664 -15.664
  612   2HG   PRO  78           HG2      PRO  78  -4.081 -14.505 -14.505
  613   1HD   PRO  78           HD1      PRO  78  -3.850 -17.562 -17.562
  614   2HD   PRO  78           HD2      PRO  78  -3.285 -16.377 -16.377
  615    H    ASP  79           HN       ASP  79  -0.805 -17.870 -17.870
  616    HA   ASP  79           HA       ASP  79  -1.371 -18.833 -18.833
  617   1HB   ASP  79           HB1      ASP  79  -1.023 -21.204 -21.204
  618   2HB   ASP  79           HB2      ASP  79  -2.511 -20.385 -20.385
  619    H    ALA  80           HN       ALA  80   0.644 -17.088 -17.088
  620    HA   ALA  80           HA       ALA  80   3.079 -18.711 -18.711
  621   1HB   ALA  80           HB1      ALA  80   2.889 -16.325 -16.325
  622   2HB   ALA  80           HB2      ALA  80   4.378 -17.140 -17.140
  623   3HB   ALA  80           HB3      ALA  80   3.153 -17.995 -17.995
  624    H    ALA  81           HN       ALA  81   2.264 -15.294 -15.294
  625    HA   ALA  81           HA       ALA  81   3.129 -14.859 -14.859
  626   1HB   ALA  81           HB1      ALA  81   4.911 -14.123 -14.123
  627   2HB   ALA  81           HB2      ALA  81   3.764 -13.087 -13.087
  628   3HB   ALA  81           HB3      ALA  81   4.211 -12.745 -12.745
  629   1H1   BME  16           HE1      MER  16  -7.710  10.070  10.070
  630   2H1   BME  16           HE2      MER  16  -8.906   9.800   9.800
  631   1H2   BME  16           HZ1      MER  16  -8.448  12.236  12.236
  632   2H2   BME  16           HZ2      MER  16  -7.964  11.650  11.650
  633    HO1  BME  16           HH       MER  16  -6.425   9.991   9.991

  Start of MODEL    8
    1    H    ASN   3           HN       ASN   3   0.462 -10.346 -10.346
    2    HA   ASN   3           HA       ASN   3   1.477 -11.286 -11.286
    3   1HB   ASN   3           HB1      ASN   3  -0.416 -12.867 -12.867
    4   2HB   ASN   3           HB2      ASN   3  -0.095 -12.684 -12.684
    5   1HD2  ASN   3          HD21      ASN   3  -3.760 -11.912 -11.912
    6   2HD2  ASN   3          HD22      ASN   3  -2.588 -12.782 -12.782
    7    H    ALA   4           HN       ALA   4   1.890 -10.822 -10.822
    8    HA   ALA   4           HA       ALA   4   1.715 -10.061 -10.061
    9   1HB   ALA   4           HB1      ALA   4  -0.206 -11.662 -11.662
   10   2HB   ALA   4           HB2      ALA   4  -1.300 -10.406 -10.406
   11   3HB   ALA   4           HB3      ALA   4  -0.482 -10.226 -10.226
   12    HA   PRO   5           HA       PRO   5   0.964  -5.789  -5.789
   13   1HB   PRO   5           HB1      PRO   5   3.688  -5.544  -5.544
   14   2HB   PRO   5           HB2      PRO   5   3.095  -4.919  -4.919
   15   1HG   PRO   5           HG1      PRO   5   4.722  -7.054  -7.054
   16   2HG   PRO   5           HG2      PRO   5   3.283  -7.065  -7.065
   17   1HD   PRO   5           HD1      PRO   5   3.547  -8.311  -8.311
   18   2HD   PRO   5           HD2      PRO   5   3.034  -9.113  -9.113
   19    H    LYS   6           HN       LYS   6  -0.402  -4.974  -4.974
   20    HA   LYS   6           HA       LYS   6  -0.294  -5.516  -5.516
   21   1HB   LYS   6           HB1      LYS   6  -1.961  -3.610  -3.610
   22   2HB   LYS   6           HB2      LYS   6  -2.136  -3.706  -3.706
   23   1HG   LYS   6           HG1      LYS   6  -2.395  -6.330  -6.330
   24   2HG   LYS   6           HG2      LYS   6  -2.740  -5.781  -5.781
   25   1HD   LYS   6           HD1      LYS   6  -4.866  -6.019  -6.019
   26   2HD   LYS   6           HD2      LYS   6  -4.575  -4.308  -4.308
   27   1HE   LYS   6           HE1      LYS   6  -3.784  -5.653  -5.653
   28   2HE   LYS   6           HE2      LYS   6  -5.438  -5.137  -5.137
   29   1HZ   LYS   6           HZ1      LYS   6  -3.723  -3.035  -3.035
   30   2HZ   LYS   6           HZ2      LYS   6  -3.272  -3.610  -3.610
   31   3HZ   LYS   6           HZ3      LYS   6  -4.866  -3.104  -3.104
   32    H    ARG   7           HN       ARG   7  -0.872  -3.074  -3.074
   33    HA   ARG   7           HA       ARG   7   1.816  -1.970  -1.970
   34   1HB   ARG   7           HB1      ARG   7   1.038  -0.802  -0.802
   35   2HB   ARG   7           HB2      ARG   7   0.685  -2.513  -2.513
   36   1HG   ARG   7           HG1      ARG   7  -1.703  -1.819  -1.819
   37   2HG   ARG   7           HG2      ARG   7  -1.238  -0.204  -0.204
   38   1HD   ARG   7           HD1      ARG   7  -0.712  -1.135  -1.135
   39   2HD   ARG   7           HD2      ARG   7  -1.403  -2.662  -2.662
   40    HE   ARG   7           HE       ARG   7  -3.542  -1.400  -1.400
   41   1HH1  ARG   7          HH11      ARG   7  -1.608   1.034   1.034
   42   2HH1  ARG   7          HH12      ARG   7  -2.469   1.496   1.496
   43   1HH2  ARG   7          HH21      ARG   7  -4.456  -1.392  -1.392
   44   2HH2  ARG   7          HH22      ARG   7  -4.128   0.081   0.081
   45    HA   PRO   8           HA       PRO   8   0.545   0.885   0.885
   46   1HB   PRO   8           HB1      PRO   8   2.849   2.433   2.433
   47   2HB   PRO   8           HB2      PRO   8   2.760   0.786   0.786
   48   1HG   PRO   8           HG1      PRO   8   3.671   1.697   1.697
   49   2HG   PRO   8           HG2      PRO   8   4.550   0.689   0.689
   50   1HD   PRO   8           HD1      PRO   8   3.158  -0.493  -0.493
   51   2HD   PRO   8           HD2      PRO   8   3.025  -1.169  -1.169
   52    HA   PRO   9           HA       PRO   9  -0.785   5.142   5.142
   53   1HB   PRO   9           HB1      PRO   9   1.697   6.457   6.457
   54   2HB   PRO   9           HB2      PRO   9   0.134   6.420   6.420
   55   1HG   PRO   9           HG1      PRO   9   2.470   4.550   4.550
   56   2HG   PRO   9           HG2      PRO   9   1.306   5.134   5.134
   57   1HD   PRO   9           HD1      PRO   9   0.990   2.649   2.649
   58   2HD   PRO   9           HD2      PRO   9  -0.450   3.686   3.686
   59    H    SER  10           HN       SER  10  -0.261   7.089   7.089
   60    HA   SER  10           HA       SER  10   1.171   6.395   6.395
   61   1HB   SER  10           HB1      SER  10  -1.202   8.226   8.226
   62   2HB   SER  10           HB2      SER  10  -0.429   7.954   7.954
   63    HG   SER  10           HG       SER  10  -2.140   6.383   6.383
   64    H    ALA  11           HN       ALA  11   1.114   8.707   8.707
   65    HA   ALA  11           HA       ALA  11   3.180  10.070  10.070
   66   1HB   ALA  11           HB1      ALA  11   2.473  11.081  11.081
   67   2HB   ALA  11           HB2      ALA  11   3.756  11.710  11.710
   68   3HB   ALA  11           HB3      ALA  11   3.898  10.106  10.106
   69    H    PHE  12           HN       PHE  12   0.524  10.677  10.677
   70    HA   PHE  12           HA       PHE  12  -0.516  13.130  13.130
   71   1HB   PHE  12           HB1      PHE  12  -1.248  12.178  12.178
   72   2HB   PHE  12           HB2      PHE  12  -1.692  10.647  10.647
   73    HD1  PHE  12           HD1      PHE  12  -2.544  14.263  14.263
   74    HD2  PHE  12           HD2      PHE  12  -3.948  10.289  10.289
   75    HE1  PHE  12           HE1      PHE  12  -4.824  15.105  15.105
   76    HE2  PHE  12           HE2      PHE  12  -6.241  11.137  11.137
   77    HZ   PHE  12           HZ       PHE  12  -6.680  13.544  13.544
   78    H    PHE  13           HN       PHE  13  -0.747   9.869   9.869
   79    HA   PHE  13           HA       PHE  13  -2.934  10.016  10.016
   80   1HB   PHE  13           HB1      PHE  13  -1.508   7.980   7.980
   81   2HB   PHE  13           HB2      PHE  13  -0.415   8.474   8.474
   82    HD1  PHE  13           HD1      PHE  13  -3.918   7.535   7.535
   83    HD2  PHE  13           HD2      PHE  13  -1.015   8.030   8.030
   84    HE1  PHE  13           HE1      PHE  13  -5.457   6.514   6.514
   85    HE2  PHE  13           HE2      PHE  13  -2.558   7.006   7.006
   86    HZ   PHE  13           HZ       PHE  13  -4.780   6.244   6.244
   87    H    LEU  14           HN       LEU  14   0.496  10.510  10.510
   88    HA   LEU  14           HA       LEU  14   0.215  11.160  11.160
   89   1HB   LEU  14           HB1      LEU  14   2.160  12.488  12.488
   90   2HB   LEU  14           HB2      LEU  14   2.309  12.494  12.494
   91    HG   LEU  14           HG       LEU  14   3.883  10.976  10.976
   92   1HD1  LEU  14          HD11      LEU  14   2.624   9.937   9.937
   93   2HD1  LEU  14          HD12      LEU  14   1.523   9.182   9.182
   94   3HD1  LEU  14          HD13      LEU  14   3.217   8.717   8.717
   95   1HD2  LEU  14          HD21      LEU  14   3.394  10.806  10.806
   96   2HD2  LEU  14          HD22      LEU  14   3.669   9.205   9.205
   97   3HD2  LEU  14          HD23      LEU  14   2.037   9.724   9.724
   98    H    PHE  15           HN       PHE  15   0.362  13.517  13.517
   99    HA   PHE  15           HA       PHE  15  -0.354  15.708  15.708
  100   1HB   PHE  15           HB1      PHE  15   0.715  16.685  16.685
  101   2HB   PHE  15           HB2      PHE  15   0.594  15.174  15.174
  102    HD1  PHE  15           HD1      PHE  15  -1.668  14.787  14.787
  103    HD2  PHE  15           HD2      PHE  15  -0.199  18.619  18.619
  104    HE1  PHE  15           HE1      PHE  15  -3.062  15.835  15.835
  105    HE2  PHE  15           HE2      PHE  15  -1.620  19.669  19.669
  106    HZ   PHE  15           HZ       PHE  15  -3.049  18.266  18.266
  107    H    CYS  16           HN       MER  16  -2.355  13.707  13.707
  108    HA   CYS  16           HA       MER  16  -4.749  15.173  15.173
  109   1HB   CYS  16           HB1      MER  16  -4.788  13.355  13.355
  110   2HB   CYS  16           HB2      MER  16  -4.338  12.182  12.182
  111    H    SER  17           HN       SER  17  -3.394  12.617  12.617
  112    HA   SER  17           HA       SER  17  -5.500  12.342  12.342
  113   1HB   SER  17           HB1      SER  17  -3.419  10.921  10.921
  114   2HB   SER  17           HB2      SER  17  -2.502  12.269  12.269
  115    HG   SER  17           HG       SER  17  -4.087  10.540  10.540
  116    H    GLU  18           HN       GLU  18  -2.737  14.461  14.461
  117    HA   GLU  18           HA       GLU  18  -3.487  15.953  15.953
  118   1HB   GLU  18           HB1      GLU  18  -1.193  15.673  15.673
  119   2HB   GLU  18           HB2      GLU  18  -1.582  16.528  16.528
  120   1HG   GLU  18           HG1      GLU  18  -1.966  18.611  18.611
  121   2HG   GLU  18           HG2      GLU  18  -1.772  17.785  17.785
  122    H    TYR  19           HN       TYR  19  -4.808  16.036  16.036
  123    HA   TYR  19           HA       TYR  19  -5.559  18.908  18.908
  124   1HB   TYR  19           HB1      TYR  19  -5.406  16.830  16.830
  125   2HB   TYR  19           HB2      TYR  19  -6.701  18.043  18.043
  126    HD1  TYR  19           HD1      TYR  19  -3.120  18.189  18.189
  127    HD2  TYR  19           HD2      TYR  19  -6.116  19.690  19.690
  128    HE1  TYR  19           HE1      TYR  19  -1.525  19.815  19.815
  129    HE2  TYR  19           HE2      TYR  19  -4.527  21.320  21.320
  130    HH   TYR  19           HH       TYR  19  -1.993  22.347  22.347
  131    H    ARG  20           HN       ARG  20  -7.028  15.755  15.755
  132    HA   ARG  20           HA       ARG  20  -9.648  16.001  16.001
  133   1HB   ARG  20           HB1      ARG  20  -8.119  14.504  14.504
  134   2HB   ARG  20           HB2      ARG  20  -9.874  14.412  14.412
  135   1HG   ARG  20           HG1      ARG  20  -9.713  13.594  13.594
  136   2HG   ARG  20           HG2      ARG  20  -7.964  13.712  13.712
  137   1HD   ARG  20           HD1      ARG  20  -8.646  11.406  11.406
  138   2HD   ARG  20           HD2      ARG  20  -8.013  12.121  12.121
  139    HE   ARG  20           HE       ARG  20 -10.407  12.584  12.584
  140   1HH1  ARG  20          HH11      ARG  20  -9.558   9.928   9.928
  141   2HH1  ARG  20          HH12      ARG  20 -11.071   9.130   9.130
  142   1HH2  ARG  20          HH21      ARG  20 -12.372  11.667  11.667
  143   2HH2  ARG  20          HH22      ARG  20 -12.691  10.128  10.128
  144    HA   PRO  21           HA       PRO  21 -11.239  17.348  17.348
  145   1HB   PRO  21           HB1      PRO  21  -9.716  17.898  17.898
  146   2HB   PRO  21           HB2      PRO  21  -9.980  16.222  16.222
  147   1HG   PRO  21           HG1      PRO  21  -7.640  18.043  18.043
  148   2HG   PRO  21           HG2      PRO  21  -7.536  16.502  16.502
  149   1HD   PRO  21           HD1      PRO  21  -7.349  16.457  16.457
  150   2HD   PRO  21           HD2      PRO  21  -8.428  15.284  15.284
  151    H    LYS  22           HN       LYS  22  -8.816  19.036  19.036
  152    HA   LYS  22           HA       LYS  22  -9.324  21.689  21.689
  153   1HB   LYS  22           HB1      LYS  22  -7.075  20.559  20.559
  154   2HB   LYS  22           HB2      LYS  22  -7.601  21.017  21.017
  155   1HG   LYS  22           HG1      LYS  22  -7.156  22.931  22.931
  156   2HG   LYS  22           HG2      LYS  22  -6.024  22.622  22.622
  157   1HD   LYS  22           HD1      LYS  22  -8.383  23.311  23.311
  158   2HD   LYS  22           HD2      LYS  22  -8.410  24.362  24.362
  159   1HE   LYS  22           HE1      LYS  22  -6.137  24.083  24.083
  160   2HE   LYS  22           HE2      LYS  22  -7.191  25.474  25.474
  161   1HZ   LYS  22           HZ1      LYS  22  -6.043  24.906  24.906
  162   2HZ   LYS  22           HZ2      LYS  22  -4.805  24.900  24.900
  163   3HZ   LYS  22           HZ3      LYS  22  -5.800  26.263  26.263
  164    H    ILE  23           HN       ILE  23  -9.768  20.001  20.001
  165    HA   ILE  23           HA       ILE  23 -11.242  22.334  22.334
  166    HB   ILE  23           HB       ILE  23 -11.515  20.615  20.615
  167   1HG1  ILE  23          HG11      ILE  23  -8.920  19.551  19.551
  168   2HG1  ILE  23          HG12      ILE  23 -10.420  18.662  18.662
  169   1HG2  ILE  23          HG21      ILE  23 -10.276  22.737  22.737
  170   2HG2  ILE  23          HG22      ILE  23  -8.912  21.975  21.975
  171   3HG2  ILE  23          HG23      ILE  23  -9.335  21.520  21.520
  172   1HD1  ILE  23          HD11      ILE  23 -10.646  18.656  18.656
  173   2HD1  ILE  23          HD12      ILE  23  -9.100  19.471  19.471
  174   3HD1  ILE  23          HD13      ILE  23  -9.185  17.852  17.852
  175    H    LYS  24           HN       LYS  24 -11.649  19.248  19.248
  176    HA   LYS  24           HA       LYS  24 -14.390  18.738  18.738
  177   1HB   LYS  24           HB1      LYS  24 -12.630  17.111  17.111
  178   2HB   LYS  24           HB2      LYS  24 -12.574  17.852  17.852
  179   1HG   LYS  24           HG1      LYS  24 -15.146  17.284  17.284
  180   2HG   LYS  24           HG2      LYS  24 -14.854  16.214  16.214
  181   1HD   LYS  24           HD1      LYS  24 -13.538  16.097  16.097
  182   2HD   LYS  24           HD2      LYS  24 -14.685  14.950  14.950
  183   1HE   LYS  24           HE1      LYS  24 -11.867  15.433  15.433
  184   2HE   LYS  24           HE2      LYS  24 -12.397  14.036  14.036
  185   1HZ   LYS  24           HZ1      LYS  24 -14.109  14.354  14.354
  186   2HZ   LYS  24           HZ2      LYS  24 -12.508  14.438  14.438
  187   3HZ   LYS  24           HZ3      LYS  24 -13.026  13.086  13.086
  188    H    GLY  25           HN       GLY  25 -12.526  20.249  20.249
  189   1HA   GLY  25           HA1      GLY  25 -14.545  20.763  20.763
  190   2HA   GLY  25           HA2      GLY  25 -13.054  21.690  21.690
  191    H    GLU  26           HN       GLU  26 -13.294  22.692  22.692
  192    HA   GLU  26           HA       GLU  26 -15.048  24.923  24.923
  193   1HB   GLU  26           HB1      GLU  26 -13.495  24.044  24.044
  194   2HB   GLU  26           HB2      GLU  26 -14.141  25.648  25.648
  195   1HG   GLU  26           HG1      GLU  26 -12.208  24.407  24.407
  196   2HG   GLU  26           HG2      GLU  26 -11.606  25.191  25.191
  197    H    HIS  27           HN       HIS  27 -15.020  22.320  22.320
  198    HA   HIS  27           HA       HIS  27 -17.882  22.743  22.743
  199   1HB   HIS  27           HB1      HIS  27 -15.844  21.717  21.717
  200   2HB   HIS  27           HB2      HIS  27 -17.418  22.451  22.451
  201    HD1  HIS  27           HD1      HIS  27 -17.419  25.100  25.100
  202    HD2  HIS  27           HD2      HIS  27 -13.768  23.466  23.466
  203    HE1  HIS  27           HE1      HIS  27 -15.861  26.990  26.990
  204    HA   PRO  28           HA       PRO  28 -17.570  18.364  18.364
  205   1HB   PRO  28           HB1      PRO  28 -19.311  18.391  18.391
  206   2HB   PRO  28           HB2      PRO  28 -17.669  18.992  18.992
  207   1HG   PRO  28           HG1      PRO  28 -20.175  20.626  20.626
  208   2HG   PRO  28           HG2      PRO  28 -19.057  20.893  20.893
  209   1HD   PRO  28           HD1      PRO  28 -18.770  22.250  22.250
  210   2HD   PRO  28           HD2      PRO  28 -17.354  21.790  21.790
  211    H    GLY  29           HN       GLY  29 -18.778  19.699  19.699
  212   1HA   GLY  29           HA1      GLY  29 -21.297  18.204  18.204
  213   2HA   GLY  29           HA2      GLY  29 -21.313  19.917  19.917
  214    H    LEU  30           HN       LEU  30 -18.485  17.997  17.997
  215    HA   LEU  30           HA       LEU  30 -19.244  18.351  18.351
  216   1HB   LEU  30           HB1      LEU  30 -16.487  17.361  17.361
  217   2HB   LEU  30           HB2      LEU  30 -17.070  18.331  18.331
  218    HG   LEU  30           HG       LEU  30 -16.810  19.431  19.431
  219   1HD1  LEU  30          HD11      LEU  30 -14.623  18.797  18.797
  220   2HD1  LEU  30          HD12      LEU  30 -15.014  19.657  19.657
  221   3HD1  LEU  30          HD13      LEU  30 -14.775  20.539  20.539
  222   1HD2  LEU  30          HD21      LEU  30 -17.305  20.688  20.688
  223   2HD2  LEU  30          HD22      LEU  30 -18.514  20.555  20.555
  224   3HD2  LEU  30          HD23      LEU  30 -17.114  21.592  21.592
  225    H    SER  31           HN       SER  31 -17.285  15.989  15.989
  226    HA   SER  31           HA       SER  31 -18.355  13.650  13.650
  227   1HB   SER  31           HB1      SER  31 -18.552  13.913  13.913
  228   2HB   SER  31           HB2      SER  31 -18.433  12.333  12.333
  229    HG   SER  31           HG       SER  31 -20.415  12.534  12.534
  230    H    ILE  32           HN       ILE  32 -17.110  11.670  11.670
  231    HA   ILE  32           HA       ILE  32 -14.299  12.208  12.208
  232    HB   ILE  32           HB       ILE  32 -15.573  10.315  10.315
  233   1HG1  ILE  32          HG11      ILE  32 -13.894   8.522   8.522
  234   2HG1  ILE  32          HG12      ILE  32 -13.305   9.284   9.284
  235   1HG2  ILE  32          HG21      ILE  32 -17.039   9.745   9.745
  236   2HG2  ILE  32          HG22      ILE  32 -15.668   9.203   9.203
  237   3HG2  ILE  32          HG23      ILE  32 -16.145   8.319   8.319
  238   1HD1  ILE  32          HD11      ILE  32 -13.121  10.486  10.486
  239   2HD1  ILE  32          HD12      ILE  32 -11.800   9.751   9.751
  240   3HD1  ILE  32          HD13      ILE  32 -12.509  11.249  11.249
  241    H    GLY  33           HN       GLY  33 -16.204  12.286  12.286
  242   1HA   GLY  33           HA1      GLY  33 -14.195  11.418  11.418
  243   2HA   GLY  33           HA2      GLY  33 -15.912  11.674  11.674
  244    H    ASP  34           HN       ASP  34 -15.430  14.195  14.195
  245    HA   ASP  34           HA       ASP  34 -14.648  15.972  15.972
  246   1HB   ASP  34           HB1      ASP  34 -16.375  16.156  16.156
  247   2HB   ASP  34           HB2      ASP  34 -15.864  17.617  17.617
  248    H    VAL  35           HN       VAL  35 -14.258  15.309  15.309
  249    HA   VAL  35           HA       VAL  35 -12.256  17.292  17.292
  250    HB   VAL  35           HB       VAL  35 -13.115  14.686  14.686
  251   1HG1  VAL  35          HG11      VAL  35 -10.786  15.190  15.190
  252   2HG1  VAL  35          HG12      VAL  35 -11.282  16.806  16.806
  253   3HG1  VAL  35          HG13      VAL  35 -11.919  15.419  15.419
  254   1HG2  VAL  35          HG21      VAL  35 -14.831  16.470  16.470
  255   2HG2  VAL  35          HG22      VAL  35 -14.219  16.152  16.152
  256   3HG2  VAL  35          HG23      VAL  35 -13.673  17.571  17.571
  257    H    ALA  36           HN       ALA  36 -12.339  14.149  14.149
  258    HA   ALA  36           HA       ALA  36  -9.460  13.732  13.732
  259   1HB   ALA  36           HB1      ALA  36 -11.008  11.881  11.881
  260   2HB   ALA  36           HB2      ALA  36 -11.679  12.086  12.086
  261   3HB   ALA  36           HB3      ALA  36 -10.025  11.524  11.524
  262    H    LYS  37           HN       LYS  37 -11.973  14.263  14.263
  263    HA   LYS  37           HA       LYS  37 -10.019  14.076  14.076
  264   1HB   LYS  37           HB1      LYS  37 -12.440  13.631  13.631
  265   2HB   LYS  37           HB2      LYS  37 -12.779  15.346  15.346
  266   1HG   LYS  37           HG1      LYS  37 -11.449  15.961  15.961
  267   2HG   LYS  37           HG2      LYS  37 -10.807  14.328  14.328
  268   1HD   LYS  37           HD1      LYS  37 -13.153  13.534  13.534
  269   2HD   LYS  37           HD2      LYS  37 -13.688  15.206  15.206
  270   1HE   LYS  37           HE1      LYS  37 -11.518  14.142  14.142
  271   2HE   LYS  37           HE2      LYS  37 -13.187  14.393  14.393
  272   1HZ   LYS  37           HZ1      LYS  37 -12.246  16.735  16.735
  273   2HZ   LYS  37           HZ2      LYS  37 -11.112  16.246  16.246
  274   3HZ   LYS  37           HZ3      LYS  37 -12.731  16.494  16.494
  275    H    LYS  38           HN       LYS  38 -11.396  16.750  16.750
  276    HA   LYS  38           HA       LYS  38 -10.244  18.810  18.810
  277   1HB   LYS  38           HB1      LYS  38 -12.196  19.199  19.199
  278   2HB   LYS  38           HB2      LYS  38 -11.174  18.863  18.863
  279   1HG   LYS  38           HG1      LYS  38 -10.239  21.025  21.025
  280   2HG   LYS  38           HG2      LYS  38 -11.632  21.375  21.375
  281   1HD   LYS  38           HD1      LYS  38 -10.342  20.891  20.891
  282   2HD   LYS  38           HD2      LYS  38  -8.957  20.381  20.381
  283   1HE   LYS  38           HE1      LYS  38  -8.709  22.708  22.708
  284   2HE   LYS  38           HE2      LYS  38  -8.668  22.642  22.642
  285   1HZ   LYS  38           HZ1      LYS  38 -11.330  22.960  22.960
  286   2HZ   LYS  38           HZ2      LYS  38 -10.352  24.135  24.135
  287   3HZ   LYS  38           HZ3      LYS  38 -10.386  24.000  24.000
  288    H    LEU  39           HN       LEU  39  -9.258  17.386  17.386
  289    HA   LEU  39           HA       LEU  39  -6.825  18.928  18.928
  290   1HB   LEU  39           HB1      LEU  39  -6.916  18.227  18.227
  291   2HB   LEU  39           HB2      LEU  39  -8.378  17.389  17.389
  292    HG   LEU  39           HG       LEU  39  -6.866  15.490  15.490
  293   1HD1  LEU  39          HD11      LEU  39  -4.808  16.853  16.853
  294   2HD1  LEU  39          HD12      LEU  39  -5.093  17.079  17.079
  295   3HD1  LEU  39          HD13      LEU  39  -4.729  15.473  15.473
  296   1HD2  LEU  39          HD21      LEU  39  -7.049  16.254  16.254
  297   2HD2  LEU  39          HD22      LEU  39  -8.283  15.337  15.337
  298   3HD2  LEU  39          HD23      LEU  39  -6.691  14.666  14.666
  299    H    GLY  40           HN       GLY  40  -7.787  15.820  15.820
  300   1HA   GLY  40           HA1      GLY  40  -5.277  14.660  14.660
  301   2HA   GLY  40           HA2      GLY  40  -6.689  14.461  14.461
  302    H    GLU  41           HN       GLU  41  -7.157  17.001  17.001
  303    HA   GLU  41           HA       GLU  41  -5.354  17.381  17.381
  304   1HB   GLU  41           HB1      GLU  41  -7.369  19.123  19.123
  305   2HB   GLU  41           HB2      GLU  41  -6.571  19.594  19.594
  306   1HG   GLU  41           HG1      GLU  41  -7.520  17.677  17.677
  307   2HG   GLU  41           HG2      GLU  41  -8.135  16.969  16.969
  308    H    MET  42           HN       MET  42  -5.852  19.257  19.257
  309    HA   MET  42           HA       MET  42  -3.927  21.233  21.233
  310   1HB   MET  42           HB1      MET  42  -4.582  19.598  19.598
  311   2HB   MET  42           HB2      MET  42  -3.761  21.154  21.154
  312   1HG   MET  42           HG1      MET  42  -6.510  20.764  20.764
  313   2HG   MET  42           HG2      MET  42  -6.342  21.168  21.168
  314   1HE   MET  42           HE1      MET  42  -5.835  22.115  22.115
  315   2HE   MET  42           HE2      MET  42  -7.489  22.532  22.532
  316   3HE   MET  42           HE3      MET  42  -6.352  23.784  23.784
  317    H    TRP  43           HN       TRP  43  -3.510  18.064  18.064
  318    HA   TRP  43           HA       TRP  43  -0.822  17.977  17.977
  319   1HB   TRP  43           HB1      TRP  43  -2.344  16.228  16.228
  320   2HB   TRP  43           HB2      TRP  43  -2.662  15.884  15.884
  321    HD1  TRP  43           HD1      TRP  43  -1.241  14.102  14.102
  322    HE1  TRP  43           HE1      TRP  43   0.890  13.004  13.004
  323    HE3  TRP  43           HE3      TRP  43  -0.116  16.688  16.688
  324    HZ2  TRP  43           HZ2      TRP  43   2.929  13.102  13.102
  325    HZ3  TRP  43           HZ3      TRP  43   1.881  16.171  16.171
  326    HH2  TRP  43           HH2      TRP  43   3.429  14.386  14.386
  327    H    ASN  44           HN       ASN  44  -2.299  17.082  17.082
  328    HA   ASN  44           HA       ASN  44   0.068  16.464  16.464
  329   1HB   ASN  44           HB1      ASN  44  -2.481  17.705  17.705
  330   2HB   ASN  44           HB2      ASN  44  -1.229  16.861  16.861
  331   1HD2  ASN  44          HD21      ASN  44  -4.096  14.623  14.623
  332   2HD2  ASN  44          HD22      ASN  44  -4.225  16.255  16.255
  333    H    ASN  45           HN       ASN  45  -1.221  19.493  19.493
  334    HA   ASN  45           HA       ASN  45   1.036  20.945  20.945
  335   1HB   ASN  45           HB1      ASN  45  -1.546  22.397  22.397
  336   2HB   ASN  45           HB2      ASN  45  -0.402  22.678  22.678
  337   1HD2  ASN  45          HD21      ASN  45  -3.611  20.314  20.314
  338   2HD2  ASN  45          HD22      ASN  45  -3.325  21.241  21.241
  339    H    THR  46           HN       THR  46   1.131  19.832  19.832
  340    HA   THR  46           HA       THR  46   0.565  21.924  21.924
  341    HB   THR  46           HB       THR  46   0.832  19.460  19.460
  342    HG1  THR  46           HG1      THR  46   1.246  20.370  20.370
  343   1HG2  THR  46          HG21      THR  46   3.856  20.020  20.020
  344   2HG2  THR  46          HG22      THR  46   3.099  18.611  18.611
  345   3HG2  THR  46          HG23      THR  46   2.994  18.897  18.897
  346    H    ALA  47           HN       ALA  47   3.390  20.842  20.842
  347    HA   ALA  47           HA       ALA  47   4.645  23.291  23.291
  348   1HB   ALA  47           HB1      ALA  47   5.046  23.428  23.428
  349   2HB   ALA  47           HB2      ALA  47   5.871  21.885  21.885
  350   3HB   ALA  47           HB3      ALA  47   6.540  23.284  23.284
  351    H    ALA  48           HN       ALA  48   5.323  20.144  20.144
  352    HA   ALA  48           HA       ALA  48   6.034  18.167  18.167
  353   1HB   ALA  48           HB1      ALA  48   6.034  19.289  19.289
  354   2HB   ALA  48           HB2      ALA  48   7.583  20.027  20.027
  355   3HB   ALA  48           HB3      ALA  48   7.438  18.283  18.283
  356    H    ASP  49           HN       ASP  49   7.509  20.986  20.986
  357    HA   ASP  49           HA       ASP  49  10.036  19.755  19.755
  358   1HB   ASP  49           HB1      ASP  49   9.118  22.676  22.676
  359   2HB   ASP  49           HB2      ASP  49  10.757  22.107  22.107
  360    H    ASP  50           HN       ASP  50   6.933  20.170  20.170
  361    HA   ASP  50           HA       ASP  50   7.486  20.412  20.412
  362   1HB   ASP  50           HB1      ASP  50   6.013  22.236  22.236
  363   2HB   ASP  50           HB2      ASP  50   4.939  21.032  21.032
  364    H    LYS  51           HN       LYS  51   6.826  18.324  18.324
  365    HA   LYS  51           HA       LYS  51   5.037  16.503  16.503
  366   1HB   LYS  51           HB1      LYS  51   6.569  16.044  16.044
  367   2HB   LYS  51           HB2      LYS  51   5.420  14.925  14.925
  368   1HG   LYS  51           HG1      LYS  51   3.666  16.682  16.682
  369   2HG   LYS  51           HG2      LYS  51   4.830  17.662  17.662
  370   1HD   LYS  51           HD1      LYS  51   5.126  15.678  15.678
  371   2HD   LYS  51           HD2      LYS  51   3.831  14.862  14.862
  372   1HE   LYS  51           HE1      LYS  51   2.598  15.906  15.906
  373   2HE   LYS  51           HE2      LYS  51   2.535  17.104  17.104
  374   1HZ   LYS  51           HZ1      LYS  51   4.857  17.515  17.515
  375   2HZ   LYS  51           HZ2      LYS  51   3.548  17.407  17.407
  376   3HZ   LYS  51           HZ3      LYS  51   3.519  18.550  18.550
  377    H    GLN  52           HN       GLN  52   8.265  16.752  16.752
  378    HA   GLN  52           HA       GLN  52   9.702  14.651  14.651
  379   1HB   GLN  52           HB1      GLN  52  10.290  17.362  17.362
  380   2HB   GLN  52           HB2      GLN  52  10.903  17.029  17.029
  381   1HG   GLN  52           HG1      GLN  52  12.706  16.674  16.674
  382   2HG   GLN  52           HG2      GLN  52  12.226  15.105  15.105
  383   1HE2  GLN  52          HE21      GLN  52  10.414  15.252  15.252
  384   2HE2  GLN  52          HE22      GLN  52   9.779  15.987  15.987
  385    HA   PRO  53           HA       PRO  53   9.986  15.113  15.113
  386   1HB   PRO  53           HB1      PRO  53   7.688  16.349  16.349
  387   2HB   PRO  53           HB2      PRO  53   9.264  17.121  17.121
  388   1HG   PRO  53           HG1      PRO  53   6.945  17.092  17.092
  389   2HG   PRO  53           HG2      PRO  53   7.824  18.501  18.501
  390   1HD   PRO  53           HD1      PRO  53   8.603  17.556  17.556
  391   2HD   PRO  53           HD2      PRO  53   9.884  17.800  17.800
  392    H    TYR  54           HN       TYR  54   6.728  15.054  15.054
  393    HA   TYR  54           HA       TYR  54   5.813  12.812  12.812
  394   1HB   TYR  54           HB1      TYR  54   4.683  14.095  14.095
  395   2HB   TYR  54           HB2      TYR  54   3.829  12.902  12.902
  396    HD1  TYR  54           HD1      TYR  54   4.046  13.635  13.635
  397    HD2  TYR  54           HD2      TYR  54   3.959  16.281  16.281
  398    HE1  TYR  54           HE1      TYR  54   3.236  15.433  15.433
  399    HE2  TYR  54           HE2      TYR  54   3.150  18.080  18.080
  400    HH   TYR  54           HH       TYR  54   1.738  17.987  17.987
  401    H    GLU  55           HN       GLU  55   6.646  13.245  13.245
  402    HA   GLU  55           HA       GLU  55   6.286  10.646  10.646
  403   1HB   GLU  55           HB1      GLU  55   7.483  13.120  13.120
  404   2HB   GLU  55           HB2      GLU  55   8.625  11.868  11.868
  405   1HG   GLU  55           HG1      GLU  55   6.713  10.598  10.598
  406   2HG   GLU  55           HG2      GLU  55   5.667  11.961  11.961
  407    H    LYS  56           HN       LYS  56   9.312  11.982  11.982
  408    HA   LYS  56           HA       LYS  56  10.999   9.809   9.809
  409   1HB   LYS  56           HB1      LYS  56  11.753  12.030  12.030
  410   2HB   LYS  56           HB2      LYS  56  10.746  11.985  11.985
  411   1HG   LYS  56           HG1      LYS  56  12.145  10.246  10.246
  412   2HG   LYS  56           HG2      LYS  56  13.097  10.097  10.097
  413   1HD   LYS  56           HD1      LYS  56  13.912  12.419  12.419
  414   2HD   LYS  56           HD2      LYS  56  12.852  12.684  12.684
  415   1HE   LYS  56           HE1      LYS  56  15.082  10.602  10.602
  416   2HE   LYS  56           HE2      LYS  56  15.230  12.206  12.206
  417   1HZ   LYS  56           HZ1      LYS  56  12.888  11.053  11.053
  418   2HZ   LYS  56           HZ2      LYS  56  14.135   9.913   9.913
  419   3HZ   LYS  56           HZ3      LYS  56  14.299  11.463  11.463
  420    H    LYS  57           HN       LYS  57   8.499  10.442  10.442
  421    HA   LYS  57           HA       LYS  57   9.157   8.299   8.299
  422   1HB   LYS  57           HB1      LYS  57   7.363  10.462  10.462
  423   2HB   LYS  57           HB2      LYS  57   6.274   9.107   9.107
  424   1HG   LYS  57           HG1      LYS  57   8.309   9.552   9.552
  425   2HG   LYS  57           HG2      LYS  57   6.566   9.610   9.610
  426   1HD   LYS  57           HD1      LYS  57   6.490   7.143   7.143
  427   2HD   LYS  57           HD2      LYS  57   8.245   7.124   7.124
  428   1HE   LYS  57           HE1      LYS  57   7.442   6.364   6.364
  429   2HE   LYS  57           HE2      LYS  57   8.206   7.934   7.934
  430   1HZ   LYS  57           HZ1      LYS  57   5.513   8.340   8.340
  431   2HZ   LYS  57           HZ2      LYS  57   5.600   7.199   7.199
  432   3HZ   LYS  57           HZ3      LYS  57   6.338   8.717   8.717
  433    H    ALA  58           HN       ALA  58   6.572   8.707   8.707
  434    HA   ALA  58           HA       ALA  58   5.410   6.215   6.215
  435   1HB   ALA  58           HB1      ALA  58   4.718   8.105   8.105
  436   2HB   ALA  58           HB2      ALA  58   6.171   7.913   7.913
  437   3HB   ALA  58           HB3      ALA  58   4.955   6.651   6.651
  438    H    ALA  59           HN       ALA  59   8.270   7.167   7.167
  439    HA   ALA  59           HA       ALA  59   8.943   4.811   4.811
  440   1HB   ALA  59           HB1      ALA  59  10.182   6.954   6.954
  441   2HB   ALA  59           HB2      ALA  59  10.869   6.780   6.780
  442   3HB   ALA  59           HB3      ALA  59  11.303   5.647   5.647
  443    H    LYS  60           HN       LYS  60  10.285   5.790   5.790
  444    HA   LYS  60           HA       LYS  60  11.669   3.577   3.577
  445   1HB   LYS  60           HB1      LYS  60  11.155   5.896   5.896
  446   2HB   LYS  60           HB2      LYS  60   9.865   5.022   5.022
  447   1HG   LYS  60           HG1      LYS  60  11.704   4.799   4.799
  448   2HG   LYS  60           HG2      LYS  60  11.632   3.256   3.256
  449   1HD   LYS  60           HD1      LYS  60  13.959   3.881   3.881
  450   2HD   LYS  60           HD2      LYS  60  13.405   4.180   4.180
  451   1HE   LYS  60           HE1      LYS  60  14.722   6.108   6.108
  452   2HE   LYS  60           HE2      LYS  60  13.049   6.630   6.630
  453   1HZ   LYS  60           HZ1      LYS  60  13.538   5.571   5.571
  454   2HZ   LYS  60           HZ2      LYS  60  14.757   6.692   6.692
  455   3HZ   LYS  60           HZ3      LYS  60  13.127   7.162   7.162
  456    H    LEU  61           HN       LEU  61   8.210   4.085   4.085
  457    HA   LEU  61           HA       LEU  61   7.723   1.570   1.570
  458   1HB   LEU  61           HB1      LEU  61   5.774   3.210   3.210
  459   2HB   LEU  61           HB2      LEU  61   5.352   2.066   2.066
  460    HG   LEU  61           HG       LEU  61   6.890   4.685   4.685
  461   1HD1  LEU  61          HD11      LEU  61   4.192   3.788   3.788
  462   2HD1  LEU  61          HD12      LEU  61   4.978   5.319   5.319
  463   3HD1  LEU  61          HD13      LEU  61   4.510   4.963   4.963
  464   1HD2  LEU  61          HD21      LEU  61   6.277   2.589   2.589
  465   2HD2  LEU  61          HD22      LEU  61   7.874   3.001   3.001
  466   3HD2  LEU  61          HD23      LEU  61   6.957   4.184   4.184
  467    H    LYS  62           HN       LYS  62   7.097   2.467   2.467
  468    HA   LYS  62           HA       LYS  62   6.304   0.035   0.035
  469   1HB   LYS  62           HB1      LYS  62   6.746   2.139   2.139
  470   2HB   LYS  62           HB2      LYS  62   8.464   1.843   1.843
  471   1HG   LYS  62           HG1      LYS  62   7.900  -0.525  -0.525
  472   2HG   LYS  62           HG2      LYS  62   6.407   0.238   0.238
  473   1HD   LYS  62           HD1      LYS  62   7.770   2.074   2.074
  474   2HD   LYS  62           HD2      LYS  62   9.224   1.197   1.197
  475   1HE   LYS  62           HE1      LYS  62   7.018   0.173   0.173
  476   2HE   LYS  62           HE2      LYS  62   8.626   0.683   0.683
  477   1HZ   LYS  62           HZ1      LYS  62   8.916  -1.254  -1.254
  478   2HZ   LYS  62           HZ2      LYS  62   7.802  -1.840  -1.840
  479   3HZ   LYS  62           HZ3      LYS  62   9.345  -1.347  -1.347
  480    H    GLU  63           HN       GLU  63   9.557   1.089   1.089
  481    HA   GLU  63           HA       GLU  63  11.022  -1.161  -1.161
  482   1HB   GLU  63           HB1      GLU  63  11.761   1.306   1.306
  483   2HB   GLU  63           HB2      GLU  63  11.721   0.823   0.823
  484   1HG   GLU  63           HG1      GLU  63  13.503  -0.550  -0.550
  485   2HG   GLU  63           HG2      GLU  63  13.994   0.837   0.837
  486    H    LYS  64           HN       LYS  64   9.954  -0.266  -0.266
  487    HA   LYS  64           HA       LYS  64  10.865  -2.572  -2.572
  488   1HB   LYS  64           HB1      LYS  64   9.714  -0.496  -0.496
  489   2HB   LYS  64           HB2      LYS  64   8.189  -1.256  -1.256
  490   1HG   LYS  64           HG1      LYS  64   8.847  -3.297  -3.297
  491   2HG   LYS  64           HG2      LYS  64  10.348  -2.510  -2.510
  492   1HD   LYS  64           HD1      LYS  64   8.856  -2.296  -2.296
  493   2HD   LYS  64           HD2      LYS  64   9.074  -0.710  -0.710
  494   1HE   LYS  64           HE1      LYS  64   6.699  -2.463  -2.463
  495   2HE   LYS  64           HE2      LYS  64   6.656  -1.362  -1.362
  496   1HZ   LYS  64           HZ1      LYS  64   7.629   0.041   0.041
  497   2HZ   LYS  64           HZ2      LYS  64   6.227  -0.785  -0.785
  498   3HZ   LYS  64           HZ3      LYS  64   6.179   0.271   0.271
  499    H    TYR  65           HN       TYR  65   7.759  -2.060  -2.060
  500    HA   TYR  65           HA       TYR  65   6.457  -4.481  -4.481
  501   1HB   TYR  65           HB1      TYR  65   5.178  -2.798  -2.798
  502   2HB   TYR  65           HB2      TYR  65   6.456  -2.416  -2.416
  503    HD1  TYR  65           HD1      TYR  65   5.095  -5.833  -5.833
  504    HD2  TYR  65           HD2      TYR  65   5.110  -2.419  -2.419
  505    HE1  TYR  65           HE1      TYR  65   3.927  -7.096  -7.096
  506    HE2  TYR  65           HE2      TYR  65   3.934  -3.697  -3.697
  507    HH   TYR  65           HH       TYR  65   3.801  -6.376  -6.376
  508    H    GLU  66           HN       GLU  66   8.218  -3.728  -3.728
  509    HA   GLU  66           HA       GLU  66   8.265  -6.160  -6.160
  510   1HB   GLU  66           HB1      GLU  66  10.539  -4.218  -4.218
  511   2HB   GLU  66           HB2      GLU  66  10.412  -5.465  -5.465
  512   1HG   GLU  66           HG1      GLU  66   8.032  -3.630  -3.630
  513   2HG   GLU  66           HG2      GLU  66   9.481  -2.883  -2.883
  514    H    LYS  67           HN       LYS  67  10.199  -5.294  -5.294
  515    HA   LYS  67           HA       LYS  67  11.916  -7.652  -7.652
  516   1HB   LYS  67           HB1      LYS  67  11.785  -5.252  -5.252
  517   2HB   LYS  67           HB2      LYS  67  12.587  -6.666  -6.666
  518   1HG   LYS  67           HG1      LYS  67  14.147  -5.137  -5.137
  519   2HG   LYS  67           HG2      LYS  67  14.134  -6.717  -6.717
  520   1HD   LYS  67           HD1      LYS  67  12.773  -5.849  -5.849
  521   2HD   LYS  67           HD2      LYS  67  12.598  -4.304  -4.304
  522   1HE   LYS  67           HE1      LYS  67  15.135  -4.052  -4.052
  523   2HE   LYS  67           HE2      LYS  67  15.176  -5.548  -5.548
  524   1HZ   LYS  67           HZ1      LYS  67  13.254  -3.896  -3.896
  525   2HZ   LYS  67           HZ2      LYS  67  14.651  -2.962  -2.962
  526   3HZ   LYS  67           HZ3      LYS  67  14.739  -4.403  -4.403
  527    H    ASP  68           HN       ASP  68   9.320  -6.633  -6.633
  528    HA   ASP  68           HA       ASP  68   9.423  -8.914  -8.914
  529   1HB   ASP  68           HB1      ASP  68   7.519  -6.601  -6.601
  530   2HB   ASP  68           HB2      ASP  68   7.240  -7.909  -7.909
  531    H    ILE  69           HN       ILE  69   8.101  -8.121  -8.121
  532    HA   ILE  69           HA       ILE  69   5.952 -10.153 -10.153
  533    HB   ILE  69           HB       ILE  69   5.844  -7.850  -7.850
  534   1HG1  ILE  69          HG11      ILE  69   3.956  -8.917  -8.917
  535   2HG1  ILE  69          HG12      ILE  69   4.625  -8.923  -8.923
  536   1HG2  ILE  69          HG21      ILE  69   7.890  -7.989  -7.989
  537   2HG2  ILE  69          HG22      ILE  69   7.303  -9.342  -9.342
  538   3HG2  ILE  69          HG23      ILE  69   6.550  -7.756  -7.756
  539   1HD1  ILE  69          HD11      ILE  69   5.445 -11.242 -11.242
  540   2HD1  ILE  69          HD12      ILE  69   4.692 -11.239 -11.239
  541   3HD1  ILE  69          HD13      ILE  69   3.694 -11.118 -11.118
  542    H    ALA  70           HN       ALA  70   8.976  -9.423  -9.423
  543    HA   ALA  70           HA       ALA  70   9.278 -11.828 -11.828
  544   1HB   ALA  70           HB1      ALA  70  11.473 -10.068 -10.068
  545   2HB   ALA  70           HB2      ALA  70  11.725 -11.281 -11.281
  546   3HB   ALA  70           HB3      ALA  70  10.782  -9.852  -9.852
  547    H    ALA  71           HN       ALA  71   9.660 -10.951 -10.951
  548    HA   ALA  71           HA       ALA  71  11.055 -13.379 -13.379
  549   1HB   ALA  71           HB1      ALA  71   9.788 -11.137 -11.137
  550   2HB   ALA  71           HB2      ALA  71  10.800 -12.415 -12.415
  551   3HB   ALA  71           HB3      ALA  71  11.480 -11.240 -11.240
  552    H    TYR  72           HN       TYR  72   7.867 -11.948 -11.948
  553    HA   TYR  72           HA       TYR  72   6.433 -13.771 -13.771
  554   1HB   TYR  72           HB1      TYR  72   5.495 -11.685 -11.685
  555   2HB   TYR  72           HB2      TYR  72   5.567 -12.269 -12.269
  556    HD1  TYR  72           HD1      TYR  72   4.129 -13.326 -13.326
  557    HD2  TYR  72           HD2      TYR  72   3.618 -13.087 -13.087
  558    HE1  TYR  72           HE1      TYR  72   1.880 -14.268 -14.268
  559    HE2  TYR  72           HE2      TYR  72   1.369 -14.032 -14.032
  560    HH   TYR  72           HH       TYR  72  -0.413 -14.020 -14.020
  561    H    ARG  73           HN       ARG  73   7.019 -13.771 -13.771
  562    HA   ARG  73           HA       ARG  73   5.736 -16.277 -16.277
  563   1HB   ARG  73           HB1      ARG  73   7.663 -14.545 -14.545
  564   2HB   ARG  73           HB2      ARG  73   6.918 -15.995 -15.995
  565   1HG   ARG  73           HG1      ARG  73   4.646 -14.948 -14.948
  566   2HG   ARG  73           HG2      ARG  73   5.504 -13.465 -13.465
  567   1HD   ARG  73           HD1      ARG  73   5.721 -14.899 -14.899
  568   2HD   ARG  73           HD2      ARG  73   4.610 -13.570 -13.570
  569    HE   ARG  73           HE       ARG  73   7.575 -13.259 -13.259
  570   1HH1  ARG  73          HH11      ARG  73   4.740 -11.522 -11.522
  571   2HH1  ARG  73          HH12      ARG  73   5.231 -10.341 -10.341
  572   1HH2  ARG  73          HH21      ARG  73   8.118 -12.098 -12.098
  573   2HH2  ARG  73          HH22      ARG  73   7.175 -10.679 -10.679
  574    H    ALA  74           HN       ALA  74   8.903 -15.205 -15.205
  575    HA   ALA  74           HA       ALA  74  10.311 -17.600 -17.600
  576   1HB   ALA  74           HB1      ALA  74  11.421 -15.431 -15.431
  577   2HB   ALA  74           HB2      ALA  74  11.041 -15.465 -15.465
  578   3HB   ALA  74           HB3      ALA  74  12.148 -16.645 -16.645
  579    H    LYS  75           HN       LYS  75   7.952 -17.350 -17.350
  580    HA   LYS  75           HA       LYS  75   9.112 -19.420 -19.420
  581   1HB   LYS  75           HB1      LYS  75   8.731 -17.223 -17.223
  582   2HB   LYS  75           HB2      LYS  75   7.043 -17.264 -17.264
  583   1HG   LYS  75           HG1      LYS  75   6.639 -19.292 -19.292
  584   2HG   LYS  75           HG2      LYS  75   8.345 -19.467 -19.467
  585   1HD   LYS  75           HD1      LYS  75   6.622 -17.120 -17.120
  586   2HD   LYS  75           HD2      LYS  75   7.021 -18.513 -18.513
  587   1HE   LYS  75           HE1      LYS  75   9.470 -17.976 -17.976
  588   2HE   LYS  75           HE2      LYS  75   9.030 -16.523 -16.523
  589   1HZ   LYS  75           HZ1      LYS  75   7.580 -16.560 -16.560
  590   2HZ   LYS  75           HZ2      LYS  75   9.210 -16.872 -16.872
  591   3HZ   LYS  75           HZ3      LYS  75   8.785 -15.474 -15.474
  592    H    GLY  76           HN       GLY  76   5.976 -18.070 -18.070
  593   1HA   GLY  76           HA1      GLY  76   4.288 -19.227 -19.227
  594   2HA   GLY  76           HA2      GLY  76   5.065 -20.757 -20.757
  595    H    LYS  77           HN       LYS  77   4.214 -18.026 -18.026
  596    HA   LYS  77           HA       LYS  77   2.828 -17.691 -17.691
  597   1HB   LYS  77           HB1      LYS  77   1.410 -20.280 -20.280
  598   2HB   LYS  77           HB2      LYS  77   0.749 -19.053 -19.053
  599   1HG   LYS  77           HG1      LYS  77   0.899 -17.369 -17.369
  600   2HG   LYS  77           HG2      LYS  77   1.559 -18.573 -18.573
  601   1HD   LYS  77           HD1      LYS  77  -0.504 -19.941 -19.941
  602   2HD   LYS  77           HD2      LYS  77  -1.192 -18.741 -18.741
  603   1HE   LYS  77           HE1      LYS  77  -2.077 -18.334 -18.334
  604   2HE   LYS  77           HE2      LYS  77  -0.935 -17.046 -17.046
  605   1HZ   LYS  77           HZ1      LYS  77   0.504 -19.145 -19.145
  606   2HZ   LYS  77           HZ2      LYS  77  -0.870 -18.899 -18.899
  607   3HZ   LYS  77           HZ3      LYS  77   0.196 -17.611 -17.611
  608    HA   PRO  78           HA       PRO  78   4.377 -20.073 -20.073
  609   1HB   PRO  78           HB1      PRO  78   1.570 -20.239 -20.239
  610   2HB   PRO  78           HB2      PRO  78   3.069 -19.680 -19.680
  611   1HG   PRO  78           HG1      PRO  78   1.302 -17.854 -17.854
  612   2HG   PRO  78           HG2      PRO  78   3.009 -17.592 -17.592
  613   1HD   PRO  78           HD1      PRO  78   0.869 -18.852 -18.852
  614   2HD   PRO  78           HD2      PRO  78   1.964 -17.524 -17.524
  615    H    ASP  79           HN       ASP  79   1.320 -21.438 -21.438
  616    HA   ASP  79           HA       ASP  79   2.525 -24.163 -24.163
  617   1HB   ASP  79           HB1      ASP  79  -0.381 -23.343 -23.343
  618   2HB   ASP  79           HB2      ASP  79   0.187 -24.999 -24.999
  619    H    ALA  80           HN       ALA  80   3.280 -23.965 -23.965
  620    HA   ALA  80           HA       ALA  80   2.270 -23.412 -23.412
  621   1HB   ALA  80           HB1      ALA  80   3.583 -26.087 -26.087
  622   2HB   ALA  80           HB2      ALA  80   3.470 -25.380 -25.380
  623   3HB   ALA  80           HB3      ALA  80   4.413 -24.580 -24.580
  624    H    ALA  81           HN       ALA  81   1.283 -26.253 -26.253
  625    HA   ALA  81           HA       ALA  81  -0.657 -27.120 -27.120
  626   1HB   ALA  81           HB1      ALA  81   0.625 -28.801 -28.801
  627   2HB   ALA  81           HB2      ALA  81  -0.077 -28.174 -28.174
  628   3HB   ALA  81           HB3      ALA  81  -1.100 -28.967 -28.967
  629   1H1   BME  16           HE1      MER  16  -6.725   8.159   8.159
  630   2H1   BME  16           HE2      MER  16  -8.208   7.822   7.822
  631   1H2   BME  16           HZ1      MER  16  -7.039   9.788   9.788
  632   2H2   BME  16           HZ2      MER  16  -8.608  10.214  10.214
  633    HO1  BME  16           HH       MER  16  -9.274   8.258   8.258

  Start of MODEL    9
    1    H    ASN   3           HN       ASN   3   1.805  -9.073  -9.073
    2    HA   ASN   3           HA       ASN   3   1.952 -11.686 -11.686
    3   1HB   ASN   3           HB1      ASN   3   0.561 -11.638 -11.638
    4   2HB   ASN   3           HB2      ASN   3  -0.425 -10.356 -10.356
    5   1HD2  ASN   3          HD21      ASN   3  -2.491 -12.672 -12.672
    6   2HD2  ASN   3          HD22      ASN   3  -2.310 -11.140 -11.140
    7    H    ALA   4           HN       ALA   4   2.574 -10.672 -10.672
    8    HA   ALA   4           HA       ALA   4   2.237  -9.853  -9.853
    9   1HB   ALA   4           HB1      ALA   4   0.341 -11.444 -11.444
   10   2HB   ALA   4           HB2      ALA   4  -0.719 -10.229 -10.229
   11   3HB   ALA   4           HB3      ALA   4  -0.066  -9.998  -9.998
   12    HA   PRO   5           HA       PRO   5   1.610  -5.580  -5.580
   13   1HB   PRO   5           HB1      PRO   5   4.173  -5.296  -5.296
   14   2HB   PRO   5           HB2      PRO   5   3.763  -4.654  -4.654
   15   1HG   PRO   5           HG1      PRO   5   5.380  -6.787  -6.787
   16   2HG   PRO   5           HG2      PRO   5   4.061  -6.799  -6.799
   17   1HD   PRO   5           HD1      PRO   5   4.044  -8.085  -8.085
   18   2HD   PRO   5           HD2      PRO   5   3.656  -8.826  -8.826
   19    H    LYS   6           HN       LYS   6  -0.112  -5.079  -5.079
   20    HA   LYS   6           HA       LYS   6  -0.232  -5.229  -5.229
   21   1HB   LYS   6           HB1      LYS   6  -2.153  -4.973  -4.973
   22   2HB   LYS   6           HB2      LYS   6  -1.868  -3.255  -3.255
   23   1HG   LYS   6           HG1      LYS   6  -2.308  -3.477  -3.477
   24   2HG   LYS   6           HG2      LYS   6  -2.647  -5.184  -5.184
   25   1HD   LYS   6           HD1      LYS   6  -4.428  -4.443  -4.443
   26   2HD   LYS   6           HD2      LYS   6  -4.200  -2.814  -2.814
   27   1HE   LYS   6           HE1      LYS   6  -5.116  -5.219  -5.219
   28   2HE   LYS   6           HE2      LYS   6  -6.112  -3.864  -3.864
   29   1HZ   LYS   6           HZ1      LYS   6  -3.884  -2.846  -2.846
   30   2HZ   LYS   6           HZ2      LYS   6  -4.538  -4.100  -4.100
   31   3HZ   LYS   6           HZ3      LYS   6  -5.516  -2.799  -2.799
   32    H    ARG   7           HN       ARG   7  -0.233  -3.274  -3.274
   33    HA   ARG   7           HA       ARG   7   2.101  -1.825  -1.825
   34   1HB   ARG   7           HB1      ARG   7   0.943  -2.183  -2.183
   35   2HB   ARG   7           HB2      ARG   7  -0.243  -0.967  -0.967
   36   1HG   ARG   7           HG1      ARG   7   1.495   0.767   0.767
   37   2HG   ARG   7           HG2      ARG   7   2.767  -0.425  -0.425
   38   1HD   ARG   7           HD1      ARG   7   1.729  -0.975  -0.975
   39   2HD   ARG   7           HD2      ARG   7   0.668   0.415   0.415
   40    HE   ARG   7           HE       ARG   7   2.723   1.834   1.834
   41   1HH1  ARG   7          HH11      ARG   7   5.438  -0.394  -0.394
   42   2HH1  ARG   7          HH12      ARG   7   4.830  -0.111  -0.111
   43   1HH2  ARG   7          HH21      ARG   7   2.601   0.959   0.959
   44   2HH2  ARG   7          HH22      ARG   7   4.145   0.227   0.227
   45    HA   PRO   8           HA       PRO   8   0.688   0.778   0.778
   46   1HB   PRO   8           HB1      PRO   8   2.948   2.389   2.389
   47   2HB   PRO   8           HB2      PRO   8   2.886   0.710   0.710
   48   1HG   PRO   8           HG1      PRO   8   3.816   1.796   1.796
   49   2HG   PRO   8           HG2      PRO   8   4.711   0.748   0.748
   50   1HD   PRO   8           HD1      PRO   8   3.389  -0.354  -0.354
   51   2HD   PRO   8           HD2      PRO   8   3.230  -1.127  -1.127
   52    HA   PRO   9           HA       PRO   9  -0.777   5.025   5.025
   53   1HB   PRO   9           HB1      PRO   9   1.516   6.450   6.450
   54   2HB   PRO   9           HB2      PRO   9  -0.071   6.195   6.195
   55   1HG   PRO   9           HG1      PRO   9   2.433   4.494   4.494
   56   2HG   PRO   9           HG2      PRO   9   1.235   4.900   4.900
   57   1HD   PRO   9           HD1      PRO   9   1.087   2.474   2.474
   58   2HD   PRO   9           HD2      PRO   9  -0.418   3.412   3.412
   59    H    SER  10           HN       SER  10  -0.112   7.164   7.164
   60    HA   SER  10           HA       SER  10   1.405   6.682   6.682
   61   1HB   SER  10           HB1      SER  10  -0.836   8.662   8.662
   62   2HB   SER  10           HB2      SER  10  -0.050   8.412   8.412
   63    HG   SER  10           HG       SER  10  -1.246   6.726   6.726
   64    H    ALA  11           HN       ALA  11   0.782   9.181   9.181
   65    HA   ALA  11           HA       ALA  11   3.006  10.333  10.333
   66   1HB   ALA  11           HB1      ALA  11   2.490  11.500  11.500
   67   2HB   ALA  11           HB2      ALA  11   3.664  12.119  12.119
   68   3HB   ALA  11           HB3      ALA  11   3.928  10.572  10.572
   69    H    PHE  12           HN       PHE  12   0.414  10.879  10.879
   70    HA   PHE  12           HA       PHE  12  -0.781  13.279  13.279
   71   1HB   PHE  12           HB1      PHE  12  -1.196  12.684  12.684
   72   2HB   PHE  12           HB2      PHE  12  -1.462  10.973  10.973
   73    HD1  PHE  12           HD1      PHE  12  -3.012  14.279  14.279
   74    HD2  PHE  12           HD2      PHE  12  -3.590  10.228  10.228
   75    HE1  PHE  12           HE1      PHE  12  -5.435  14.618  14.618
   76    HE2  PHE  12           HE2      PHE  12  -6.020  10.572  10.572
   77    HZ   PHE  12           HZ       PHE  12  -6.945  12.765  12.765
   78    H    PHE  13           HN       PHE  13  -0.465  10.276  10.276
   79    HA   PHE  13           HA       PHE  13  -3.121  10.272  10.272
   80   1HB   PHE  13           HB1      PHE  13  -1.767   8.179   8.179
   81   2HB   PHE  13           HB2      PHE  13  -0.950   8.307   8.307
   82    HD1  PHE  13           HD1      PHE  13  -2.563   8.543   8.543
   83    HD2  PHE  13           HD2      PHE  13  -3.827   7.088   7.088
   84    HE1  PHE  13           HE1      PHE  13  -4.534   7.518   7.518
   85    HE2  PHE  13           HE2      PHE  13  -5.799   6.067   6.067
   86    HZ   PHE  13           HZ       PHE  13  -6.154   6.281   6.281
   87    H    LEU  14           HN       LEU  14   0.370  10.450  10.450
   88    HA   LEU  14           HA       LEU  14   0.077  10.838  10.838
   89   1HB   LEU  14           HB1      LEU  14   2.047  12.319  12.319
   90   2HB   LEU  14           HB2      LEU  14   2.195  12.151  12.151
   91    HG   LEU  14           HG       LEU  14   3.758  10.667  10.667
   92   1HD1  LEU  14          HD11      LEU  14   2.440   9.434   9.434
   93   2HD1  LEU  14          HD12      LEU  14   1.367   8.836   8.836
   94   3HD1  LEU  14          HD13      LEU  14   3.056   8.355   8.355
   95   1HD2  LEU  14          HD21      LEU  14   3.336  10.775  10.775
   96   2HD2  LEU  14          HD22      LEU  14   3.548   9.104   9.104
   97   3HD2  LEU  14          HD23      LEU  14   1.942   9.711   9.711
   98    H    PHE  15           HN       PHE  15   0.186  13.123  13.123
   99    HA   PHE  15           HA       PHE  15  -0.453  15.528  15.528
  100   1HB   PHE  15           HB1      PHE  15   0.521  15.756  15.756
  101   2HB   PHE  15           HB2      PHE  15  -0.370  14.364  14.364
  102    HD1  PHE  15           HD1      PHE  15  -2.500  14.592  14.592
  103    HD2  PHE  15           HD2      PHE  15  -0.409  18.055  18.055
  104    HE1  PHE  15           HE1      PHE  15  -3.969  16.001  16.001
  105    HE2  PHE  15           HE2      PHE  15  -1.908  19.466  19.466
  106    HZ   PHE  15           HZ       PHE  15  -3.688  18.432  18.432
  107    H    CYS  16           HN       MER  16  -2.678  13.358  13.358
  108    HA   CYS  16           HA       MER  16  -5.084  14.705  14.705
  109   1HB   CYS  16           HB1      MER  16  -6.273  12.703  12.703
  110   2HB   CYS  16           HB2      MER  16  -4.849  12.560  12.560
  111    H    SER  17           HN       SER  17  -3.496  12.339  12.339
  112    HA   SER  17           HA       SER  17  -5.426  12.160  12.160
  113   1HB   SER  17           HB1      SER  17  -3.351  10.717  10.717
  114   2HB   SER  17           HB2      SER  17  -2.377  12.062  12.062
  115    HG   SER  17           HG       SER  17  -3.829  10.338  10.338
  116    H    GLU  18           HN       GLU  18  -2.729  14.331  14.331
  117    HA   GLU  18           HA       GLU  18  -3.396  15.881  15.881
  118   1HB   GLU  18           HB1      GLU  18  -1.098  15.395  15.395
  119   2HB   GLU  18           HB2      GLU  18  -1.469  16.494  16.494
  120   1HG   GLU  18           HG1      GLU  18  -1.737  18.380  18.380
  121   2HG   GLU  18           HG2      GLU  18  -1.537  17.295  17.295
  122    H    TYR  19           HN       TYR  19  -4.865  15.796  15.796
  123    HA   TYR  19           HA       TYR  19  -5.401  18.730  18.730
  124   1HB   TYR  19           HB1      TYR  19  -5.243  16.564  16.564
  125   2HB   TYR  19           HB2      TYR  19  -6.627  17.666  17.666
  126    HD1  TYR  19           HD1      TYR  19  -3.008  17.819  17.819
  127    HD2  TYR  19           HD2      TYR  19  -6.211  19.634  19.634
  128    HE1  TYR  19           HE1      TYR  19  -1.468  19.511  19.511
  129    HE2  TYR  19           HE2      TYR  19  -4.676  21.326  21.326
  130    HH   TYR  19           HH       TYR  19  -2.613  22.117  22.117
  131    H    ARG  20           HN       ARG  20  -6.965  15.682  15.682
  132    HA   ARG  20           HA       ARG  20  -9.538  15.755  15.755
  133   1HB   ARG  20           HB1      ARG  20  -8.063  15.143  15.143
  134   2HB   ARG  20           HB2      ARG  20  -9.816  15.017  15.017
  135   1HG   ARG  20           HG1      ARG  20  -9.617  13.411  13.411
  136   2HG   ARG  20           HG2      ARG  20  -7.867  13.563  13.563
  137   1HD   ARG  20           HD1      ARG  20  -7.788  12.642  12.642
  138   2HD   ARG  20           HD2      ARG  20  -9.531  12.766  12.766
  139    HE   ARG  20           HE       ARG  20  -8.196  10.866  10.866
  140   1HH1  ARG  20          HH11      ARG  20 -10.520  10.378  10.378
  141   2HH1  ARG  20          HH12      ARG  20 -11.535   9.574   9.574
  142   1HH2  ARG  20          HH21      ARG  20  -9.518  10.511  10.511
  143   2HH2  ARG  20          HH22      ARG  20 -10.949   9.651   9.651
  144    HA   PRO  21           HA       PRO  21 -11.116  18.627  18.627
  145   1HB   PRO  21           HB1      PRO  21  -9.442  20.091  20.091
  146   2HB   PRO  21           HB2      PRO  21  -9.745  18.367  18.367
  147   1HG   PRO  21           HG1      PRO  21  -7.444  19.536  19.536
  148   2HG   PRO  21           HG2      PRO  21  -7.324  18.530  18.530
  149   1HD   PRO  21           HD1      PRO  21  -7.289  17.305  17.305
  150   2HD   PRO  21           HD2      PRO  21  -8.337  16.632  16.632
  151    H    LYS  22           HN       LYS  22  -8.202  19.977  19.977
  152    HA   LYS  22           HA       LYS  22  -8.906  22.641  22.641
  153   1HB   LYS  22           HB1      LYS  22  -6.624  21.536  21.536
  154   2HB   LYS  22           HB2      LYS  22  -7.188  21.018  21.018
  155   1HG   LYS  22           HG1      LYS  22  -7.697  23.502  23.502
  156   2HG   LYS  22           HG2      LYS  22  -6.854  23.878  23.878
  157   1HD   LYS  22           HD1      LYS  22  -4.809  22.738  22.738
  158   2HD   LYS  22           HD2      LYS  22  -5.665  22.395  22.395
  159   1HE   LYS  22           HE1      LYS  22  -6.036  24.885  24.885
  160   2HE   LYS  22           HE2      LYS  22  -5.024  25.156  25.156
  161   1HZ   LYS  22           HZ1      LYS  22  -3.671  23.428  23.428
  162   2HZ   LYS  22           HZ2      LYS  22  -4.236  24.751  24.751
  163   3HZ   LYS  22           HZ3      LYS  22  -3.261  25.010  25.010
  164    H    ILE  23           HN       ILE  23  -9.627  19.960  19.960
  165    HA   ILE  23           HA       ILE  23 -10.808  21.905  21.905
  166    HB   ILE  23           HB       ILE  23 -11.342  19.556  19.556
  167   1HG1  ILE  23          HG11      ILE  23  -8.822  18.854  18.854
  168   2HG1  ILE  23          HG12      ILE  23 -10.395  18.238  18.238
  169   1HG2  ILE  23          HG21      ILE  23  -9.969  21.402  21.402
  170   2HG2  ILE  23          HG22      ILE  23  -8.614  20.891  20.891
  171   3HG2  ILE  23          HG23      ILE  23  -9.172  19.874  19.874
  172   1HD1  ILE  23          HD11      ILE  23 -10.648  17.284  17.284
  173   2HD1  ILE  23          HD12      ILE  23  -9.036  17.838  17.838
  174   3HD1  ILE  23          HD13      ILE  23  -9.255  16.614  16.614
  175    H    LYS  24           HN       LYS  24 -11.613  19.591  19.591
  176    HA   LYS  24           HA       LYS  24 -14.412  19.367  19.367
  177   1HB   LYS  24           HB1      LYS  24 -12.970  17.724  17.724
  178   2HB   LYS  24           HB2      LYS  24 -12.754  18.791  18.791
  179   1HG   LYS  24           HG1      LYS  24 -15.000  18.616  18.616
  180   2HG   LYS  24           HG2      LYS  24 -15.621  18.107  18.107
  181   1HD   LYS  24           HD1      LYS  24 -15.694  16.255  16.255
  182   2HD   LYS  24           HD2      LYS  24 -14.560  15.898  15.898
  183   1HE   LYS  24           HE1      LYS  24 -12.666  16.497  16.497
  184   2HE   LYS  24           HE2      LYS  24 -13.811  16.896  16.896
  185   1HZ   LYS  24           HZ1      LYS  24 -14.445  14.360  14.360
  186   2HZ   LYS  24           HZ2      LYS  24 -12.772  14.394  14.394
  187   3HZ   LYS  24           HZ3      LYS  24 -13.851  14.786  14.786
  188    H    GLY  25           HN       GLY  25 -12.455  21.644  21.644
  189   1HA   GLY  25           HA1      GLY  25 -14.504  22.901  22.901
  190   2HA   GLY  25           HA2      GLY  25 -12.819  23.407  23.407
  191    H    GLU  26           HN       GLU  26 -12.650  23.466  23.466
  192    HA   GLU  26           HA       GLU  26 -13.868  26.023  26.023
  193   1HB   GLU  26           HB1      GLU  26 -12.160  24.157  24.157
  194   2HB   GLU  26           HB2      GLU  26 -12.600  25.777  25.777
  195   1HG   GLU  26           HG1      GLU  26 -11.086  25.113  25.113
  196   2HG   GLU  26           HG2      GLU  26 -10.309  25.612  25.612
  197    H    HIS  27           HN       HIS  27 -14.147  22.780  22.780
  198    HA   HIS  27           HA       HIS  27 -16.709  23.472  23.472
  199   1HB   HIS  27           HB1      HIS  27 -14.664  21.460  21.460
  200   2HB   HIS  27           HB2      HIS  27 -16.041  22.139  22.139
  201    HD1  HIS  27           HD1      HIS  27 -15.753  24.918  24.918
  202    HD2  HIS  27           HD2      HIS  27 -12.330  22.760  22.760
  203    HE1  HIS  27           HE1      HIS  27 -13.891  26.383  26.383
  204    HA   PRO  28           HA       PRO  28 -17.597  19.872  19.872
  205   1HB   PRO  28           HB1      PRO  28 -19.536  20.980  20.980
  206   2HB   PRO  28           HB2      PRO  28 -17.839  21.318  21.318
  207   1HG   PRO  28           HG1      PRO  28 -19.762  22.997  22.997
  208   2HG   PRO  28           HG2      PRO  28 -18.808  23.537  23.537
  209   1HD   PRO  28           HD1      PRO  28 -17.875  23.841  23.841
  210   2HD   PRO  28           HD2      PRO  28 -16.742  23.472  23.472
  211    H    GLY  29           HN       GLY  29 -18.201  20.408  20.408
  212   1HA   GLY  29           HA1      GLY  29 -20.931  19.339  19.339
  213   2HA   GLY  29           HA2      GLY  29 -20.506  20.744  20.744
  214    H    LEU  30           HN       LEU  30 -18.068  18.362  18.362
  215    HA   LEU  30           HA       LEU  30 -18.100  17.474  17.474
  216   1HB   LEU  30           HB1      LEU  30 -15.954  17.246  17.246
  217   2HB   LEU  30           HB2      LEU  30 -15.712  16.813  16.813
  218    HG   LEU  30           HG       LEU  30 -16.083  19.526  19.526
  219   1HD1  LEU  30          HD11      LEU  30 -13.818  18.299  18.299
  220   2HD1  LEU  30          HD12      LEU  30 -13.832  19.949  19.949
  221   3HD1  LEU  30          HD13      LEU  30 -13.820  18.611  18.611
  222   1HD2  LEU  30          HD21      LEU  30 -15.965  18.965  18.965
  223   2HD2  LEU  30          HD22      LEU  30 -17.363  19.586  19.586
  224   3HD2  LEU  30          HD23      LEU  30 -15.907  20.551  20.551
  225    H    SER  31           HN       SER  31 -17.447  15.241  15.241
  226    HA   SER  31           HA       SER  31 -18.610  13.306  13.306
  227   1HB   SER  31           HB1      SER  31 -19.112  11.903  11.903
  228   2HB   SER  31           HB2      SER  31 -19.715  13.529  13.529
  229    HG   SER  31           HG       SER  31 -17.702  12.169  12.169
  230    H    ILE  32           HN       ILE  32 -17.546  11.029  11.029
  231    HA   ILE  32           HA       ILE  32 -14.746  11.311  11.311
  232    HB   ILE  32           HB       ILE  32 -16.249   9.566   9.566
  233   1HG1  ILE  32          HG11      ILE  32 -14.820   7.581   7.581
  234   2HG1  ILE  32          HG12      ILE  32 -14.064   8.234   8.234
  235   1HG2  ILE  32          HG21      ILE  32 -16.337   8.497   8.497
  236   2HG2  ILE  32          HG22      ILE  32 -16.995   7.664   7.664
  237   3HG2  ILE  32          HG23      ILE  32 -17.681   9.194   9.194
  238   1HD1  ILE  32          HD11      ILE  32 -13.860   9.427   9.427
  239   2HD1  ILE  32          HD12      ILE  32 -12.598   8.532   8.532
  240   3HD1  ILE  32          HD13      ILE  32 -13.099  10.100  10.100
  241    H    GLY  33           HN       GLY  33 -16.296  11.729  11.729
  242   1HA   GLY  33           HA1      GLY  33 -14.232  10.717  10.717
  243   2HA   GLY  33           HA2      GLY  33 -15.897  11.117  11.117
  244    H    ASP  34           HN       ASP  34 -15.417  13.470  13.470
  245    HA   ASP  34           HA       ASP  34 -14.319  15.338  15.338
  246   1HB   ASP  34           HB1      ASP  34 -16.070  15.686  15.686
  247   2HB   ASP  34           HB2      ASP  34 -15.573  17.087  17.087
  248    H    VAL  35           HN       VAL  35 -14.398  14.611  14.611
  249    HA   VAL  35           HA       VAL  35 -12.311  16.305  16.305
  250    HB   VAL  35           HB       VAL  35 -13.343  13.589  13.589
  251   1HG1  VAL  35          HG11      VAL  35 -11.003  13.853  13.853
  252   2HG1  VAL  35          HG12      VAL  35 -11.427  15.419  15.419
  253   3HG1  VAL  35          HG13      VAL  35 -12.156  13.962  13.962
  254   1HG2  VAL  35          HG21      VAL  35 -13.742  16.392  16.392
  255   2HG2  VAL  35          HG22      VAL  35 -14.936  15.442  15.442
  256   3HG2  VAL  35          HG23      VAL  35 -14.388  14.914  14.914
  257    H    ALA  36           HN       ALA  36 -12.434  13.317  13.317
  258    HA   ALA  36           HA       ALA  36  -9.613  12.731  12.731
  259   1HB   ALA  36           HB1      ALA  36 -11.910  11.447  11.447
  260   2HB   ALA  36           HB2      ALA  36 -10.323  10.697  10.697
  261   3HB   ALA  36           HB3      ALA  36 -11.306  10.972  10.972
  262    H    LYS  37           HN       LYS  37 -11.790  13.666  13.666
  263    HA   LYS  37           HA       LYS  37  -9.423  13.791  13.791
  264   1HB   LYS  37           HB1      LYS  37 -12.358  14.253  14.253
  265   2HB   LYS  37           HB2      LYS  37 -11.098  14.380  14.380
  266   1HG   LYS  37           HG1      LYS  37 -10.404  12.028  12.028
  267   2HG   LYS  37           HG2      LYS  37 -11.704  11.882  11.882
  268   1HD   LYS  37           HD1      LYS  37 -13.384  12.313  12.313
  269   2HD   LYS  37           HD2      LYS  37 -12.115  12.591  12.591
  270   1HE   LYS  37           HE1      LYS  37 -13.034  10.296  10.296
  271   2HE   LYS  37           HE2      LYS  37 -11.343  10.241  10.241
  272   1HZ   LYS  37           HZ1      LYS  37 -12.906  10.376  10.376
  273   2HZ   LYS  37           HZ2      LYS  37 -13.553   9.168   9.168
  274   3HZ   LYS  37           HZ3      LYS  37 -11.919   9.104   9.104
  275    H    LYS  38           HN       LYS  38 -10.722  15.927  15.927
  276    HA   LYS  38           HA       LYS  38 -10.174  18.279  18.279
  277   1HB   LYS  38           HB1      LYS  38 -12.350  18.250  18.250
  278   2HB   LYS  38           HB2      LYS  38 -11.293  18.141  18.141
  279   1HG   LYS  38           HG1      LYS  38 -11.989  20.467  20.467
  280   2HG   LYS  38           HG2      LYS  38 -10.257  20.277  20.277
  281   1HD   LYS  38           HD1      LYS  38 -11.088  21.777  21.777
  282   2HD   LYS  38           HD2      LYS  38 -10.382  20.358  20.358
  283   1HE   LYS  38           HE1      LYS  38 -13.383  20.669  20.669
  284   2HE   LYS  38           HE2      LYS  38 -12.597  21.127  21.127
  285   1HZ   LYS  38           HZ1      LYS  38 -11.799  18.529  18.529
  286   2HZ   LYS  38           HZ2      LYS  38 -13.478  18.602  18.602
  287   3HZ   LYS  38           HZ3      LYS  38 -12.775  19.065  19.065
  288    H    LEU  39           HN       LEU  39  -9.624  16.592  16.592
  289    HA   LEU  39           HA       LEU  39  -7.325  18.151  18.151
  290   1HB   LEU  39           HB1      LEU  39  -8.523  16.583  16.583
  291   2HB   LEU  39           HB2      LEU  39  -7.979  15.227  15.227
  292    HG   LEU  39           HG       LEU  39  -5.744  16.249  16.249
  293   1HD1  LEU  39          HD11      LEU  39  -6.959  17.537  17.537
  294   2HD1  LEU  39          HD12      LEU  39  -5.240  17.385  17.385
  295   3HD1  LEU  39          HD13      LEU  39  -6.211  18.364  18.364
  296   1HD2  LEU  39          HD21      LEU  39  -6.307  14.070  14.070
  297   2HD2  LEU  39          HD22      LEU  39  -5.204  14.978  14.978
  298   3HD2  LEU  39          HD23      LEU  39  -6.920  14.888  14.888
  299    H    GLY  40           HN       GLY  40  -7.836  15.190  15.190
  300   1HA   GLY  40           HA1      GLY  40  -5.212  14.475  14.475
  301   2HA   GLY  40           HA2      GLY  40  -6.565  14.253  14.253
  302    H    GLU  41           HN       GLU  41  -7.302  16.801  16.801
  303    HA   GLU  41           HA       GLU  41  -5.429  17.575  17.575
  304   1HB   GLU  41           HB1      GLU  41  -7.527  19.123  19.123
  305   2HB   GLU  41           HB2      GLU  41  -6.644  19.811  19.811
  306   1HG   GLU  41           HG1      GLU  41  -7.514  18.103  18.103
  307   2HG   GLU  41           HG2      GLU  41  -8.256  17.228  17.228
  308    H    MET  42           HN       MET  42  -6.170  19.245  19.245
  309    HA   MET  42           HA       MET  42  -4.330  21.255  21.255
  310   1HB   MET  42           HB1      MET  42  -5.095  19.338  19.338
  311   2HB   MET  42           HB2      MET  42  -4.368  20.917  20.917
  312   1HG   MET  42           HG1      MET  42  -6.952  20.510  20.510
  313   2HG   MET  42           HG2      MET  42  -6.981  20.711  20.711
  314   1HE   MET  42           HE1      MET  42  -8.736  22.127  22.127
  315   2HE   MET  42           HE2      MET  42  -8.237  23.689  23.689
  316   3HE   MET  42           HE3      MET  42  -7.534  22.233  22.233
  317    H    TRP  43           HN       TRP  43  -3.821  17.980  17.980
  318    HA   TRP  43           HA       TRP  43  -1.172  18.032  18.032
  319   1HB   TRP  43           HB1      TRP  43  -2.476  16.080  16.080
  320   2HB   TRP  43           HB2      TRP  43  -2.813  15.886  15.886
  321    HD1  TRP  43           HD1      TRP  43  -1.166  14.424  14.424
  322    HE1  TRP  43           HE1      TRP  43   1.068  13.473  13.473
  323    HE3  TRP  43           HE3      TRP  43  -0.422  16.529  16.529
  324    HZ2  TRP  43           HZ2      TRP  43   3.048  13.497  13.497
  325    HZ3  TRP  43           HZ3      TRP  43   1.600  16.064  16.064
  326    HH2  TRP  43           HH2      TRP  43   3.349  14.548  14.548
  327    H    ASN  44           HN       ASN  44  -2.400  17.245  17.245
  328    HA   ASN  44           HA       ASN  44   0.073  16.931  16.931
  329   1HB   ASN  44           HB1      ASN  44  -1.371  16.279  16.279
  330   2HB   ASN  44           HB2      ASN  44  -2.711  16.878  16.878
  331   1HD2  ASN  44          HD21      ASN  44  -3.547  19.258  19.258
  332   2HD2  ASN  44          HD22      ASN  44  -3.980  18.355  18.355
  333    H    ASN  45           HN       ASN  45  -1.460  19.733  19.733
  334    HA   ASN  45           HA       ASN  45   0.598  21.489  21.489
  335   1HB   ASN  45           HB1      ASN  45  -2.127  22.582  22.582
  336   2HB   ASN  45           HB2      ASN  45  -1.000  23.160  23.160
  337   1HD2  ASN  45          HD21      ASN  45  -3.914  20.590  20.590
  338   2HD2  ASN  45          HD22      ASN  45  -3.779  21.378  21.378
  339    H    THR  46           HN       THR  46   0.732  20.222  20.222
  340    HA   THR  46           HA       THR  46   0.065  22.249  22.249
  341    HB   THR  46           HB       THR  46   0.364  19.849  19.849
  342    HG1  THR  46           HG1      THR  46   0.949  20.763  20.763
  343   1HG2  THR  46          HG21      THR  46   2.417  19.228  19.228
  344   2HG2  THR  46          HG22      THR  46   3.397  20.239  20.239
  345   3HG2  THR  46          HG23      THR  46   2.579  18.844  18.844
  346    H    ALA  47           HN       ALA  47   3.046  21.217  21.217
  347    HA   ALA  47           HA       ALA  47   4.139  23.795  23.795
  348   1HB   ALA  47           HB1      ALA  47   4.490  23.769  23.769
  349   2HB   ALA  47           HB2      ALA  47   5.392  22.277  22.277
  350   3HB   ALA  47           HB3      ALA  47   6.010  23.763  23.763
  351    H    ALA  48           HN       ALA  48   4.907  20.627  20.627
  352    HA   ALA  48           HA       ALA  48   5.616  18.747  18.747
  353   1HB   ALA  48           HB1      ALA  48   5.771  20.051  20.051
  354   2HB   ALA  48           HB2      ALA  48   7.275  20.771  20.771
  355   3HB   ALA  48           HB3      ALA  48   7.171  19.041  19.041
  356    H    ASP  49           HN       ASP  49   7.096  21.507  21.507
  357    HA   ASP  49           HA       ASP  49   9.606  20.272  20.272
  358   1HB   ASP  49           HB1      ASP  49   8.504  23.092  23.092
  359   2HB   ASP  49           HB2      ASP  49  10.159  22.584  22.584
  360    H    ASP  50           HN       ASP  50   6.461  20.684  20.684
  361    HA   ASP  50           HA       ASP  50   6.961  20.413  20.413
  362   1HB   ASP  50           HB1      ASP  50   4.648  21.515  21.515
  363   2HB   ASP  50           HB2      ASP  50   4.417  21.083  21.083
  364    H    LYS  51           HN       LYS  51   6.434  18.672  18.672
  365    HA   LYS  51           HA       LYS  51   4.601  16.642  16.642
  366   1HB   LYS  51           HB1      LYS  51   6.175  16.602  16.602
  367   2HB   LYS  51           HB2      LYS  51   5.109  15.330  15.330
  368   1HG   LYS  51           HG1      LYS  51   3.190  16.901  16.901
  369   2HG   LYS  51           HG2      LYS  51   4.299  18.138  18.138
  370   1HD   LYS  51           HD1      LYS  51   4.945  16.655  16.655
  371   2HD   LYS  51           HD2      LYS  51   3.845  15.424  15.424
  372   1HE   LYS  51           HE1      LYS  51   1.939  16.748  16.748
  373   2HE   LYS  51           HE2      LYS  51   2.879  18.201  18.201
  374   1HZ   LYS  51           HZ1      LYS  51   3.724  16.114  16.114
  375   2HZ   LYS  51           HZ2      LYS  51   2.031  16.235  16.235
  376   3HZ   LYS  51           HZ3      LYS  51   2.999  17.593  17.593
  377    H    GLN  52           HN       GLN  52   7.798  17.118  17.118
  378    HA   GLN  52           HA       GLN  52   9.307  15.024  15.024
  379   1HB   GLN  52           HB1      GLN  52   9.841  17.724  17.724
  380   2HB   GLN  52           HB2      GLN  52  10.417  17.329  17.329
  381   1HG   GLN  52           HG1      GLN  52  12.277  17.132  17.132
  382   2HG   GLN  52           HG2      GLN  52  11.849  15.514  15.514
  383   1HE2  GLN  52          HE21      GLN  52  10.107  15.797  15.797
  384   2HE2  GLN  52          HE22      GLN  52   9.437  16.459  16.459
  385    HA   PRO  53           HA       PRO  53   9.768  14.903  14.903
  386   1HB   PRO  53           HB1      PRO  53   7.514  15.950  15.950
  387   2HB   PRO  53           HB2      PRO  53   9.060  16.785  16.785
  388   1HG   PRO  53           HG1      PRO  53   6.616  16.943  16.943
  389   2HG   PRO  53           HG2      PRO  53   7.517  18.280  18.280
  390   1HD   PRO  53           HD1      PRO  53   8.155  17.631  17.631
  391   2HD   PRO  53           HD2      PRO  53   9.499  17.789  17.789
  392    H    TYR  54           HN       TYR  54   6.464  14.943  14.943
  393    HA   TYR  54           HA       TYR  54   5.609  12.531  12.531
  394   1HB   TYR  54           HB1      TYR  54   4.419  14.036  14.036
  395   2HB   TYR  54           HB2      TYR  54   3.586  12.781  12.781
  396    HD1  TYR  54           HD1      TYR  54   3.961  13.327  13.327
  397    HD2  TYR  54           HD2      TYR  54   3.701  16.175  16.175
  398    HE1  TYR  54           HE1      TYR  54   3.247  15.035  15.035
  399    HE2  TYR  54           HE2      TYR  54   2.987  17.881  17.881
  400    HH   TYR  54           HH       TYR  54   3.400  17.713  17.713
  401    H    GLU  55           HN       GLU  55   6.364  13.355  13.355
  402    HA   GLU  55           HA       GLU  55   6.058  10.880  10.880
  403   1HB   GLU  55           HB1      GLU  55   7.306  13.451  13.451
  404   2HB   GLU  55           HB2      GLU  55   8.369  12.210  12.210
  405   1HG   GLU  55           HG1      GLU  55   6.376  11.213  11.213
  406   2HG   GLU  55           HG2      GLU  55   5.385  12.514  12.514
  407    H    LYS  56           HN       LYS  56   9.086  12.100  12.100
  408    HA   LYS  56           HA       LYS  56  10.754   9.937   9.937
  409   1HB   LYS  56           HB1      LYS  56  10.569  11.980  11.980
  410   2HB   LYS  56           HB2      LYS  56  11.887  10.826  10.826
  411   1HG   LYS  56           HG1      LYS  56  11.215  12.540  12.540
  412   2HG   LYS  56           HG2      LYS  56  12.203  13.186  13.186
  413   1HD   LYS  56           HD1      LYS  56  12.953  10.479  10.479
  414   2HD   LYS  56           HD2      LYS  56  13.287  11.896  11.896
  415   1HE   LYS  56           HE1      LYS  56  14.177  11.646  11.646
  416   2HE   LYS  56           HE2      LYS  56  15.196  11.193  11.193
  417   1HZ   LYS  56           HZ1      LYS  56  14.123  13.723  13.723
  418   2HZ   LYS  56           HZ2      LYS  56  14.757  13.734  13.734
  419   3HZ   LYS  56           HZ3      LYS  56  15.743  13.297  13.297
  420    H    LYS  57           HN       LYS  57   8.272  10.349  10.349
  421    HA   LYS  57           HA       LYS  57   8.987   8.054   8.054
  422   1HB   LYS  57           HB1      LYS  57   7.370  10.052  10.052
  423   2HB   LYS  57           HB2      LYS  57   6.161   9.180   9.180
  424   1HG   LYS  57           HG1      LYS  57   5.684   8.001   8.001
  425   2HG   LYS  57           HG2      LYS  57   7.209   7.173   7.173
  426   1HD   LYS  57           HD1      LYS  57   6.796   9.735   9.735
  427   2HD   LYS  57           HD2      LYS  57   7.012   8.136   8.136
  428   1HE   LYS  57           HE1      LYS  57   9.297   8.000   8.000
  429   2HE   LYS  57           HE2      LYS  57   9.115   9.544   9.544
  430   1HZ   LYS  57           HZ1      LYS  57   8.442   9.877   9.877
  431   2HZ   LYS  57           HZ2      LYS  57   9.939   9.076   9.076
  432   3HZ   LYS  57           HZ3      LYS  57   9.721  10.567  10.567
  433    H    ALA  58           HN       ALA  58   6.393   8.650   8.650
  434    HA   ALA  58           HA       ALA  58   5.271   6.151   6.151
  435   1HB   ALA  58           HB1      ALA  58   4.524   8.184   8.184
  436   2HB   ALA  58           HB2      ALA  58   5.961   8.095   8.095
  437   3HB   ALA  58           HB3      ALA  58   4.754   6.822   6.822
  438    H    ALA  59           HN       ALA  59   8.034   7.374   7.374
  439    HA   ALA  59           HA       ALA  59   8.767   5.154   5.154
  440   1HB   ALA  59           HB1      ALA  59  10.632   7.146   7.146
  441   2HB   ALA  59           HB2      ALA  59  11.075   6.115   6.115
  442   3HB   ALA  59           HB3      ALA  59   9.873   7.373   7.373
  443    H    LYS  60           HN       LYS  60  10.188   5.998   5.998
  444    HA   LYS  60           HA       LYS  60  11.736   3.837   3.837
  445   1HB   LYS  60           HB1      LYS  60  11.189   5.985   5.985
  446   2HB   LYS  60           HB2      LYS  60   9.869   5.063   5.063
  447   1HG   LYS  60           HG1      LYS  60  11.492   3.311   3.311
  448   2HG   LYS  60           HG2      LYS  60  12.803   4.257   4.257
  449   1HD   LYS  60           HD1      LYS  60  12.091   6.188   6.188
  450   2HD   LYS  60           HD2      LYS  60  10.958   5.086   5.086
  451   1HE   LYS  60           HE1      LYS  60  13.031   5.151   5.151
  452   2HE   LYS  60           HE2      LYS  60  12.893   3.565   3.565
  453   1HZ   LYS  60           HZ1      LYS  60  14.208   5.262   5.262
  454   2HZ   LYS  60           HZ2      LYS  60  14.945   5.433   5.433
  455   3HZ   LYS  60           HZ3      LYS  60  14.816   3.897   3.897
  456    H    LEU  61           HN       LEU  61   8.254   4.085   4.085
  457    HA   LEU  61           HA       LEU  61   8.009   1.399   1.399
  458   1HB   LEU  61           HB1      LEU  61   5.847   3.066   3.066
  459   2HB   LEU  61           HB2      LEU  61   5.602   1.771   1.771
  460    HG   LEU  61           HG       LEU  61   6.937   4.465   4.465
  461   1HD1  LEU  61          HD11      LEU  61   4.470   3.201   3.201
  462   2HD1  LEU  61          HD12      LEU  61   5.154   4.757   4.757
  463   3HD1  LEU  61          HD13      LEU  61   4.531   4.521   4.521
  464   1HD2  LEU  61          HD21      LEU  61   6.791   2.101   2.101
  465   2HD2  LEU  61          HD22      LEU  61   8.255   2.767   2.767
  466   3HD2  LEU  61          HD23      LEU  61   7.323   3.724   3.724
  467    H    LYS  62           HN       LYS  62   7.053   2.634   2.634
  468    HA   LYS  62           HA       LYS  62   6.371   0.325   0.325
  469   1HB   LYS  62           HB1      LYS  62   6.524   2.529   2.529
  470   2HB   LYS  62           HB2      LYS  62   8.261   2.531   2.531
  471   1HG   LYS  62           HG1      LYS  62   8.414   0.507   0.507
  472   2HG   LYS  62           HG2      LYS  62   6.670   0.527   0.527
  473   1HD   LYS  62           HD1      LYS  62   6.799   2.780   2.780
  474   2HD   LYS  62           HD2      LYS  62   8.528   2.828   2.828
  475   1HE   LYS  62           HE1      LYS  62   8.870   0.922   0.922
  476   2HE   LYS  62           HE2      LYS  62   7.136   0.797   0.797
  477   1HZ   LYS  62           HZ1      LYS  62   7.923   3.445   3.445
  478   2HZ   LYS  62           HZ2      LYS  62   8.966   2.427   2.427
  479   3HZ   LYS  62           HZ3      LYS  62   7.287   2.325   2.325
  480    H    GLU  63           HN       GLU  63   9.623   1.431   1.431
  481    HA   GLU  63           HA       GLU  63  11.085  -0.691  -0.691
  482   1HB   GLU  63           HB1      GLU  63  11.893   1.668   1.668
  483   2HB   GLU  63           HB2      GLU  63  11.872   1.092   1.092
  484   1HG   GLU  63           HG1      GLU  63  13.561  -0.698  -0.698
  485   2HG   GLU  63           HG2      GLU  63  13.642   0.015   0.015
  486    H    LYS  64           HN       LYS  64  10.236  -0.112  -0.112
  487    HA   LYS  64           HA       LYS  64  11.327  -2.456  -2.456
  488   1HB   LYS  64           HB1      LYS  64  10.415  -0.555  -0.555
  489   2HB   LYS  64           HB2      LYS  64   8.793  -0.928  -0.928
  490   1HG   LYS  64           HG1      LYS  64   8.673  -2.915  -2.915
  491   2HG   LYS  64           HG2      LYS  64  10.411  -2.980  -2.980
  492   1HD   LYS  64           HD1      LYS  64  10.304  -0.973  -0.973
  493   2HD   LYS  64           HD2      LYS  64   8.600  -0.752  -0.752
  494   1HE   LYS  64           HE1      LYS  64   9.754  -3.212  -3.212
  495   2HE   LYS  64           HE2      LYS  64   9.014  -1.852  -1.852
  496   1HZ   LYS  64           HZ1      LYS  64   7.296  -2.676  -2.676
  497   2HZ   LYS  64           HZ2      LYS  64   7.768  -4.053  -4.053
  498   3HZ   LYS  64           HZ3      LYS  64   7.052  -2.739  -2.739
  499    H    TYR  65           HN       TYR  65   8.145  -1.939  -1.939
  500    HA   TYR  65           HA       TYR  65   6.984  -4.460  -4.460
  501   1HB   TYR  65           HB1      TYR  65   5.515  -2.815  -2.815
  502   2HB   TYR  65           HB2      TYR  65   6.665  -2.231  -2.231
  503    HD1  TYR  65           HD1      TYR  65   5.447  -5.755  -5.755
  504    HD2  TYR  65           HD2      TYR  65   5.363  -2.271  -2.271
  505    HE1  TYR  65           HE1      TYR  65   4.264  -7.004  -7.004
  506    HE2  TYR  65           HE2      TYR  65   4.176  -3.528  -3.528
  507    HH   TYR  65           HH       TYR  65   4.057  -6.720  -6.720
  508    H    GLU  66           HN       GLU  66   8.467  -3.463  -3.463
  509    HA   GLU  66           HA       GLU  66   8.295  -5.962  -5.962
  510   1HB   GLU  66           HB1      GLU  66  10.299  -5.310  -5.310
  511   2HB   GLU  66           HB2      GLU  66   8.919  -4.234  -4.234
  512   1HG   GLU  66           HG1      GLU  66  10.034  -2.709  -2.709
  513   2HG   GLU  66           HG2      GLU  66  11.290  -3.874  -3.874
  514    H    LYS  67           HN       LYS  67  10.571  -5.024  -5.024
  515    HA   LYS  67           HA       LYS  67  12.287  -7.339  -7.339
  516   1HB   LYS  67           HB1      LYS  67  12.293  -4.999  -4.999
  517   2HB   LYS  67           HB2      LYS  67  13.100  -6.438  -6.438
  518   1HG   LYS  67           HG1      LYS  67  14.696  -5.032  -5.032
  519   2HG   LYS  67           HG2      LYS  67  14.484  -6.501  -6.501
  520   1HD   LYS  67           HD1      LYS  67  13.025  -5.261  -5.261
  521   2HD   LYS  67           HD2      LYS  67  13.227  -3.798  -3.798
  522   1HE   LYS  67           HE1      LYS  67  15.700  -3.905  -3.905
  523   2HE   LYS  67           HE2      LYS  67  15.468  -5.348  -5.348
  524   1HZ   LYS  67           HZ1      LYS  67  13.721  -3.369  -3.369
  525   2HZ   LYS  67           HZ2      LYS  67  15.267  -2.684  -2.684
  526   3HZ   LYS  67           HZ3      LYS  67  15.034  -4.077  -4.077
  527    H    ASP  68           HN       ASP  68   9.733  -6.525  -6.525
  528    HA   ASP  68           HA       ASP  68   9.958  -8.738  -8.738
  529   1HB   ASP  68           HB1      ASP  68   7.751  -6.739  -6.739
  530   2HB   ASP  68           HB2      ASP  68   7.786  -7.902  -7.902
  531    H    ILE  69           HN       ILE  69   8.407  -7.995  -7.995
  532    HA   ILE  69           HA       ILE  69   6.551 -10.246 -10.246
  533    HB   ILE  69           HB       ILE  69   5.814  -8.281  -8.281
  534   1HG1  ILE  69          HG11      ILE  69   5.056  -9.284  -9.284
  535   2HG1  ILE  69          HG12      ILE  69   6.361 -10.469 -10.469
  536   1HG2  ILE  69          HG21      ILE  69   8.016  -7.595  -7.595
  537   2HG2  ILE  69          HG22      ILE  69   8.072  -8.900  -8.900
  538   3HG2  ILE  69          HG23      ILE  69   6.867  -7.633  -7.633
  539   1HD1  ILE  69          HD11      ILE  69   4.182 -10.257 -10.257
  540   2HD1  ILE  69          HD12      ILE  69   4.231 -11.464 -11.464
  541   3HD1  ILE  69          HD13      ILE  69   5.453 -11.475 -11.475
  542    H    ALA  70           HN       ALA  70   9.388  -9.398  -9.398
  543    HA   ALA  70           HA       ALA  70   9.821 -11.742 -11.742
  544   1HB   ALA  70           HB1      ALA  70  11.919  -9.916  -9.916
  545   2HB   ALA  70           HB2      ALA  70  12.249 -11.041 -11.041
  546   3HB   ALA  70           HB3      ALA  70  11.207  -9.656  -9.656
  547    H    ALA  71           HN       ALA  71  10.368 -10.955 -10.955
  548    HA   ALA  71           HA       ALA  71  11.764 -13.460 -13.460
  549   1HB   ALA  71           HB1      ALA  71  10.774 -11.231 -11.231
  550   2HB   ALA  71           HB2      ALA  71  11.802 -12.571 -12.571
  551   3HB   ALA  71           HB3      ALA  71  12.402 -11.380 -11.380
  552    H    TYR  72           HN       TYR  72   8.626 -11.976 -11.976
  553    HA   TYR  72           HA       TYR  72   7.388 -13.868 -13.868
  554   1HB   TYR  72           HB1      TYR  72   6.351 -11.772 -11.772
  555   2HB   TYR  72           HB2      TYR  72   6.321 -12.071 -12.071
  556    HD1  TYR  72           HD1      TYR  72   4.709 -13.737 -13.737
  557    HD2  TYR  72           HD2      TYR  72   4.638 -12.612 -12.612
  558    HE1  TYR  72           HE1      TYR  72   2.459 -14.676 -14.676
  559    HE2  TYR  72           HE2      TYR  72   2.386 -13.550 -13.550
  560    HH   TYR  72           HH       TYR  72   0.520 -14.184 -14.184
  561    H    ARG  73           HN       ARG  73   7.565 -13.744 -13.744
  562    HA   ARG  73           HA       ARG  73   6.071 -16.192 -16.192
  563   1HB   ARG  73           HB1      ARG  73   6.079 -15.585 -15.585
  564   2HB   ARG  73           HB2      ARG  73   6.488 -14.020 -14.020
  565   1HG   ARG  73           HG1      ARG  73   8.903 -14.478 -14.478
  566   2HG   ARG  73           HG2      ARG  73   8.508 -16.048 -16.048
  567   1HD   ARG  73           HD1      ARG  73   6.976 -14.638 -14.638
  568   2HD   ARG  73           HD2      ARG  73   8.058 -13.324 -13.324
  569    HE   ARG  73           HE       ARG  73   8.996 -15.921 -15.921
  570   1HH1  ARG  73          HH11      ARG  73  11.327 -14.887 -14.887
  571   2HH1  ARG  73          HH12      ARG  73  11.850 -13.696 -13.696
  572   1HH2  ARG  73          HH21      ARG  73   8.653 -13.385 -13.385
  573   2HH2  ARG  73          HH22      ARG  73  10.286 -12.819 -12.819
  574    H    ALA  74           HN       ALA  74   9.345 -15.163 -15.163
  575    HA   ALA  74           HA       ALA  74  10.944 -17.131 -17.131
  576   1HB   ALA  74           HB1      ALA  74  11.807 -15.278 -15.278
  577   2HB   ALA  74           HB2      ALA  74  11.247 -16.123 -16.123
  578   3HB   ALA  74           HB3      ALA  74  12.514 -16.817 -16.817
  579    H    LYS  75           HN       LYS  75   9.121 -17.373 -17.373
  580    HA   LYS  75           HA       LYS  75   8.201 -19.936 -19.936
  581   1HB   LYS  75           HB1      LYS  75  11.106 -19.923 -19.923
  582   2HB   LYS  75           HB2      LYS  75  10.126 -20.624 -20.624
  583   1HG   LYS  75           HG1      LYS  75   9.064 -22.158 -22.158
  584   2HG   LYS  75           HG2      LYS  75  10.064 -21.491 -21.491
  585   1HD   LYS  75           HD1      LYS  75  11.130 -23.526 -23.526
  586   2HD   LYS  75           HD2      LYS  75  12.109 -22.213 -22.213
  587   1HE   LYS  75           HE1      LYS  75  11.054 -22.432 -22.432
  588   2HE   LYS  75           HE2      LYS  75   9.981 -23.683 -23.683
  589   1HZ   LYS  75           HZ1      LYS  75  12.619 -24.376 -24.376
  590   2HZ   LYS  75           HZ2      LYS  75  12.549 -23.953 -23.953
  591   3HZ   LYS  75           HZ3      LYS  75  11.529 -25.165 -25.165
  592    H    GLY  76           HN       GLY  76   9.418 -17.183 -17.183
  593   1HA   GLY  76           HA1      GLY  76   8.963 -17.238 -17.238
  594   2HA   GLY  76           HA2      GLY  76   8.325 -15.910 -15.910
  595    H    LYS  77           HN       LYS  77   6.297 -16.997 -16.997
  596    HA   LYS  77           HA       LYS  77   4.009 -16.720 -16.720
  597   1HB   LYS  77           HB1      LYS  77   3.034 -18.604 -18.604
  598   2HB   LYS  77           HB2      LYS  77   4.005 -17.404 -17.404
  599   1HG   LYS  77           HG1      LYS  77   5.860 -18.910 -18.910
  600   2HG   LYS  77           HG2      LYS  77   5.196 -20.016 -20.016
  601   1HD   LYS  77           HD1      LYS  77   4.971 -20.902 -20.902
  602   2HD   LYS  77           HD2      LYS  77   3.416 -20.678 -20.678
  603   1HE   LYS  77           HE1      LYS  77   4.580 -18.564 -18.564
  604   2HE   LYS  77           HE2      LYS  77   3.619 -19.907 -19.907
  605   1HZ   LYS  77           HZ1      LYS  77   2.269 -18.782 -18.782
  606   2HZ   LYS  77           HZ2      LYS  77   2.734 -17.518 -17.518
  607   3HZ   LYS  77           HZ3      LYS  77   1.810 -18.815 -18.815
  608    HA   PRO  78           HA       PRO  78   3.370 -19.247 -19.247
  609   1HB   PRO  78           HB1      PRO  78   0.659 -19.650 -19.650
  610   2HB   PRO  78           HB2      PRO  78   1.350 -18.020 -18.020
  611   1HG   PRO  78           HG1      PRO  78   0.353 -19.448 -19.448
  612   2HG   PRO  78           HG2      PRO  78  -0.188 -17.893 -17.893
  613   1HD   PRO  78           HD1      PRO  78   1.729 -17.946 -17.946
  614   2HD   PRO  78           HD2      PRO  78   1.929 -16.827 -16.827
  615    H    ASP  79           HN       ASP  79   3.835 -20.804 -20.804
  616    HA   ASP  79           HA       ASP  79   2.995 -23.443 -23.443
  617   1HB   ASP  79           HB1      ASP  79   1.720 -22.690 -22.690
  618   2HB   ASP  79           HB2      ASP  79   3.252 -22.643 -22.643
  619    H    ALA  80           HN       ALA  80   5.399 -21.940 -21.940
  620    HA   ALA  80           HA       ALA  80   7.557 -23.083 -23.083
  621   1HB   ALA  80           HB1      ALA  80   7.794 -20.920 -20.920
  622   2HB   ALA  80           HB2      ALA  80   7.598 -21.744 -21.744
  623   3HB   ALA  80           HB3      ALA  80   9.009 -22.066 -22.066
  624    H    ALA  81           HN       ALA  81   6.601 -23.498 -23.498
  625    HA   ALA  81           HA       ALA  81   6.096 -25.648 -25.648
  626   1HB   ALA  81           HB1      ALA  81   6.927 -27.087 -27.087
  627   2HB   ALA  81           HB2      ALA  81   8.590 -26.672 -26.672
  628   3HB   ALA  81           HB3      ALA  81   7.612 -27.597 -27.597
  629   1H1   BME  16           HE1      MER  16  -9.843  10.853  10.853
  630   2H1   BME  16           HE2      MER  16  -9.506   9.217   9.217
  631   1H2   BME  16           HZ1      MER  16  -7.599  11.557  11.557
  632   2H2   BME  16           HZ2      MER  16  -7.469  10.008  10.008
  633    HO1  BME  16           HH       MER  16 -10.076  11.441  11.441

  Start of MODEL   10
    1    H    ASN   3           HN       ASN   3   3.504  -6.596  -6.596
    2    HA   ASN   3           HA       ASN   3   4.968  -9.148  -9.148
    3   1HB   ASN   3           HB1      ASN   3   3.510  -8.461  -8.461
    4   2HB   ASN   3           HB2      ASN   3   2.120  -8.496  -8.496
    5   1HD2  ASN   3          HD21      ASN   3   3.353 -11.878 -11.878
    6   2HD2  ASN   3          HD22      ASN   3   3.860 -10.326 -10.326
    7    H    ALA   4           HN       ALA   4   5.222  -8.896  -8.896
    8    HA   ALA   4           HA       ALA   4   4.986  -9.923  -9.923
    9   1HB   ALA   4           HB1      ALA   4   3.533 -11.703 -11.703
   10   2HB   ALA   4           HB2      ALA   4   2.093 -10.693 -10.693
   11   3HB   ALA   4           HB3      ALA   4   2.907 -11.245 -11.245
   12    HA   PRO   5           HA       PRO   5   3.990  -7.037  -7.037
   13   1HB   PRO   5           HB1      PRO   5   1.995  -9.133  -9.133
   14   2HB   PRO   5           HB2      PRO   5   3.102  -8.173  -8.173
   15   1HG   PRO   5           HG1      PRO   5   3.669 -10.744 -10.744
   16   2HG   PRO   5           HG2      PRO   5   4.900  -9.622  -9.622
   17   1HD   PRO   5           HD1      PRO   5   4.501 -10.544 -10.544
   18   2HD   PRO   5           HD2      PRO   5   5.606  -9.248  -9.248
   19    H    LYS   6           HN       LYS   6   3.119  -5.351  -5.351
   20    HA   LYS   6           HA       LYS   6   0.150  -5.139  -5.139
   21   1HB   LYS   6           HB1      LYS   6   0.251  -3.782  -3.782
   22   2HB   LYS   6           HB2      LYS   6   0.706  -5.464  -5.464
   23   1HG   LYS   6           HG1      LYS   6   2.987  -4.993  -4.993
   24   2HG   LYS   6           HG2      LYS   6   2.902  -3.452  -3.452
   25   1HD   LYS   6           HD1      LYS   6   3.173  -3.109  -3.109
   26   2HD   LYS   6           HD2      LYS   6   1.630  -2.490  -2.490
   27   1HE   LYS   6           HE1      LYS   6   0.536  -4.633  -4.633
   28   2HE   LYS   6           HE2      LYS   6   2.105  -5.128  -5.128
   29   1HZ   LYS   6           HZ1      LYS   6   1.645  -2.535  -2.535
   30   2HZ   LYS   6           HZ2      LYS   6   0.213  -3.404  -3.404
   31   3HZ   LYS   6           HZ3      LYS   6   1.674  -3.956  -3.956
   32    H    ARG   7           HN       ARG   7   1.070  -4.153  -4.153
   33    HA   ARG   7           HA       ARG   7   2.163  -1.960  -1.960
   34   1HB   ARG   7           HB1      ARG   7  -0.775  -2.487  -2.487
   35   2HB   ARG   7           HB2      ARG   7   0.103  -1.254  -1.254
   36   1HG   ARG   7           HG1      ARG   7   1.743  -3.069  -3.069
   37   2HG   ARG   7           HG2      ARG   7   0.658  -4.266  -4.266
   38   1HD   ARG   7           HD1      ARG   7   0.186  -4.070  -4.070
   39   2HD   ARG   7           HD2      ARG   7  -1.148  -3.292  -3.292
   40    HE   ARG   7           HE       ARG   7  -0.085  -1.110  -1.110
   41   1HH1  ARG   7          HH11      ARG   7   2.153  -3.345  -3.345
   42   2HH1  ARG   7          HH12      ARG   7   2.396  -2.618  -2.618
   43   1HH2  ARG   7          HH21      ARG   7  -0.267  -0.383  -0.383
   44   2HH2  ARG   7          HH22      ARG   7   0.994  -0.902  -0.902
   45    HA   PRO   8           HA       PRO   8   0.956   0.906   0.906
   46   1HB   PRO   8           HB1      PRO   8   3.152   2.568   2.568
   47   2HB   PRO   8           HB2      PRO   8   3.208   0.971   0.971
   48   1HG   PRO   8           HG1      PRO   8   3.900   1.690   1.690
   49   2HG   PRO   8           HG2      PRO   8   4.912   0.863   0.863
   50   1HD   PRO   8           HD1      PRO   8   3.509  -0.580  -0.580
   51   2HD   PRO   8           HD2      PRO   8   3.543  -1.119  -1.119
   52    HA   PRO   9           HA       PRO   9  -0.822   4.834   4.834
   53   1HB   PRO   9           HB1      PRO   9   1.382   6.543   6.543
   54   2HB   PRO   9           HB2      PRO   9  -0.163   6.241   6.241
   55   1HG   PRO   9           HG1      PRO   9   2.464   4.774   4.774
   56   2HG   PRO   9           HG2      PRO   9   1.293   5.277   5.277
   57   1HD   PRO   9           HD1      PRO   9   1.235   2.743   2.743
   58   2HD   PRO   9           HD2      PRO   9  -0.320   3.606   3.606
   59    H    SER  10           HN       SER  10  -0.090   7.066   7.066
   60    HA   SER  10           HA       SER  10   1.060   6.429   6.429
   61   1HB   SER  10           HB1      SER  10  -0.312   8.384   8.384
   62   2HB   SER  10           HB2      SER  10  -1.288   7.086   7.086
   63    HG   SER  10           HG       SER  10  -1.851   8.432   8.432
   64    H    ALA  11           HN       ALA  11   0.820   9.123   9.123
   65    HA   ALA  11           HA       ALA  11   3.224  10.073  10.073
   66   1HB   ALA  11           HB1      ALA  11   2.491  11.193  11.193
   67   2HB   ALA  11           HB2      ALA  11   3.805  11.736  11.736
   68   3HB   ALA  11           HB3      ALA  11   3.881  10.152  10.152
   69    H    PHE  12           HN       PHE  12   0.383  10.839  10.839
   70    HA   PHE  12           HA       PHE  12  -0.260  13.332  13.332
   71   1HB   PHE  12           HB1      PHE  12  -1.188  13.384  13.384
   72   2HB   PHE  12           HB2      PHE  12  -1.228  11.607  11.607
   73    HD1  PHE  12           HD1      PHE  12  -3.216  13.844  13.844
   74    HD2  PHE  12           HD2      PHE  12  -3.132  11.149  11.149
   75    HE1  PHE  12           HE1      PHE  12  -5.665  13.832  13.832
   76    HE2  PHE  12           HE2      PHE  12  -5.577  11.152  11.152
   77    HZ   PHE  12           HZ       PHE  12  -6.858  12.481  12.481
   78    H    PHE  13           HN       PHE  13  -0.706   9.956   9.956
   79    HA   PHE  13           HA       PHE  13  -3.065   9.966   9.966
   80   1HB   PHE  13           HB1      PHE  13  -1.719   7.948   7.948
   81   2HB   PHE  13           HB2      PHE  13  -0.608   8.316   8.316
   82    HD1  PHE  13           HD1      PHE  13  -4.248   7.872   7.872
   83    HD2  PHE  13           HD2      PHE  13  -1.148   7.498   7.498
   84    HE1  PHE  13           HE1      PHE  13  -5.842   6.865   6.865
   85    HE2  PHE  13           HE2      PHE  13  -2.748   6.494   6.494
   86    HZ   PHE  13           HZ       PHE  13  -5.094   6.172   6.172
   87    H    LEU  14           HN       LEU  14   0.324  10.467  10.467
   88    HA   LEU  14           HA       LEU  14  -0.080  10.962  10.962
   89   1HB   LEU  14           HB1      LEU  14   1.951  12.387  12.387
   90   2HB   LEU  14           HB2      LEU  14   2.055  12.254  12.254
   91    HG   LEU  14           HG       LEU  14   3.662  10.755  10.755
   92   1HD1  LEU  14          HD11      LEU  14   1.279   8.965   8.965
   93   2HD1  LEU  14          HD12      LEU  14   2.969   8.476   8.476
   94   3HD1  LEU  14          HD13      LEU  14   2.400   9.614   9.614
   95   1HD2  LEU  14          HD21      LEU  14   3.201  10.751  10.751
   96   2HD2  LEU  14          HD22      LEU  14   3.456   9.119   9.119
   97   3HD2  LEU  14          HD23      LEU  14   1.836   9.663   9.663
   98    H    PHE  15           HN       PHE  15   0.350  13.296  13.296
   99    HA   PHE  15           HA       PHE  15  -0.327  15.720  15.720
  100   1HB   PHE  15           HB1      PHE  15   0.525  15.479  15.479
  101   2HB   PHE  15           HB2      PHE  15  -0.866  14.477  14.477
  102    HD1  PHE  15           HD1      PHE  15  -0.590  17.969  17.969
  103    HD2  PHE  15           HD2      PHE  15  -2.003  15.437  15.437
  104    HE1  PHE  15           HE1      PHE  15  -1.674  19.876  19.876
  105    HE2  PHE  15           HE2      PHE  15  -3.075  17.347  17.347
  106    HZ   PHE  15           HZ       PHE  15  -2.907  19.575  19.575
  107    H    CYS  16           HN       MER  16  -2.651  13.656  13.656
  108    HA   CYS  16           HA       MER  16  -5.029  15.032  15.032
  109   1HB   CYS  16           HB1      MER  16  -5.009  13.143  13.143
  110   2HB   CYS  16           HB2      MER  16  -4.587  12.040  12.040
  111    H    SER  17           HN       SER  17  -3.564  12.465  12.465
  112    HA   SER  17           HA       SER  17  -5.499  12.280  12.280
  113   1HB   SER  17           HB1      SER  17  -2.447  12.223  12.223
  114   2HB   SER  17           HB2      SER  17  -3.642  11.577  11.577
  115    HG   SER  17           HG       SER  17  -2.739  10.530  10.530
  116    H    GLU  18           HN       GLU  18  -2.820  14.435  14.435
  117    HA   GLU  18           HA       GLU  18  -3.279  15.969  15.969
  118   1HB   GLU  18           HB1      GLU  18  -1.171  15.802  15.802
  119   2HB   GLU  18           HB2      GLU  18  -1.908  16.796  16.796
  120   1HG   GLU  18           HG1      GLU  18  -0.998  18.558  18.558
  121   2HG   GLU  18           HG2      GLU  18  -2.328  18.360  18.360
  122    H    TYR  19           HN       TYR  19  -4.658  16.146  16.146
  123    HA   TYR  19           HA       TYR  19  -5.878  18.807  18.807
  124   1HB   TYR  19           HB1      TYR  19  -5.522  16.819  16.819
  125   2HB   TYR  19           HB2      TYR  19  -6.902  17.941  17.941
  126    HD1  TYR  19           HD1      TYR  19  -3.371  18.131  18.131
  127    HD2  TYR  19           HD2      TYR  19  -6.404  19.858  19.858
  128    HE1  TYR  19           HE1      TYR  19  -1.798  19.867  19.867
  129    HE2  TYR  19           HE2      TYR  19  -4.831  21.601  21.601
  130    HH   TYR  19           HH       TYR  19  -2.723  22.317  22.317
  131    H    ARG  20           HN       ARG  20  -7.068  15.596  15.596
  132    HA   ARG  20           HA       ARG  20  -9.662  15.461  15.461
  133   1HB   ARG  20           HB1      ARG  20  -8.611  13.720  13.720
  134   2HB   ARG  20           HB2      ARG  20  -8.237  14.699  14.699
  135   1HG   ARG  20           HG1      ARG  20 -10.665  14.832  14.832
  136   2HG   ARG  20           HG2      ARG  20 -11.087  14.008  14.008
  137   1HD   ARG  20           HD1      ARG  20 -11.110  12.386  12.386
  138   2HD   ARG  20           HD2      ARG  20  -9.732  12.017  12.017
  139    HE   ARG  20           HE       ARG  20  -8.319  13.285  13.285
  140   1HH1  ARG  20          HH11      ARG  20 -11.011  14.075  14.075
  141   2HH1  ARG  20          HH12      ARG  20 -10.900  13.121  13.121
  142   1HH2  ARG  20          HH21      ARG  20  -8.286  11.158  11.158
  143   2HH2  ARG  20          HH22      ARG  20  -9.310  11.419  11.419
  144    HA   PRO  21           HA       PRO  21 -11.475  17.953  17.953
  145   1HB   PRO  21           HB1      PRO  21  -9.979  19.243  19.243
  146   2HB   PRO  21           HB2      PRO  21 -10.191  17.482  17.482
  147   1HG   PRO  21           HG1      PRO  21  -7.849  19.014  19.014
  148   2HG   PRO  21           HG2      PRO  21  -7.794  17.761  17.761
  149   1HD   PRO  21           HD1      PRO  21  -7.522  17.050  17.050
  150   2HD   PRO  21           HD2      PRO  21  -8.481  16.055  16.055
  151    H    LYS  22           HN       LYS  22  -8.538  19.619  19.619
  152    HA   LYS  22           HA       LYS  22  -9.386  22.252  22.252
  153   1HB   LYS  22           HB1      LYS  22  -7.079  21.482  21.482
  154   2HB   LYS  22           HB2      LYS  22  -7.313  20.751  20.751
  155   1HG   LYS  22           HG1      LYS  22  -7.516  22.904  22.904
  156   2HG   LYS  22           HG2      LYS  22  -7.656  23.736  23.736
  157   1HD   LYS  22           HD1      LYS  22  -5.360  23.151  23.151
  158   2HD   LYS  22           HD2      LYS  22  -5.192  22.104  22.104
  159   1HE   LYS  22           HE1      LYS  22  -5.674  25.115  25.115
  160   2HE   LYS  22           HE2      LYS  22  -4.088  24.365  24.365
  161   1HZ   LYS  22           HZ1      LYS  22  -5.780  23.050  23.050
  162   2HZ   LYS  22           HZ2      LYS  22  -5.974  24.720  24.720
  163   3HZ   LYS  22           HZ3      LYS  22  -4.430  24.020  24.020
  164    H    ILE  23           HN       ILE  23  -9.819  19.793  19.793
  165    HA   ILE  23           HA       ILE  23 -10.754  21.855  21.855
  166    HB   ILE  23           HB       ILE  23 -11.091  18.825  18.825
  167   1HG1  ILE  23          HG11      ILE  23  -8.878  20.584  20.584
  168   2HG1  ILE  23          HG12      ILE  23  -8.663  19.511  19.511
  169   1HG2  ILE  23          HG21      ILE  23 -12.553  20.306  20.306
  170   2HG2  ILE  23          HG22      ILE  23 -11.107  21.085  21.085
  171   3HG2  ILE  23          HG23      ILE  23 -11.419  19.391  19.391
  172   1HD1  ILE  23          HD11      ILE  23  -9.369  17.588  17.588
  173   2HD1  ILE  23          HD12      ILE  23  -9.550  18.640  18.640
  174   3HD1  ILE  23          HD13      ILE  23  -7.967  18.398  18.398
  175    H    LYS  24           HN       LYS  24 -11.915  19.188  19.188
  176    HA   LYS  24           HA       LYS  24 -14.663  19.297  19.297
  177   1HB   LYS  24           HB1      LYS  24 -13.248  17.575  17.575
  178   2HB   LYS  24           HB2      LYS  24 -13.090  18.526  18.526
  179   1HG   LYS  24           HG1      LYS  24 -15.544  18.425  18.425
  180   2HG   LYS  24           HG2      LYS  24 -15.820  17.588  17.588
  181   1HD   LYS  24           HD1      LYS  24 -15.899  15.960  15.960
  182   2HD   LYS  24           HD2      LYS  24 -14.469  15.661  15.661
  183   1HE   LYS  24           HE1      LYS  24 -13.071  16.815  16.815
  184   2HE   LYS  24           HE2      LYS  24 -14.489  17.188  17.188
  185   1HZ   LYS  24           HZ1      LYS  24 -14.477  14.447  14.447
  186   2HZ   LYS  24           HZ2      LYS  24 -12.923  14.877  14.877
  187   3HZ   LYS  24           HZ3      LYS  24 -14.279  15.225  15.225
  188    H    GLY  25           HN       GLY  25 -12.702  21.411  21.411
  189   1HA   GLY  25           HA1      GLY  25 -14.778  22.515  22.515
  190   2HA   GLY  25           HA2      GLY  25 -13.112  23.083  23.083
  191    H    GLU  26           HN       GLU  26 -12.886  23.500  23.500
  192    HA   GLU  26           HA       GLU  26 -14.244  26.014  26.014
  193   1HB   GLU  26           HB1      GLU  26 -12.485  24.442  24.442
  194   2HB   GLU  26           HB2      GLU  26 -12.902  26.136  26.136
  195   1HG   GLU  26           HG1      GLU  26 -11.428  24.947  24.947
  196   2HG   GLU  26           HG2      GLU  26 -10.634  25.778  25.778
  197    H    HIS  27           HN       HIS  27 -14.470  22.897  22.897
  198    HA   HIS  27           HA       HIS  27 -16.984  23.680  23.680
  199   1HB   HIS  27           HB1      HIS  27 -14.835  21.800  21.800
  200   2HB   HIS  27           HB2      HIS  27 -16.229  22.420  22.420
  201    HD1  HIS  27           HD1      HIS  27 -16.151  25.241  25.241
  202    HD2  HIS  27           HD2      HIS  27 -12.597  23.263  23.263
  203    HE1  HIS  27           HE1      HIS  27 -14.389  26.879  26.879
  204    HA   PRO  28           HA       PRO  28 -17.907  19.885  19.885
  205   1HB   PRO  28           HB1      PRO  28 -19.847  20.867  20.867
  206   2HB   PRO  28           HB2      PRO  28 -18.147  21.184  21.184
  207   1HG   PRO  28           HG1      PRO  28 -20.099  22.975  22.975
  208   2HG   PRO  28           HG2      PRO  28 -19.127  23.409  23.409
  209   1HD   PRO  28           HD1      PRO  28 -18.208  23.918  23.918
  210   2HD   PRO  28           HD2      PRO  28 -17.074  23.459  23.459
  211    H    GLY  29           HN       GLY  29 -18.477  20.575  20.575
  212   1HA   GLY  29           HA1      GLY  29 -21.257  19.682  19.682
  213   2HA   GLY  29           HA2      GLY  29 -20.575  20.973  20.973
  214    H    LEU  30           HN       LEU  30 -17.973  19.103  19.103
  215    HA   LEU  30           HA       LEU  30 -18.167  17.796  17.796
  216   1HB   LEU  30           HB1      LEU  30 -15.955  17.714  17.714
  217   2HB   LEU  30           HB2      LEU  30 -15.770  17.233  17.233
  218    HG   LEU  30           HG       LEU  30 -16.242  20.006  20.006
  219   1HD1  LEU  30          HD11      LEU  30 -13.866  18.751  18.751
  220   2HD1  LEU  30          HD12      LEU  30 -13.972  20.441  20.441
  221   3HD1  LEU  30          HD13      LEU  30 -13.951  19.198  19.198
  222   1HD2  LEU  30          HD21      LEU  30 -17.419  19.771  19.771
  223   2HD2  LEU  30          HD22      LEU  30 -16.035  20.837  20.837
  224   3HD2  LEU  30          HD23      LEU  30 -15.925  19.199  19.199
  225    H    SER  31           HN       SER  31 -17.456  15.593  15.593
  226    HA   SER  31           HA       SER  31 -18.517  13.722  13.722
  227   1HB   SER  31           HB1      SER  31 -19.591  13.758  13.758
  228   2HB   SER  31           HB2      SER  31 -18.044  13.115  13.115
  229    HG   SER  31           HG       SER  31 -18.589  11.285  11.285
  230    H    ILE  32           HN       ILE  32 -17.329  11.513  11.513
  231    HA   ILE  32           HA       ILE  32 -14.532  12.004  12.004
  232    HB   ILE  32           HB       ILE  32 -15.990  10.263  10.263
  233   1HG1  ILE  32          HG11      ILE  32 -14.386   8.384   8.384
  234   2HG1  ILE  32          HG12      ILE  32 -13.576   8.975   8.975
  235   1HG2  ILE  32          HG21      ILE  32 -15.842   8.875   8.875
  236   2HG2  ILE  32          HG22      ILE  32 -16.486   8.140   8.140
  237   3HG2  ILE  32          HG23      ILE  32 -17.285   9.532   9.532
  238   1HD1  ILE  32          HD11      ILE  32 -13.703  10.390  10.390
  239   2HD1  ILE  32          HD12      ILE  32 -12.294   9.595   9.595
  240   3HD1  ILE  32          HD13      ILE  32 -12.921  11.054  11.054
  241    H    GLY  33           HN       GLY  33 -16.081  12.054  12.054
  242   1HA   GLY  33           HA1      GLY  33 -13.896  10.954  10.954
  243   2HA   GLY  33           HA2      GLY  33 -15.579  11.142  11.142
  244    H    ASP  34           HN       ASP  34 -15.205  13.734  13.734
  245    HA   ASP  34           HA       ASP  34 -14.385  15.481  15.481
  246   1HB   ASP  34           HB1      ASP  34 -16.024  15.848  15.848
  247   2HB   ASP  34           HB2      ASP  34 -15.636  17.234  17.234
  248    H    VAL  35           HN       VAL  35 -14.203  15.077  15.077
  249    HA   VAL  35           HA       VAL  35 -12.134  16.960  16.960
  250    HB   VAL  35           HB       VAL  35 -12.933  14.329  14.329
  251   1HG1  VAL  35          HG11      VAL  35 -11.190  16.584  16.584
  252   2HG1  VAL  35          HG12      VAL  35 -11.710  15.178  15.178
  253   3HG1  VAL  35          HG13      VAL  35 -10.606  14.987  14.987
  254   1HG2  VAL  35          HG21      VAL  35 -13.608  17.208  17.208
  255   2HG2  VAL  35          HG22      VAL  35 -14.708  16.013  16.013
  256   3HG2  VAL  35          HG23      VAL  35 -14.067  15.801  15.801
  257    H    ALA  36           HN       ALA  36 -12.254  13.764  13.764
  258    HA   ALA  36           HA       ALA  36  -9.452  13.181  13.181
  259   1HB   ALA  36           HB1      ALA  36 -11.791  11.867  11.867
  260   2HB   ALA  36           HB2      ALA  36 -10.208  11.108  11.108
  261   3HB   ALA  36           HB3      ALA  36 -11.160  11.466  11.466
  262    H    LYS  37           HN       LYS  37 -11.688  13.977  13.977
  263    HA   LYS  37           HA       LYS  37  -9.438  13.915  13.915
  264   1HB   LYS  37           HB1      LYS  37 -12.310  14.819  14.819
  265   2HB   LYS  37           HB2      LYS  37 -11.126  15.046  15.046
  266   1HG   LYS  37           HG1      LYS  37 -10.586  12.583  12.583
  267   2HG   LYS  37           HG2      LYS  37 -11.894  12.392  12.392
  268   1HD   LYS  37           HD1      LYS  37 -12.736  11.791  11.791
  269   2HD   LYS  37           HD2      LYS  37 -13.479  13.313  13.313
  270   1HE   LYS  37           HE1      LYS  37 -11.894  14.588  14.588
  271   2HE   LYS  37           HE2      LYS  37 -10.960  13.134  13.134
  272   1HZ   LYS  37           HZ1      LYS  37 -13.585  12.615  12.615
  273   2HZ   LYS  37           HZ2      LYS  37 -13.180  14.142  14.142
  274   3HZ   LYS  37           HZ3      LYS  37 -12.221  12.794  12.794
  275    H    LYS  38           HN       LYS  38 -10.908  16.358  16.358
  276    HA   LYS  38           HA       LYS  38  -9.823  18.578  18.578
  277   1HB   LYS  38           HB1      LYS  38 -11.923  18.750  18.750
  278   2HB   LYS  38           HB2      LYS  38 -11.042  18.397  18.397
  279   1HG   LYS  38           HG1      LYS  38  -9.793  20.409  20.409
  280   2HG   LYS  38           HG2      LYS  38 -10.239  20.749  20.749
  281   1HD   LYS  38           HD1      LYS  38 -12.209  20.665  20.665
  282   2HD   LYS  38           HD2      LYS  38 -11.440  22.136  22.136
  283   1HE   LYS  38           HE1      LYS  38 -13.273  20.353  20.353
  284   2HE   LYS  38           HE2      LYS  38 -13.693  21.913  21.913
  285   1HZ   LYS  38           HZ1      LYS  38 -11.323  22.230  22.230
  286   2HZ   LYS  38           HZ2      LYS  38 -12.410  21.375  21.375
  287   3HZ   LYS  38           HZ3      LYS  38 -12.853  22.879  22.879
  288    H    LEU  39           HN       LEU  39  -9.055  16.927  16.927
  289    HA   LEU  39           HA       LEU  39  -6.584  18.512  18.512
  290   1HB   LEU  39           HB1      LEU  39  -6.828  18.094  18.094
  291   2HB   LEU  39           HB2      LEU  39  -8.349  17.324  17.324
  292    HG   LEU  39           HG       LEU  39  -6.842  15.273  15.273
  293   1HD1  LEU  39          HD11      LEU  39  -4.690  16.569  16.569
  294   2HD1  LEU  39          HD12      LEU  39  -5.158  17.036  17.036
  295   3HD1  LEU  39          HD13      LEU  39  -4.769  15.364  15.364
  296   1HD2  LEU  39          HD21      LEU  39  -8.489  15.483  15.483
  297   2HD2  LEU  39          HD22      LEU  39  -7.019  14.709  14.709
  298   3HD2  LEU  39          HD23      LEU  39  -7.293  16.390  16.390
  299    H    GLY  40           HN       GLY  40  -7.657  15.613  15.613
  300   1HA   GLY  40           HA1      GLY  40  -5.012  14.326  14.326
  301   2HA   GLY  40           HA2      GLY  40  -6.403  13.782  13.782
  302    H    GLU  41           HN       GLU  41  -6.717  16.728  16.728
  303    HA   GLU  41           HA       GLU  41  -5.003  16.671  16.671
  304   1HB   GLU  41           HB1      GLU  41  -7.339  17.139  17.139
  305   2HB   GLU  41           HB2      GLU  41  -7.271  18.467  18.467
  306   1HG   GLU  41           HG1      GLU  41  -5.650  19.622  19.622
  307   2HG   GLU  41           HG2      GLU  41  -5.833  18.303  18.303
  308    H    MET  42           HN       MET  42  -5.787  18.731  18.731
  309    HA   MET  42           HA       MET  42  -3.895  20.773  20.773
  310   1HB   MET  42           HB1      MET  42  -4.889  19.644  19.644
  311   2HB   MET  42           HB2      MET  42  -3.861  21.077  21.077
  312   1HG   MET  42           HG1      MET  42  -5.677  21.984  21.984
  313   2HG   MET  42           HG2      MET  42  -6.700  20.750  20.750
  314   1HE   MET  42           HE1      MET  42  -7.945  20.698  20.698
  315   2HE   MET  42           HE2      MET  42  -6.382  20.528  20.528
  316   3HE   MET  42           HE3      MET  42  -7.562  21.702  21.702
  317    H    TRP  43           HN       TRP  43  -3.639  17.572  17.572
  318    HA   TRP  43           HA       TRP  43  -1.085  17.646  17.646
  319   1HB   TRP  43           HB1      TRP  43  -2.404  15.651  15.651
  320   2HB   TRP  43           HB2      TRP  43  -2.577  15.573  15.573
  321    HD1  TRP  43           HD1      TRP  43  -1.068  13.939  13.939
  322    HE1  TRP  43           HE1      TRP  43   1.202  13.041  13.041
  323    HE3  TRP  43           HE3      TRP  43  -0.146  16.468  16.468
  324    HZ2  TRP  43           HZ2      TRP  43   3.259  13.287  13.287
  325    HZ3  TRP  43           HZ3      TRP  43   1.840  16.135  16.135
  326    HH2  TRP  43           HH2      TRP  43   3.606  14.544  14.544
  327    H    ASN  44           HN       ASN  44  -2.126  17.147  17.147
  328    HA   ASN  44           HA       ASN  44   0.543  16.917  16.917
  329   1HB   ASN  44           HB1      ASN  44  -2.035  17.691  17.691
  330   2HB   ASN  44           HB2      ASN  44  -0.546  17.103  17.103
  331   1HD2  ASN  44          HD21      ASN  44  -3.129  14.392  14.392
  332   2HD2  ASN  44          HD22      ASN  44  -3.523  15.994  15.994
  333    H    ASN  45           HN       ASN  45  -1.451  19.518  19.518
  334    HA   ASN  45           HA       ASN  45   0.543  21.534  21.534
  335   1HB   ASN  45           HB1      ASN  45  -2.372  22.249  22.249
  336   2HB   ASN  45           HB2      ASN  45  -1.202  22.977  22.977
  337   1HD2  ASN  45          HD21      ASN  45  -3.661  20.075  20.075
  338   2HD2  ASN  45          HD22      ASN  45  -3.775  20.857  20.857
  339    H    THR  46           HN       THR  46   0.950  20.401  20.401
  340    HA   THR  46           HA       THR  46  -0.262  22.256  22.256
  341    HB   THR  46           HB       THR  46  -0.017  19.854  19.854
  342    HG1  THR  46           HG1      THR  46   1.849  20.853  20.853
  343   1HG2  THR  46          HG21      THR  46   2.169  19.273  19.273
  344   2HG2  THR  46          HG22      THR  46   3.032  20.265  20.265
  345   3HG2  THR  46          HG23      THR  46   2.146  18.855  18.855
  346    H    ALA  47           HN       ALA  47   2.924  21.376  21.376
  347    HA   ALA  47           HA       ALA  47   3.914  24.066  24.066
  348   1HB   ALA  47           HB1      ALA  47   4.121  23.620  23.620
  349   2HB   ALA  47           HB2      ALA  47   5.086  22.203  22.203
  350   3HB   ALA  47           HB3      ALA  47   5.689  23.806  23.806
  351    H    ALA  48           HN       ALA  48   4.779  20.782  20.782
  352    HA   ALA  48           HA       ALA  48   5.671  19.208  19.208
  353   1HB   ALA  48           HB1      ALA  48   5.892  20.886  20.886
  354   2HB   ALA  48           HB2      ALA  48   7.304  21.572  21.572
  355   3HB   ALA  48           HB3      ALA  48   7.330  19.913  19.913
  356    H    ASP  49           HN       ASP  49   7.002  21.860  21.860
  357    HA   ASP  49           HA       ASP  49   9.411  20.454  20.454
  358   1HB   ASP  49           HB1      ASP  49   8.526  23.350  23.350
  359   2HB   ASP  49           HB2      ASP  49  10.131  22.730  22.730
  360    H    ASP  50           HN       ASP  50   6.430  20.318  20.318
  361    HA   ASP  50           HA       ASP  50   6.737  20.356  20.356
  362   1HB   ASP  50           HB1      ASP  50   5.231  22.224  22.224
  363   2HB   ASP  50           HB2      ASP  50   4.229  21.015  21.015
  364    H    LYS  51           HN       LYS  51   6.186  18.800  18.800
  365    HA   LYS  51           HA       LYS  51   4.560  16.594  16.594
  366   1HB   LYS  51           HB1      LYS  51   6.178  16.840  16.840
  367   2HB   LYS  51           HB2      LYS  51   4.997  15.594  15.594
  368   1HG   LYS  51           HG1      LYS  51   3.233  17.332  17.332
  369   2HG   LYS  51           HG2      LYS  51   4.421  18.579  18.579
  370   1HD   LYS  51           HD1      LYS  51   3.291  18.075  18.075
  371   2HD   LYS  51           HD2      LYS  51   4.887  17.351  17.351
  372   1HE   LYS  51           HE1      LYS  51   3.963  15.164  15.164
  373   2HE   LYS  51           HE2      LYS  51   2.379  15.925  15.925
  374   1HZ   LYS  51           HZ1      LYS  51   3.382  16.569  16.569
  375   2HZ   LYS  51           HZ2      LYS  51   3.595  14.897  14.897
  376   3HZ   LYS  51           HZ3      LYS  51   2.047  15.585  15.585
  377    H    GLN  52           HN       GLN  52   7.810  17.069  17.069
  378    HA   GLN  52           HA       GLN  52   9.217  14.901  14.901
  379   1HB   GLN  52           HB1      GLN  52   9.821  17.660  17.660
  380   2HB   GLN  52           HB2      GLN  52  10.596  16.967  16.967
  381   1HG   GLN  52           HG1      GLN  52  12.172  16.950  16.950
  382   2HG   GLN  52           HG2      GLN  52  11.746  15.300  15.300
  383   1HE2  GLN  52          HE21      GLN  52   9.490  15.973  15.973
  384   2HE2  GLN  52          HE22      GLN  52   9.043  16.439  16.439
  385    HA   PRO  53           HA       PRO  53   9.779  14.765  14.765
  386   1HB   PRO  53           HB1      PRO  53   7.605  15.917  15.917
  387   2HB   PRO  53           HB2      PRO  53   9.180  16.679  16.679
  388   1HG   PRO  53           HG1      PRO  53   6.712  16.916  16.916
  389   2HG   PRO  53           HG2      PRO  53   7.673  18.232  18.232
  390   1HD   PRO  53           HD1      PRO  53   8.225  17.545  17.545
  391   2HD   PRO  53           HD2      PRO  53   9.609  17.647  17.647
  392    H    TYR  54           HN       TYR  54   6.463  14.926  14.926
  393    HA   TYR  54           HA       TYR  54   5.596  12.536  12.536
  394   1HB   TYR  54           HB1      TYR  54   4.328  14.081  14.081
  395   2HB   TYR  54           HB2      TYR  54   3.527  12.802  12.802
  396    HD1  TYR  54           HD1      TYR  54   3.995  13.326  13.326
  397    HD2  TYR  54           HD2      TYR  54   3.540  16.187  16.187
  398    HE1  TYR  54           HE1      TYR  54   3.264  14.989  14.989
  399    HE2  TYR  54           HE2      TYR  54   2.811  17.855  17.855
  400    HH   TYR  54           HH       TYR  54   1.636  17.632  17.632
  401    H    GLU  55           HN       GLU  55   6.224  13.356  13.356
  402    HA   GLU  55           HA       GLU  55   5.736  10.864  10.864
  403   1HB   GLU  55           HB1      GLU  55   6.579  13.383  13.383
  404   2HB   GLU  55           HB2      GLU  55   7.985  12.413  12.413
  405   1HG   GLU  55           HG1      GLU  55   5.173  11.688  11.688
  406   2HG   GLU  55           HG2      GLU  55   6.275  12.549  12.549
  407    H    LYS  56           HN       LYS  56   8.997  12.010  12.010
  408    HA   LYS  56           HA       LYS  56  10.349   9.646   9.646
  409   1HB   LYS  56           HB1      LYS  56  10.937  11.561  11.561
  410   2HB   LYS  56           HB2      LYS  56  12.026  10.289  10.289
  411   1HG   LYS  56           HG1      LYS  56  11.804  11.404  11.404
  412   2HG   LYS  56           HG2      LYS  56  11.175  12.788  12.788
  413   1HD   LYS  56           HD1      LYS  56  13.902  11.515  11.515
  414   2HD   LYS  56           HD2      LYS  56  13.607  13.006  13.006
  415   1HE   LYS  56           HE1      LYS  56  14.350  13.647  13.647
  416   2HE   LYS  56           HE2      LYS  56  12.616  13.928  13.928
  417   1HZ   LYS  56           HZ1      LYS  56  13.085  11.288  11.288
  418   2HZ   LYS  56           HZ2      LYS  56  14.117  12.289  12.289
  419   3HZ   LYS  56           HZ3      LYS  56  12.445  12.565  12.565
  420    H    LYS  57           HN       LYS  57   8.277  10.368  10.368
  421    HA   LYS  57           HA       LYS  57   9.118   8.164   8.164
  422   1HB   LYS  57           HB1      LYS  57   7.154  10.317  10.317
  423   2HB   LYS  57           HB2      LYS  57   6.317   8.818   8.818
  424   1HG   LYS  57           HG1      LYS  57   8.034   8.328   8.328
  425   2HG   LYS  57           HG2      LYS  57   8.867   9.821   9.821
  426   1HD   LYS  57           HD1      LYS  57   6.827  11.120  11.120
  427   2HD   LYS  57           HD2      LYS  57   5.996   9.628   9.628
  428   1HE   LYS  57           HE1      LYS  57   6.916  10.658  10.658
  429   2HE   LYS  57           HE2      LYS  57   7.763   9.155   9.155
  430   1HZ   LYS  57           HZ1      LYS  57   9.079  11.196  11.196
  431   2HZ   LYS  57           HZ2      LYS  57   8.818  11.730  11.730
  432   3HZ   LYS  57           HZ3      LYS  57   9.636  10.269  10.269
  433    H    ALA  58           HN       ALA  58   6.239   8.677   8.677
  434    HA   ALA  58           HA       ALA  58   5.100   6.162   6.162
  435   1HB   ALA  58           HB1      ALA  58   4.180   8.098   8.098
  436   2HB   ALA  58           HB2      ALA  58   5.485   7.966   7.966
  437   3HB   ALA  58           HB3      ALA  58   4.295   6.680   6.680
  438    H    ALA  59           HN       ALA  59   7.621   7.300   7.300
  439    HA   ALA  59           HA       ALA  59   8.189   4.996   4.996
  440   1HB   ALA  59           HB1      ALA  59   9.179   7.236   7.236
  441   2HB   ALA  59           HB2      ALA  59  10.158   7.123   7.123
  442   3HB   ALA  59           HB3      ALA  59  10.447   6.024   6.024
  443    H    LYS  60           HN       LYS  60   9.962   6.074   6.074
  444    HA   LYS  60           HA       LYS  60  11.614   3.920   3.920
  445   1HB   LYS  60           HB1      LYS  60  11.511   6.085   6.085
  446   2HB   LYS  60           HB2      LYS  60  10.154   5.443   5.443
  447   1HG   LYS  60           HG1      LYS  60  11.604   3.469   3.469
  448   2HG   LYS  60           HG2      LYS  60  12.948   4.211   4.211
  449   1HD   LYS  60           HD1      LYS  60  11.464   5.396   5.396
  450   2HD   LYS  60           HD2      LYS  60  13.047   4.638   4.638
  451   1HE   LYS  60           HE1      LYS  60  13.946   6.409   6.409
  452   2HE   LYS  60           HE2      LYS  60  12.371   7.199   7.199
  453   1HZ   LYS  60           HZ1      LYS  60  13.115   6.712   6.712
  454   2HZ   LYS  60           HZ2      LYS  60  14.433   7.430   7.430
  455   3HZ   LYS  60           HZ3      LYS  60  12.922   8.200   8.200
  456    H    LEU  61           HN       LEU  61   8.243   4.232   4.232
  457    HA   LEU  61           HA       LEU  61   8.217   1.666   1.666
  458   1HB   LEU  61           HB1      LEU  61   5.882   3.129   3.129
  459   2HB   LEU  61           HB2      LEU  61   5.754   1.913   1.913
  460    HG   LEU  61           HG       LEU  61   7.086   4.645   4.645
  461   1HD1  LEU  61          HD11      LEU  61   4.645   3.481   3.481
  462   2HD1  LEU  61          HD12      LEU  61   5.347   5.065   5.065
  463   3HD1  LEU  61          HD13      LEU  61   4.682   4.722   4.722
  464   1HD2  LEU  61          HD21      LEU  61   6.975   2.442   2.442
  465   2HD2  LEU  61          HD22      LEU  61   8.427   3.028   3.028
  466   3HD2  LEU  61          HD23      LEU  61   7.542   4.086   4.086
  467    H    LYS  62           HN       LYS  62   6.869   2.512   2.512
  468    HA   LYS  62           HA       LYS  62   6.256   0.026   0.026
  469   1HB   LYS  62           HB1      LYS  62   6.147   2.235   2.235
  470   2HB   LYS  62           HB2      LYS  62   7.880   2.186   2.186
  471   1HG   LYS  62           HG1      LYS  62   6.672  -0.329  -0.329
  472   2HG   LYS  62           HG2      LYS  62   5.897   1.023   1.023
  473   1HD   LYS  62           HD1      LYS  62   8.231   1.898   1.898
  474   2HD   LYS  62           HD2      LYS  62   8.881   0.392   0.392
  475   1HE   LYS  62           HE1      LYS  62   6.819   0.590   0.590
  476   2HE   LYS  62           HE2      LYS  62   8.531   0.299   0.299
  477   1HZ   LYS  62           HZ1      LYS  62   7.566  -1.537  -1.537
  478   2HZ   LYS  62           HZ2      LYS  62   6.545  -1.554  -1.554
  479   3HZ   LYS  62           HZ3      LYS  62   8.209  -1.831  -1.831
  480    H    GLU  63           HN       GLU  63   9.452   1.441   1.441
  481    HA   GLU  63           HA       GLU  63  10.941  -0.704  -0.704
  482   1HB   GLU  63           HB1      GLU  63  11.702   1.758   1.758
  483   2HB   GLU  63           HB2      GLU  63  11.817   1.469   1.469
  484   1HG   GLU  63           HG1      GLU  63  13.409  -0.468  -0.468
  485   2HG   GLU  63           HG2      GLU  63  13.903   1.204   1.204
  486    H    LYS  64           HN       LYS  64  10.351   0.150   0.150
  487    HA   LYS  64           HA       LYS  64  11.798  -1.987  -1.987
  488   1HB   LYS  64           HB1      LYS  64  10.651  -0.010  -0.010
  489   2HB   LYS  64           HB2      LYS  64   9.178  -0.966  -0.966
  490   1HG   LYS  64           HG1      LYS  64  10.273  -2.856  -2.856
  491   2HG   LYS  64           HG2      LYS  64  11.802  -2.009  -2.009
  492   1HD   LYS  64           HD1      LYS  64  10.815  -1.843  -1.843
  493   2HD   LYS  64           HD2      LYS  64  10.884  -0.263  -0.263
  494   1HE   LYS  64           HE1      LYS  64   8.373  -1.922  -1.922
  495   2HE   LYS  64           HE2      LYS  64   8.642  -0.979  -0.979
  496   1HZ   LYS  64           HZ1      LYS  64   9.201   0.602   0.602
  497   2HZ   LYS  64           HZ2      LYS  64   7.665  -0.095  -0.095
  498   3HZ   LYS  64           HZ3      LYS  64   8.025   0.830   0.830
  499    H    TYR  65           HN       TYR  65   8.491  -1.883  -1.883
  500    HA   TYR  65           HA       TYR  65   7.561  -4.416  -4.416
  501   1HB   TYR  65           HB1      TYR  65   5.920  -3.013  -3.013
  502   2HB   TYR  65           HB2      TYR  65   6.952  -2.486  -2.486
  503    HD1  TYR  65           HD1      TYR  65   6.774  -6.108  -6.108
  504    HD2  TYR  65           HD2      TYR  65   4.589  -2.568  -2.568
  505    HE1  TYR  65           HE1      TYR  65   5.429  -7.337  -7.337
  506    HE2  TYR  65           HE2      TYR  65   3.242  -3.813  -3.813
  507    HH   TYR  65           HH       TYR  65   3.797  -6.138  -6.138
  508    H    GLU  66           HN       GLU  66   8.827  -3.527  -3.527
  509    HA   GLU  66           HA       GLU  66   9.166  -5.989  -5.989
  510   1HB   GLU  66           HB1      GLU  66  11.149  -3.715  -3.715
  511   2HB   GLU  66           HB2      GLU  66  11.049  -4.989  -4.989
  512   1HG   GLU  66           HG1      GLU  66   8.587  -3.316  -3.316
  513   2HG   GLU  66           HG2      GLU  66   9.822  -2.654  -2.654
  514    H    LYS  67           HN       LYS  67  11.188  -4.600  -4.600
  515    HA   LYS  67           HA       LYS  67  13.267  -6.598  -6.598
  516   1HB   LYS  67           HB1      LYS  67  12.671  -4.213  -4.213
  517   2HB   LYS  67           HB2      LYS  67  13.718  -5.408  -5.408
  518   1HG   LYS  67           HG1      LYS  67  15.015  -3.729  -3.729
  519   2HG   LYS  67           HG2      LYS  67  15.216  -5.290  -5.290
  520   1HD   LYS  67           HD1      LYS  67  13.561  -4.534  -4.534
  521   2HD   LYS  67           HD2      LYS  67  13.477  -2.978  -2.978
  522   1HE   LYS  67           HE1      LYS  67  15.061  -2.913  -2.913
  523   2HE   LYS  67           HE2      LYS  67  15.868  -2.605  -2.605
  524   1HZ   LYS  67           HZ1      LYS  67  15.861  -5.364  -5.364
  525   2HZ   LYS  67           HZ2      LYS  67  16.411  -4.600  -4.600
  526   3HZ   LYS  67           HZ3      LYS  67  17.185  -4.305  -4.305
  527    H    ASP  68           HN       ASP  68  10.493  -6.245  -6.245
  528    HA   ASP  68           HA       ASP  68  11.104  -8.331  -8.331
  529   1HB   ASP  68           HB1      ASP  68   8.838  -6.481  -6.481
  530   2HB   ASP  68           HB2      ASP  68   8.465  -7.975  -7.975
  531    H    ILE  69           HN       ILE  69   9.557  -7.935  -7.935
  532    HA   ILE  69           HA       ILE  69   8.235 -10.551 -10.551
  533    HB   ILE  69           HB       ILE  69   7.055  -8.909  -8.909
  534   1HG1  ILE  69          HG11      ILE  69   6.754 -10.124 -10.124
  535   2HG1  ILE  69          HG12      ILE  69   8.365 -10.823 -10.823
  536   1HG2  ILE  69          HG21      ILE  69   8.942  -7.549  -7.549
  537   2HG2  ILE  69          HG22      ILE  69   9.482  -8.766  -8.766
  538   3HG2  ILE  69          HG23      ILE  69   7.951  -7.951  -7.951
  539   1HD1  ILE  69          HD11      ILE  69   6.134 -11.348 -11.348
  540   2HD1  ILE  69          HD12      ILE  69   6.625 -12.471 -12.471
  541   3HD1  ILE  69          HD13      ILE  69   7.712 -12.085 -12.085
  542    H    ALA  70           HN       ALA  70  10.786  -9.076  -9.076
  543    HA   ALA  70           HA       ALA  70  11.796 -11.359 -11.359
  544   1HB   ALA  70           HB1      ALA  70  13.343  -8.950  -8.950
  545   2HB   ALA  70           HB2      ALA  70  13.963 -10.056 -10.056
  546   3HB   ALA  70           HB3      ALA  70  12.583  -9.032  -9.032
  547    H    ALA  71           HN       ALA  71  12.038 -10.306 -10.306
  548    HA   ALA  71           HA       ALA  71  14.137 -12.224 -12.224
  549   1HB   ALA  71           HB1      ALA  71  12.472 -10.388 -10.388
  550   2HB   ALA  71           HB2      ALA  71  13.841 -11.345 -11.345
  551   3HB   ALA  71           HB3      ALA  71  14.083 -10.049 -10.049
  552    H    TYR  72           HN       TYR  72  10.705 -11.728 -11.728
  553    HA   TYR  72           HA       TYR  72  10.232 -13.974 -13.974
  554   1HB   TYR  72           HB1      TYR  72   8.601 -12.289 -12.289
  555   2HB   TYR  72           HB2      TYR  72   7.901 -13.828 -13.828
  556    HD1  TYR  72           HD1      TYR  72  10.107 -11.484 -11.484
  557    HD2  TYR  72           HD2      TYR  72   6.212 -13.115 -13.115
  558    HE1  TYR  72           HE1      TYR  72   9.377 -10.435 -10.435
  559    HE2  TYR  72           HE2      TYR  72   5.485 -12.063 -12.063
  560    HH   TYR  72           HH       TYR  72   6.960 -11.263 -11.263
  561    H    ARG  73           HN       ARG  73  10.412 -13.735 -13.735
  562    HA   ARG  73           HA       ARG  73   9.625 -16.534 -16.534
  563   1HB   ARG  73           HB1      ARG  73   9.216 -15.949 -15.949
  564   2HB   ARG  73           HB2      ARG  73   9.181 -14.335 -14.335
  565   1HG   ARG  73           HG1      ARG  73  11.629 -14.069 -14.069
  566   2HG   ARG  73           HG2      ARG  73  11.514 -15.611 -15.611
  567   1HD   ARG  73           HD1      ARG  73   9.963 -13.069 -13.069
  568   2HD   ARG  73           HD2      ARG  73  11.093 -13.921 -13.921
  569    HE   ARG  73           HE       ARG  73   8.453 -15.074 -15.074
  570   1HH1  ARG  73          HH11      ARG  73   9.804 -17.160 -17.160
  571   2HH1  ARG  73          HH12      ARG  73   9.578 -16.948 -16.948
  572   1HH2  ARG  73          HH21      ARG  73   8.655 -13.583 -13.583
  573   2HH2  ARG  73          HH22      ARG  73   8.908 -14.866 -14.866
  574    H    ALA  74           HN       ALA  74  12.431 -14.588 -14.588
  575    HA   ALA  74           HA       ALA  74  14.182 -16.739 -16.739
  576   1HB   ALA  74           HB1      ALA  74  14.695 -14.415 -14.415
  577   2HB   ALA  74           HB2      ALA  74  14.859 -14.005 -14.005
  578   3HB   ALA  74           HB3      ALA  74  16.010 -15.092 -15.092
  579    H    LYS  75           HN       LYS  75  12.673 -17.249 -17.249
  580    HA   LYS  75           HA       LYS  75  12.667 -17.924 -17.924
  581   1HB   LYS  75           HB1      LYS  75  13.854 -19.709 -19.709
  582   2HB   LYS  75           HB2      LYS  75  15.347 -19.164 -19.164
  583   1HG   LYS  75           HG1      LYS  75  14.767 -20.896 -20.896
  584   2HG   LYS  75           HG2      LYS  75  14.016 -19.543 -19.543
  585   1HD   LYS  75           HD1      LYS  75  11.860 -20.018 -20.018
  586   2HD   LYS  75           HD2      LYS  75  12.604 -21.437 -21.437
  587   1HE   LYS  75           HE1      LYS  75  12.118 -20.974 -20.974
  588   2HE   LYS  75           HE2      LYS  75  11.292 -22.119 -22.119
  589   1HZ   LYS  75           HZ1      LYS  75  14.026 -22.600 -22.600
  590   2HZ   LYS  75           HZ2      LYS  75  13.670 -22.480 -22.480
  591   3HZ   LYS  75           HZ3      LYS  75  12.835 -23.595 -23.595
  592    H    GLY  76           HN       GLY  76  13.476 -15.460 -15.460
  593   1HA   GLY  76           HA1      GLY  76  15.735 -15.113 -15.113
  594   2HA   GLY  76           HA2      GLY  76  15.226 -13.923 -13.923
  595    H    LYS  77           HN       LYS  77  13.638 -15.891 -15.891
  596    HA   LYS  77           HA       LYS  77  11.987 -13.639 -13.639
  597   1HB   LYS  77           HB1      LYS  77  11.831 -16.578 -16.578
  598   2HB   LYS  77           HB2      LYS  77  10.575 -15.367 -15.367
  599   1HG   LYS  77           HG1      LYS  77  10.543 -15.188 -15.188
  600   2HG   LYS  77           HG2      LYS  77  11.624 -16.567 -16.567
  601   1HD   LYS  77           HD1      LYS  77   9.435 -17.474 -17.474
  602   2HD   LYS  77           HD2      LYS  77   9.862 -17.856 -17.856
  603   1HE   LYS  77           HE1      LYS  77   8.560 -15.866 -15.866
  604   2HE   LYS  77           HE2      LYS  77   8.148 -15.478 -15.478
  605   1HZ   LYS  77           HZ1      LYS  77   7.497 -18.157 -18.157
  606   2HZ   LYS  77           HZ2      LYS  77   6.839 -17.188 -17.188
  607   3HZ   LYS  77           HZ3      LYS  77   6.477 -16.862 -16.862
  608    HA   PRO  78           HA       PRO  78  14.169 -13.103 -13.103
  609   1HB   PRO  78           HB1      PRO  78  11.715 -14.013 -14.013
  610   2HB   PRO  78           HB2      PRO  78  12.669 -12.534 -12.534
  611   1HG   PRO  78           HG1      PRO  78  10.345 -12.311 -12.311
  612   2HG   PRO  78           HG2      PRO  78  11.775 -11.578 -11.578
  613   1HD   PRO  78           HD1      PRO  78  10.590 -14.331 -14.331
  614   2HD   PRO  78           HD2      PRO  78  10.933 -13.051 -13.051
  615    H    ASP  79           HN       ASP  79  12.727 -16.089 -16.089
  616    HA   ASP  79           HA       ASP  79  14.771 -17.475 -17.475
  617   1HB   ASP  79           HB1      ASP  79  11.966 -18.454 -18.454
  618   2HB   ASP  79           HB2      ASP  79  13.114 -19.350 -19.350
  619    H    ALA  80           HN       ALA  80  16.061 -16.974 -16.974
  620    HA   ALA  80           HA       ALA  80  15.568 -18.348 -18.348
  621   1HB   ALA  80           HB1      ALA  80  16.891 -16.242 -16.242
  622   2HB   ALA  80           HB2      ALA  80  18.120 -17.052 -17.052
  623   3HB   ALA  80           HB3      ALA  80  17.839 -17.540 -17.540
  624    H    ALA  81           HN       ALA  81  15.197 -20.409 -20.409
  625    HA   ALA  81           HA       ALA  81  17.634 -22.007 -22.007
  626   1HB   ALA  81           HB1      ALA  81  14.712 -22.510 -22.510
  627   2HB   ALA  81           HB2      ALA  81  16.054 -23.563 -23.563
  628   3HB   ALA  81           HB3      ALA  81  15.957 -21.948 -21.948
  629   1H1   BME  16           HE1      MER  16  -8.159   8.558   8.558
  630   2H1   BME  16           HE2      MER  16  -9.244   9.071   9.071
  631   1H2   BME  16           HZ1      MER  16  -6.288   9.809   9.809
  632   2H2   BME  16           HZ2      MER  16  -6.932   8.708   8.708
  633    HO1  BME  16           HH       MER  16  -8.575  10.394  10.394

  Start of MODEL   11
    1    H    ASN   3           HN       ASN   3  -3.889 -12.654 -12.654
    2    HA   ASN   3           HA       ASN   3  -2.530 -11.483 -11.483
    3   1HB   ASN   3           HB1      ASN   3  -3.539  -9.290  -9.290
    4   2HB   ASN   3           HB2      ASN   3  -4.642 -10.599 -10.599
    5   1HD2  ASN   3          HD21      ASN   3  -5.886 -10.742 -10.742
    6   2HD2  ASN   3          HD22      ASN   3  -6.070 -11.107 -11.107
    7    H    ALA   4           HN       ALA   4  -0.523 -10.978 -10.978
    8    HA   ALA   4           HA       ALA   4   1.069  -9.841  -9.841
    9   1HB   ALA   4           HB1      ALA   4   2.002 -11.157 -11.157
   10   2HB   ALA   4           HB2      ALA   4   3.043 -10.528 -10.528
   11   3HB   ALA   4           HB3      ALA   4   1.964 -11.868 -11.868
   12    HA   PRO   5           HA       PRO   5   2.197  -6.832  -6.832
   13   1HB   PRO   5           HB1      PRO   5   0.273  -6.573  -6.573
   14   2HB   PRO   5           HB2      PRO   5   1.715  -7.567  -7.567
   15   1HG   PRO   5           HG1      PRO   5  -1.106  -8.346  -8.346
   16   2HG   PRO   5           HG2      PRO   5  -0.022  -9.180  -9.180
   17   1HD   PRO   5           HD1      PRO   5  -0.345 -10.010 -10.010
   18   2HD   PRO   5           HD2      PRO   5   1.280 -10.137 -10.137
   19    H    LYS   6           HN       LYS   6   1.904  -5.072  -5.072
   20    HA   LYS   6           HA       LYS   6  -0.833  -4.205  -4.205
   21   1HB   LYS   6           HB1      LYS   6   0.899  -4.801  -4.801
   22   2HB   LYS   6           HB2      LYS   6   1.822  -3.413  -3.413
   23   1HG   LYS   6           HG1      LYS   6  -1.085  -3.193  -3.193
   24   2HG   LYS   6           HG2      LYS   6   0.214  -3.203  -3.203
   25   1HD   LYS   6           HD1      LYS   6  -0.238  -1.074  -1.074
   26   2HD   LYS   6           HD2      LYS   6  -0.503  -0.922  -0.922
   27   1HE   LYS   6           HE1      LYS   6   1.896  -1.289  -1.289
   28   2HE   LYS   6           HE2      LYS   6   2.233  -1.422  -1.422
   29   1HZ   LYS   6           HZ1      LYS   6   0.785   0.924   0.924
   30   2HZ   LYS   6           HZ2      LYS   6   2.061   0.873   0.873
   31   3HZ   LYS   6           HZ3      LYS   6   2.385   0.740   0.740
   32    H    ARG   7           HN       ARG   7  -1.166  -3.387  -3.387
   33    HA   ARG   7           HA       ARG   7  -0.374  -1.757  -1.757
   34   1HB   ARG   7           HB1      ARG   7  -2.526  -0.499  -0.499
   35   2HB   ARG   7           HB2      ARG   7  -2.631  -2.242  -2.242
   36   1HG   ARG   7           HG1      ARG   7  -3.044  -2.241  -2.241
   37   2HG   ARG   7           HG2      ARG   7  -2.729  -0.525  -0.525
   38   1HD   ARG   7           HD1      ARG   7  -4.701  -0.092  -0.092
   39   2HD   ARG   7           HD2      ARG   7  -5.026  -1.824  -1.824
   40    HE   ARG   7           HE       ARG   7  -5.073  -0.126  -0.126
   41   1HH1  ARG   7          HH11      ARG   7  -4.834  -2.977  -2.977
   42   2HH1  ARG   7          HH12      ARG   7  -6.478  -3.517  -3.517
   43   1HH2  ARG   7          HH21      ARG   7  -7.701  -0.652  -0.652
   44   2HH2  ARG   7          HH22      ARG   7  -8.152  -2.158  -2.158
   45    HA   PRO   8           HA       PRO   8   1.851   1.577   1.577
   46   1HB   PRO   8           HB1      PRO   8   3.482   2.195   2.195
   47   2HB   PRO   8           HB2      PRO   8   3.854   0.968   0.968
   48   1HG   PRO   8           HG1      PRO   8   2.320   0.562   0.562
   49   2HG   PRO   8           HG2      PRO   8   3.735  -0.349  -0.349
   50   1HD   PRO   8           HD1      PRO   8   1.505  -1.476  -1.476
   51   2HD   PRO   8           HD2      PRO   8   2.557  -1.271  -1.271
   52    HA   PRO   9           HA       PRO   9  -0.129   5.340   5.340
   53   1HB   PRO   9           HB1      PRO   9   1.920   7.187   7.187
   54   2HB   PRO   9           HB2      PRO   9   1.197   6.554   6.554
   55   1HG   PRO   9           HG1      PRO   9   3.631   5.440   5.440
   56   2HG   PRO   9           HG2      PRO   9   3.583   5.991   5.991
   57   1HD   PRO   9           HD1      PRO   9   3.256   3.391   3.391
   58   2HD   PRO   9           HD2      PRO   9   2.052   4.155   4.155
   59    H    SER  10           HN       SER  10   0.421   7.322   7.322
   60    HA   SER  10           HA       SER  10   1.134   6.112   6.112
   61   1HB   SER  10           HB1      SER  10  -0.604   7.581   7.581
   62   2HB   SER  10           HB2      SER  10  -1.298   6.536   6.536
   63    HG   SER  10           HG       SER  10  -1.774   8.267   8.267
   64    H    ALA  11           HN       ALA  11   1.357   8.916   8.916
   65    HA   ALA  11           HA       ALA  11   3.532  10.239  10.239
   66   1HB   ALA  11           HB1      ALA  11   2.404  10.820  10.820
   67   2HB   ALA  11           HB2      ALA  11   3.818  11.557  11.557
   68   3HB   ALA  11           HB3      ALA  11   3.867   9.877   9.877
   69    H    PHE  12           HN       PHE  12   0.570  10.489  10.489
   70    HA   PHE  12           HA       PHE  12  -0.282  13.103  13.103
   71   1HB   PHE  12           HB1      PHE  12  -1.174  12.330  12.330
   72   2HB   PHE  12           HB2      PHE  12  -1.491  10.705  10.705
   73    HD1  PHE  12           HD1      PHE  12  -3.408  10.343  10.343
   74    HD2  PHE  12           HD2      PHE  12  -2.796  14.103  14.103
   75    HE1  PHE  12           HE1      PHE  12  -5.714  10.961  10.961
   76    HE2  PHE  12           HE2      PHE  12  -5.114  14.724  14.724
   77    HZ   PHE  12           HZ       PHE  12  -6.577  13.159  13.159
   78    H    PHE  13           HN       PHE  13  -0.516   9.839   9.839
   79    HA   PHE  13           HA       PHE  13  -2.693  10.105  10.105
   80   1HB   PHE  13           HB1      PHE  13  -1.437   7.970   7.970
   81   2HB   PHE  13           HB2      PHE  13  -0.243   8.403   8.403
   82    HD1  PHE  13           HD1      PHE  13  -0.951   8.482   8.482
   83    HD2  PHE  13           HD2      PHE  13  -3.644   7.265   7.265
   84    HE1  PHE  13           HE1      PHE  13  -2.498   7.600   7.600
   85    HE2  PHE  13           HE2      PHE  13  -5.185   6.385   6.385
   86    HZ   PHE  13           HZ       PHE  13  -4.613   6.548   6.548
   87    H    LEU  14           HN       LEU  14   0.745  10.721  10.721
   88    HA   LEU  14           HA       LEU  14   0.574  11.235  11.235
   89   1HB   LEU  14           HB1      LEU  14   2.364  12.616  12.616
   90   2HB   LEU  14           HB2      LEU  14   2.611  12.692  12.692
   91    HG   LEU  14           HG       LEU  14   4.208  11.177  11.177
   92   1HD1  LEU  14          HD11      LEU  14   3.173  10.225  10.225
   93   2HD1  LEU  14          HD12      LEU  14   1.988   9.363   9.363
   94   3HD1  LEU  14          HD13      LEU  14   3.696   8.965   8.965
   95   1HD2  LEU  14          HD21      LEU  14   3.445  10.861  10.861
   96   2HD2  LEU  14          HD22      LEU  14   3.861   9.315   9.315
   97   3HD2  LEU  14          HD23      LEU  14   2.180   9.753   9.753
   98    H    PHE  15           HN       PHE  15   0.453  13.675  13.675
   99    HA   PHE  15           HA       PHE  15  -0.307  15.713  15.713
  100   1HB   PHE  15           HB1      PHE  15   0.486  17.003  17.003
  101   2HB   PHE  15           HB2      PHE  15   0.780  15.504  15.504
  102    HD1  PHE  15           HD1      PHE  15  -1.334  14.652  14.652
  103    HD2  PHE  15           HD2      PHE  15  -0.608  18.673  18.673
  104    HE1  PHE  15           HE1      PHE  15  -2.782  15.445  15.445
  105    HE2  PHE  15           HE2      PHE  15  -2.065  19.475  19.475
  106    HZ   PHE  15           HZ       PHE  15  -3.149  17.853  17.853
  107    H    CYS  16           HN       MER  16  -2.190  13.704  13.704
  108    HA   CYS  16           HA       MER  16  -4.716  14.924  14.924
  109   1HB   CYS  16           HB1      MER  16  -5.740  12.844  12.844
  110   2HB   CYS  16           HB2      MER  16  -4.179  12.736  12.736
  111    H    SER  17           HN       SER  17  -3.133  12.620  12.620
  112    HA   SER  17           HA       SER  17  -5.185  12.386  12.386
  113   1HB   SER  17           HB1      SER  17  -3.092  10.988  10.988
  114   2HB   SER  17           HB2      SER  17  -2.164  12.376  12.376
  115    HG   SER  17           HG       SER  17  -3.717  10.685  10.685
  116    H    GLU  18           HN       GLU  18  -2.504  14.623  14.623
  117    HA   GLU  18           HA       GLU  18  -3.220  16.151  16.151
  118   1HB   GLU  18           HB1      GLU  18  -0.948  15.926  15.926
  119   2HB   GLU  18           HB2      GLU  18  -1.441  16.785  16.785
  120   1HG   GLU  18           HG1      GLU  18  -1.816  18.824  18.824
  121   2HG   GLU  18           HG2      GLU  18  -1.715  18.018  18.018
  122    H    TYR  19           HN       TYR  19  -4.771  15.978  15.978
  123    HA   TYR  19           HA       TYR  19  -5.678  18.822  18.822
  124   1HB   TYR  19           HB1      TYR  19  -5.168  16.770  16.770
  125   2HB   TYR  19           HB2      TYR  19  -6.693  17.663  17.663
  126    HD1  TYR  19           HD1      TYR  19  -3.048  17.929  17.929
  127    HD2  TYR  19           HD2      TYR  19  -6.663  20.062  20.062
  128    HE1  TYR  19           HE1      TYR  19  -1.763  19.842  19.842
  129    HE2  TYR  19           HE2      TYR  19  -5.388  21.978  21.978
  130    HH   TYR  19           HH       TYR  19  -3.390  22.865  22.865
  131    H    ARG  20           HN       ARG  20  -6.890  15.613  15.613
  132    HA   ARG  20           HA       ARG  20  -9.471  15.513  15.513
  133   1HB   ARG  20           HB1      ARG  20  -8.356  13.609  13.609
  134   2HB   ARG  20           HB2      ARG  20  -7.796  14.325  14.325
  135   1HG   ARG  20           HG1      ARG  20  -9.908  14.058  14.058
  136   2HG   ARG  20           HG2      ARG  20 -10.757  13.900  13.900
  137   1HD   ARG  20           HD1      ARG  20 -10.362  11.713  11.713
  138   2HD   ARG  20           HD2      ARG  20  -9.896  11.680  11.680
  139    HE   ARG  20           HE       ARG  20  -7.525  12.170  12.170
  140   1HH1  ARG  20          HH11      ARG  20  -6.875  12.265  12.265
  141   2HH1  ARG  20          HH12      ARG  20  -7.059  10.727  10.727
  142   1HH2  ARG  20          HH21      ARG  20  -9.138   9.485   9.485
  143   2HH2  ARG  20          HH22      ARG  20  -8.378   9.105   9.105
  144    HA   PRO  21           HA       PRO  21 -11.151  17.191  17.191
  145   1HB   PRO  21           HB1      PRO  21  -9.480  18.500  18.500
  146   2HB   PRO  21           HB2      PRO  21  -9.693  16.740  16.740
  147   1HG   PRO  21           HG1      PRO  21  -7.516  18.332  18.332
  148   2HG   PRO  21           HG2      PRO  21  -7.305  17.021  17.021
  149   1HD   PRO  21           HD1      PRO  21  -7.290  16.418  16.418
  150   2HD   PRO  21           HD2      PRO  21  -8.231  15.376  15.376
  151    H    LYS  22           HN       LYS  22  -8.501  19.143  19.143
  152    HA   LYS  22           HA       LYS  22  -9.658  21.717  21.717
  153   1HB   LYS  22           HB1      LYS  22  -7.502  20.690  20.690
  154   2HB   LYS  22           HB2      LYS  22  -7.891  22.381  22.381
  155   1HG   LYS  22           HG1      LYS  22  -7.208  22.329  22.329
  156   2HG   LYS  22           HG2      LYS  22  -7.120  20.583  20.583
  157   1HD   LYS  22           HD1      LYS  22  -4.856  21.650  21.650
  158   2HD   LYS  22           HD2      LYS  22  -5.190  20.584  20.584
  159   1HE   LYS  22           HE1      LYS  22  -4.127  22.740  22.740
  160   2HE   LYS  22           HE2      LYS  22  -5.689  22.491  22.491
  161   1HZ   LYS  22           HZ1      LYS  22  -6.051  23.815  23.815
  162   2HZ   LYS  22           HZ2      LYS  22  -4.852  24.630  24.630
  163   3HZ   LYS  22           HZ3      LYS  22  -6.385  24.373  24.373
  164    H    ILE  23           HN       ILE  23 -10.080  19.322  19.322
  165    HA   ILE  23           HA       ILE  23 -11.235  21.356  21.356
  166    HB   ILE  23           HB       ILE  23 -11.241  18.317  18.317
  167   1HG1  ILE  23          HG11      ILE  23  -9.175  20.312  20.312
  168   2HG1  ILE  23          HG12      ILE  23  -8.881  19.280  19.280
  169   1HG2  ILE  23          HG21      ILE  23 -12.764  19.738  19.738
  170   2HG2  ILE  23          HG22      ILE  23 -11.368  20.654  20.654
  171   3HG2  ILE  23          HG23      ILE  23 -11.520  18.964  18.964
  172   1HD1  ILE  23          HD11      ILE  23  -9.612  18.268  18.268
  173   2HD1  ILE  23          HD12      ILE  23  -8.013  18.240  18.240
  174   3HD1  ILE  23          HD13      ILE  23  -9.308  17.277  17.277
  175    H    LYS  24           HN       LYS  24 -12.003  18.566  18.566
  176    HA   LYS  24           HA       LYS  24 -14.801  18.481  18.481
  177   1HB   LYS  24           HB1      LYS  24 -13.142  16.773  16.773
  178   2HB   LYS  24           HB2      LYS  24 -13.014  17.527  17.527
  179   1HG   LYS  24           HG1      LYS  24 -15.308  17.048  17.048
  180   2HG   LYS  24           HG2      LYS  24 -15.721  16.534  16.534
  181   1HD   LYS  24           HD1      LYS  24 -13.697  15.136  15.136
  182   2HD   LYS  24           HD2      LYS  24 -15.362  14.624  14.624
  183   1HE   LYS  24           HE1      LYS  24 -13.304  14.753  14.753
  184   2HE   LYS  24           HE2      LYS  24 -13.845  13.298  13.298
  185   1HZ   LYS  24           HZ1      LYS  24 -16.107  14.712  14.712
  186   2HZ   LYS  24           HZ2      LYS  24 -15.034  14.626  14.626
  187   3HZ   LYS  24           HZ3      LYS  24 -15.547  13.204  13.204
  188    H    GLY  25           HN       GLY  25 -12.921  20.620  20.620
  189   1HA   GLY  25           HA1      GLY  25 -14.889  21.347  21.347
  190   2HA   GLY  25           HA2      GLY  25 -13.250  21.977  21.977
  191    H    GLU  26           HN       GLU  26 -13.244  22.668  22.668
  192    HA   GLU  26           HA       GLU  26 -14.697  25.173  25.173
  193   1HB   GLU  26           HB1      GLU  26 -12.852  23.925  23.925
  194   2HB   GLU  26           HB2      GLU  26 -13.437  25.571  25.571
  195   1HG   GLU  26           HG1      GLU  26 -11.849  24.425  24.425
  196   2HG   GLU  26           HG2      GLU  26 -11.130  25.354  25.354
  197    H    HIS  27           HN       HIS  27 -14.793  22.232  22.232
  198    HA   HIS  27           HA       HIS  27 -17.355  23.030  23.030
  199   1HB   HIS  27           HB1      HIS  27 -15.184  21.314  21.314
  200   2HB   HIS  27           HB2      HIS  27 -16.596  22.018  22.018
  201    HD1  HIS  27           HD1      HIS  27 -16.496  24.814  24.814
  202    HD2  HIS  27           HD2      HIS  27 -12.936  22.823  22.823
  203    HE1  HIS  27           HE1      HIS  27 -14.736  26.494  26.494
  204    HA   PRO  28           HA       PRO  28 -18.020  19.034  19.034
  205   1HB   PRO  28           HB1      PRO  28 -19.969  19.815  19.815
  206   2HB   PRO  28           HB2      PRO  28 -18.283  20.204  20.204
  207   1HG   PRO  28           HG1      PRO  28 -20.343  21.979  21.979
  208   2HG   PRO  28           HG2      PRO  28 -19.382  22.386  22.386
  209   1HD   PRO  28           HD1      PRO  28 -18.533  23.084  23.084
  210   2HD   PRO  28           HD2      PRO  28 -17.350  22.602  22.602
  211    H    GLY  29           HN       GLY  29 -18.696  19.935  19.935
  212   1HA   GLY  29           HA1      GLY  29 -21.411  18.869  18.869
  213   2HA   GLY  29           HA2      GLY  29 -20.877  20.320  20.320
  214    H    LEU  30           HN       LEU  30 -18.214  18.360  18.360
  215    HA   LEU  30           HA       LEU  30 -18.357  17.396  17.396
  216   1HB   LEU  30           HB1      LEU  30 -16.074  17.413  17.413
  217   2HB   LEU  30           HB2      LEU  30 -15.882  17.014  17.014
  218    HG   LEU  30           HG       LEU  30 -16.460  19.650  19.650
  219   1HD1  LEU  30          HD11      LEU  30 -14.128  18.974  18.974
  220   2HD1  LEU  30          HD12      LEU  30 -14.274  18.731  18.731
  221   3HD1  LEU  30          HD13      LEU  30 -14.400  20.351  20.351
  222   1HD2  LEU  30          HD21      LEU  30 -16.622  19.154  19.154
  223   2HD2  LEU  30          HD22      LEU  30 -17.968  19.608  19.608
  224   3HD2  LEU  30          HD23      LEU  30 -16.647  20.725  20.725
  225    H    SER  31           HN       SER  31 -17.561  15.289  15.289
  226    HA   SER  31           HA       SER  31 -18.254  13.178  13.178
  227   1HB   SER  31           HB1      SER  31 -19.661  13.310  13.310
  228   2HB   SER  31           HB2      SER  31 -18.182  12.943  12.943
  229    HG   SER  31           HG       SER  31 -18.390  10.964  10.964
  230    H    ILE  32           HN       ILE  32 -17.053  11.110  11.110
  231    HA   ILE  32           HA       ILE  32 -14.263  11.559  11.559
  232    HB   ILE  32           HB       ILE  32 -16.206   9.318   9.318
  233   1HG1  ILE  32          HG11      ILE  32 -14.750   8.196   8.196
  234   2HG1  ILE  32          HG12      ILE  32 -13.490   9.400   9.400
  235   1HG2  ILE  32          HG21      ILE  32 -13.527   8.695   8.695
  236   2HG2  ILE  32          HG22      ILE  32 -14.773   7.521   7.521
  237   3HG2  ILE  32          HG23      ILE  32 -15.076   8.726   8.726
  238   1HD1  ILE  32          HD11      ILE  32 -16.300   9.917   9.917
  239   2HD1  ILE  32          HD12      ILE  32 -14.821   9.896   9.896
  240   3HD1  ILE  32          HD13      ILE  32 -15.082  11.163  11.163
  241    H    GLY  33           HN       GLY  33 -16.085  11.788  11.788
  242   1HA   GLY  33           HA1      GLY  33 -13.753  11.368  11.368
  243   2HA   GLY  33           HA2      GLY  33 -15.434  11.458  11.458
  244    H    ASP  34           HN       ASP  34 -15.128  13.827  13.827
  245    HA   ASP  34           HA       ASP  34 -14.522  15.885  15.885
  246   1HB   ASP  34           HB1      ASP  34 -16.195  15.850  15.850
  247   2HB   ASP  34           HB2      ASP  34 -15.878  17.365  17.365
  248    H    VAL  35           HN       VAL  35 -14.213  15.010  15.010
  249    HA   VAL  35           HA       VAL  35 -12.276  16.987  16.987
  250    HB   VAL  35           HB       VAL  35 -12.853  14.142  14.142
  251   1HG1  VAL  35          HG11      VAL  35 -11.380  16.463  16.463
  252   2HG1  VAL  35          HG12      VAL  35 -11.740  14.923  14.923
  253   3HG1  VAL  35          HG13      VAL  35 -10.608  15.000  15.000
  254   1HG2  VAL  35          HG21      VAL  35 -13.855  16.836  16.836
  255   2HG2  VAL  35          HG22      VAL  35 -14.805  15.613  15.613
  256   3HG2  VAL  35          HG23      VAL  35 -14.157  15.283  15.283
  257    H    ALA  36           HN       ALA  36 -12.236  13.930  13.930
  258    HA   ALA  36           HA       ALA  36  -9.374  13.564  13.564
  259   1HB   ALA  36           HB1      ALA  36 -11.628  12.150  12.150
  260   2HB   ALA  36           HB2      ALA  36  -9.975  11.542  11.542
  261   3HB   ALA  36           HB3      ALA  36 -10.900  11.685  11.685
  262    H    LYS  37           HN       LYS  37 -11.848  14.400  14.400
  263    HA   LYS  37           HA       LYS  37  -9.734  14.564  14.564
  264   1HB   LYS  37           HB1      LYS  37 -11.387  15.161  15.161
  265   2HB   LYS  37           HB2      LYS  37 -12.296  14.235  14.235
  266   1HG   LYS  37           HG1      LYS  37 -13.715  16.066  16.066
  267   2HG   LYS  37           HG2      LYS  37 -12.688  16.689  16.689
  268   1HD   LYS  37           HD1      LYS  37 -11.269  17.864  17.864
  269   2HD   LYS  37           HD2      LYS  37 -12.286  17.199  17.199
  270   1HE   LYS  37           HE1      LYS  37 -14.225  18.450  18.450
  271   2HE   LYS  37           HE2      LYS  37 -13.167  19.122  19.122
  272   1HZ   LYS  37           HZ1      LYS  37 -11.962  19.509  19.509
  273   2HZ   LYS  37           HZ2      LYS  37 -13.575  20.023  20.023
  274   3HZ   LYS  37           HZ3      LYS  37 -12.556  20.674  20.674
  275    H    LYS  38           HN       LYS  38 -11.071  16.753  16.753
  276    HA   LYS  38           HA       LYS  38 -10.151  19.198  19.198
  277   1HB   LYS  38           HB1      LYS  38 -11.982  19.124  19.124
  278   2HB   LYS  38           HB2      LYS  38 -10.895  18.395  18.395
  279   1HG   LYS  38           HG1      LYS  38 -11.189  20.731  20.731
  280   2HG   LYS  38           HG2      LYS  38  -9.536  20.476  20.476
  281   1HD   LYS  38           HD1      LYS  38 -10.018  21.355  21.355
  282   2HD   LYS  38           HD2      LYS  38 -11.723  21.495  21.495
  283   1HE   LYS  38           HE1      LYS  38  -9.481  22.995  22.995
  284   2HE   LYS  38           HE2      LYS  38 -10.544  23.685  23.685
  285   1HZ   LYS  38           HZ1      LYS  38 -12.131  22.461  22.461
  286   2HZ   LYS  38           HZ2      LYS  38 -10.991  23.434  23.434
  287   3HZ   LYS  38           HZ3      LYS  38 -12.011  24.110  24.110
  288    H    LEU  39           HN       LEU  39  -9.016  17.352  17.352
  289    HA   LEU  39           HA       LEU  39  -6.478  18.785  18.785
  290   1HB   LEU  39           HB1      LEU  39  -6.478  18.047  18.047
  291   2HB   LEU  39           HB2      LEU  39  -8.088  17.477  17.477
  292    HG   LEU  39           HG       LEU  39  -6.948  15.315  15.315
  293   1HD1  LEU  39          HD11      LEU  39  -4.906  16.541  16.541
  294   2HD1  LEU  39          HD12      LEU  39  -4.839  14.889  14.889
  295   3HD1  LEU  39          HD13      LEU  39  -4.671  16.230  16.230
  296   1HD2  LEU  39          HD21      LEU  39  -8.409  15.544  15.544
  297   2HD2  LEU  39          HD22      LEU  39  -7.055  14.452  14.452
  298   3HD2  LEU  39          HD23      LEU  39  -6.987  16.103  16.103
  299    H    GLY  40           HN       GLY  40  -7.717  16.006  16.006
  300   1HA   GLY  40           HA1      GLY  40  -5.253  14.540  14.540
  301   2HA   GLY  40           HA2      GLY  40  -6.765  14.360  14.360
  302    H    GLU  41           HN       GLU  41  -6.949  17.196  17.196
  303    HA   GLU  41           HA       GLU  41  -5.393  17.360  17.360
  304   1HB   GLU  41           HB1      GLU  41  -7.671  17.941  17.941
  305   2HB   GLU  41           HB2      GLU  41  -7.488  19.025  19.025
  306   1HG   GLU  41           HG1      GLU  41  -6.007  20.467  20.467
  307   2HG   GLU  41           HG2      GLU  41  -6.307  19.402  19.402
  308    H    MET  42           HN       MET  42  -5.840  19.239  19.239
  309    HA   MET  42           HA       MET  42  -3.874  21.194  21.194
  310   1HB   MET  42           HB1      MET  42  -4.555  19.737  19.737
  311   2HB   MET  42           HB2      MET  42  -3.530  21.173  21.173
  312   1HG   MET  42           HG1      MET  42  -5.586  22.214  22.214
  313   2HG   MET  42           HG2      MET  42  -6.491  20.921  20.921
  314   1HE   MET  42           HE1      MET  42  -5.797  20.459  20.459
  315   2HE   MET  42           HE2      MET  42  -6.742  21.645  21.645
  316   3HE   MET  42           HE3      MET  42  -7.468  20.826  20.826
  317    H    TRP  43           HN       TRP  43  -3.567  17.956  17.956
  318    HA   TRP  43           HA       TRP  43  -0.851  17.839  17.839
  319   1HB   TRP  43           HB1      TRP  43  -2.424  16.103  16.103
  320   2HB   TRP  43           HB2      TRP  43  -2.769  15.825  15.825
  321    HD1  TRP  43           HD1      TRP  43  -1.429  13.980  13.980
  322    HE1  TRP  43           HE1      TRP  43   0.734  12.892  12.892
  323    HE3  TRP  43           HE3      TRP  43  -0.107  16.599  16.599
  324    HZ2  TRP  43           HZ2      TRP  43   2.866  12.999  12.999
  325    HZ3  TRP  43           HZ3      TRP  43   1.958  16.101  16.101
  326    HH2  TRP  43           HH2      TRP  43   3.473  14.292  14.292
  327    H    ASN  44           HN       ASN  44  -2.498  17.052  17.052
  328    HA   ASN  44           HA       ASN  44  -0.253  16.479  16.479
  329   1HB   ASN  44           HB1      ASN  44  -1.996  15.830  15.830
  330   2HB   ASN  44           HB2      ASN  44  -3.133  16.711  16.711
  331   1HD2  ASN  44          HD21      ASN  44  -3.927  18.917  18.917
  332   2HD2  ASN  44          HD22      ASN  44  -4.296  18.257  18.257
  333    H    ASN  45           HN       ASN  45  -1.492  19.469  19.469
  334    HA   ASN  45           HA       ASN  45   0.557  20.994  20.994
  335   1HB   ASN  45           HB1      ASN  45  -1.991  22.355  22.355
  336   2HB   ASN  45           HB2      ASN  45  -0.947  22.732  22.732
  337   1HD2  ASN  45          HD21      ASN  45  -4.159  20.395  20.395
  338   2HD2  ASN  45          HD22      ASN  45  -3.817  21.288  21.288
  339    H    THR  46           HN       THR  46   0.969  19.878  19.878
  340    HA   THR  46           HA       THR  46   0.538  22.035  22.035
  341    HB   THR  46           HB       THR  46   0.761  19.642  19.642
  342    HG1  THR  46           HG1      THR  46   1.491  20.624  20.624
  343   1HG2  THR  46          HG21      THR  46   2.699  18.869  18.869
  344   2HG2  THR  46          HG22      THR  46   3.771  19.887  19.887
  345   3HG2  THR  46          HG23      THR  46   2.942  18.558  18.558
  346    H    ALA  47           HN       ALA  47   3.294  20.747  20.747
  347    HA   ALA  47           HA       ALA  47   4.518  23.180  23.180
  348   1HB   ALA  47           HB1      ALA  47   5.029  23.403  23.403
  349   2HB   ALA  47           HB2      ALA  47   5.833  21.850  21.850
  350   3HB   ALA  47           HB3      ALA  47   6.481  23.218  23.218
  351    H    ALA  48           HN       ALA  48   5.201  20.100  20.100
  352    HA   ALA  48           HA       ALA  48   5.762  18.054  18.054
  353   1HB   ALA  48           HB1      ALA  48   5.894  19.130  19.130
  354   2HB   ALA  48           HB2      ALA  48   7.451  19.821  19.821
  355   3HB   ALA  48           HB3      ALA  48   7.255  18.083  18.083
  356    H    ASP  49           HN       ASP  49   7.434  20.864  20.864
  357    HA   ASP  49           HA       ASP  49   9.914  19.631  19.631
  358   1HB   ASP  49           HB1      ASP  49  10.059  21.781  21.781
  359   2HB   ASP  49           HB2      ASP  49   8.842  22.479  22.479
  360    H    ASP  50           HN       ASP  50   6.837  20.319  20.319
  361    HA   ASP  50           HA       ASP  50   7.434  20.365  20.365
  362   1HB   ASP  50           HB1      ASP  50   5.030  21.248  21.248
  363   2HB   ASP  50           HB2      ASP  50   4.928  21.086  21.086
  364    H    LYS  51           HN       LYS  51   6.936  18.327  18.327
  365    HA   LYS  51           HA       LYS  51   5.091  16.454  16.454
  366   1HB   LYS  51           HB1      LYS  51   6.506  16.282  16.282
  367   2HB   LYS  51           HB2      LYS  51   5.616  14.952  14.952
  368   1HG   LYS  51           HG1      LYS  51   3.576  16.435  16.435
  369   2HG   LYS  51           HG2      LYS  51   4.518  17.611  17.611
  370   1HD   LYS  51           HD1      LYS  51   4.935  15.952  15.952
  371   2HD   LYS  51           HD2      LYS  51   4.048  14.732  14.732
  372   1HE   LYS  51           HE1      LYS  51   1.996  16.088  16.088
  373   2HE   LYS  51           HE2      LYS  51   2.863  17.344  17.344
  374   1HZ   LYS  51           HZ1      LYS  51   3.295  14.892  14.892
  375   2HZ   LYS  51           HZ2      LYS  51   1.626  15.076  15.076
  376   3HZ   LYS  51           HZ3      LYS  51   2.488  16.272  16.272
  377    H    GLN  52           HN       GLN  52   8.315  16.759  16.759
  378    HA   GLN  52           HA       GLN  52   9.731  14.623  14.623
  379   1HB   GLN  52           HB1      GLN  52  10.327  17.509  17.509
  380   2HB   GLN  52           HB2      GLN  52  11.406  16.494  16.494
  381   1HG   GLN  52           HG1      GLN  52  12.446  16.772  16.772
  382   2HG   GLN  52           HG2      GLN  52  11.784  15.149  15.149
  383   1HE2  GLN  52          HE21      GLN  52   9.282  15.933  15.933
  384   2HE2  GLN  52          HE22      GLN  52   9.651  14.871  14.871
  385    HA   PRO  53           HA       PRO  53  10.169  15.132  15.132
  386   1HB   PRO  53           HB1      PRO  53   7.880  16.385  16.385
  387   2HB   PRO  53           HB2      PRO  53   9.458  17.134  17.134
  388   1HG   PRO  53           HG1      PRO  53   7.118  17.147  17.147
  389   2HG   PRO  53           HG2      PRO  53   8.051  18.533  18.533
  390   1HD   PRO  53           HD1      PRO  53   8.750  17.542  17.542
  391   2HD   PRO  53           HD2      PRO  53  10.071  17.767  17.767
  392    H    TYR  54           HN       TYR  54   6.909  15.047  15.047
  393    HA   TYR  54           HA       TYR  54   6.040  12.814  12.814
  394   1HB   TYR  54           HB1      TYR  54   4.803  14.116  14.116
  395   2HB   TYR  54           HB2      TYR  54   3.995  12.918  12.918
  396    HD1  TYR  54           HD1      TYR  54   4.443  13.700  13.700
  397    HD2  TYR  54           HD2      TYR  54   3.957  16.243  16.243
  398    HE1  TYR  54           HE1      TYR  54   3.666  15.500  15.500
  399    HE2  TYR  54           HE2      TYR  54   3.178  18.044  18.044
  400    HH   TYR  54           HH       TYR  54   2.033  18.126  18.126
  401    H    GLU  55           HN       GLU  55   6.649  13.275  13.275
  402    HA   GLU  55           HA       GLU  55   6.236  10.691  10.691
  403   1HB   GLU  55           HB1      GLU  55   7.424  13.148  13.148
  404   2HB   GLU  55           HB2      GLU  55   8.531  11.880  11.880
  405   1HG   GLU  55           HG1      GLU  55   6.529  10.640  10.640
  406   2HG   GLU  55           HG2      GLU  55   5.555  12.056  12.056
  407    H    LYS  56           HN       LYS  56   9.425  11.946  11.946
  408    HA   LYS  56           HA       LYS  56  10.933   9.647   9.647
  409   1HB   LYS  56           HB1      LYS  56  11.115  11.913  11.913
  410   2HB   LYS  56           HB2      LYS  56  12.349  10.676  10.676
  411   1HG   LYS  56           HG1      LYS  56  12.879  11.287  11.287
  412   2HG   LYS  56           HG2      LYS  56  11.545  12.422  12.422
  413   1HD   LYS  56           HD1      LYS  56  12.562  13.898  13.898
  414   2HD   LYS  56           HD2      LYS  56  13.748  12.698  12.698
  415   1HE   LYS  56           HE1      LYS  56  13.609  13.955  13.955
  416   2HE   LYS  56           HE2      LYS  56  14.712  14.461  14.461
  417   1HZ   LYS  56           HZ1      LYS  56  14.907  11.691  11.691
  418   2HZ   LYS  56           HZ2      LYS  56  15.013  12.362  12.362
  419   3HZ   LYS  56           HZ3      LYS  56  16.082  12.866  12.866
  420    H    LYS  57           HN       LYS  57   8.803  10.515  10.515
  421    HA   LYS  57           HA       LYS  57   9.637   8.391   8.391
  422   1HB   LYS  57           HB1      LYS  57   8.463  10.603  10.603
  423   2HB   LYS  57           HB2      LYS  57   6.980   9.899   9.899
  424   1HG   LYS  57           HG1      LYS  57   7.066   8.104   8.104
  425   2HG   LYS  57           HG2      LYS  57   8.646   8.632   8.632
  426   1HD   LYS  57           HD1      LYS  57   7.594  10.881  10.881
  427   2HD   LYS  57           HD2      LYS  57   6.030  10.197  10.197
  428   1HE   LYS  57           HE1      LYS  57   6.288   8.483   8.483
  429   2HE   LYS  57           HE2      LYS  57   7.897   9.088   9.088
  430   1HZ   LYS  57           HZ1      LYS  57   6.123  11.242  11.242
  431   2HZ   LYS  57           HZ2      LYS  57   5.444   9.983   9.983
  432   3HZ   LYS  57           HZ3      LYS  57   7.000  10.556  10.556
  433    H    ALA  58           HN       ALA  58   6.711   8.939   8.939
  434    HA   ALA  58           HA       ALA  58   5.403   6.519   6.519
  435   1HB   ALA  58           HB1      ALA  58   4.521   8.428   8.428
  436   2HB   ALA  58           HB2      ALA  58   5.722   8.092   8.092
  437   3HB   ALA  58           HB3      ALA  58   4.450   6.928   6.928
  438    H    ALA  59           HN       ALA  59   7.930   7.294   7.294
  439    HA   ALA  59           HA       ALA  59   8.170   4.900   4.900
  440   1HB   ALA  59           HB1      ALA  59  10.401   6.787   6.787
  441   2HB   ALA  59           HB2      ALA  59  10.543   5.614   5.614
  442   3HB   ALA  59           HB3      ALA  59   9.435   6.964   6.964
  443    H    LYS  60           HN       LYS  60  10.312   5.770   5.770
  444    HA   LYS  60           HA       LYS  60  11.540   3.331   3.331
  445   1HB   LYS  60           HB1      LYS  60  12.014   5.566   5.566
  446   2HB   LYS  60           HB2      LYS  60  10.654   5.295   5.295
  447   1HG   LYS  60           HG1      LYS  60  12.726   3.109   3.109
  448   2HG   LYS  60           HG2      LYS  60  13.214   4.578   4.578
  449   1HD   LYS  60           HD1      LYS  60  10.725   2.998   2.998
  450   2HD   LYS  60           HD2      LYS  60  12.300   2.765   2.765
  451   1HE   LYS  60           HE1      LYS  60  12.324   5.202   5.202
  452   2HE   LYS  60           HE2      LYS  60  10.692   5.365   5.365
  453   1HZ   LYS  60           HZ1      LYS  60  10.785   3.144   3.144
  454   2HZ   LYS  60           HZ2      LYS  60  11.504   4.460   4.460
  455   3HZ   LYS  60           HZ3      LYS  60   9.923   4.597   4.597
  456    H    LEU  61           HN       LEU  61   8.503   4.448   4.448
  457    HA   LEU  61           HA       LEU  61   7.877   2.199   2.199
  458   1HB   LEU  61           HB1      LEU  61   6.073   4.093   4.093
  459   2HB   LEU  61           HB2      LEU  61   5.470   2.944   2.944
  460    HG   LEU  61           HG       LEU  61   6.251   5.594   5.594
  461   1HD1  LEU  61          HD11      LEU  61   6.014   3.232   3.232
  462   2HD1  LEU  61          HD12      LEU  61   5.857   4.916   4.916
  463   3HD1  LEU  61          HD13      LEU  61   4.672   4.190   4.190
  464   1HD2  LEU  61          HD21      LEU  61   8.387   3.801   3.801
  465   2HD2  LEU  61          HD22      LEU  61   8.698   5.056   5.056
  466   3HD2  LEU  61          HD23      LEU  61   8.103   5.481   5.481
  467    H    LYS  62           HN       LYS  62   6.675   2.866   2.866
  468    HA   LYS  62           HA       LYS  62   5.443   0.474   0.474
  469   1HB   LYS  62           HB1      LYS  62   5.545   2.585   2.585
  470   2HB   LYS  62           HB2      LYS  62   7.165   2.129   2.129
  471   1HG   LYS  62           HG1      LYS  62   6.356   0.112   0.112
  472   2HG   LYS  62           HG2      LYS  62   4.730   0.360   0.360
  473   1HD   LYS  62           HD1      LYS  62   4.580   2.516   2.516
  474   2HD   LYS  62           HD2      LYS  62   6.194   2.264   2.264
  475   1HE   LYS  62           HE1      LYS  62   3.845   0.375   0.375
  476   2HE   LYS  62           HE2      LYS  62   4.391   1.581   1.581
  477   1HZ   LYS  62           HZ1      LYS  62   6.609   0.080   0.080
  478   2HZ   LYS  62           HZ2      LYS  62   5.359  -1.002  -1.002
  479   3HZ   LYS  62           HZ3      LYS  62   5.859   0.157   0.157
  480    H    GLU  63           HN       GLU  63   8.780   1.300   1.300
  481    HA   GLU  63           HA       GLU  63   9.783  -1.063  -1.063
  482   1HB   GLU  63           HB1      GLU  63  10.785   1.456   1.456
  483   2HB   GLU  63           HB2      GLU  63  11.622   0.359   0.359
  484   1HG   GLU  63           HG1      GLU  63  11.637   0.340   0.340
  485   2HG   GLU  63           HG2      GLU  63  12.960   0.805   0.805
  486    H    LYS  64           HN       LYS  64   9.640  -0.122  -0.122
  487    HA   LYS  64           HA       LYS  64  10.662  -2.488  -2.488
  488   1HB   LYS  64           HB1      LYS  64  10.183  -0.414  -0.414
  489   2HB   LYS  64           HB2      LYS  64   8.461  -0.663  -0.663
  490   1HG   LYS  64           HG1      LYS  64   8.595  -2.805  -2.805
  491   2HG   LYS  64           HG2      LYS  64  10.329  -2.602  -2.602
  492   1HD   LYS  64           HD1      LYS  64   9.920  -0.469  -0.469
  493   2HD   LYS  64           HD2      LYS  64   8.192  -0.688  -0.688
  494   1HE   LYS  64           HE1      LYS  64   8.168  -1.922  -1.922
  495   2HE   LYS  64           HE2      LYS  64   9.158  -3.140  -3.140
  496   1HZ   LYS  64           HZ1      LYS  64  10.794  -0.985  -0.985
  497   2HZ   LYS  64           HZ2      LYS  64   9.849  -1.429  -1.429
  498   3HZ   LYS  64           HZ3      LYS  64  10.822  -2.587  -2.587
  499    H    TYR  65           HN       TYR  65   7.325  -1.632  -1.632
  500    HA   TYR  65           HA       TYR  65   5.897  -3.871  -3.871
  501   1HB   TYR  65           HB1      TYR  65   4.678  -2.003  -2.003
  502   2HB   TYR  65           HB2      TYR  65   5.632  -1.856  -1.856
  503    HD1  TYR  65           HD1      TYR  65   2.752  -3.569  -3.569
  504    HD2  TYR  65           HD2      TYR  65   5.096  -3.139  -3.139
  505    HE1  TYR  65           HE1      TYR  65   1.025  -4.706  -4.706
  506    HE2  TYR  65           HE2      TYR  65   3.369  -4.289  -4.289
  507    HH   TYR  65           HH       TYR  65   1.434  -6.092  -6.092
  508    H    GLU  66           HN       GLU  66   7.089  -3.442  -3.442
  509    HA   GLU  66           HA       GLU  66   6.425  -6.080  -6.080
  510   1HB   GLU  66           HB1      GLU  66   7.869  -5.700  -5.700
  511   2HB   GLU  66           HB2      GLU  66   6.631  -4.501  -4.501
  512   1HG   GLU  66           HG1      GLU  66   8.204  -2.889  -2.889
  513   2HG   GLU  66           HG2      GLU  66   9.386  -4.101  -4.101
  514    H    LYS  67           HN       LYS  67   9.018  -5.020  -5.020
  515    HA   LYS  67           HA       LYS  67  10.766  -7.269  -7.269
  516   1HB   LYS  67           HB1      LYS  67  11.137  -4.670  -4.670
  517   2HB   LYS  67           HB2      LYS  67  12.009  -5.974  -5.974
  518   1HG   LYS  67           HG1      LYS  67  13.419  -4.950  -4.950
  519   2HG   LYS  67           HG2      LYS  67  13.024  -6.577  -6.577
  520   1HD   LYS  67           HD1      LYS  67  11.243  -5.590  -5.590
  521   2HD   LYS  67           HD2      LYS  67  11.751  -3.998  -3.998
  522   1HE   LYS  67           HE1      LYS  67  13.528  -6.035  -6.035
  523   2HE   LYS  67           HE2      LYS  67  12.812  -4.617  -4.617
  524   1HZ   LYS  67           HZ1      LYS  67  14.151  -3.798  -3.798
  525   2HZ   LYS  67           HZ2      LYS  67  15.202  -4.789  -4.789
  526   3HZ   LYS  67           HZ3      LYS  67  14.498  -3.419  -3.419
  527    H    ASP  68           HN       ASP  68   8.779  -6.207  -6.207
  528    HA   ASP  68           HA       ASP  68   9.497  -8.238  -8.238
  529   1HB   ASP  68           HB1      ASP  68   8.680  -5.835  -5.835
  530   2HB   ASP  68           HB2      ASP  68   7.068  -6.421  -6.421
  531    H    ILE  69           HN       ILE  69   7.309  -7.732  -7.732
  532    HA   ILE  69           HA       ILE  69   5.574  -9.967  -9.967
  533    HB   ILE  69           HB       ILE  69   4.908  -7.774  -7.774
  534   1HG1  ILE  69          HG11      ILE  69   3.249  -9.274  -9.274
  535   2HG1  ILE  69          HG12      ILE  69   3.233  -8.957  -8.957
  536   1HG2  ILE  69          HG21      ILE  69   6.619  -7.834  -7.834
  537   2HG2  ILE  69          HG22      ILE  69   5.939  -9.261  -9.261
  538   3HG2  ILE  69          HG23      ILE  69   5.031  -7.751  -7.751
  539   1HD1  ILE  69          HD11      ILE  69   4.484 -11.112 -11.112
  540   2HD1  ILE  69          HD12      ILE  69   4.380 -11.435 -11.435
  541   3HD1  ILE  69          HD13      ILE  69   2.924 -11.372 -11.372
  542    H    ALA  70           HN       ALA  70   8.062  -9.058  -9.058
  543    HA   ALA  70           HA       ALA  70   8.267 -11.556 -11.556
  544   1HB   ALA  70           HB1      ALA  70  10.425  -9.460  -9.460
  545   2HB   ALA  70           HB2      ALA  70  10.535 -10.755 -10.755
  546   3HB   ALA  70           HB3      ALA  70   9.339  -9.495  -9.495
  547    H    ALA  71           HN       ALA  71   9.336 -10.345 -10.345
  548    HA   ALA  71           HA       ALA  71  11.201 -12.545 -12.545
  549   1HB   ALA  71           HB1      ALA  71  10.196 -10.318 -10.318
  550   2HB   ALA  71           HB2      ALA  71  11.472 -11.455 -11.455
  551   3HB   ALA  71           HB3      ALA  71  11.712 -10.297 -10.297
  552    H    TYR  72           HN       TYR  72   7.965 -11.523 -11.523
  553    HA   TYR  72           HA       TYR  72   7.298 -13.310 -13.310
  554   1HB   TYR  72           HB1      TYR  72   5.844 -11.482 -11.482
  555   2HB   TYR  72           HB2      TYR  72   5.644 -11.970 -11.970
  556    HD1  TYR  72           HD1      TYR  72   5.058 -13.177 -13.177
  557    HD2  TYR  72           HD2      TYR  72   3.797 -13.324 -13.324
  558    HE1  TYR  72           HE1      TYR  72   3.115 -14.515 -14.515
  559    HE2  TYR  72           HE2      TYR  72   1.853 -14.664 -14.664
  560    HH   TYR  72           HH       TYR  72   0.875 -15.035 -15.035
  561    H    ARG  73           HN       ARG  73   6.941 -13.544 -13.544
  562    HA   ARG  73           HA       ARG  73   5.852 -16.221 -16.221
  563   1HB   ARG  73           HB1      ARG  73   5.302 -15.771 -15.771
  564   2HB   ARG  73           HB2      ARG  73   5.688 -14.128 -14.128
  565   1HG   ARG  73           HG1      ARG  73   7.988 -14.356 -14.356
  566   2HG   ARG  73           HG2      ARG  73   7.697 -16.033 -16.033
  567   1HD   ARG  73           HD1      ARG  73   5.755 -15.112 -15.112
  568   2HD   ARG  73           HD2      ARG  73   6.570 -13.557 -13.557
  569    HE   ARG  73           HE       ARG  73   7.887 -16.008 -16.008
  570   1HH1  ARG  73          HH11      ARG  73   9.976 -14.281 -14.281
  571   2HH1  ARG  73          HH12      ARG  73  10.070 -13.192 -13.192
  572   1HH2  ARG  73          HH21      ARG  73   6.803 -13.931 -13.931
  573   2HH2  ARG  73          HH22      ARG  73   8.216 -12.989 -12.989
  574    H    ALA  74           HN       ALA  74   8.883 -14.756 -14.756
  575    HA   ALA  74           HA       ALA  74  10.229 -17.154 -17.154
  576   1HB   ALA  74           HB1      ALA  74  11.317 -14.551 -14.551
  577   2HB   ALA  74           HB2      ALA  74  12.287 -15.794 -15.794
  578   3HB   ALA  74           HB3      ALA  74  11.046 -14.954 -14.954
  579    H    LYS  75           HN       LYS  75   9.484 -15.759 -15.759
  580    HA   LYS  75           HA       LYS  75  10.664 -18.117 -18.117
  581   1HB   LYS  75           HB1      LYS  75  12.454 -16.269 -16.269
  582   2HB   LYS  75           HB2      LYS  75  11.471 -15.325 -15.325
  583   1HG   LYS  75           HG1      LYS  75  11.545 -17.554 -17.554
  584   2HG   LYS  75           HG2      LYS  75  12.912 -17.954 -17.954
  585   1HD   LYS  75           HD1      LYS  75  13.974 -15.752 -15.752
  586   2HD   LYS  75           HD2      LYS  75  12.642 -15.456 -15.456
  587   1HE   LYS  75           HE1      LYS  75  14.616 -17.777 -17.777
  588   2HE   LYS  75           HE2      LYS  75  14.519 -16.408 -16.408
  589   1HZ   LYS  75           HZ1      LYS  75  11.989 -17.598 -17.598
  590   2HZ   LYS  75           HZ2      LYS  75  13.136 -18.824 -18.824
  591   3HZ   LYS  75           HZ3      LYS  75  13.062 -17.511 -17.511
  592    H    GLY  76           HN       GLY  76   8.058 -17.814 -17.814
  593   1HA   GLY  76           HA1      GLY  76   7.220 -16.869 -16.869
  594   2HA   GLY  76           HA2      GLY  76   6.176 -16.714 -16.714
  595    H    LYS  77           HN       LYS  77   6.139 -18.786 -18.786
  596    HA   LYS  77           HA       LYS  77   4.507 -20.676 -20.676
  597   1HB   LYS  77           HB1      LYS  77   6.655 -21.530 -21.530
  598   2HB   LYS  77           HB2      LYS  77   5.030 -22.128 -22.128
  599   1HG   LYS  77           HG1      LYS  77   5.854 -19.392 -19.392
  600   2HG   LYS  77           HG2      LYS  77   5.063 -20.684 -20.684
  601   1HD   LYS  77           HD1      LYS  77   3.059 -20.459 -20.459
  602   2HD   LYS  77           HD2      LYS  77   3.833 -19.084 -19.084
  603   1HE   LYS  77           HE1      LYS  77   2.310 -18.226 -18.226
  604   2HE   LYS  77           HE2      LYS  77   3.947 -17.946 -17.946
  605   1HZ   LYS  77           HZ1      LYS  77   3.144 -20.486 -20.486
  606   2HZ   LYS  77           HZ2      LYS  77   1.905 -19.394 -19.394
  607   3HZ   LYS  77           HZ3      LYS  77   3.484 -19.119 -19.119
  608    HA   PRO  78           HA       PRO  78   7.801 -23.750 -23.750
  609   1HB   PRO  78           HB1      PRO  78  10.497 -22.488 -22.488
  610   2HB   PRO  78           HB2      PRO  78   9.945 -23.898 -23.898
  611   1HG   PRO  78           HG1      PRO  78  10.462 -21.555 -21.555
  612   2HG   PRO  78           HG2      PRO  78   9.138 -22.604 -22.604
  613   1HD   PRO  78           HD1      PRO  78   8.971 -20.194 -20.194
  614   2HD   PRO  78           HD2      PRO  78   8.048 -20.470 -20.470
  615    H    ASP  79           HN       ASP  79   7.208 -20.932 -20.932
  616    HA   ASP  79           HA       ASP  79   8.230 -21.623 -21.623
  617   1HB   ASP  79           HB1      ASP  79   9.173 -19.495 -19.495
  618   2HB   ASP  79           HB2      ASP  79   7.598 -18.787 -18.787
  619    H    ALA  80           HN       ALA  80   5.862 -22.086 -22.086
  620    HA   ALA  80           HA       ALA  80   3.727 -21.638 -21.638
  621   1HB   ALA  80           HB1      ALA  80   3.512 -20.997 -20.997
  622   2HB   ALA  80           HB2      ALA  80   2.179 -20.928 -20.928
  623   3HB   ALA  80           HB3      ALA  80   3.524 -19.810 -19.810
  624    H    ALA  81           HN       ALA  81   4.615 -23.914 -23.914
  625    HA   ALA  81           HA       ALA  81   3.280 -25.779 -25.779
  626   1HB   ALA  81           HB1      ALA  81   5.649 -26.282 -26.282
  627   2HB   ALA  81           HB2      ALA  81   4.936 -27.460 -27.460
  628   3HB   ALA  81           HB3      ALA  81   5.737 -26.037 -26.037
  629   1H1   BME  16           HE1      MER  16  -8.844  10.464  10.464
  630   2H1   BME  16           HE2      MER  16  -8.778   9.766   9.766
  631   1H2   BME  16           HZ1      MER  16  -6.621   8.611   8.611
  632   2H2   BME  16           HZ2      MER  16  -6.702   9.466   9.466
  633    HO1  BME  16           HH       MER  16  -8.270   7.948   7.948

  Start of MODEL   12
    1    H    ASN   3           HN       ASN   3   4.718  -9.613  -9.613
    2    HA   ASN   3           HA       ASN   3   3.018 -11.648 -11.648
    3   1HB   ASN   3           HB1      ASN   3   3.094 -10.672 -10.672
    4   2HB   ASN   3           HB2      ASN   3   1.572 -11.260 -11.260
    5   1HD2  ASN   3          HD21      ASN   3   4.234 -13.967 -13.967
    6   2HD2  ASN   3          HD22      ASN   3   4.299 -12.336 -12.336
    7    H    ALA   4           HN       ALA   4   2.343 -10.411 -10.411
    8    HA   ALA   4           HA       ALA   4   1.259  -8.626  -8.626
    9   1HB   ALA   4           HB1      ALA   4  -0.762  -9.408  -9.408
   10   2HB   ALA   4           HB2      ALA   4  -1.144  -8.592  -8.592
   11   3HB   ALA   4           HB3      ALA   4  -0.537 -10.238 -10.238
   12    HA   PRO   5           HA       PRO   5   2.107  -4.812  -4.812
   13   1HB   PRO   5           HB1      PRO   5   3.155  -4.616  -4.616
   14   2HB   PRO   5           HB2      PRO   5   3.804  -3.897  -3.897
   15   1HG   PRO   5           HG1      PRO   5   5.019  -6.052  -6.052
   16   2HG   PRO   5           HG2      PRO   5   4.583  -6.092  -6.092
   17   1HD   PRO   5           HD1      PRO   5   2.932  -7.171  -7.171
   18   2HD   PRO   5           HD2      PRO   5   3.480  -8.109  -8.109
   19    H    LYS   6           HN       LYS   6   1.556  -2.799  -2.799
   20    HA   LYS   6           HA       LYS   6  -1.298  -3.202  -3.202
   21   1HB   LYS   6           HB1      LYS   6  -0.017  -0.712  -0.712
   22   2HB   LYS   6           HB2      LYS   6  -1.647  -0.772  -0.772
   23   1HG   LYS   6           HG1      LYS   6  -2.243  -2.500  -2.500
   24   2HG   LYS   6           HG2      LYS   6  -0.631  -2.334  -2.334
   25   1HD   LYS   6           HD1      LYS   6  -1.017   0.091   0.091
   26   2HD   LYS   6           HD2      LYS   6  -2.596  -0.020  -0.020
   27   1HE   LYS   6           HE1      LYS   6  -3.352  -1.567  -1.567
   28   2HE   LYS   6           HE2      LYS   6  -1.771  -1.436  -1.436
   29   1HZ   LYS   6           HZ1      LYS   6  -2.716   1.141   1.141
   30   2HZ   LYS   6           HZ2      LYS   6  -3.957   0.273   0.273
   31   3HZ   LYS   6           HZ3      LYS   6  -2.431   0.405   0.405
   32    H    ARG   7           HN       ARG   7  -2.155  -1.986  -1.986
   33    HA   ARG   7           HA       ARG   7  -0.584  -1.784  -1.784
   34   1HB   ARG   7           HB1      ARG   7  -3.110  -2.112  -2.112
   35   2HB   ARG   7           HB2      ARG   7  -3.255  -0.413  -0.413
   36   1HG   ARG   7           HG1      ARG   7  -3.591  -0.294  -0.294
   37   2HG   ARG   7           HG2      ARG   7  -1.842  -0.157  -0.157
   38   1HD   ARG   7           HD1      ARG   7  -1.648  -2.635  -2.635
   39   2HD   ARG   7           HD2      ARG   7  -3.406  -2.746  -2.746
   40    HE   ARG   7           HE       ARG   7  -3.324  -1.198  -1.198
   41   1HH1  ARG   7          HH11      ARG   7   0.322  -2.465  -2.465
   42   2HH1  ARG   7          HH12      ARG   7  -0.165  -1.901  -1.901
   43   1HH2  ARG   7          HH21      ARG   7  -2.936  -2.434  -2.434
   44   2HH2  ARG   7          HH22      ARG   7  -1.280  -2.774  -2.774
   45    HA   PRO   8           HA       PRO   8   1.418   1.954   1.954
   46   1HB   PRO   8           HB1      PRO   8   3.030   2.485   2.485
   47   2HB   PRO   8           HB2      PRO   8   3.346   1.184   1.184
   48   1HG   PRO   8           HG1      PRO   8   1.785   1.019   1.019
   49   2HG   PRO   8           HG2      PRO   8   3.170   0.035   0.035
   50   1HD   PRO   8           HD1      PRO   8   0.733  -0.954  -0.954
   51   2HD   PRO   8           HD2      PRO   8   1.902  -1.100  -1.100
   52    HA   PRO   9           HA       PRO   9  -0.682   5.531   5.531
   53   1HB   PRO   9           HB1      PRO   9   1.160   7.544   7.544
   54   2HB   PRO   9           HB2      PRO   9   0.457   6.710   6.710
   55   1HG   PRO   9           HG1      PRO   9   3.059   6.026   6.026
   56   2HG   PRO   9           HG2      PRO   9   2.852   6.402   6.402
   57   1HD   PRO   9           HD1      PRO   9   2.866   3.831   3.831
   58   2HD   PRO   9           HD2      PRO   9   1.625   4.350   4.350
   59    H    SER  10           HN       SER  10   0.115   7.682   7.682
   60    HA   SER  10           HA       SER  10   0.826   6.596   6.596
   61   1HB   SER  10           HB1      SER  10  -0.571   8.535   8.535
   62   2HB   SER  10           HB2      SER  10  -1.499   7.399   7.399
   63    HG   SER  10           HG       SER  10  -0.345   9.174   9.174
   64    H    ALA  11           HN       ALA  11   1.011   9.436   9.436
   65    HA   ALA  11           HA       ALA  11   3.456  10.341  10.341
   66   1HB   ALA  11           HB1      ALA  11   2.624  11.237  11.237
   67   2HB   ALA  11           HB2      ALA  11   4.042  11.780  11.780
   68   3HB   ALA  11           HB3      ALA  11   3.958  10.135  10.135
   69    H    PHE  12           HN       PHE  12   0.482  11.062  11.062
   70    HA   PHE  12           HA       PHE  12   0.172  13.700  13.700
   71   1HB   PHE  12           HB1      PHE  12  -0.990  13.971  13.971
   72   2HB   PHE  12           HB2      PHE  12  -0.886  12.228  12.228
   73    HD1  PHE  12           HD1      PHE  12  -3.095  14.081  14.081
   74    HD2  PHE  12           HD2      PHE  12  -2.736  11.675  11.675
   75    HE1  PHE  12           HE1      PHE  12  -5.534  13.925  13.925
   76    HE2  PHE  12           HE2      PHE  12  -5.175  11.541  11.541
   77    HZ   PHE  12           HZ       PHE  12  -6.584  12.655  12.655
   78    H    PHE  13           HN       PHE  13  -0.354  10.434  10.434
   79    HA   PHE  13           HA       PHE  13  -2.738  10.709  10.709
   80   1HB   PHE  13           HB1      PHE  13  -1.215   8.594   8.594
   81   2HB   PHE  13           HB2      PHE  13  -0.663   8.839   8.839
   82    HD1  PHE  13           HD1      PHE  13  -2.602   9.259   9.259
   83    HD2  PHE  13           HD2      PHE  13  -3.221   7.475   7.475
   84    HE1  PHE  13           HE1      PHE  13  -4.735   8.322   8.322
   85    HE2  PHE  13           HE2      PHE  13  -5.352   6.543   6.543
   86    HZ   PHE  13           HZ       PHE  13  -6.114   6.963   6.963
   87    H    LEU  14           HN       LEU  14   0.727  11.127  11.127
   88    HA   LEU  14           HA       LEU  14   0.507  11.653  11.653
   89   1HB   LEU  14           HB1      LEU  14   2.343  13.034  13.034
   90   2HB   LEU  14           HB2      LEU  14   2.582  13.110  13.110
   91    HG   LEU  14           HG       LEU  14   4.156  11.543  11.543
   92   1HD1  LEU  14          HD11      LEU  14   1.803   9.812   9.812
   93   2HD1  LEU  14          HD12      LEU  14   3.473   9.276   9.276
   94   3HD1  LEU  14          HD13      LEU  14   3.006  10.516  10.516
   95   1HD2  LEU  14          HD21      LEU  14   3.422  11.318  11.318
   96   2HD2  LEU  14          HD22      LEU  14   3.914   9.794   9.794
   97   3HD2  LEU  14          HD23      LEU  14   2.202  10.139  10.139
   98    H    PHE  15           HN       PHE  15   0.567  13.892  13.892
   99    HA   PHE  15           HA       PHE  15  -0.120  16.338  16.338
  100   1HB   PHE  15           HB1      PHE  15   0.677  16.159  16.159
  101   2HB   PHE  15           HB2      PHE  15  -0.611  15.008  15.008
  102    HD1  PHE  15           HD1      PHE  15  -0.803  18.499  18.499
  103    HD2  PHE  15           HD2      PHE  15  -1.696  15.816  15.816
  104    HE1  PHE  15           HE1      PHE  15  -2.071  20.260  20.260
  105    HE2  PHE  15           HE2      PHE  15  -2.960  17.573  17.573
  106    HZ   PHE  15           HZ       PHE  15  -3.148  19.797  19.797
  107    H    CYS  16           HN       MER  16  -2.324  14.149  14.149
  108    HA   CYS  16           HA       MER  16  -4.810  15.273  15.273
  109   1HB   CYS  16           HB1      MER  16  -5.708  13.324  13.324
  110   2HB   CYS  16           HB2      MER  16  -4.084  13.023  13.023
  111    H    SER  17           HN       SER  17  -3.041  12.998  12.998
  112    HA   SER  17           HA       SER  17  -4.985  12.674  12.674
  113   1HB   SER  17           HB1      SER  17  -1.938  12.801  12.801
  114   2HB   SER  17           HB2      SER  17  -3.095  12.023  12.023
  115    HG   SER  17           HG       SER  17  -2.052  11.107  11.107
  116    H    GLU  18           HN       GLU  18  -2.448  15.044  15.044
  117    HA   GLU  18           HA       GLU  18  -3.096  16.507  16.507
  118   1HB   GLU  18           HB1      GLU  18  -0.895  16.496  16.496
  119   2HB   GLU  18           HB2      GLU  18  -1.593  17.340  17.340
  120   1HG   GLU  18           HG1      GLU  18  -2.067  19.314  19.314
  121   2HG   GLU  18           HG2      GLU  18  -1.617  18.469  18.469
  122    H    TYR  19           HN       TYR  19  -4.566  16.413  16.413
  123    HA   TYR  19           HA       TYR  19  -5.807  19.090  19.090
  124   1HB   TYR  19           HB1      TYR  19  -5.382  17.066  17.066
  125   2HB   TYR  19           HB2      TYR  19  -6.918  17.964  17.964
  126    HD1  TYR  19           HD1      TYR  19  -3.349  18.647  18.647
  127    HD2  TYR  19           HD2      TYR  19  -6.841  19.946  19.946
  128    HE1  TYR  19           HE1      TYR  19  -2.110  20.574  20.574
  129    HE2  TYR  19           HE2      TYR  19  -5.612  21.875  21.875
  130    HH   TYR  19           HH       TYR  19  -3.554  23.243  23.243
  131    H    ARG  20           HN       ARG  20  -6.814  15.776  15.776
  132    HA   ARG  20           HA       ARG  20  -9.414  15.534  15.534
  133   1HB   ARG  20           HB1      ARG  20  -8.091  13.725  13.725
  134   2HB   ARG  20           HB2      ARG  20  -7.656  14.495  14.495
  135   1HG   ARG  20           HG1      ARG  20 -10.100  14.372  14.372
  136   2HG   ARG  20           HG2      ARG  20 -10.461  13.600  13.600
  137   1HD   ARG  20           HD1      ARG  20  -8.842  11.745  11.745
  138   2HD   ARG  20           HD2      ARG  20  -8.658  12.523  12.523
  139    HE   ARG  20           HE       ARG  20 -11.070  12.133  12.133
  140   1HH1  ARG  20          HH11      ARG  20 -11.830  11.710  11.710
  141   2HH1  ARG  20          HH12      ARG  20 -12.028   9.994   9.994
  142   1HH2  ARG  20          HH21      ARG  20 -10.292   9.448   9.448
  143   2HH2  ARG  20          HH22      ARG  20 -11.130   8.673   8.673
  144    HA   PRO  21           HA       PRO  21 -10.999  17.067  17.067
  145   1HB   PRO  21           HB1      PRO  21  -9.453  18.221  18.221
  146   2HB   PRO  21           HB2      PRO  21  -9.394  16.464  16.464
  147   1HG   PRO  21           HG1      PRO  21  -7.580  18.574  18.574
  148   2HG   PRO  21           HG2      PRO  21  -7.072  17.239  17.239
  149   1HD   PRO  21           HD1      PRO  21  -7.091  16.827  16.827
  150   2HD   PRO  21           HD2      PRO  21  -7.819  15.588  15.588
  151    H    LYS  22           HN       LYS  22  -8.748  19.035  19.035
  152    HA   LYS  22           HA       LYS  22  -9.950  21.617  21.617
  153   1HB   LYS  22           HB1      LYS  22  -7.535  21.482  21.482
  154   2HB   LYS  22           HB2      LYS  22  -7.668  20.734  20.734
  155   1HG   LYS  22           HG1      LYS  22  -8.688  22.845  22.845
  156   2HG   LYS  22           HG2      LYS  22  -8.490  23.579  23.579
  157   1HD   LYS  22           HD1      LYS  22  -6.143  23.647  23.647
  158   2HD   LYS  22           HD2      LYS  22  -6.063  22.348  22.348
  159   1HE   LYS  22           HE1      LYS  22  -5.582  24.561  24.561
  160   2HE   LYS  22           HE2      LYS  22  -7.033  23.846  23.846
  161   1HZ   LYS  22           HZ1      LYS  22  -7.766  25.371  25.371
  162   2HZ   LYS  22           HZ2      LYS  22  -6.747  26.316  26.316
  163   3HZ   LYS  22           HZ3      LYS  22  -8.150  25.622  25.622
  164    H    ILE  23           HN       ILE  23 -10.151  19.275  19.275
  165    HA   ILE  23           HA       ILE  23 -11.512  21.282  21.282
  166    HB   ILE  23           HB       ILE  23 -11.406  18.258  18.258
  167   1HG1  ILE  23          HG11      ILE  23  -9.434  20.361  20.361
  168   2HG1  ILE  23          HG12      ILE  23  -9.057  19.176  19.176
  169   1HG2  ILE  23          HG21      ILE  23 -13.070  19.662  19.662
  170   2HG2  ILE  23          HG22      ILE  23 -11.752  20.688  20.688
  171   3HG2  ILE  23          HG23      ILE  23 -11.855  19.017  19.017
  172   1HD1  ILE  23          HD11      ILE  23  -9.588  17.332  17.332
  173   2HD1  ILE  23          HD12      ILE  23  -9.951  18.476  18.476
  174   3HD1  ILE  23          HD13      ILE  23  -8.320  18.351  18.351
  175    H    LYS  24           HN       LYS  24 -11.964  18.395  18.395
  176    HA   LYS  24           HA       LYS  24 -14.726  17.999  17.999
  177   1HB   LYS  24           HB1      LYS  24 -12.857  16.487  16.487
  178   2HB   LYS  24           HB2      LYS  24 -12.855  17.415  17.415
  179   1HG   LYS  24           HG1      LYS  24 -14.223  15.495  15.495
  180   2HG   LYS  24           HG2      LYS  24 -15.362  16.803  16.803
  181   1HD   LYS  24           HD1      LYS  24 -16.240  14.925  14.925
  182   2HD   LYS  24           HD2      LYS  24 -15.639  16.044  16.044
  183   1HE   LYS  24           HE1      LYS  24 -14.861  13.805  13.805
  184   2HE   LYS  24           HE2      LYS  24 -13.459  14.701  14.701
  185   1HZ   LYS  24           HZ1      LYS  24 -14.670  13.520  13.520
  186   2HZ   LYS  24           HZ2      LYS  24 -14.483  12.331  12.331
  187   3HZ   LYS  24           HZ3      LYS  24 -13.134  13.214  13.214
  188    H    GLY  25           HN       GLY  25 -12.848  20.149  20.149
  189   1HA   GLY  25           HA1      GLY  25 -14.912  20.822  20.822
  190   2HA   GLY  25           HA2      GLY  25 -13.350  21.611  21.611
  191    H    GLU  26           HN       GLU  26 -13.625  22.204  22.204
  192    HA   GLU  26           HA       GLU  26 -15.253  24.612  24.612
  193   1HB   GLU  26           HB1      GLU  26 -13.437  23.587  23.587
  194   2HB   GLU  26           HB2      GLU  26 -14.149  25.186  25.186
  195   1HG   GLU  26           HG1      GLU  26 -12.387  24.083  24.083
  196   2HG   GLU  26           HG2      GLU  26 -11.749  25.032  25.032
  197    H    HIS  27           HN       HIS  27 -15.173  21.742  21.742
  198    HA   HIS  27           HA       HIS  27 -17.893  22.278  22.278
  199   1HB   HIS  27           HB1      HIS  27 -15.651  20.949  20.949
  200   2HB   HIS  27           HB2      HIS  27 -17.186  21.574  21.574
  201    HD1  HIS  27           HD1      HIS  27 -17.350  24.308  24.308
  202    HD2  HIS  27           HD2      HIS  27 -13.588  22.717  22.717
  203    HE1  HIS  27           HE1      HIS  27 -15.816  26.201  26.201
  204    HA   PRO  28           HA       PRO  28 -17.976  18.057  18.057
  205   1HB   PRO  28           HB1      PRO  28 -19.898  18.455  18.455
  206   2HB   PRO  28           HB2      PRO  28 -18.242  18.971  18.971
  207   1HG   PRO  28           HG1      PRO  28 -20.540  20.669  20.669
  208   2HG   PRO  28           HG2      PRO  28 -19.525  21.015  21.015
  209   1HD   PRO  28           HD1      PRO  28 -18.931  22.054  22.054
  210   2HD   PRO  28           HD2      PRO  28 -17.623  21.596  21.596
  211    H    GLY  29           HN       GLY  29 -18.809  18.982  18.982
  212   1HA   GLY  29           HA1      GLY  29 -21.488  17.816  17.816
  213   2HA   GLY  29           HA2      GLY  29 -21.043  19.305  19.305
  214    H    LEU  30           HN       LEU  30 -18.178  17.979  17.979
  215    HA   LEU  30           HA       LEU  30 -18.424  16.960  16.960
  216   1HB   LEU  30           HB1      LEU  30 -16.083  16.815  16.815
  217   2HB   LEU  30           HB2      LEU  30 -15.968  16.645  16.645
  218    HG   LEU  30           HG       LEU  30 -16.588  19.080  19.080
  219   1HD1  LEU  30          HD11      LEU  30 -14.230  18.551  18.551
  220   2HD1  LEU  30          HD12      LEU  30 -14.380  18.473  18.473
  221   3HD1  LEU  30          HD13      LEU  30 -14.586  20.003  20.003
  222   1HD2  LEU  30          HD21      LEU  30 -16.777  18.895  18.895
  223   2HD2  LEU  30          HD22      LEU  30 -18.125  19.187  19.187
  224   3HD2  LEU  30          HD23      LEU  30 -16.856  20.379  20.379
  225    H    SER  31           HN       SER  31 -17.351  14.955  14.955
  226    HA   SER  31           HA       SER  31 -18.172  12.651  12.651
  227   1HB   SER  31           HB1      SER  31 -18.465  11.417  11.417
  228   2HB   SER  31           HB2      SER  31 -19.335  12.949  12.949
  229    HG   SER  31           HG       SER  31 -18.009  13.389  13.389
  230    H    ILE  32           HN       ILE  32 -16.785  10.669  10.669
  231    HA   ILE  32           HA       ILE  32 -14.034  11.325  11.325
  232    HB   ILE  32           HB       ILE  32 -15.600   9.249   9.249
  233   1HG1  ILE  32          HG11      ILE  32 -13.414   9.248   9.248
  234   2HG1  ILE  32          HG12      ILE  32 -13.730   7.688   7.688
  235   1HG2  ILE  32          HG21      ILE  32 -16.168   8.606   8.606
  236   2HG2  ILE  32          HG22      ILE  32 -14.480   8.287   8.287
  237   3HG2  ILE  32          HG23      ILE  32 -15.326   7.285   7.285
  238   1HD1  ILE  32          HD11      ILE  32 -12.284   8.288   8.288
  239   2HD1  ILE  32          HD12      ILE  32 -11.954   9.847   9.847
  240   3HD1  ILE  32          HD13      ILE  32 -11.414   8.371   8.371
  241    H    GLY  33           HN       GLY  33 -15.780  11.629  11.629
  242   1HA   GLY  33           HA1      GLY  33 -13.664  11.062  11.062
  243   2HA   GLY  33           HA2      GLY  33 -15.392  11.206  11.206
  244    H    ASP  34           HN       ASP  34 -15.096  13.534  13.534
  245    HA   ASP  34           HA       ASP  34 -14.480  15.612  15.612
  246   1HB   ASP  34           HB1      ASP  34 -16.015  15.557  15.557
  247   2HB   ASP  34           HB2      ASP  34 -15.779  17.094  17.094
  248    H    VAL  35           HN       VAL  35 -14.096  14.753  14.753
  249    HA   VAL  35           HA       VAL  35 -12.137  16.702  16.702
  250    HB   VAL  35           HB       VAL  35 -12.719  13.856  13.856
  251   1HG1  VAL  35          HG11      VAL  35 -11.124  16.073  16.073
  252   2HG1  VAL  35          HG12      VAL  35 -11.513  14.523  14.523
  253   3HG1  VAL  35          HG13      VAL  35 -10.424  14.600  14.600
  254   1HG2  VAL  35          HG21      VAL  35 -13.597  16.561  16.561
  255   2HG2  VAL  35          HG22      VAL  35 -14.608  15.380  15.380
  256   3HG2  VAL  35          HG23      VAL  35 -13.929  15.007  15.007
  257    H    ALA  36           HN       ALA  36 -12.076  13.664  13.664
  258    HA   ALA  36           HA       ALA  36  -9.213  13.363  13.363
  259   1HB   ALA  36           HB1      ALA  36 -11.490  11.959  11.959
  260   2HB   ALA  36           HB2      ALA  36  -9.837  11.351  11.351
  261   3HB   ALA  36           HB3      ALA  36 -10.752  11.450  11.450
  262    H    LYS  37           HN       LYS  37 -11.711  14.241  14.241
  263    HA   LYS  37           HA       LYS  37  -9.723  14.504  14.504
  264   1HB   LYS  37           HB1      LYS  37 -12.596  15.324  15.324
  265   2HB   LYS  37           HB2      LYS  37 -11.632  16.138  16.138
  266   1HG   LYS  37           HG1      LYS  37 -10.936  13.761  13.761
  267   2HG   LYS  37           HG2      LYS  37 -12.227  13.155  13.155
  268   1HD   LYS  37           HD1      LYS  37 -13.061  13.439  13.439
  269   2HD   LYS  37           HD2      LYS  37 -13.861  14.606  14.606
  270   1HE   LYS  37           HE1      LYS  37 -12.374  16.409  16.409
  271   2HE   LYS  37           HE2      LYS  37 -11.392  15.264  15.264
  272   1HZ   LYS  37           HZ1      LYS  37 -14.070  14.986  14.986
  273   2HZ   LYS  37           HZ2      LYS  37 -13.662  16.635  16.635
  274   3HZ   LYS  37           HZ3      LYS  37 -12.742  15.515  15.515
  275    H    LYS  38           HN       LYS  38 -11.082  16.844  16.844
  276    HA   LYS  38           HA       LYS  38  -9.924  19.086  19.086
  277   1HB   LYS  38           HB1      LYS  38 -11.893  19.122  19.122
  278   2HB   LYS  38           HB2      LYS  38 -10.858  18.720  18.720
  279   1HG   LYS  38           HG1      LYS  38  -9.585  20.795  20.795
  280   2HG   LYS  38           HG2      LYS  38 -10.441  21.195  21.195
  281   1HD   LYS  38           HD1      LYS  38 -11.716  20.943  20.943
  282   2HD   LYS  38           HD2      LYS  38 -11.269  22.463  22.463
  283   1HE   LYS  38           HE1      LYS  38 -12.827  21.884  21.884
  284   2HE   LYS  38           HE2      LYS  38 -13.372  20.484  20.484
  285   1HZ   LYS  38           HZ1      LYS  38 -13.458  22.749  22.749
  286   2HZ   LYS  38           HZ2      LYS  38 -14.260  23.091  23.091
  287   3HZ   LYS  38           HZ3      LYS  38 -14.729  21.756  21.756
  288    H    LEU  39           HN       LEU  39  -8.962  17.278  17.278
  289    HA   LEU  39           HA       LEU  39  -6.465  18.796  18.796
  290   1HB   LEU  39           HB1      LEU  39  -6.581  18.166  18.166
  291   2HB   LEU  39           HB2      LEU  39  -8.148  17.498  17.498
  292    HG   LEU  39           HG       LEU  39  -6.807  15.427  15.427
  293   1HD1  LEU  39          HD11      LEU  39  -4.896  17.005  17.005
  294   2HD1  LEU  39          HD12      LEU  39  -4.667  15.311  15.311
  295   3HD1  LEU  39          HD13      LEU  39  -4.556  16.460  16.460
  296   1HD2  LEU  39          HD21      LEU  39  -8.388  15.650  15.650
  297   2HD2  LEU  39          HD22      LEU  39  -6.991  14.702  14.702
  298   3HD2  LEU  39          HD23      LEU  39  -7.095  16.389  16.389
  299    H    GLY  40           HN       GLY  40  -7.461  15.708  15.708
  300   1HA   GLY  40           HA1      GLY  40  -4.795  14.669  14.669
  301   2HA   GLY  40           HA2      GLY  40  -6.194  14.116  14.116
  302    H    GLU  41           HN       GLU  41  -6.743  16.966  16.966
  303    HA   GLU  41           HA       GLU  41  -5.021  16.897  16.897
  304   1HB   GLU  41           HB1      GLU  41  -7.192  18.711  18.711
  305   2HB   GLU  41           HB2      GLU  41  -6.331  19.066  19.066
  306   1HG   GLU  41           HG1      GLU  41  -7.015  16.941  16.941
  307   2HG   GLU  41           HG2      GLU  41  -7.821  16.426  16.426
  308    H    MET  42           HN       MET  42  -5.592  18.998  18.998
  309    HA   MET  42           HA       MET  42  -3.648  20.958  20.958
  310   1HB   MET  42           HB1      MET  42  -4.543  19.949  19.949
  311   2HB   MET  42           HB2      MET  42  -3.506  21.361  21.361
  312   1HG   MET  42           HG1      MET  42  -5.362  22.202  22.202
  313   2HG   MET  42           HG2      MET  42  -6.374  21.000  21.000
  314   1HE   MET  42           HE1      MET  42  -7.495  20.945  20.945
  315   2HE   MET  42           HE2      MET  42  -6.065  21.008  21.008
  316   3HE   MET  42           HE3      MET  42  -7.414  22.116  22.116
  317    H    TRP  43           HN       TRP  43  -3.374  17.852  17.852
  318    HA   TRP  43           HA       TRP  43  -0.762  17.917  17.917
  319   1HB   TRP  43           HB1      TRP  43  -2.094  15.960  15.960
  320   2HB   TRP  43           HB2      TRP  43  -2.358  15.768  15.768
  321    HD1  TRP  43           HD1      TRP  43  -0.848  14.115  14.115
  322    HE1  TRP  43           HE1      TRP  43   1.405  13.181  13.181
  323    HE3  TRP  43           HE3      TRP  43   0.137  16.713  16.713
  324    HZ2  TRP  43           HZ2      TRP  43   3.472  13.424  13.424
  325    HZ3  TRP  43           HZ3      TRP  43   2.158  16.380  16.380
  326    HH2  TRP  43           HH2      TRP  43   3.867  14.725  14.725
  327    H    ASN  44           HN       ASN  44  -1.932  17.198  17.198
  328    HA   ASN  44           HA       ASN  44   0.615  16.744  16.744
  329   1HB   ASN  44           HB1      ASN  44  -1.890  17.847  17.847
  330   2HB   ASN  44           HB2      ASN  44  -0.521  17.056  17.056
  331   1HD2  ASN  44          HD21      ASN  44  -3.435  14.725  14.725
  332   2HD2  ASN  44          HD22      ASN  44  -3.592  16.363  16.363
  333    H    ASN  45           HN       ASN  45  -1.095  19.593  19.593
  334    HA   ASN  45           HA       ASN  45   1.113  21.324  21.324
  335   1HB   ASN  45           HB1      ASN  45  -1.682  22.410  22.410
  336   2HB   ASN  45           HB2      ASN  45  -0.447  22.917  22.917
  337   1HD2  ASN  45          HD21      ASN  45  -3.225  20.216  20.216
  338   2HD2  ASN  45          HD22      ASN  45  -3.242  21.097  21.097
  339    H    THR  46           HN       THR  46   1.326  20.237  20.237
  340    HA   THR  46           HA       THR  46   0.331  22.265  22.265
  341    HB   THR  46           HB       THR  46   0.615  19.939  19.939
  342    HG1  THR  46           HG1      THR  46   1.702  22.165  22.165
  343   1HG2  THR  46          HG21      THR  46   2.661  19.182  19.182
  344   2HG2  THR  46          HG22      THR  46   3.654  20.241  20.241
  345   3HG2  THR  46          HG23      THR  46   2.792  18.915  18.915
  346    H    ALA  47           HN       ALA  47   3.449  21.289  21.289
  347    HA   ALA  47           HA       ALA  47   4.483  23.967  23.967
  348   1HB   ALA  47           HB1      ALA  47   4.920  23.577  23.577
  349   2HB   ALA  47           HB2      ALA  47   5.827  22.143  22.143
  350   3HB   ALA  47           HB3      ALA  47   6.396  23.727  23.727
  351    H    ALA  48           HN       ALA  48   5.264  20.694  20.694
  352    HA   ALA  48           HA       ALA  48   5.877  19.000  19.000
  353   1HB   ALA  48           HB1      ALA  48   6.061  20.577  20.577
  354   2HB   ALA  48           HB2      ALA  48   7.593  21.156  21.156
  355   3HB   ALA  48           HB3      ALA  48   7.418  19.481  19.481
  356    H    ASP  49           HN       ASP  49   7.692  21.688  21.688
  357    HA   ASP  49           HA       ASP  49   9.992  20.091  20.091
  358   1HB   ASP  49           HB1      ASP  49  10.050  22.367  22.367
  359   2HB   ASP  49           HB2      ASP  49   9.511  23.095  23.095
  360    H    ASP  50           HN       ASP  50   7.195  20.006  20.006
  361    HA   ASP  50           HA       ASP  50   7.781  20.371  20.371
  362   1HB   ASP  50           HB1      ASP  50   6.168  22.163  22.163
  363   2HB   ASP  50           HB2      ASP  50   5.142  20.935  20.935
  364    H    LYS  51           HN       LYS  51   6.640  18.647  18.647
  365    HA   LYS  51           HA       LYS  51   5.175  16.571  16.571
  366   1HB   LYS  51           HB1      LYS  51   6.478  16.481  16.481
  367   2HB   LYS  51           HB2      LYS  51   5.237  15.401  15.401
  368   1HG   LYS  51           HG1      LYS  51   3.634  17.213  17.213
  369   2HG   LYS  51           HG2      LYS  51   4.867  18.400  18.400
  370   1HD   LYS  51           HD1      LYS  51   3.706  18.061  18.061
  371   2HD   LYS  51           HD2      LYS  51   5.202  17.155  17.155
  372   1HE   LYS  51           HE1      LYS  51   2.681  15.895  15.895
  373   2HE   LYS  51           HE2      LYS  51   3.130  15.993  15.993
  374   1HZ   LYS  51           HZ1      LYS  51   5.330  15.025  15.025
  375   2HZ   LYS  51           HZ2      LYS  51   3.973  14.116  14.116
  376   3HZ   LYS  51           HZ3      LYS  51   4.407  14.227  14.227
  377    H    GLN  52           HN       GLN  52   8.253  16.833  16.833
  378    HA   GLN  52           HA       GLN  52   9.622  14.635  14.635
  379   1HB   GLN  52           HB1      GLN  52  10.323  17.388  17.388
  380   2HB   GLN  52           HB2      GLN  52  11.229  16.717  16.717
  381   1HG   GLN  52           HG1      GLN  52  12.580  16.598  16.598
  382   2HG   GLN  52           HG2      GLN  52  12.201  14.986  14.986
  383   1HE2  GLN  52          HE21      GLN  52   9.610  15.302  15.302
  384   2HE2  GLN  52          HE22      GLN  52   9.308  15.807  15.807
  385    HA   PRO  53           HA       PRO  53  10.622  14.510  14.510
  386   1HB   PRO  53           HB1      PRO  53   8.826  15.881  15.881
  387   2HB   PRO  53           HB2      PRO  53  10.401  16.502  16.502
  388   1HG   PRO  53           HG1      PRO  53   7.721  16.942  16.942
  389   2HG   PRO  53           HG2      PRO  53   8.872  18.178  18.178
  390   1HD   PRO  53           HD1      PRO  53   8.986  17.430  17.430
  391   2HD   PRO  53           HD2      PRO  53  10.524  17.463  17.463
  392    H    TYR  54           HN       TYR  54   7.190  15.085  15.085
  393    HA   TYR  54           HA       TYR  54   6.172  12.885  12.885
  394   1HB   TYR  54           HB1      TYR  54   5.038  14.474  14.474
  395   2HB   TYR  54           HB2      TYR  54   4.111  13.235  13.235
  396    HD1  TYR  54           HD1      TYR  54   6.204  14.847  14.847
  397    HD2  TYR  54           HD2      TYR  54   2.676  15.439  15.439
  398    HE1  TYR  54           HE1      TYR  54   5.435  16.536  16.536
  399    HE2  TYR  54           HE2      TYR  54   1.915  17.128  17.128
  400    HH   TYR  54           HH       TYR  54   3.111  18.734  18.734
  401    H    GLU  55           HN       GLU  55   6.883  13.329  13.329
  402    HA   GLU  55           HA       GLU  55   6.105  10.798  10.798
  403   1HB   GLU  55           HB1      GLU  55   7.248  13.147  13.147
  404   2HB   GLU  55           HB2      GLU  55   8.534  11.979  11.979
  405   1HG   GLU  55           HG1      GLU  55   6.837  10.449  10.449
  406   2HG   GLU  55           HG2      GLU  55   5.657  11.743  11.743
  407    H    LYS  56           HN       LYS  56   9.359  11.834  11.834
  408    HA   LYS  56           HA       LYS  56  10.749   9.486   9.486
  409   1HB   LYS  56           HB1      LYS  56  11.016  11.965  11.965
  410   2HB   LYS  56           HB2      LYS  56  11.927  10.602  10.602
  411   1HG   LYS  56           HG1      LYS  56  13.217  12.101  12.101
  412   2HG   LYS  56           HG2      LYS  56  13.204  10.428  10.428
  413   1HD   LYS  56           HD1      LYS  56  11.432  10.975  10.975
  414   2HD   LYS  56           HD2      LYS  56  11.465  12.649  12.649
  415   1HE   LYS  56           HE1      LYS  56  13.895  11.179  11.179
  416   2HE   LYS  56           HE2      LYS  56  12.866  12.231  12.231
  417   1HZ   LYS  56           HZ1      LYS  56  13.585  13.590  13.590
  418   2HZ   LYS  56           HZ2      LYS  56  14.992  12.938  12.938
  419   3HZ   LYS  56           HZ3      LYS  56  13.989  13.953  13.953
  420    H    LYS  57           HN       LYS  57   8.712  10.563  10.563
  421    HA   LYS  57           HA       LYS  57   9.268   8.469   8.469
  422   1HB   LYS  57           HB1      LYS  57   7.113  10.543  10.543
  423   2HB   LYS  57           HB2      LYS  57   6.681   9.191   9.191
  424   1HG   LYS  57           HG1      LYS  57   9.307  10.571  10.571
  425   2HG   LYS  57           HG2      LYS  57   7.841  11.444  11.444
  426   1HD   LYS  57           HD1      LYS  57   7.071   9.458   9.458
  427   2HD   LYS  57           HD2      LYS  57   8.580   8.643   8.643
  428   1HE   LYS  57           HE1      LYS  57   9.858  10.364  10.364
  429   2HE   LYS  57           HE2      LYS  57   8.405  11.330  11.330
  430   1HZ   LYS  57           HZ1      LYS  57   7.887   8.771   8.771
  431   2HZ   LYS  57           HZ2      LYS  57   9.389   9.256   9.256
  432   3HZ   LYS  57           HZ3      LYS  57   8.014  10.222  10.222
  433    H    ALA  58           HN       ALA  58   6.444   8.952   8.952
  434    HA   ALA  58           HA       ALA  58   5.150   6.562   6.562
  435   1HB   ALA  58           HB1      ALA  58   5.658   8.061   8.061
  436   2HB   ALA  58           HB2      ALA  58   4.390   6.868   6.868
  437   3HB   ALA  58           HB3      ALA  58   4.349   8.386   8.386
  438    H    ALA  59           HN       ALA  59   7.765   7.185   7.185
  439    HA   ALA  59           HA       ALA  59   8.030   4.659   4.659
  440   1HB   ALA  59           HB1      ALA  59   9.299   6.675   6.675
  441   2HB   ALA  59           HB2      ALA  59  10.257   6.632   6.632
  442   3HB   ALA  59           HB3      ALA  59  10.404   5.341   5.341
  443    H    LYS  60           HN       LYS  60  10.074   5.808   5.808
  444    HA   LYS  60           HA       LYS  60  11.391   3.470   3.470
  445   1HB   LYS  60           HB1      LYS  60  11.647   5.846   5.846
  446   2HB   LYS  60           HB2      LYS  60  10.371   5.472   5.472
  447   1HG   LYS  60           HG1      LYS  60  12.628   3.496   3.496
  448   2HG   LYS  60           HG2      LYS  60  13.032   5.073   5.073
  449   1HD   LYS  60           HD1      LYS  60  11.236   4.855   4.855
  450   2HD   LYS  60           HD2      LYS  60  10.791   3.286   3.286
  451   1HE   LYS  60           HE1      LYS  60  12.289   3.050   3.050
  452   2HE   LYS  60           HE2      LYS  60  13.054   2.402   2.402
  453   1HZ   LYS  60           HZ1      LYS  60  13.677   5.127   5.127
  454   2HZ   LYS  60           HZ2      LYS  60  13.977   4.411   4.411
  455   3HZ   LYS  60           HZ3      LYS  60  14.714   3.788   3.788
  456    H    LEU  61           HN       LEU  61   8.184   4.411   4.411
  457    HA   LEU  61           HA       LEU  61   7.890   2.044   2.044
  458   1HB   LEU  61           HB1      LEU  61   5.729   3.880   3.880
  459   2HB   LEU  61           HB2      LEU  61   5.585   2.847   2.847
  460    HG   LEU  61           HG       LEU  61   7.512   5.204   5.204
  461   1HD1  LEU  61          HD11      LEU  61   5.206   5.860   5.860
  462   2HD1  LEU  61          HD12      LEU  61   5.074   4.839   4.839
  463   3HD1  LEU  61          HD13      LEU  61   6.150   6.231   6.231
  464   1HD2  LEU  61          HD21      LEU  61   7.157   3.325   3.325
  465   2HD2  LEU  61          HD22      LEU  61   8.572   3.412   3.412
  466   3HD2  LEU  61          HD23      LEU  61   8.154   4.772   4.772
  467    H    LYS  62           HN       LYS  62   6.354   2.941   2.941
  468    HA   LYS  62           HA       LYS  62   4.991   0.631   0.631
  469   1HB   LYS  62           HB1      LYS  62   4.983   2.637   2.637
  470   2HB   LYS  62           HB2      LYS  62   6.688   2.459   2.459
  471   1HG   LYS  62           HG1      LYS  62   6.342   0.620   0.620
  472   2HG   LYS  62           HG2      LYS  62   4.744   0.259   0.259
  473   1HD   LYS  62           HD1      LYS  62   3.821   2.307   2.307
  474   2HD   LYS  62           HD2      LYS  62   5.411   2.876   2.876
  475   1HE   LYS  62           HE1      LYS  62   4.186   0.320   0.320
  476   2HE   LYS  62           HE2      LYS  62   4.003   1.892   1.892
  477   1HZ   LYS  62           HZ1      LYS  62   6.706   1.541   1.541
  478   2HZ   LYS  62           HZ2      LYS  62   6.157   0.119   0.119
  479   3HZ   LYS  62           HZ3      LYS  62   5.945   1.621   1.621
  480    H    GLU  63           HN       GLU  63   8.351   1.311   1.311
  481    HA   GLU  63           HA       GLU  63   9.249  -1.072  -1.072
  482   1HB   GLU  63           HB1      GLU  63  10.636   0.999   0.999
  483   2HB   GLU  63           HB2      GLU  63  10.578   1.089   1.089
  484   1HG   GLU  63           HG1      GLU  63  12.038  -1.143  -1.143
  485   2HG   GLU  63           HG2      GLU  63  12.781   0.335   0.335
  486    H    LYS  64           HN       LYS  64   9.199  -0.117  -0.117
  487    HA   LYS  64           HA       LYS  64  10.279  -2.542  -2.542
  488   1HB   LYS  64           HB1      LYS  64   9.703  -0.319  -0.319
  489   2HB   LYS  64           HB2      LYS  64   8.094  -0.993  -0.993
  490   1HG   LYS  64           HG1      LYS  64   9.276  -1.663  -1.663
  491   2HG   LYS  64           HG2      LYS  64   9.194  -3.102  -3.102
  492   1HD   LYS  64           HD1      LYS  64  11.556  -2.371  -2.371
  493   2HD   LYS  64           HD2      LYS  64  11.561  -1.233  -1.233
  494   1HE   LYS  64           HE1      LYS  64  11.290  -3.104  -3.104
  495   2HE   LYS  64           HE2      LYS  64  11.271  -4.245  -4.245
  496   1HZ   LYS  64           HZ1      LYS  64  13.498  -2.582  -2.582
  497   2HZ   LYS  64           HZ2      LYS  64  13.474  -3.179  -3.179
  498   3HZ   LYS  64           HZ3      LYS  64  13.447  -4.256  -4.256
  499    H    TYR  65           HN       TYR  65   6.903  -1.638  -1.638
  500    HA   TYR  65           HA       TYR  65   5.678  -4.018  -4.018
  501   1HB   TYR  65           HB1      TYR  65   4.277  -2.125  -2.125
  502   2HB   TYR  65           HB2      TYR  65   4.928  -1.874  -1.874
  503    HD1  TYR  65           HD1      TYR  65   4.251  -3.490  -3.490
  504    HD2  TYR  65           HD2      TYR  65   2.309  -3.468  -3.468
  505    HE1  TYR  65           HE1      TYR  65   2.376  -4.731  -4.731
  506    HE2  TYR  65           HE2      TYR  65   0.435  -4.715  -4.715
  507    HH   TYR  65           HH       TYR  65  -0.391  -4.875  -4.875
  508    H    GLU  66           HN       GLU  66   6.416  -3.142  -3.142
  509    HA   GLU  66           HA       GLU  66   5.746  -5.498  -5.498
  510   1HB   GLU  66           HB1      GLU  66   8.150  -3.822  -3.822
  511   2HB   GLU  66           HB2      GLU  66   7.473  -5.028  -5.028
  512   1HG   GLU  66           HG1      GLU  66   5.248  -3.382  -3.382
  513   2HG   GLU  66           HG2      GLU  66   6.576  -2.257  -2.257
  514    H    LYS  67           HN       LYS  67   8.597  -5.059  -5.059
  515    HA   LYS  67           HA       LYS  67   9.783  -7.554  -7.554
  516   1HB   LYS  67           HB1      LYS  67  10.688  -5.265  -5.265
  517   2HB   LYS  67           HB2      LYS  67  11.453  -6.807  -6.807
  518   1HG   LYS  67           HG1      LYS  67  12.721  -5.544  -5.544
  519   2HG   LYS  67           HG2      LYS  67  12.092  -7.037  -7.037
  520   1HD   LYS  67           HD1      LYS  67  10.228  -5.728  -5.728
  521   2HD   LYS  67           HD2      LYS  67  10.919  -4.245  -4.245
  522   1HE   LYS  67           HE1      LYS  67  12.996  -4.657  -4.657
  523   2HE   LYS  67           HE2      LYS  67  12.348  -6.183  -6.183
  524   1HZ   LYS  67           HZ1      LYS  67  10.488  -4.145  -4.145
  525   2HZ   LYS  67           HZ2      LYS  67  12.011  -3.639  -3.639
  526   3HZ   LYS  67           HZ3      LYS  67  11.354  -5.105  -5.105
  527    H    ASP  68           HN       ASP  68   8.289  -6.400  -6.400
  528    HA   ASP  68           HA       ASP  68   8.724  -8.841  -8.841
  529   1HB   ASP  68           HB1      ASP  68   7.201  -6.290  -6.290
  530   2HB   ASP  68           HB2      ASP  68   7.224  -7.656  -7.656
  531    H    ILE  69           HN       ILE  69   6.528  -7.585  -7.585
  532    HA   ILE  69           HA       ILE  69   4.321  -9.302  -9.302
  533    HB   ILE  69           HB       ILE  69   4.182  -6.861  -6.861
  534   1HG1  ILE  69          HG11      ILE  69   2.166  -7.574  -7.574
  535   2HG1  ILE  69          HG12      ILE  69   2.026  -7.499  -7.499
  536   1HG2  ILE  69          HG21      ILE  69   5.474  -7.323  -7.323
  537   2HG2  ILE  69          HG22      ILE  69   4.252  -8.439  -8.439
  538   3HG2  ILE  69          HG23      ILE  69   3.872  -6.730  -6.730
  539   1HD1  ILE  69          HD11      ILE  69   2.475  -9.963  -9.963
  540   2HD1  ILE  69          HD12      ILE  69   2.516 -10.018 -10.018
  541   3HD1  ILE  69          HD13      ILE  69   1.036  -9.598  -9.598
  542    H    ALA  70           HN       ALA  70   6.629  -8.858  -8.858
  543    HA   ALA  70           HA       ALA  70   5.944 -11.130 -11.130
  544   1HB   ALA  70           HB1      ALA  70   8.651  -9.752  -9.752
  545   2HB   ALA  70           HB2      ALA  70   8.253 -10.877 -10.877
  546   3HB   ALA  70           HB3      ALA  70   7.438  -9.332  -9.332
  547    H    ALA  71           HN       ALA  71   7.732 -10.563 -10.563
  548    HA   ALA  71           HA       ALA  71   9.010 -13.175 -13.175
  549   1HB   ALA  71           HB1      ALA  71   8.657 -11.029 -11.029
  550   2HB   ALA  71           HB2      ALA  71   9.686 -12.447 -12.447
  551   3HB   ALA  71           HB3      ALA  71  10.071 -11.212 -11.212
  552    H    TYR  72           HN       TYR  72   6.223 -11.516 -11.516
  553    HA   TYR  72           HA       TYR  72   5.344 -13.487 -13.487
  554   1HB   TYR  72           HB1      TYR  72   4.398 -11.309 -11.309
  555   2HB   TYR  72           HB2      TYR  72   3.895 -11.384 -11.384
  556    HD1  TYR  72           HD1      TYR  72   3.273 -13.026 -13.026
  557    HD2  TYR  72           HD2      TYR  72   1.745 -12.077 -12.077
  558    HE1  TYR  72           HE1      TYR  72   1.081 -13.902 -13.902
  559    HE2  TYR  72           HE2      TYR  72  -0.449 -12.955 -12.955
  560    HH   TYR  72           HH       TYR  72  -1.005 -14.937 -14.937
  561    H    ARG  73           HN       ARG  73   4.490 -12.986 -12.986
  562    HA   ARG  73           HA       ARG  73   2.726 -15.229 -15.229
  563   1HB   ARG  73           HB1      ARG  73   4.173 -13.630 -13.630
  564   2HB   ARG  73           HB2      ARG  73   2.919 -14.809 -14.809
  565   1HG   ARG  73           HG1      ARG  73   1.309 -13.443 -13.443
  566   2HG   ARG  73           HG2      ARG  73   2.573 -12.263 -12.263
  567   1HD   ARG  73           HD1      ARG  73   1.181 -11.508 -11.508
  568   2HD   ARG  73           HD2      ARG  73   2.776 -11.925 -11.925
  569    HE   ARG  73           HE       ARG  73   0.418 -13.772 -13.772
  570   1HH1  ARG  73          HH11      ARG  73   2.335 -15.460 -15.460
  571   2HH1  ARG  73          HH12      ARG  73   2.778 -15.066 -15.066
  572   1HH2  ARG  73          HH21      ARG  73   1.373 -11.857 -11.857
  573   2HH2  ARG  73          HH22      ARG  73   2.217 -12.966 -12.966
  574    H    ALA  74           HN       ALA  74   6.047 -14.727 -14.727
  575    HA   ALA  74           HA       ALA  74   6.539 -17.373 -17.373
  576   1HB   ALA  74           HB1      ALA  74   7.708 -15.436 -15.436
  577   2HB   ALA  74           HB2      ALA  74   8.393 -15.095 -15.095
  578   3HB   ALA  74           HB3      ALA  74   8.877 -16.544 -16.544
  579    H    LYS  75           HN       LYS  75   6.196 -16.122 -16.122
  580    HA   LYS  75           HA       LYS  75   7.367 -18.543 -18.543
  581   1HB   LYS  75           HB1      LYS  75   9.245 -16.771 -16.771
  582   2HB   LYS  75           HB2      LYS  75   8.428 -15.844 -15.844
  583   1HG   LYS  75           HG1      LYS  75   8.862 -17.344 -17.344
  584   2HG   LYS  75           HG2      LYS  75   9.034 -18.718 -18.718
  585   1HD   LYS  75           HD1      LYS  75  11.034 -16.489 -16.489
  586   2HD   LYS  75           HD2      LYS  75  11.154 -17.411 -17.411
  587   1HE   LYS  75           HE1      LYS  75  12.575 -18.377 -18.377
  588   2HE   LYS  75           HE2      LYS  75  11.374 -19.518 -19.518
  589   1HZ   LYS  75           HZ1      LYS  75  10.263 -18.059 -18.059
  590   2HZ   LYS  75           HZ2      LYS  75  11.795 -18.597 -18.597
  591   3HZ   LYS  75           HZ3      LYS  75  10.638 -19.708 -19.708
  592    H    GLY  76           HN       GLY  76   4.808 -17.951 -17.951
  593   1HA   GLY  76           HA1      GLY  76   4.147 -17.379 -17.379
  594   2HA   GLY  76           HA2      GLY  76   3.173 -16.668 -16.668
  595    H    LYS  77           HN       LYS  77   2.917 -18.378 -18.378
  596    HA   LYS  77           HA       LYS  77   1.045 -20.329 -20.329
  597   1HB   LYS  77           HB1      LYS  77   2.277 -19.967 -19.967
  598   2HB   LYS  77           HB2      LYS  77   0.837 -20.891 -20.891
  599   1HG   LYS  77           HG1      LYS  77   1.129 -17.902 -17.902
  600   2HG   LYS  77           HG2      LYS  77   0.372 -18.572 -18.572
  601   1HD   LYS  77           HD1      LYS  77  -1.367 -19.663 -19.663
  602   2HD   LYS  77           HD2      LYS  77  -0.608 -19.155 -19.155
  603   1HE   LYS  77           HE1      LYS  77  -1.706 -17.238 -17.238
  604   2HE   LYS  77           HE2      LYS  77  -2.510 -17.684 -17.684
  605   1HZ   LYS  77           HZ1      LYS  77   0.080 -16.882 -16.882
  606   2HZ   LYS  77           HZ2      LYS  77  -0.574 -15.713 -15.713
  607   3HZ   LYS  77           HZ3      LYS  77  -1.389 -16.130 -16.130
  608    HA   PRO  78           HA       PRO  78   4.262 -23.646 -23.646
  609   1HB   PRO  78           HB1      PRO  78   6.940 -22.418 -22.418
  610   2HB   PRO  78           HB2      PRO  78   6.023 -23.338 -23.338
  611   1HG   PRO  78           HG1      PRO  78   6.441 -20.647 -20.647
  612   2HG   PRO  78           HG2      PRO  78   4.947 -21.407 -21.407
  613   1HD   PRO  78           HD1      PRO  78   5.429 -20.033 -20.033
  614   2HD   PRO  78           HD2      PRO  78   4.158 -19.698 -19.698
  615    H    ASP  79           HN       ASP  79   3.503 -22.941 -22.941
  616    HA   ASP  79           HA       ASP  79   3.818 -23.086 -23.086
  617   1HB   ASP  79           HB1      ASP  79   5.897 -25.082 -25.082
  618   2HB   ASP  79           HB2      ASP  79   5.335 -24.998 -24.998
  619    H    ALA  80           HN       ALA  80   4.553 -20.951 -20.951
  620    HA   ALA  80           HA       ALA  80   7.420 -20.703 -20.703
  621   1HB   ALA  80           HB1      ALA  80   5.571 -18.568 -18.568
  622   2HB   ALA  80           HB2      ALA  80   7.225 -18.301 -18.301
  623   3HB   ALA  80           HB3      ALA  80   6.902 -19.324 -19.324
  624    H    ALA  81           HN       ALA  81   4.106 -19.795 -19.795
  625    HA   ALA  81           HA       ALA  81   4.805 -18.656 -18.656
  626   1HB   ALA  81           HB1      ALA  81   3.178 -17.461 -17.461
  627   2HB   ALA  81           HB2      ALA  81   2.138 -18.876 -18.876
  628   3HB   ALA  81           HB3      ALA  81   2.409 -17.980 -17.980
  629   1H1   BME  16           HE1      MER  16  -9.053  11.573  11.573
  630   2H1   BME  16           HE2      MER  16  -8.546  10.287  10.287
  631   1H2   BME  16           HZ1      MER  16  -8.070   9.600   9.600
  632   2H2   BME  16           HZ2      MER  16  -6.615   9.760   9.760
  633    HO1  BME  16           HH       MER  16  -6.431  11.806  11.806

  Start of MODEL   13
    1    H    ASN   3           HN       ASN   3   5.400  -6.799  -6.799
    2    HA   ASN   3           HA       ASN   3   6.448  -7.343  -7.343
    3   1HB   ASN   3           HB1      ASN   3   6.758  -9.693  -9.693
    4   2HB   ASN   3           HB2      ASN   3   7.663  -8.460  -8.460
    5   1HD2  ASN   3          HD21      ASN   3   4.742 -10.524 -10.524
    6   2HD2  ASN   3          HD22      ASN   3   5.137 -10.830 -10.830
    7    H    ALA   4           HN       ALA   4   5.504  -9.032  -9.032
    8    HA   ALA   4           HA       ALA   4   3.953 -10.311 -10.311
    9   1HB   ALA   4           HB1      ALA   4   3.136 -11.097 -11.097
   10   2HB   ALA   4           HB2      ALA   4   2.098  -9.677  -9.677
   11   3HB   ALA   4           HB3      ALA   4   1.804 -10.838 -10.838
   12    HA   PRO   5           HA       PRO   5   3.223  -6.996  -6.996
   13   1HB   PRO   5           HB1      PRO   5   1.272  -7.955  -7.955
   14   2HB   PRO   5           HB2      PRO   5   2.990  -8.347  -8.347
   15   1HG   PRO   5           HG1      PRO   5   0.796  -9.913  -9.913
   16   2HG   PRO   5           HG2      PRO   5   1.983 -10.530 -10.530
   17   1HD   PRO   5           HD1      PRO   5   2.649 -10.777 -10.777
   18   2HD   PRO   5           HD2      PRO   5   3.844  -9.983  -9.983
   19    H    LYS   6           HN       LYS   6   2.572  -5.445  -5.445
   20    HA   LYS   6           HA       LYS   6  -0.320  -4.756  -4.756
   21   1HB   LYS   6           HB1      LYS   6   1.813  -4.563  -4.563
   22   2HB   LYS   6           HB2      LYS   6   0.479  -3.439  -3.439
   23   1HG   LYS   6           HG1      LYS   6  -0.247  -6.329  -6.329
   24   2HG   LYS   6           HG2      LYS   6   0.415  -5.859  -5.859
   25   1HD   LYS   6           HD1      LYS   6  -1.319  -3.967  -3.967
   26   2HD   LYS   6           HD2      LYS   6  -2.020  -4.632  -4.632
   27   1HE   LYS   6           HE1      LYS   6  -3.229  -5.430  -5.430
   28   2HE   LYS   6           HE2      LYS   6  -2.459  -6.778  -6.778
   29   1HZ   LYS   6           HZ1      LYS   6  -0.637  -5.685  -5.685
   30   2HZ   LYS   6           HZ2      LYS   6  -2.114  -5.919  -5.919
   31   3HZ   LYS   6           HZ3      LYS   6  -1.362  -7.221  -7.221
   32    H    ARG   7           HN       ARG   7   0.141  -3.700  -3.700
   33    HA   ARG   7           HA       ARG   7   1.691  -1.663  -1.663
   34   1HB   ARG   7           HB1      ARG   7  -0.180  -2.502  -2.502
   35   2HB   ARG   7           HB2      ARG   7  -1.336  -1.745  -1.745
   36   1HG   ARG   7           HG1      ARG   7  -0.482   0.513   0.513
   37   2HG   ARG   7           HG2      ARG   7   0.737  -0.238  -0.238
   38   1HD   ARG   7           HD1      ARG   7  -1.039  -1.220  -1.220
   39   2HD   ARG   7           HD2      ARG   7  -2.279  -0.553  -0.553
   40    HE   ARG   7           HE       ARG   7  -0.364   1.172   1.172
   41   1HH1  ARG   7          HH11      ARG   7  -2.184   2.335   2.335
   42   2HH1  ARG   7          HH12      ARG   7  -3.508   2.910   2.910
   43   1HH2  ARG   7          HH21      ARG   7  -2.576   1.016   1.016
   44   2HH2  ARG   7          HH22      ARG   7  -3.737   2.144   2.144
   45    HA   PRO   8           HA       PRO   8   1.150   0.969   0.969
   46   1HB   PRO   8           HB1      PRO   8   3.378   2.558   2.558
   47   2HB   PRO   8           HB2      PRO   8   3.497   0.878   0.878
   48   1HG   PRO   8           HG1      PRO   8   3.660   1.974   1.974
   49   2HG   PRO   8           HG2      PRO   8   4.839   0.999   0.999
   50   1HD   PRO   8           HD1      PRO   8   3.088  -0.215  -0.215
   51   2HD   PRO   8           HD2      PRO   8   3.425  -0.967  -0.967
   52    HA   PRO   9           HA       PRO   9  -0.314   5.268   5.268
   53   1HB   PRO   9           HB1      PRO   9   2.592   5.759   5.759
   54   2HB   PRO   9           HB2      PRO   9   1.238   6.881   6.881
   55   1HG   PRO   9           HG1      PRO   9   1.801   5.355   5.355
   56   2HG   PRO   9           HG2      PRO   9   0.109   5.426   5.426
   57   1HD   PRO   9           HD1      PRO   9   2.111   3.200   3.200
   58   2HD   PRO   9           HD2      PRO   9   0.355   3.081   3.081
   59    H    SER  10           HN       SER  10   0.065   7.025   7.025
   60    HA   SER  10           HA       SER  10   1.329   6.128   6.128
   61   1HB   SER  10           HB1      SER  10  -1.090   7.925   7.925
   62   2HB   SER  10           HB2      SER  10  -0.424   7.477   7.477
   63    HG   SER  10           HG       SER  10  -1.362   5.625   5.625
   64    H    ALA  11           HN       ALA  11   1.362   8.546   8.546
   65    HA   ALA  11           HA       ALA  11   3.353  10.038  10.038
   66   1HB   ALA  11           HB1      ALA  11   2.448  10.846  10.846
   67   2HB   ALA  11           HB2      ALA  11   3.759  11.580  11.580
   68   3HB   ALA  11           HB3      ALA  11   3.928   9.945   9.945
   69    H    PHE  12           HN       PHE  12   0.558  10.405  10.405
   70    HA   PHE  12           HA       PHE  12  -0.489  12.886  12.886
   71   1HB   PHE  12           HB1      PHE  12  -1.267  11.964  11.964
   72   2HB   PHE  12           HB2      PHE  12  -1.596  10.384  10.384
   73    HD1  PHE  12           HD1      PHE  12  -3.661  10.093  10.093
   74    HD2  PHE  12           HD2      PHE  12  -2.829  13.724  13.724
   75    HE1  PHE  12           HE1      PHE  12  -5.989  10.823  10.823
   76    HE2  PHE  12           HE2      PHE  12  -5.139  14.443  14.443
   77    HZ   PHE  12           HZ       PHE  12  -6.730  12.993  12.993
   78    H    PHE  13           HN       PHE  13  -0.653   9.612   9.612
   79    HA   PHE  13           HA       PHE  13  -2.815   9.871   9.871
   80   1HB   PHE  13           HB1      PHE  13  -1.593   7.729   7.729
   81   2HB   PHE  13           HB2      PHE  13  -0.267   8.300   8.300
   82    HD1  PHE  13           HD1      PHE  13  -3.808   7.250   7.250
   83    HD2  PHE  13           HD2      PHE  13  -0.562   8.374   8.374
   84    HE1  PHE  13           HE1      PHE  13  -5.077   6.505   6.505
   85    HE2  PHE  13           HE2      PHE  13  -1.837   7.629   7.629
   86    HZ   PHE  13           HZ       PHE  13  -4.096   6.697   6.697
   87    H    LEU  14           HN       LEU  14   0.633  10.489  10.489
   88    HA   LEU  14           HA       LEU  14   0.347  11.242  11.242
   89   1HB   LEU  14           HB1      LEU  14   2.248  12.514  12.514
   90   2HB   LEU  14           HB2      LEU  14   2.438  12.584  12.584
   91    HG   LEU  14           HG       LEU  14   4.018  11.047  11.047
   92   1HD1  LEU  14          HD11      LEU  14   2.789  10.020  10.020
   93   2HD1  LEU  14          HD12      LEU  14   1.703   9.209   9.209
   94   3HD1  LEU  14          HD13      LEU  14   3.406   8.793   8.793
   95   1HD2  LEU  14          HD21      LEU  14   3.520  10.794  10.794
   96   2HD2  LEU  14          HD22      LEU  14   3.817   9.220   9.220
   97   3HD2  LEU  14          HD23      LEU  14   2.179   9.708   9.708
   98    H    PHE  15           HN       PHE  15   0.398  13.510  13.510
   99    HA   PHE  15           HA       PHE  15  -0.364  15.736  15.736
  100   1HB   PHE  15           HB1      PHE  15   0.506  16.817  16.817
  101   2HB   PHE  15           HB2      PHE  15   0.661  15.249  15.249
  102    HD1  PHE  15           HD1      PHE  15  -1.466  14.426  14.426
  103    HD2  PHE  15           HD2      PHE  15  -0.709  18.500  18.500
  104    HE1  PHE  15           HE1      PHE  15  -3.003  15.139  15.139
  105    HE2  PHE  15           HE2      PHE  15  -2.259  19.218  19.218
  106    HZ   PHE  15           HZ       PHE  15  -3.402  17.532  17.532
  107    H    CYS  16           HN       MER  16  -2.297  13.598  13.598
  108    HA   CYS  16           HA       MER  16  -4.726  15.059  15.059
  109   1HB   CYS  16           HB1      MER  16  -5.831  13.123  13.123
  110   2HB   CYS  16           HB2      MER  16  -4.251  12.970  12.970
  111    H    SER  17           HN       SER  17  -3.313  12.569  12.569
  112    HA   SER  17           HA       SER  17  -5.422  12.249  12.249
  113   1HB   SER  17           HB1      SER  17  -2.398  12.301  12.301
  114   2HB   SER  17           HB2      SER  17  -3.623  11.594  11.594
  115    HG   SER  17           HG       SER  17  -3.562   9.922   9.922
  116    H    GLU  18           HN       GLU  18  -2.722  14.455  14.455
  117    HA   GLU  18           HA       GLU  18  -3.464  15.991  15.991
  118   1HB   GLU  18           HB1      GLU  18  -1.240  15.957  15.957
  119   2HB   GLU  18           HB2      GLU  18  -1.893  16.810  16.810
  120   1HG   GLU  18           HG1      GLU  18  -2.393  18.780  18.780
  121   2HG   GLU  18           HG2      GLU  18  -1.957  17.942  17.942
  122    H    TYR  19           HN       TYR  19  -4.690  16.106  16.106
  123    HA   TYR  19           HA       TYR  19  -5.962  18.748  18.748
  124   1HB   TYR  19           HB1      TYR  19  -5.731  16.736  16.736
  125   2HB   TYR  19           HB2      TYR  19  -6.953  18.031  18.031
  126    HD1  TYR  19           HD1      TYR  19  -3.817  18.905  18.905
  127    HD2  TYR  19           HD2      TYR  19  -5.823  18.710  18.710
  128    HE1  TYR  19           HE1      TYR  19  -2.183  20.452  20.452
  129    HE2  TYR  19           HE2      TYR  19  -4.196  20.262  20.262
  130    HH   TYR  19           HH       TYR  19  -2.445  22.233  22.233
  131    H    ARG  20           HN       ARG  20  -7.125  15.460  15.460
  132    HA   ARG  20           HA       ARG  20  -9.716  15.397  15.397
  133   1HB   ARG  20           HB1      ARG  20  -8.785  13.495  13.495
  134   2HB   ARG  20           HB2      ARG  20  -8.137  14.300  14.300
  135   1HG   ARG  20           HG1      ARG  20 -10.479  14.489  14.489
  136   2HG   ARG  20           HG2      ARG  20 -11.113  13.759  13.759
  137   1HD   ARG  20           HD1      ARG  20 -10.856  12.115  12.115
  138   2HD   ARG  20           HD2      ARG  20  -9.891  11.668  11.668
  139    HE   ARG  20           HE       ARG  20  -7.923  12.704  12.704
  140   1HH1  ARG  20          HH11      ARG  20  -7.772  13.765  13.765
  141   2HH1  ARG  20          HH12      ARG  20  -8.217  12.712  12.712
  142   1HH2  ARG  20          HH21      ARG  20  -9.806  10.426  10.426
  143   2HH2  ARG  20          HH22      ARG  20  -9.397  10.772  10.772
  144    HA   PRO  21           HA       PRO  21 -11.620  17.446  17.446
  145   1HB   PRO  21           HB1      PRO  21 -10.342  18.072  18.072
  146   2HB   PRO  21           HB2      PRO  21 -10.451  16.367  16.367
  147   1HG   PRO  21           HG1      PRO  21  -8.144  18.298  18.298
  148   2HG   PRO  21           HG2      PRO  21  -8.052  16.776  16.776
  149   1HD   PRO  21           HD1      PRO  21  -7.602  16.815  16.815
  150   2HD   PRO  21           HD2      PRO  21  -8.474  15.474  15.474
  151    H    LYS  22           HN       LYS  22  -8.889  18.896  18.896
  152    HA   LYS  22           HA       LYS  22  -9.477  21.661  21.661
  153   1HB   LYS  22           HB1      LYS  22  -7.160  20.702  20.702
  154   2HB   LYS  22           HB2      LYS  22  -7.371  20.512  20.512
  155   1HG   LYS  22           HG1      LYS  22  -7.628  22.963  22.963
  156   2HG   LYS  22           HG2      LYS  22  -7.487  23.176  23.176
  157   1HD   LYS  22           HD1      LYS  22  -5.214  22.073  22.073
  158   2HD   LYS  22           HD2      LYS  22  -5.364  21.990  21.990
  159   1HE   LYS  22           HE1      LYS  22  -5.493  24.455  24.455
  160   2HE   LYS  22           HE2      LYS  22  -5.408  24.567  24.567
  161   1HZ   LYS  22           HZ1      LYS  22  -3.298  22.964  22.964
  162   2HZ   LYS  22           HZ2      LYS  22  -3.309  24.393  24.393
  163   3HZ   LYS  22           HZ3      LYS  22  -3.228  24.469  24.469
  164    H    ILE  23           HN       ILE  23  -9.880  19.595  19.595
  165    HA   ILE  23           HA       ILE  23 -10.626  21.893  21.893
  166    HB   ILE  23           HB       ILE  23 -11.112  18.915  18.915
  167   1HG1  ILE  23          HG11      ILE  23  -8.771  20.606  20.606
  168   2HG1  ILE  23          HG12      ILE  23  -8.640  19.462  19.462
  169   1HG2  ILE  23          HG21      ILE  23 -12.433  20.587  20.587
  170   2HG2  ILE  23          HG22      ILE  23 -10.945  21.384  21.384
  171   3HG2  ILE  23          HG23      ILE  23 -11.287  19.764  19.764
  172   1HD1  ILE  23          HD11      ILE  23  -9.538  18.756  18.756
  173   2HD1  ILE  23          HD12      ILE  23  -7.972  18.407  18.407
  174   3HD1  ILE  23          HD13      ILE  23  -9.409  17.637  17.637
  175    H    LYS  24           HN       LYS  24 -11.876  19.116  19.116
  176    HA   LYS  24           HA       LYS  24 -14.626  19.369  19.369
  177   1HB   LYS  24           HB1      LYS  24 -13.334  17.451  17.451
  178   2HB   LYS  24           HB2      LYS  24 -13.098  18.301  18.301
  179   1HG   LYS  24           HG1      LYS  24 -15.223  17.954  17.954
  180   2HG   LYS  24           HG2      LYS  24 -15.984  18.208  18.208
  181   1HD   LYS  24           HD1      LYS  24 -14.545  15.669  15.669
  182   2HD   LYS  24           HD2      LYS  24 -16.283  15.887  15.887
  183   1HE   LYS  24           HE1      LYS  24 -15.534  16.666  16.666
  184   2HE   LYS  24           HE2      LYS  24 -14.460  15.324  15.324
  185   1HZ   LYS  24           HZ1      LYS  24 -17.018  14.660  14.660
  186   2HZ   LYS  24           HZ2      LYS  24 -17.150  15.243  15.243
  187   3HZ   LYS  24           HZ3      LYS  24 -16.112  13.941  13.941
  188    H    GLY  25           HN       GLY  25 -12.492  20.914  20.914
  189   1HA   GLY  25           HA1      GLY  25 -14.421  21.991  21.991
  190   2HA   GLY  25           HA2      GLY  25 -12.762  22.562  22.562
  191    H    GLU  26           HN       GLU  26 -12.745  23.240  23.240
  192    HA   GLU  26           HA       GLU  26 -13.968  25.828  25.828
  193   1HB   GLU  26           HB1      GLU  26 -12.503  24.258  24.258
  194   2HB   GLU  26           HB2      GLU  26 -12.873  25.967  25.967
  195   1HG   GLU  26           HG1      GLU  26 -11.290  24.775  24.775
  196   2HG   GLU  26           HG2      GLU  26 -10.510  25.337  25.337
  197    H    HIS  27           HN       HIS  27 -14.399  22.970  22.970
  198    HA   HIS  27           HA       HIS  27 -17.067  23.844  23.844
  199   1HB   HIS  27           HB1      HIS  27 -15.179  22.083  22.083
  200   2HB   HIS  27           HB2      HIS  27 -16.574  23.008  23.008
  201    HD1  HIS  27           HD1      HIS  27 -16.144  25.721  25.721
  202    HD2  HIS  27           HD2      HIS  27 -12.790  23.382  23.382
  203    HE1  HIS  27           HE1      HIS  27 -14.259  27.232  27.232
  204    HA   PRO  28           HA       PRO  28 -17.976  19.736  19.736
  205   1HB   PRO  28           HB1      PRO  28 -19.763  20.483  20.483
  206   2HB   PRO  28           HB2      PRO  28 -18.037  20.630  20.630
  207   1HG   PRO  28           HG1      PRO  28 -19.930  22.809  22.809
  208   2HG   PRO  28           HG2      PRO  28 -18.853  22.896  22.896
  209   1HD   PRO  28           HD1      PRO  28 -18.086  23.842  23.842
  210   2HD   PRO  28           HD2      PRO  28 -16.889  23.151  23.151
  211    H    GLY  29           HN       GLY  29 -18.501  20.845  20.845
  212   1HA   GLY  29           HA1      GLY  29 -21.413  20.579  20.579
  213   2HA   GLY  29           HA2      GLY  29 -20.468  21.785  21.785
  214    H    LEU  30           HN       LEU  30 -18.218  19.607  19.607
  215    HA   LEU  30           HA       LEU  30 -19.174  18.419  18.419
  216   1HB   LEU  30           HB1      LEU  30 -16.447  17.655  17.655
  217   2HB   LEU  30           HB2      LEU  30 -17.079  18.564  18.564
  218    HG   LEU  30           HG       LEU  30 -16.423  19.903  19.903
  219   1HD1  LEU  30          HD11      LEU  30 -14.400  18.823  18.823
  220   2HD1  LEU  30          HD12      LEU  30 -14.736  19.592  19.592
  221   3HD1  LEU  30          HD13      LEU  30 -14.303  20.565  20.565
  222   1HD2  LEU  30          HD21      LEU  30 -16.842  20.922  20.922
  223   2HD2  LEU  30          HD22      LEU  30 -17.995  21.124  21.124
  224   3HD2  LEU  30          HD23      LEU  30 -16.434  21.919  21.919
  225    H    SER  31           HN       SER  31 -17.983  16.204  16.204
  226    HA   SER  31           HA       SER  31 -18.896  14.332  14.332
  227   1HB   SER  31           HB1      SER  31 -19.205  12.694  12.694
  228   2HB   SER  31           HB2      SER  31 -20.041  14.194  14.194
  229    HG   SER  31           HG       SER  31 -17.894  13.049  13.049
  230    H    ILE  32           HN       ILE  32 -17.703  12.117  12.117
  231    HA   ILE  32           HA       ILE  32 -14.907  12.567  12.567
  232    HB   ILE  32           HB       ILE  32 -16.704  10.818  10.818
  233   1HG1  ILE  32          HG11      ILE  32 -14.485  10.684  10.684
  234   2HG1  ILE  32          HG12      ILE  32 -15.092   9.093   9.093
  235   1HG2  ILE  32          HG21      ILE  32 -17.377   9.950   9.950
  236   2HG2  ILE  32          HG22      ILE  32 -15.762   9.344   9.344
  237   3HG2  ILE  32          HG23      ILE  32 -16.725   8.642   8.642
  238   1HD1  ILE  32          HD11      ILE  32 -13.653   9.056   9.056
  239   2HD1  ILE  32          HD12      ILE  32 -13.013  10.635  10.635
  240   3HD1  ILE  32          HD13      ILE  32 -12.727   9.246   9.246
  241    H    GLY  33           HN       GLY  33 -16.661  12.514  12.514
  242   1HA   GLY  33           HA1      GLY  33 -14.590  11.421  11.421
  243   2HA   GLY  33           HA2      GLY  33 -16.276  11.748  11.748
  244    H    ASP  34           HN       ASP  34 -15.739  14.338  14.338
  245    HA   ASP  34           HA       ASP  34 -14.759  15.952  15.952
  246   1HB   ASP  34           HB1      ASP  34 -16.416  16.560  16.560
  247   2HB   ASP  34           HB2      ASP  34 -15.911  17.845  17.845
  248    H    VAL  35           HN       VAL  35 -14.537  15.452  15.452
  249    HA   VAL  35           HA       VAL  35 -12.417  17.307  17.307
  250    HB   VAL  35           HB       VAL  35 -13.411  14.758  14.758
  251   1HG1  VAL  35          HG11      VAL  35 -11.430  16.808  16.808
  252   2HG1  VAL  35          HG12      VAL  35 -12.115  15.475  15.475
  253   3HG1  VAL  35          HG13      VAL  35 -11.036  15.153  15.153
  254   1HG2  VAL  35          HG21      VAL  35 -15.001  16.694  16.694
  255   2HG2  VAL  35          HG22      VAL  35 -14.406  16.335  16.335
  256   3HG2  VAL  35          HG23      VAL  35 -13.755  17.698  17.698
  257    H    ALA  36           HN       ALA  36 -12.626  14.191  14.191
  258    HA   ALA  36           HA       ALA  36  -9.771  13.627  13.627
  259   1HB   ALA  36           HB1      ALA  36 -11.457  11.850  11.850
  260   2HB   ALA  36           HB2      ALA  36 -12.105  12.158  12.158
  261   3HB   ALA  36           HB3      ALA  36 -10.494  11.474  11.474
  262    H    LYS  37           HN       LYS  37 -12.239  14.347  14.347
  263    HA   LYS  37           HA       LYS  37 -10.477  14.212  14.212
  264   1HB   LYS  37           HB1      LYS  37 -12.859  14.057  14.057
  265   2HB   LYS  37           HB2      LYS  37 -13.118  15.607  15.607
  266   1HG   LYS  37           HG1      LYS  37 -13.459  15.753  15.753
  267   2HG   LYS  37           HG2      LYS  37 -12.090  16.735  16.735
  268   1HD   LYS  37           HD1      LYS  37 -10.494  15.144  15.144
  269   2HD   LYS  37           HD2      LYS  37 -11.705  13.883  13.883
  270   1HE   LYS  37           HE1      LYS  37 -11.125  14.912  14.912
  271   2HE   LYS  37           HE2      LYS  37 -12.821  15.135  15.135
  272   1HZ   LYS  37           HZ1      LYS  37 -11.364  17.285  17.285
  273   2HZ   LYS  37           HZ2      LYS  37 -10.911  17.075  17.075
  274   3HZ   LYS  37           HZ3      LYS  37 -12.546  17.296  17.296
  275    H    LYS  38           HN       LYS  38 -11.328  16.843  16.843
  276    HA   LYS  38           HA       LYS  38 -10.028  18.918  18.918
  277   1HB   LYS  38           HB1      LYS  38 -11.314  18.604  18.604
  278   2HB   LYS  38           HB2      LYS  38 -10.090  19.843  19.843
  279   1HG   LYS  38           HG1      LYS  38 -12.241  20.801  20.801
  280   2HG   LYS  38           HG2      LYS  38 -11.194  20.896  20.896
  281   1HD   LYS  38           HD1      LYS  38 -12.386  19.182  19.182
  282   2HD   LYS  38           HD2      LYS  38 -13.219  18.643  18.643
  283   1HE   LYS  38           HE1      LYS  38 -14.671  20.033  20.033
  284   2HE   LYS  38           HE2      LYS  38 -14.517  20.695  20.695
  285   1HZ   LYS  38           HZ1      LYS  38 -12.438  21.717  21.717
  286   2HZ   LYS  38           HZ2      LYS  38 -13.885  21.903  21.903
  287   3HZ   LYS  38           HZ3      LYS  38 -13.742  22.541  22.541
  288    H    LEU  39           HN       LEU  39  -9.190  17.394  17.394
  289    HA   LEU  39           HA       LEU  39  -6.550  18.492  18.492
  290   1HB   LEU  39           HB1      LEU  39  -6.651  17.819  17.819
  291   2HB   LEU  39           HB2      LEU  39  -8.271  17.290  17.290
  292    HG   LEU  39           HG       LEU  39  -7.194  15.066  15.066
  293   1HD1  LEU  39          HD11      LEU  39  -4.878  15.927  15.927
  294   2HD1  LEU  39          HD12      LEU  39  -5.101  16.281  16.281
  295   3HD1  LEU  39          HD13      LEU  39  -5.104  14.621  14.621
  296   1HD2  LEU  39          HD21      LEU  39  -8.629  15.460  15.460
  297   2HD2  LEU  39          HD22      LEU  39  -7.336  14.327  14.327
  298   3HD2  LEU  39          HD23      LEU  39  -7.181  15.995  15.995
  299    H    GLY  40           HN       GLY  40  -7.897  15.653  15.653
  300   1HA   GLY  40           HA1      GLY  40  -5.525  14.067  14.067
  301   2HA   GLY  40           HA2      GLY  40  -6.974  13.999  13.999
  302    H    GLU  41           HN       GLU  41  -7.056  16.756  16.756
  303    HA   GLU  41           HA       GLU  41  -5.255  16.761  16.761
  304   1HB   GLU  41           HB1      GLU  41  -7.651  17.332  17.332
  305   2HB   GLU  41           HB2      GLU  41  -7.259  18.783  18.783
  306   1HG   GLU  41           HG1      GLU  41  -5.779  19.494  19.494
  307   2HG   GLU  41           HG2      GLU  41  -6.254  18.048  18.048
  308    H    MET  42           HN       MET  42  -5.897  18.778  18.778
  309    HA   MET  42           HA       MET  42  -4.001  20.798  20.798
  310   1HB   MET  42           HB1      MET  42  -4.766  19.238  19.238
  311   2HB   MET  42           HB2      MET  42  -3.831  20.728  20.728
  312   1HG   MET  42           HG1      MET  42  -6.597  20.527  20.527
  313   2HG   MET  42           HG2      MET  42  -6.349  21.024  21.024
  314   1HE   MET  42           HE1      MET  42  -5.670  21.801  21.801
  315   2HE   MET  42           HE2      MET  42  -7.343  22.137  22.137
  316   3HE   MET  42           HE3      MET  42  -6.283  23.442  23.442
  317    H    TRP  43           HN       TRP  43  -3.625  17.612  17.612
  318    HA   TRP  43           HA       TRP  43  -0.969  17.569  17.569
  319   1HB   TRP  43           HB1      TRP  43  -2.535  15.807  15.807
  320   2HB   TRP  43           HB2      TRP  43  -2.786  15.501  15.501
  321    HD1  TRP  43           HD1      TRP  43  -1.418  13.664  13.664
  322    HE1  TRP  43           HE1      TRP  43   0.750  12.610  12.610
  323    HE3  TRP  43           HE3      TRP  43  -0.219  16.391  16.391
  324    HZ2  TRP  43           HZ2      TRP  43   2.832  12.802  12.802
  325    HZ3  TRP  43           HZ3      TRP  43   1.836  15.939  15.939
  326    HH2  TRP  43           HH2      TRP  43   3.376  14.145  14.145
  327    H    ASN  44           HN       ASN  44  -2.363  16.734  16.734
  328    HA   ASN  44           HA       ASN  44   0.126  16.203  16.203
  329   1HB   ASN  44           HB1      ASN  44  -2.488  17.148  17.148
  330   2HB   ASN  44           HB2      ASN  44  -1.128  16.442  16.442
  331   1HD2  ASN  44          HD21      ASN  44  -3.805  13.926  13.926
  332   2HD2  ASN  44          HD22      ASN  44  -4.067  15.533  15.533
  333    H    ASN  45           HN       ASN  45  -1.360  19.122  19.122
  334    HA   ASN  45           HA       ASN  45   0.727  20.717  20.717
  335   1HB   ASN  45           HB1      ASN  45  -1.943  21.961  21.961
  336   2HB   ASN  45           HB2      ASN  45  -0.851  22.345  22.345
  337   1HD2  ASN  45          HD21      ASN  45  -3.911  19.837  19.837
  338   2HD2  ASN  45          HD22      ASN  45  -3.697  20.830  20.830
  339    H    THR  46           HN       THR  46   0.933  19.648  19.648
  340    HA   THR  46           HA       THR  46   0.304  21.807  21.807
  341    HB   THR  46           HB       THR  46   0.537  19.425  19.425
  342    HG1  THR  46           HG1      THR  46   1.088  20.454  20.454
  343   1HG2  THR  46          HG21      THR  46   2.623  18.712  18.712
  344   2HG2  THR  46          HG22      THR  46   3.572  19.800  19.800
  345   3HG2  THR  46          HG23      THR  46   2.751  18.443  18.443
  346    H    ALA  47           HN       ALA  47   3.136  20.692  20.692
  347    HA   ALA  47           HA       ALA  47   4.395  23.128  23.128
  348   1HB   ALA  47           HB1      ALA  47   4.767  23.346  23.346
  349   2HB   ALA  47           HB2      ALA  47   5.583  21.796  21.796
  350   3HB   ALA  47           HB3      ALA  47   6.271  23.167  23.167
  351    H    ALA  48           HN       ALA  48   5.068  20.019  20.019
  352    HA   ALA  48           HA       ALA  48   5.775  18.017  18.017
  353   1HB   ALA  48           HB1      ALA  48   5.828  19.030  19.030
  354   2HB   ALA  48           HB2      ALA  48   7.375  19.782  19.782
  355   3HB   ALA  48           HB3      ALA  48   7.221  18.040  18.040
  356    H    ASP  49           HN       ASP  49   7.233  20.833  20.833
  357    HA   ASP  49           HA       ASP  49   9.783  19.637  19.637
  358   1HB   ASP  49           HB1      ASP  49   9.916  21.758  21.758
  359   2HB   ASP  49           HB2      ASP  49   8.795  22.524  22.524
  360    H    ASP  50           HN       ASP  50   6.702  20.222  20.222
  361    HA   ASP  50           HA       ASP  50   7.196  20.481  20.481
  362   1HB   ASP  50           HB1      ASP  50   5.664  22.222  22.222
  363   2HB   ASP  50           HB2      ASP  50   4.651  20.940  20.940
  364    H    LYS  51           HN       LYS  51   6.719  18.329  18.329
  365    HA   LYS  51           HA       LYS  51   4.952  16.445  16.445
  366   1HB   LYS  51           HB1      LYS  51   6.528  16.173  16.173
  367   2HB   LYS  51           HB2      LYS  51   5.568  14.886  14.886
  368   1HG   LYS  51           HG1      LYS  51   3.538  16.326  16.326
  369   2HG   LYS  51           HG2      LYS  51   4.530  17.544  17.544
  370   1HD   LYS  51           HD1      LYS  51   5.116  15.933  15.933
  371   2HD   LYS  51           HD2      LYS  51   4.207  14.673  14.673
  372   1HE   LYS  51           HE1      LYS  51   2.113  15.793  15.793
  373   2HE   LYS  51           HE2      LYS  51   2.909  17.256  17.256
  374   1HZ   LYS  51           HZ1      LYS  51   3.817  15.084  15.084
  375   2HZ   LYS  51           HZ2      LYS  51   2.118  15.030  15.030
  376   3HZ   LYS  51           HZ3      LYS  51   2.910  16.427  16.427
  377    H    GLN  52           HN       GLN  52   8.243  16.785  16.785
  378    HA   GLN  52           HA       GLN  52   9.683  14.716  14.716
  379   1HB   GLN  52           HB1      GLN  52  10.148  17.627  17.627
  380   2HB   GLN  52           HB2      GLN  52  11.218  16.666  16.666
  381   1HG   GLN  52           HG1      GLN  52  12.351  16.950  16.950
  382   2HG   GLN  52           HG2      GLN  52  11.735  15.313  15.313
  383   1HE2  GLN  52          HE21      GLN  52   9.281  16.113  16.113
  384   2HE2  GLN  52          HE22      GLN  52   9.505  15.098  15.098
  385    HA   PRO  53           HA       PRO  53   9.913  15.319  15.319
  386   1HB   PRO  53           HB1      PRO  53   7.556  16.521  16.521
  387   2HB   PRO  53           HB2      PRO  53   9.124  17.306  17.306
  388   1HG   PRO  53           HG1      PRO  53   6.845  17.233  17.233
  389   2HG   PRO  53           HG2      PRO  53   7.725  18.648  18.648
  390   1HD   PRO  53           HD1      PRO  53   8.517  17.644  17.644
  391   2HD   PRO  53           HD2      PRO  53   9.793  17.926  17.926
  392    H    TYR  54           HN       TYR  54   6.760  15.069  15.069
  393    HA   TYR  54           HA       TYR  54   5.867  12.830  12.830
  394   1HB   TYR  54           HB1      TYR  54   4.680  14.105  14.105
  395   2HB   TYR  54           HB2      TYR  54   3.858  12.919  12.919
  396    HD1  TYR  54           HD1      TYR  54   4.307  13.775  13.775
  397    HD2  TYR  54           HD2      TYR  54   3.741  16.209  16.209
  398    HE1  TYR  54           HE1      TYR  54   3.494  15.596  15.596
  399    HE2  TYR  54           HE2      TYR  54   2.929  18.033  18.033
  400    HH   TYR  54           HH       TYR  54   1.743  18.027  18.027
  401    H    GLU  55           HN       GLU  55   6.527  13.318  13.318
  402    HA   GLU  55           HA       GLU  55   6.206  10.738  10.738
  403   1HB   GLU  55           HB1      GLU  55   7.274  13.230  13.230
  404   2HB   GLU  55           HB2      GLU  55   8.501  12.042  12.042
  405   1HG   GLU  55           HG1      GLU  55   6.676  10.609  10.609
  406   2HG   GLU  55           HG2      GLU  55   5.570  11.950  11.950
  407    H    LYS  56           HN       LYS  56   9.281  12.082  12.082
  408    HA   LYS  56           HA       LYS  56  10.932   9.907   9.907
  409   1HB   LYS  56           HB1      LYS  56  11.495  12.269  12.269
  410   2HB   LYS  56           HB2      LYS  56  11.021  11.663  11.663
  411   1HG   LYS  56           HG1      LYS  56  12.781   9.854   9.854
  412   2HG   LYS  56           HG2      LYS  56  13.258  10.561  10.561
  413   1HD   LYS  56           HD1      LYS  56  13.647  12.768  12.768
  414   2HD   LYS  56           HD2      LYS  56  13.356  11.904  11.904
  415   1HE   LYS  56           HE1      LYS  56  15.766  12.054  12.054
  416   2HE   LYS  56           HE2      LYS  56  15.289  10.372  10.372
  417   1HZ   LYS  56           HZ1      LYS  56  15.027  11.632  11.632
  418   2HZ   LYS  56           HZ2      LYS  56  16.555  12.018  12.018
  419   3HZ   LYS  56           HZ3      LYS  56  16.098  10.394  10.394
  420    H    LYS  57           HN       LYS  57   8.569  10.355  10.355
  421    HA   LYS  57           HA       LYS  57   9.511   8.021   8.021
  422   1HB   LYS  57           HB1      LYS  57   6.827   9.473   9.473
  423   2HB   LYS  57           HB2      LYS  57   7.356   8.228   8.228
  424   1HG   LYS  57           HG1      LYS  57   9.490   9.970   9.970
  425   2HG   LYS  57           HG2      LYS  57   8.192  11.089  11.089
  426   1HD   LYS  57           HD1      LYS  57   6.852  10.066  10.066
  427   2HD   LYS  57           HD2      LYS  57   8.267   9.117   9.117
  428   1HE   LYS  57           HE1      LYS  57   8.334  11.085  11.085
  429   2HE   LYS  57           HE2      LYS  57   9.562  11.312  11.312
  430   1HZ   LYS  57           HZ1      LYS  57   7.183  12.300  12.300
  431   2HZ   LYS  57           HZ2      LYS  57   7.335  12.905  12.905
  432   3HZ   LYS  57           HZ3      LYS  57   8.574  13.166  13.166
  433    H    ALA  58           HN       ALA  58   6.594   8.702   8.702
  434    HA   ALA  58           HA       ALA  58   5.386   6.225   6.225
  435   1HB   ALA  58           HB1      ALA  58   5.820   8.137   8.137
  436   2HB   ALA  58           HB2      ALA  58   4.607   6.864   6.864
  437   3HB   ALA  58           HB3      ALA  58   4.505   8.221   8.221
  438    H    ALA  59           HN       ALA  59   7.988   7.367   7.367
  439    HA   ALA  59           HA       ALA  59   8.443   5.104   5.104
  440   1HB   ALA  59           HB1      ALA  59   9.547   7.339   7.339
  441   2HB   ALA  59           HB2      ALA  59  10.493   7.117   7.117
  442   3HB   ALA  59           HB3      ALA  59  10.760   6.072   6.072
  443    H    LYS  60           HN       LYS  60  10.253   5.979   5.979
  444    HA   LYS  60           HA       LYS  60  11.752   3.693   3.693
  445   1HB   LYS  60           HB1      LYS  60  11.794   5.780   5.780
  446   2HB   LYS  60           HB2      LYS  60  10.397   5.146   5.146
  447   1HG   LYS  60           HG1      LYS  60  12.305   4.448   4.448
  448   2HG   LYS  60           HG2      LYS  60  11.773   3.009   3.009
  449   1HD   LYS  60           HD1      LYS  60  13.553   3.708   3.708
  450   2HD   LYS  60           HD2      LYS  60  14.166   4.786   4.786
  451   1HE   LYS  60           HE1      LYS  60  15.418   2.698   2.698
  452   2HE   LYS  60           HE2      LYS  60  14.426   2.785   2.785
  453   1HZ   LYS  60           HZ1      LYS  60  12.932   1.588   1.588
  454   2HZ   LYS  60           HZ2      LYS  60  14.442   0.819   0.819
  455   3HZ   LYS  60           HZ3      LYS  60  13.456   0.907   0.907
  456    H    LEU  61           HN       LEU  61   8.409   4.104   4.104
  457    HA   LEU  61           HA       LEU  61   8.281   1.483   1.483
  458   1HB   LEU  61           HB1      LEU  61   5.991   3.096   3.096
  459   2HB   LEU  61           HB2      LEU  61   5.848   1.863   1.863
  460    HG   LEU  61           HG       LEU  61   7.187   4.596   4.596
  461   1HD1  LEU  61          HD11      LEU  61   4.800   4.540   4.540
  462   2HD1  LEU  61          HD12      LEU  61   4.968   3.282   3.282
  463   3HD1  LEU  61          HD13      LEU  61   5.617   4.892   4.892
  464   1HD2  LEU  61          HD21      LEU  61   7.428   2.348   2.348
  465   2HD2  LEU  61          HD22      LEU  61   8.746   3.012   3.012
  466   3HD2  LEU  61          HD23      LEU  61   7.940   4.014   4.014
  467    H    LYS  62           HN       LYS  62   6.960   2.544   2.544
  468    HA   LYS  62           HA       LYS  62   6.156   0.078   0.078
  469   1HB   LYS  62           HB1      LYS  62   5.846   2.206   2.206
  470   2HB   LYS  62           HB2      LYS  62   7.576   2.403   2.403
  471   1HG   LYS  62           HG1      LYS  62   7.748   0.616   0.616
  472   2HG   LYS  62           HG2      LYS  62   6.172  -0.032  -0.032
  473   1HD   LYS  62           HD1      LYS  62   6.133   1.182   1.182
  474   2HD   LYS  62           HD2      LYS  62   5.058   1.908   1.908
  475   1HE   LYS  62           HE1      LYS  62   6.312   3.656   3.656
  476   2HE   LYS  62           HE2      LYS  62   6.783   3.675   3.675
  477   1HZ   LYS  62           HZ1      LYS  62   8.444   1.891   1.891
  478   2HZ   LYS  62           HZ2      LYS  62   8.397   3.377   3.377
  479   3HZ   LYS  62           HZ3      LYS  62   8.858   3.326   3.326
  480    H    GLU  63           HN       GLU  63   9.364   1.457   1.457
  481    HA   GLU  63           HA       GLU  63  10.752  -0.608  -0.608
  482   1HB   GLU  63           HB1      GLU  63  11.556   1.801   1.801
  483   2HB   GLU  63           HB2      GLU  63  11.758   1.323   1.323
  484   1HG   GLU  63           HG1      GLU  63  13.310  -0.161  -0.161
  485   2HG   GLU  63           HG2      GLU  63  13.827   1.418   1.418
  486    H    LYS  64           HN       LYS  64  10.365  -0.051  -0.051
  487    HA   LYS  64           HA       LYS  64  11.749  -2.319  -2.319
  488   1HB   LYS  64           HB1      LYS  64  10.816  -0.513  -0.513
  489   2HB   LYS  64           HB2      LYS  64   9.204  -1.143  -1.143
  490   1HG   LYS  64           HG1      LYS  64   9.577  -3.126  -3.126
  491   2HG   LYS  64           HG2      LYS  64  11.315  -3.056  -3.056
  492   1HD   LYS  64           HD1      LYS  64   9.731  -1.069  -1.069
  493   2HD   LYS  64           HD2      LYS  64  10.469  -2.518  -2.518
  494   1HE   LYS  64           HE1      LYS  64  12.708  -1.741  -1.741
  495   2HE   LYS  64           HE2      LYS  64  11.980  -0.263  -0.263
  496   1HZ   LYS  64           HZ1      LYS  64  11.191  -0.597  -0.597
  497   2HZ   LYS  64           HZ2      LYS  64  12.870  -0.826  -0.826
  498   3HZ   LYS  64           HZ3      LYS  64  12.179   0.608   0.608
  499    H    TYR  65           HN       TYR  65   8.328  -2.065  -2.065
  500    HA   TYR  65           HA       TYR  65   7.437  -4.659  -4.659
  501   1HB   TYR  65           HB1      TYR  65   5.808  -3.073  -3.073
  502   2HB   TYR  65           HB2      TYR  65   6.737  -2.502  -2.502
  503    HD1  TYR  65           HD1      TYR  65   6.350  -6.111  -6.111
  504    HD2  TYR  65           HD2      TYR  65   4.350  -2.419  -2.419
  505    HE1  TYR  65           HE1      TYR  65   4.836  -7.214  -7.214
  506    HE2  TYR  65           HE2      TYR  65   2.834  -3.536  -3.536
  507    HH   TYR  65           HH       TYR  65   3.219  -5.941  -5.941
  508    H    GLU  66           HN       GLU  66   8.399  -3.484  -3.484
  509    HA   GLU  66           HA       GLU  66   8.504  -5.826  -5.826
  510   1HB   GLU  66           HB1      GLU  66  10.439  -3.529  -3.529
  511   2HB   GLU  66           HB2      GLU  66  10.163  -4.691  -4.691
  512   1HG   GLU  66           HG1      GLU  66   7.774  -3.177  -3.177
  513   2HG   GLU  66           HG2      GLU  66   8.835  -2.326  -2.326
  514    H    LYS  67           HN       LYS  67  10.867  -4.859  -4.859
  515    HA   LYS  67           HA       LYS  67  12.794  -6.879  -6.879
  516   1HB   LYS  67           HB1      LYS  67  12.812  -4.628  -4.628
  517   2HB   LYS  67           HB2      LYS  67  13.930  -5.944  -5.944
  518   1HG   LYS  67           HG1      LYS  67  15.002  -4.206  -4.206
  519   2HG   LYS  67           HG2      LYS  67  14.878  -5.692  -5.692
  520   1HD   LYS  67           HD1      LYS  67  12.924  -4.733  -4.733
  521   2HD   LYS  67           HD2      LYS  67  13.063  -3.256  -3.256
  522   1HE   LYS  67           HE1      LYS  67  14.167  -2.975  -2.975
  523   2HE   LYS  67           HE2      LYS  67  15.369  -2.924  -2.924
  524   1HZ   LYS  67           HZ1      LYS  67  15.008  -5.586  -5.586
  525   2HZ   LYS  67           HZ2      LYS  67  15.244  -4.651  -4.651
  526   3HZ   LYS  67           HZ3      LYS  67  16.394  -4.619  -4.619
  527    H    ASP  68           HN       ASP  68  10.517  -6.480  -6.480
  528    HA   ASP  68           HA       ASP  68  11.350  -8.726  -8.726
  529   1HB   ASP  68           HB1      ASP  68   8.980  -6.854  -6.854
  530   2HB   ASP  68           HB2      ASP  68   9.054  -8.249  -8.249
  531    H    ILE  69           HN       ILE  69   9.227  -7.977  -7.977
  532    HA   ILE  69           HA       ILE  69   7.800 -10.495 -10.495
  533    HB   ILE  69           HB       ILE  69   6.613  -8.493  -8.493
  534   1HG1  ILE  69          HG11      ILE  69   5.402  -9.536  -9.536
  535   2HG1  ILE  69          HG12      ILE  69   6.802 -10.435 -10.435
  536   1HG2  ILE  69          HG21      ILE  69   8.507  -7.537  -7.537
  537   2HG2  ILE  69          HG22      ILE  69   8.369  -8.771  -8.771
  538   3HG2  ILE  69          HG23      ILE  69   7.064  -7.626  -7.626
  539   1HD1  ILE  69          HD11      ILE  69   5.563 -10.877 -10.877
  540   2HD1  ILE  69          HD12      ILE  69   5.201 -11.891 -11.891
  541   3HD1  ILE  69          HD13      ILE  69   6.810 -11.842 -11.842
  542    H    ALA  70           HN       ALA  70  10.044  -9.039  -9.039
  543    HA   ALA  70           HA       ALA  70  10.530 -11.156 -11.156
  544   1HB   ALA  70           HB1      ALA  70  12.553  -9.116  -9.116
  545   2HB   ALA  70           HB2      ALA  70  12.793 -10.095 -10.095
  546   3HB   ALA  70           HB3      ALA  70  11.531  -8.879  -8.879
  547    H    ALA  71           HN       ALA  71  11.566 -10.543 -10.543
  548    HA   ALA  71           HA       ALA  71  13.488 -12.714 -12.714
  549   1HB   ALA  71           HB1      ALA  71  12.199 -11.057 -11.057
  550   2HB   ALA  71           HB2      ALA  71  13.549 -12.162 -12.162
  551   3HB   ALA  71           HB3      ALA  71  13.746 -10.721 -10.721
  552    H    TYR  72           HN       TYR  72  10.268 -12.033 -12.033
  553    HA   TYR  72           HA       TYR  72   9.604 -14.310 -14.310
  554   1HB   TYR  72           HB1      TYR  72   8.160 -12.239 -12.239
  555   2HB   TYR  72           HB2      TYR  72   7.319 -13.802 -13.802
  556    HD1  TYR  72           HD1      TYR  72   9.243 -12.040 -12.040
  557    HD2  TYR  72           HD2      TYR  72   5.679 -14.114 -14.114
  558    HE1  TYR  72           HE1      TYR  72   8.425 -11.803 -11.803
  559    HE2  TYR  72           HE2      TYR  72   4.864 -13.877 -13.877
  560    HH   TYR  72           HH       TYR  72   6.387 -11.811 -11.811
  561    H    ARG  73           HN       ARG  73   9.562 -13.842 -13.842
  562    HA   ARG  73           HA       ARG  73   8.754 -16.610 -16.610
  563   1HB   ARG  73           HB1      ARG  73   9.400 -14.281 -14.281
  564   2HB   ARG  73           HB2      ARG  73   8.820 -15.837 -15.837
  565   1HG   ARG  73           HG1      ARG  73   6.777 -15.404 -15.404
  566   2HG   ARG  73           HG2      ARG  73   7.354 -13.746 -13.746
  567   1HD   ARG  73           HD1      ARG  73   7.166 -13.573 -13.573
  568   2HD   ARG  73           HD2      ARG  73   6.694 -15.267 -15.267
  569    HE   ARG  73           HE       ARG  73   4.671 -14.582 -14.582
  570   1HH1  ARG  73          HH11      ARG  73   4.079 -12.189 -12.189
  571   2HH1  ARG  73          HH12      ARG  73   3.735 -11.242 -11.242
  572   1HH2  ARG  73          HH21      ARG  73   5.237 -13.541 -13.541
  573   2HH2  ARG  73          HH22      ARG  73   4.399 -12.030 -12.030
  574    H    ALA  74           HN       ALA  74  11.504 -14.567 -14.567
  575    HA   ALA  74           HA       ALA  74  13.293 -16.113 -16.113
  576   1HB   ALA  74           HB1      ALA  74  14.001 -14.687 -14.687
  577   2HB   ALA  74           HB2      ALA  74  15.151 -15.228 -15.228
  578   3HB   ALA  74           HB3      ALA  74  14.021 -13.958 -13.958
  579    H    LYS  75           HN       LYS  75  12.469 -16.442 -16.442
  580    HA   LYS  75           HA       LYS  75  12.346 -19.112 -19.112
  581   1HB   LYS  75           HB1      LYS  75  14.717 -19.466 -19.466
  582   2HB   LYS  75           HB2      LYS  75  15.283 -18.200 -18.200
  583   1HG   LYS  75           HG1      LYS  75  14.826 -19.599 -19.599
  584   2HG   LYS  75           HG2      LYS  75  13.893 -20.729 -20.729
  585   1HD   LYS  75           HD1      LYS  75  16.811 -20.198 -20.198
  586   2HD   LYS  75           HD2      LYS  75  16.403 -21.228 -21.228
  587   1HE   LYS  75           HE1      LYS  75  15.402 -21.677 -21.677
  588   2HE   LYS  75           HE2      LYS  75  16.757 -22.529 -22.529
  589   1HZ   LYS  75           HZ1      LYS  75  14.583 -22.665 -22.665
  590   2HZ   LYS  75           HZ2      LYS  75  14.038 -23.109 -23.109
  591   3HZ   LYS  75           HZ3      LYS  75  15.352 -23.925 -23.925
  592    H    GLY  76           HN       GLY  76  11.072 -17.133 -17.133
  593   1HA   GLY  76           HA1      GLY  76  11.808 -16.766 -16.766
  594   2HA   GLY  76           HA2      GLY  76  11.132 -15.420 -15.420
  595    H    LYS  77           HN       LYS  77  10.673 -18.860 -18.860
  596    HA   LYS  77           HA       LYS  77   7.739 -18.536 -18.536
  597   1HB   LYS  77           HB1      LYS  77   9.275 -21.127 -21.127
  598   2HB   LYS  77           HB2      LYS  77   7.616 -20.763 -20.763
  599   1HG   LYS  77           HG1      LYS  77   8.475 -18.956 -18.956
  600   2HG   LYS  77           HG2      LYS  77  10.107 -19.448 -19.448
  601   1HD   LYS  77           HD1      LYS  77   9.626 -20.515 -20.515
  602   2HD   LYS  77           HD2      LYS  77   9.508 -21.788 -21.788
  603   1HE   LYS  77           HE1      LYS  77   7.014 -21.501 -21.501
  604   2HE   LYS  77           HE2      LYS  77   7.160 -20.229 -20.229
  605   1HZ   LYS  77           HZ1      LYS  77   8.547 -22.469 -22.469
  606   2HZ   LYS  77           HZ2      LYS  77   7.013 -22.977 -22.977
  607   3HZ   LYS  77           HZ3      LYS  77   7.150 -21.743 -21.743
  608    HA   PRO  78           HA       PRO  78   7.432 -19.752 -19.752
  609   1HB   PRO  78           HB1      PRO  78   5.535 -22.034 -22.034
  610   2HB   PRO  78           HB2      PRO  78   5.256 -20.618 -20.618
  611   1HG   PRO  78           HG1      PRO  78   4.149 -20.625 -20.625
  612   2HG   PRO  78           HG2      PRO  78   4.968 -19.156 -19.156
  613   1HD   PRO  78           HD1      PRO  78   6.145 -21.412 -21.412
  614   2HD   PRO  78           HD2      PRO  78   6.076 -19.684 -19.684
  615    H    ASP  79           HN       ASP  79   8.251 -22.248 -22.248
  616    HA   ASP  79           HA       ASP  79   9.754 -23.688 -23.688
  617   1HB   ASP  79           HB1      ASP  79   9.306 -25.766 -25.766
  618   2HB   ASP  79           HB2      ASP  79   7.926 -25.083 -25.083
  619    H    ALA  80           HN       ALA  80  11.081 -21.674 -21.674
  620    HA   ALA  80           HA       ALA  80  12.807 -22.790 -22.790
  621   1HB   ALA  80           HB1      ALA  80  11.848 -20.541 -20.541
  622   2HB   ALA  80           HB2      ALA  80  12.593 -19.959 -19.959
  623   3HB   ALA  80           HB3      ALA  80  13.598 -20.458 -20.458
  624    H    ALA  81           HN       ALA  81  12.971 -21.349 -21.349
  625    HA   ALA  81           HA       ALA  81  14.692 -21.203 -21.203
  626   1HB   ALA  81           HB1      ALA  81  13.934 -23.563 -23.563
  627   2HB   ALA  81           HB2      ALA  81  15.055 -24.073 -24.073
  628   3HB   ALA  81           HB3      ALA  81  15.663 -23.466 -23.466
  629   1H1   BME  16           HE1      MER  16  -9.216   9.695   9.695
  630   2H1   BME  16           HE2      MER  16  -9.644   9.909   9.909
  631   1H2   BME  16           HZ1      MER  16  -7.234   9.341   9.341
  632   2H2   BME  16           HZ2      MER  16  -7.466  10.954  10.954
  633    HO1  BME  16           HH       MER  16  -9.734  11.692  11.692

  Start of MODEL   14
    1    H    ASN   3           HN       ASN   3  -1.511  -8.209  -8.209
    2    HA   ASN   3           HA       ASN   3  -0.486  -9.797  -9.797
    3   1HB   ASN   3           HB1      ASN   3  -2.558 -11.279 -11.279
    4   2HB   ASN   3           HB2      ASN   3  -2.230 -10.652 -10.652
    5   1HD2  ASN   3          HD21      ASN   3  -5.725  -9.739  -9.739
    6   2HD2  ASN   3          HD22      ASN   3  -4.649 -10.872 -10.872
    7    H    ALA   4           HN       ALA   4   0.092  -8.307  -8.307
    8    HA   ALA   4           HA       ALA   4   0.321  -8.758  -8.758
    9   1HB   ALA   4           HB1      ALA   4  -1.817 -10.046 -10.046
   10   2HB   ALA   4           HB2      ALA   4  -2.737  -8.559  -8.559
   11   3HB   ALA   4           HB3      ALA   4  -1.681  -8.750  -8.750
   12    HA   PRO   5           HA       PRO   5  -0.032  -4.168  -4.168
   13   1HB   PRO   5           HB1      PRO   5   2.566  -4.510  -4.510
   14   2HB   PRO   5           HB2      PRO   5   2.174  -3.444  -3.444
   15   1HG   PRO   5           HG1      PRO   5   3.666  -5.623  -5.623
   16   2HG   PRO   5           HG2      PRO   5   2.354  -5.232  -5.232
   17   1HD   PRO   5           HD1      PRO   5   2.230  -7.204  -7.204
   18   2HD   PRO   5           HD2      PRO   5   1.823  -7.518  -7.518
   19    H    LYS   6           HN       LYS   6  -1.746  -4.170  -4.170
   20    HA   LYS   6           HA       LYS   6  -1.372  -5.046  -5.046
   21   1HB   LYS   6           HB1      LYS   6  -3.857  -4.756  -4.756
   22   2HB   LYS   6           HB2      LYS   6  -3.389  -5.848  -5.848
   23   1HG   LYS   6           HG1      LYS   6  -3.783  -4.159  -4.159
   24   2HG   LYS   6           HG2      LYS   6  -4.030  -2.901  -2.901
   25   1HD   LYS   6           HD1      LYS   6  -6.027  -4.156  -4.156
   26   2HD   LYS   6           HD2      LYS   6  -5.798  -5.357  -5.357
   27   1HE   LYS   6           HE1      LYS   6  -6.295  -2.389  -2.389
   28   2HE   LYS   6           HE2      LYS   6  -7.526  -3.640  -3.640
   29   1HZ   LYS   6           HZ1      LYS   6  -5.378  -4.482  -4.482
   30   2HZ   LYS   6           HZ2      LYS   6  -5.713  -2.868  -2.868
   31   3HZ   LYS   6           HZ3      LYS   6  -6.938  -4.039  -4.039
   32    H    ARG   7           HN       ARG   7   0.163  -3.088  -3.088
   33    HA   ARG   7           HA       ARG   7   0.864  -1.205  -1.205
   34   1HB   ARG   7           HB1      ARG   7  -2.064  -0.657  -0.657
   35   2HB   ARG   7           HB2      ARG   7  -0.647   0.145   0.145
   36   1HG   ARG   7           HG1      ARG   7   0.148  -1.681  -1.681
   37   2HG   ARG   7           HG2      ARG   7  -0.789  -2.853  -2.853
   38   1HD   ARG   7           HD1      ARG   7  -2.083  -0.757  -0.757
   39   2HD   ARG   7           HD2      ARG   7  -1.654  -2.376  -2.376
   40    HE   ARG   7           HE       ARG   7  -3.176  -3.230  -3.230
   41   1HH1  ARG   7          HH11      ARG   7  -4.036  -1.058  -1.058
   42   2HH1  ARG   7          HH12      ARG   7  -5.455  -0.454  -0.454
   43   1HH2  ARG   7          HH21      ARG   7  -4.702  -2.073  -2.073
   44   2HH2  ARG   7          HH22      ARG   7  -5.844  -1.044  -1.044
   45    HA   PRO   8           HA       PRO   8  -0.070   0.991   0.991
   46   1HB   PRO   8           HB1      PRO   8   2.493   2.106   2.106
   47   2HB   PRO   8           HB2      PRO   8   2.081   0.505   0.505
   48   1HG   PRO   8           HG1      PRO   8   3.169   1.208   1.208
   49   2HG   PRO   8           HG2      PRO   8   3.836   0.051   0.051
   50   1HD   PRO   8           HD1      PRO   8   2.280  -0.880  -0.880
   51   2HD   PRO   8           HD2      PRO   8   1.909  -1.444  -1.444
   52    HA   PRO   9           HA       PRO   9  -0.756   5.432   5.432
   53   1HB   PRO   9           HB1      PRO   9   2.018   6.216   6.216
   54   2HB   PRO   9           HB2      PRO   9   0.523   6.645   6.645
   55   1HG   PRO   9           HG1      PRO   9   2.384   4.369   4.369
   56   2HG   PRO   9           HG2      PRO   9   1.210   5.140   5.140
   57   1HD   PRO   9           HD1      PRO   9   0.704   2.669   2.669
   58   2HD   PRO   9           HD2      PRO   9  -0.620   3.848   3.848
   59    H    SER  10           HN       SER  10  -0.235   7.210   7.210
   60    HA   SER  10           HA       SER  10   0.973   6.343   6.343
   61   1HB   SER  10           HB1      SER  10  -1.423   6.886   6.886
   62   2HB   SER  10           HB2      SER  10  -1.087   8.504   8.504
   63    HG   SER  10           HG       SER  10  -0.893   7.613   7.613
   64    H    ALA  11           HN       ALA  11   0.949   9.012   9.012
   65    HA   ALA  11           HA       ALA  11   3.246  10.145  10.145
   66   1HB   ALA  11           HB1      ALA  11   2.470  10.972  10.972
   67   2HB   ALA  11           HB2      ALA  11   3.801  11.650  11.650
   68   3HB   ALA  11           HB3      ALA  11   3.891   9.996   9.996
   69    H    PHE  12           HN       PHE  12   0.523  10.761  10.761
   70    HA   PHE  12           HA       PHE  12  -0.360  13.317  13.317
   71   1HB   PHE  12           HB1      PHE  12  -1.113  12.249  12.249
   72   2HB   PHE  12           HB2      PHE  12  -1.537  10.759  10.759
   73    HD1  PHE  12           HD1      PHE  12  -3.144  13.249  13.249
   74    HD2  PHE  12           HD2      PHE  12  -3.272  11.311  11.311
   75    HE1  PHE  12           HE1      PHE  12  -5.526  13.759  13.759
   76    HE2  PHE  12           HE2      PHE  12  -5.662  11.837  11.837
   77    HZ   PHE  12           HZ       PHE  12  -6.795  13.060  13.060
   78    H    PHE  13           HN       PHE  13  -0.857  10.036  10.036
   79    HA   PHE  13           HA       PHE  13  -2.733  10.362  10.362
   80   1HB   PHE  13           HB1      PHE  13  -1.410   8.244   8.244
   81   2HB   PHE  13           HB2      PHE  13  -0.177   8.817   8.817
   82    HD1  PHE  13           HD1      PHE  13  -0.939   9.276   9.276
   83    HD2  PHE  13           HD2      PHE  13  -3.377   7.200   7.200
   84    HE1  PHE  13           HE1      PHE  13  -2.321   8.411   8.411
   85    HE2  PHE  13           HE2      PHE  13  -4.760   6.341   6.341
   86    HZ   PHE  13           HZ       PHE  13  -4.239   6.947   6.947
   87    H    LEU  14           HN       LEU  14   0.736  11.049  11.049
   88    HA   LEU  14           HA       LEU  14   0.486  11.833  11.833
   89   1HB   LEU  14           HB1      LEU  14   2.444  12.963  12.963
   90   2HB   LEU  14           HB2      LEU  14   2.646  13.046  13.046
   91    HG   LEU  14           HG       LEU  14   4.149  11.436  11.436
   92   1HD1  LEU  14          HD11      LEU  14   1.767   9.672   9.672
   93   2HD1  LEU  14          HD12      LEU  14   3.446   9.176   9.176
   94   3HD1  LEU  14          HD13      LEU  14   2.901  10.393  10.393
   95   1HD2  LEU  14          HD21      LEU  14   3.731  11.136  11.136
   96   2HD2  LEU  14          HD22      LEU  14   3.911   9.572   9.572
   97   3HD2  LEU  14          HD23      LEU  14   2.312  10.140  10.140
   98    H    PHE  15           HN       PHE  15   0.630  13.887  13.887
   99    HA   PHE  15           HA       PHE  15   0.039  16.368  16.368
  100   1HB   PHE  15           HB1      PHE  15   0.876  16.807  16.807
  101   2HB   PHE  15           HB2      PHE  15   0.477  15.161  15.161
  102    HD1  PHE  15           HD1      PHE  15  -2.136  14.911  14.911
  103    HD2  PHE  15           HD2      PHE  15   0.134  18.524  18.524
  104    HE1  PHE  15           HE1      PHE  15  -3.654  15.827  15.827
  105    HE2  PHE  15           HE2      PHE  15  -1.394  19.438  19.438
  106    HZ   PHE  15           HZ       PHE  15  -3.283  18.088  18.088
  107    H    CYS  16           HN       MER  16  -2.209  14.118  14.118
  108    HA   CYS  16           HA       MER  16  -4.546  15.631  15.631
  109   1HB   CYS  16           HB1      MER  16  -5.823  13.571  13.571
  110   2HB   CYS  16           HB2      MER  16  -4.433  13.388  13.388
  111    H    SER  17           HN       SER  17  -3.263  13.185  13.185
  112    HA   SER  17           HA       SER  17  -5.265  13.586  13.586
  113   1HB   SER  17           HB1      SER  17  -3.601  12.695  12.695
  114   2HB   SER  17           HB2      SER  17  -3.631  11.816  11.816
  115    HG   SER  17           HG       SER  17  -1.642  12.360  12.360
  116    H    GLU  18           HN       GLU  18  -2.125  15.132  15.132
  117    HA   GLU  18           HA       GLU  18  -1.945  16.771  16.771
  118   1HB   GLU  18           HB1      GLU  18  -0.390  16.655  16.655
  119   2HB   GLU  18           HB2      GLU  18  -1.503  17.651  17.651
  120   1HG   GLU  18           HG1      GLU  18  -1.233  19.517  19.517
  121   2HG   GLU  18           HG2      GLU  18  -0.224  18.529  18.529
  122    H    TYR  19           HN       TYR  19  -4.079  17.416  17.416
  123    HA   TYR  19           HA       TYR  19  -5.656  19.175  19.175
  124   1HB   TYR  19           HB1      TYR  19  -5.591  21.055  21.055
  125   2HB   TYR  19           HB2      TYR  19  -3.936  20.607  20.607
  126    HD1  TYR  19           HD1      TYR  19  -2.483  19.370  19.370
  127    HD2  TYR  19           HD2      TYR  19  -6.292  20.909  20.909
  128    HE1  TYR  19           HE1      TYR  19  -1.875  19.169  19.169
  129    HE2  TYR  19           HE2      TYR  19  -5.684  20.710  20.710
  130    HH   TYR  19           HH       TYR  19  -3.092  20.696  20.696
  131    H    ARG  20           HN       ARG  20  -6.503  16.747  16.747
  132    HA   ARG  20           HA       ARG  20  -8.360  17.092  17.092
  133   1HB   ARG  20           HB1      ARG  20  -7.302  14.824  14.824
  134   2HB   ARG  20           HB2      ARG  20  -8.334  14.783  14.783
  135   1HG   ARG  20           HG1      ARG  20 -10.333  14.998  14.998
  136   2HG   ARG  20           HG2      ARG  20  -9.235  14.911  14.911
  137   1HD   ARG  20           HD1      ARG  20  -8.464  12.707  12.707
  138   2HD   ARG  20           HD2      ARG  20  -9.360  12.772  12.772
  139    HE   ARG  20           HE       ARG  20 -10.618  12.623  12.623
  140   1HH1  ARG  20          HH11      ARG  20 -12.892  13.204  13.204
  141   2HH1  ARG  20          HH12      ARG  20 -13.473  12.028  12.028
  142   1HH2  ARG  20          HH21      ARG  20 -10.272  10.667  10.667
  143   2HH2  ARG  20          HH22      ARG  20 -11.941  10.545  10.545
  144    HA   PRO  21           HA       PRO  21 -11.601  16.913  16.913
  145   1HB   PRO  21           HB1      PRO  21 -10.129  17.565  17.565
  146   2HB   PRO  21           HB2      PRO  21 -11.314  16.291  16.291
  147   1HG   PRO  21           HG1      PRO  21  -8.727  15.594  15.594
  148   2HG   PRO  21           HG2      PRO  21  -9.678  14.869  14.869
  149   1HD   PRO  21           HD1      PRO  21  -7.925  17.379  17.379
  150   2HD   PRO  21           HD2      PRO  21  -7.765  15.896  15.896
  151    H    LYS  22           HN       LYS  22  -9.157  19.122  19.122
  152    HA   LYS  22           HA       LYS  22 -10.454  21.468  21.468
  153   1HB   LYS  22           HB1      LYS  22  -7.961  21.025  21.025
  154   2HB   LYS  22           HB2      LYS  22  -8.014  21.236  21.236
  155   1HG   LYS  22           HG1      LYS  22  -8.770  23.567  23.567
  156   2HG   LYS  22           HG2      LYS  22  -8.887  23.356  23.356
  157   1HD   LYS  22           HD1      LYS  22  -6.427  22.824  22.824
  158   2HD   LYS  22           HD2      LYS  22  -6.333  23.166  23.166
  159   1HE   LYS  22           HE1      LYS  22  -7.055  25.498  25.498
  160   2HE   LYS  22           HE2      LYS  22  -7.246  25.163  25.163
  161   1HZ   LYS  22           HZ1      LYS  22  -4.688  24.350  24.350
  162   2HZ   LYS  22           HZ2      LYS  22  -4.951  25.926  25.926
  163   3HZ   LYS  22           HZ3      LYS  22  -5.133  25.584  25.584
  164    H    ILE  23           HN       ILE  23 -10.076  20.046  20.046
  165    HA   ILE  23           HA       ILE  23 -11.370  22.452  22.452
  166    HB   ILE  23           HB       ILE  23 -11.145  21.115  21.115
  167   1HG1  ILE  23          HG11      ILE  23  -9.190  19.372  19.372
  168   2HG1  ILE  23          HG12      ILE  23 -10.818  18.814  18.814
  169   1HG2  ILE  23          HG21      ILE  23  -9.608  22.924  22.924
  170   2HG2  ILE  23          HG22      ILE  23  -8.647  21.797  21.797
  171   3HG2  ILE  23          HG23      ILE  23  -8.704  21.660  21.660
  172   1HD1  ILE  23          HD11      ILE  23 -10.428  19.138  19.138
  173   2HD1  ILE  23          HD12      ILE  23  -8.775  19.627  19.627
  174   3HD1  ILE  23          HD13      ILE  23  -9.301  17.995  17.995
  175    H    LYS  24           HN       LYS  24 -11.870  19.141  19.141
  176    HA   LYS  24           HA       LYS  24 -14.408  18.705  18.705
  177   1HB   LYS  24           HB1      LYS  24 -12.683  17.083  17.083
  178   2HB   LYS  24           HB2      LYS  24 -12.962  17.522  17.522
  179   1HG   LYS  24           HG1      LYS  24 -15.505  16.768  16.768
  180   2HG   LYS  24           HG2      LYS  24 -14.349  15.458  15.458
  181   1HD   LYS  24           HD1      LYS  24 -15.011  17.023  17.023
  182   2HD   LYS  24           HD2      LYS  24 -15.980  15.648  15.648
  183   1HE   LYS  24           HE1      LYS  24 -12.943  15.553  15.553
  184   2HE   LYS  24           HE2      LYS  24 -14.118  15.058  15.058
  185   1HZ   LYS  24           HZ1      LYS  24 -14.787  13.739  13.739
  186   2HZ   LYS  24           HZ2      LYS  24 -13.098  13.634  13.634
  187   3HZ   LYS  24           HZ3      LYS  24 -14.089  13.085  13.085
  188    H    GLY  25           HN       GLY  25 -13.276  20.240  20.240
  189   1HA   GLY  25           HA1      GLY  25 -15.783  20.274  20.274
  190   2HA   GLY  25           HA2      GLY  25 -14.310  21.177  21.177
  191    H    GLU  26           HN       GLU  26 -13.881  22.559  22.559
  192    HA   GLU  26           HA       GLU  26 -15.634  24.787  24.787
  193   1HB   GLU  26           HB1      GLU  26 -13.571  24.062  24.062
  194   2HB   GLU  26           HB2      GLU  26 -14.333  25.639  25.639
  195   1HG   GLU  26           HG1      GLU  26 -12.873  24.351  24.351
  196   2HG   GLU  26           HG2      GLU  26 -12.055  25.397  25.397
  197    H    HIS  27           HN       HIS  27 -15.303  22.342  22.342
  198    HA   HIS  27           HA       HIS  27 -17.872  23.166  23.166
  199   1HB   HIS  27           HB1      HIS  27 -15.507  21.817  21.817
  200   2HB   HIS  27           HB2      HIS  27 -16.931  22.496  22.496
  201    HD1  HIS  27           HD1      HIS  27 -17.144  25.225  25.225
  202    HD2  HIS  27           HD2      HIS  27 -13.427  23.568  23.568
  203    HE1  HIS  27           HE1      HIS  27 -15.546  27.103  27.103
  204    HA   PRO  28           HA       PRO  28 -18.749  18.834  18.834
  205   1HB   PRO  28           HB1      PRO  28 -20.879  19.270  19.270
  206   2HB   PRO  28           HB2      PRO  28 -19.250  19.536  19.536
  207   1HG   PRO  28           HG1      PRO  28 -21.127  21.629  21.629
  208   2HG   PRO  28           HG2      PRO  28 -20.345  21.688  21.688
  209   1HD   PRO  28           HD1      PRO  28 -19.191  22.900  22.900
  210   2HD   PRO  28           HD2      PRO  28 -18.170  22.143  22.143
  211    H    GLY  29           HN       GLY  29 -18.975  20.025  20.025
  212   1HA   GLY  29           HA1      GLY  29 -21.727  19.628  19.628
  213   2HA   GLY  29           HA2      GLY  29 -20.611  20.826  20.826
  214    H    LEU  30           HN       LEU  30 -18.295  19.136  19.136
  215    HA   LEU  30           HA       LEU  30 -18.231  17.647  17.647
  216   1HB   LEU  30           HB1      LEU  30 -16.289  17.675  17.675
  217   2HB   LEU  30           HB2      LEU  30 -15.883  17.182  17.182
  218    HG   LEU  30           HG       LEU  30 -16.693  19.976  19.976
  219   1HD1  LEU  30          HD11      LEU  30 -13.943  18.867  18.867
  220   2HD1  LEU  30          HD12      LEU  30 -14.301  20.554  20.554
  221   3HD1  LEU  30          HD13      LEU  30 -14.500  19.367  19.367
  222   1HD2  LEU  30          HD21      LEU  30 -17.211  19.530  19.530
  223   2HD2  LEU  30          HD22      LEU  30 -15.893  20.675  20.675
  224   3HD2  LEU  30          HD23      LEU  30 -15.549  19.008  19.008
  225    H    SER  31           HN       SER  31 -17.253  15.452  15.452
  226    HA   SER  31           HA       SER  31 -18.553  13.669  13.669
  227   1HB   SER  31           HB1      SER  31 -19.554  13.510  13.510
  228   2HB   SER  31           HB2      SER  31 -17.941  13.023  13.023
  229    HG   SER  31           HG       SER  31 -18.337  11.146  11.146
  230    H    ILE  32           HN       ILE  32 -17.271  11.473  11.473
  231    HA   ILE  32           HA       ILE  32 -14.522  12.092  12.092
  232    HB   ILE  32           HB       ILE  32 -16.274  10.263  10.263
  233   1HG1  ILE  32          HG11      ILE  32 -14.154  10.357  10.357
  234   2HG1  ILE  32          HG12      ILE  32 -14.578   8.703   8.703
  235   1HG2  ILE  32          HG21      ILE  32 -16.707   9.212   9.212
  236   2HG2  ILE  32          HG22      ILE  32 -15.023   8.741   8.741
  237   3HG2  ILE  32          HG23      ILE  32 -16.013   8.025   8.025
  238   1HD1  ILE  32          HD11      ILE  32 -12.985   8.694   8.694
  239   2HD1  ILE  32          HD12      ILE  32 -12.547  10.361  10.361
  240   3HD1  ILE  32          HD13      ILE  32 -12.184   9.081   9.081
  241    H    GLY  33           HN       GLY  33 -16.071  11.928  11.928
  242   1HA   GLY  33           HA1      GLY  33 -13.806  10.895  10.895
  243   2HA   GLY  33           HA2      GLY  33 -15.484  10.977  10.977
  244    H    ASP  34           HN       ASP  34 -15.154  13.748  13.748
  245    HA   ASP  34           HA       ASP  34 -14.260  15.278  15.278
  246   1HB   ASP  34           HB1      ASP  34 -16.159  15.934  15.934
  247   2HB   ASP  34           HB2      ASP  34 -15.711  17.164  17.164
  248    H    VAL  35           HN       VAL  35 -14.339  15.137  15.137
  249    HA   VAL  35           HA       VAL  35 -12.430  17.166  17.166
  250    HB   VAL  35           HB       VAL  35 -13.044  14.506  14.506
  251   1HG1  VAL  35          HG11      VAL  35 -11.510  16.944  16.944
  252   2HG1  VAL  35          HG12      VAL  35 -11.919  15.524  15.524
  253   3HG1  VAL  35          HG13      VAL  35 -10.785  15.389  15.389
  254   1HG2  VAL  35          HG21      VAL  35 -13.968  17.339  17.339
  255   2HG2  VAL  35          HG22      VAL  35 -14.958  16.032  16.032
  256   3HG2  VAL  35          HG23      VAL  35 -14.310  15.935  15.935
  257    H    ALA  36           HN       ALA  36 -12.303  13.906  13.906
  258    HA   ALA  36           HA       ALA  36  -9.451  13.559  13.559
  259   1HB   ALA  36           HB1      ALA  36 -11.028  11.725  11.725
  260   2HB   ALA  36           HB2      ALA  36 -11.687  11.942  11.942
  261   3HB   ALA  36           HB3      ALA  36 -10.044  11.337  11.337
  262    H    LYS  37           HN       LYS  37 -11.807  13.949  13.949
  263    HA   LYS  37           HA       LYS  37  -9.605  13.883  13.883
  264   1HB   LYS  37           HB1      LYS  37 -12.538  14.549  14.549
  265   2HB   LYS  37           HB2      LYS  37 -11.441  14.758  14.758
  266   1HG   LYS  37           HG1      LYS  37 -10.761  12.373  12.373
  267   2HG   LYS  37           HG2      LYS  37 -11.894  12.131  12.131
  268   1HD   LYS  37           HD1      LYS  37 -13.786  12.731  12.731
  269   2HD   LYS  37           HD2      LYS  37 -12.692  13.163  13.163
  270   1HE   LYS  37           HE1      LYS  37 -11.917  10.814  10.814
  271   2HE   LYS  37           HE2      LYS  37 -12.988  10.359  10.359
  272   1HZ   LYS  37           HZ1      LYS  37 -14.466  11.750  11.750
  273   2HZ   LYS  37           HZ2      LYS  37 -13.566  10.540  10.540
  274   3HZ   LYS  37           HZ3      LYS  37 -14.614  10.132  10.132
  275    H    LYS  38           HN       LYS  38 -10.689  16.308  16.308
  276    HA   LYS  38           HA       LYS  38 -10.035  18.525  18.525
  277   1HB   LYS  38           HB1      LYS  38 -11.977  18.712  18.712
  278   2HB   LYS  38           HB2      LYS  38 -10.878  18.458  18.458
  279   1HG   LYS  38           HG1      LYS  38  -9.681  20.553  20.553
  280   2HG   LYS  38           HG2      LYS  38 -10.772  20.803  20.803
  281   1HD   LYS  38           HD1      LYS  38 -12.713  20.807  20.807
  282   2HD   LYS  38           HD2      LYS  38 -11.580  20.646  20.646
  283   1HE   LYS  38           HE1      LYS  38 -11.606  22.954  22.954
  284   2HE   LYS  38           HE2      LYS  38 -12.246  23.026  23.026
  285   1HZ   LYS  38           HZ1      LYS  38  -9.631  22.038  22.038
  286   2HZ   LYS  38           HZ2      LYS  38  -9.628  23.438  23.438
  287   3HZ   LYS  38           HZ3      LYS  38 -10.249  23.491  23.491
  288    H    LEU  39           HN       LEU  39  -9.264  17.275  17.275
  289    HA   LEU  39           HA       LEU  39  -6.787  18.529  18.529
  290   1HB   LEU  39           HB1      LEU  39  -8.111  17.431  17.431
  291   2HB   LEU  39           HB2      LEU  39  -7.999  15.907  15.907
  292    HG   LEU  39           HG       LEU  39  -5.715  15.867  15.867
  293   1HD1  LEU  39          HD11      LEU  39  -6.110  18.189  18.189
  294   2HD1  LEU  39          HD12      LEU  39  -4.627  17.273  17.273
  295   3HD1  LEU  39          HD13      LEU  39  -5.136  18.276  18.276
  296   1HD2  LEU  39          HD21      LEU  39  -7.206  14.648  14.648
  297   2HD2  LEU  39          HD22      LEU  39  -5.772  15.214  15.214
  298   3HD2  LEU  39          HD23      LEU  39  -7.280  16.077  16.077
  299    H    GLY  40           HN       GLY  40  -7.521  15.400  15.400
  300   1HA   GLY  40           HA1      GLY  40  -4.902  14.525  14.525
  301   2HA   GLY  40           HA2      GLY  40  -6.312  13.999  13.999
  302    H    GLU  41           HN       GLU  41  -7.061  16.408  16.408
  303    HA   GLU  41           HA       GLU  41  -5.218  16.501  16.501
  304   1HB   GLU  41           HB1      GLU  41  -7.303  18.419  18.419
  305   2HB   GLU  41           HB2      GLU  41  -6.379  18.741  18.741
  306   1HG   GLU  41           HG1      GLU  41  -7.114  16.609  16.609
  307   2HG   GLU  41           HG2      GLU  41  -8.023  16.200  16.200
  308    H    MET  42           HN       MET  42  -5.737  18.739  18.739
  309    HA   MET  42           HA       MET  42  -3.774  20.656  20.656
  310   1HB   MET  42           HB1      MET  42  -4.544  19.469  19.469
  311   2HB   MET  42           HB2      MET  42  -3.698  20.989  20.989
  312   1HG   MET  42           HG1      MET  42  -6.379  20.458  20.458
  313   2HG   MET  42           HG2      MET  42  -6.322  21.049  21.049
  314   1HE   MET  42           HE1      MET  42  -8.005  22.221  22.221
  315   2HE   MET  42           HE2      MET  42  -7.226  23.424  23.424
  316   3HE   MET  42           HE3      MET  42  -6.777  21.737  21.737
  317    H    TRP  43           HN       TRP  43  -3.450  17.670  17.670
  318    HA   TRP  43           HA       TRP  43  -0.769  17.688  17.688
  319   1HB   TRP  43           HB1      TRP  43  -2.139  15.846  15.846
  320   2HB   TRP  43           HB2      TRP  43  -2.580  15.404  15.404
  321    HD1  TRP  43           HD1      TRP  43  -1.070  13.661  13.661
  322    HE1  TRP  43           HE1      TRP  43   1.104  12.661  12.661
  323    HE3  TRP  43           HE3      TRP  43   0.030  16.383  16.383
  324    HZ2  TRP  43           HZ2      TRP  43   3.193  12.875  12.875
  325    HZ3  TRP  43           HZ3      TRP  43   2.115  15.985  15.985
  326    HH2  TRP  43           HH2      TRP  43   3.697  14.238  14.238
  327    H    ASN  44           HN       ASN  44  -2.170  16.519  16.519
  328    HA   ASN  44           HA       ASN  44   0.274  15.781  15.781
  329   1HB   ASN  44           HB1      ASN  44  -2.314  16.693  16.693
  330   2HB   ASN  44           HB2      ASN  44  -0.978  15.870  15.870
  331   1HD2  ASN  44          HD21      ASN  44  -3.638  13.601  13.601
  332   2HD2  ASN  44          HD22      ASN  44  -3.930  15.184  15.184
  333    H    ASN  45           HN       ASN  45  -0.952  18.821  18.821
  334    HA   ASN  45           HA       ASN  45   1.189  20.154  20.154
  335   1HB   ASN  45           HB1      ASN  45  -1.436  21.573  21.573
  336   2HB   ASN  45           HB2      ASN  45  -0.287  21.838  21.838
  337   1HD2  ASN  45          HD21      ASN  45  -3.410  19.384  19.384
  338   2HD2  ASN  45          HD22      ASN  45  -3.204  20.417  20.417
  339    H    THR  46           HN       THR  46   1.313  19.359  19.359
  340    HA   THR  46           HA       THR  46   0.759  21.741  21.741
  341    HB   THR  46           HB       THR  46   0.955  19.558  19.558
  342    HG1  THR  46           HG1      THR  46   3.168  20.697  20.697
  343   1HG2  THR  46          HG21      THR  46   3.956  19.584  19.584
  344   2HG2  THR  46          HG22      THR  46   3.106  18.451  18.451
  345   3HG2  THR  46          HG23      THR  46   2.817  18.448  18.448
  346    H    ALA  47           HN       ALA  47   3.552  20.410  20.410
  347    HA   ALA  47           HA       ALA  47   4.778  22.808  22.808
  348   1HB   ALA  47           HB1      ALA  47   5.256  23.175  23.175
  349   2HB   ALA  47           HB2      ALA  47   6.054  21.614  21.614
  350   3HB   ALA  47           HB3      ALA  47   6.731  22.923  22.923
  351    H    ALA  48           HN       ALA  48   5.457  19.770  19.770
  352    HA   ALA  48           HA       ALA  48   6.091  17.706  17.706
  353   1HB   ALA  48           HB1      ALA  48   6.258  18.740  18.740
  354   2HB   ALA  48           HB2      ALA  48   7.791  19.471  19.471
  355   3HB   ALA  48           HB3      ALA  48   7.631  17.724  17.724
  356    H    ASP  49           HN       ASP  49   7.744  20.596  20.596
  357    HA   ASP  49           HA       ASP  49  10.109  19.277  19.277
  358   1HB   ASP  49           HB1      ASP  49   9.427  22.238  22.238
  359   2HB   ASP  49           HB2      ASP  49  11.000  21.589  21.589
  360    H    ASP  50           HN       ASP  50   7.114  19.652  19.652
  361    HA   ASP  50           HA       ASP  50   7.591  20.369  20.369
  362   1HB   ASP  50           HB1      ASP  50   6.123  22.019  22.019
  363   2HB   ASP  50           HB2      ASP  50   5.099  20.727  20.727
  364    H    LYS  51           HN       LYS  51   6.813  18.072  18.072
  365    HA   LYS  51           HA       LYS  51   5.184  16.327  16.327
  366   1HB   LYS  51           HB1      LYS  51   6.653  15.740  15.740
  367   2HB   LYS  51           HB2      LYS  51   5.518  14.665  14.665
  368   1HG   LYS  51           HG1      LYS  51   3.699  16.321  16.321
  369   2HG   LYS  51           HG2      LYS  51   4.855  17.400  17.400
  370   1HD   LYS  51           HD1      LYS  51   5.374  15.651  15.651
  371   2HD   LYS  51           HD2      LYS  51   4.242  14.564  14.564
  372   1HE   LYS  51           HE1      LYS  51   3.240  15.582  15.582
  373   2HE   LYS  51           HE2      LYS  51   2.395  16.007  16.007
  374   1HZ   LYS  51           HZ1      LYS  51   4.309  17.969  17.969
  375   2HZ   LYS  51           HZ2      LYS  51   3.572  17.703  17.703
  376   3HZ   LYS  51           HZ3      LYS  51   2.626  18.115  18.115
  377    H    GLN  52           HN       GLN  52   8.399  16.295  16.295
  378    HA   GLN  52           HA       GLN  52   9.770  14.248  14.248
  379   1HB   GLN  52           HB1      GLN  52  10.442  16.959  16.959
  380   2HB   GLN  52           HB2      GLN  52  11.233  16.605  16.605
  381   1HG   GLN  52           HG1      GLN  52  12.773  16.094  16.094
  382   2HG   GLN  52           HG2      GLN  52  12.297  14.591  14.591
  383   1HE2  GLN  52          HE21      GLN  52  10.024  14.696  14.696
  384   2HE2  GLN  52          HE22      GLN  52   9.641  15.566  15.566
  385    HA   PRO  53           HA       PRO  53  10.431  15.326  15.326
  386   1HB   PRO  53           HB1      PRO  53   8.267  16.783  16.783
  387   2HB   PRO  53           HB2      PRO  53   9.841  17.443  17.443
  388   1HG   PRO  53           HG1      PRO  53   7.371  17.245  17.245
  389   2HG   PRO  53           HG2      PRO  53   8.333  18.693  18.693
  390   1HD   PRO  53           HD1      PRO  53   8.900  17.414  17.414
  391   2HD   PRO  53           HD2      PRO  53  10.282  17.747  17.747
  392    H    TYR  54           HN       TYR  54   7.151  15.146  15.146
  393    HA   TYR  54           HA       TYR  54   6.276  13.168  13.168
  394   1HB   TYR  54           HB1      TYR  54   4.958  14.182  14.182
  395   2HB   TYR  54           HB2      TYR  54   4.182  13.133  13.133
  396    HD1  TYR  54           HD1      TYR  54   4.538  14.164  14.164
  397    HD2  TYR  54           HD2      TYR  54   4.362  16.400  16.400
  398    HE1  TYR  54           HE1      TYR  54   3.852  16.150  16.150
  399    HE2  TYR  54           HE2      TYR  54   3.680  18.386  18.386
  400    HH   TYR  54           HH       TYR  54   4.060  18.789  18.789
  401    H    GLU  55           HN       GLU  55   6.722  13.290  13.290
  402    HA   GLU  55           HA       GLU  55   6.245  10.683  10.683
  403   1HB   GLU  55           HB1      GLU  55   7.436  13.011  13.011
  404   2HB   GLU  55           HB2      GLU  55   8.575  11.716  11.716
  405   1HG   GLU  55           HG1      GLU  55   6.718  10.333  10.333
  406   2HG   GLU  55           HG2      GLU  55   5.598  11.645  11.645
  407    H    LYS  56           HN       LYS  56   9.435  11.843  11.843
  408    HA   LYS  56           HA       LYS  56  10.939   9.578   9.578
  409   1HB   LYS  56           HB1      LYS  56  12.456  10.443  10.443
  410   2HB   LYS  56           HB2      LYS  56  11.572  11.875  11.875
  411   1HG   LYS  56           HG1      LYS  56  10.105  11.569  11.569
  412   2HG   LYS  56           HG2      LYS  56  11.124  10.219  10.219
  413   1HD   LYS  56           HD1      LYS  56  13.129  11.785  11.785
  414   2HD   LYS  56           HD2      LYS  56  12.000  13.111  13.111
  415   1HE   LYS  56           HE1      LYS  56  12.570  12.932  12.932
  416   2HE   LYS  56           HE2      LYS  56  10.889  12.462  12.462
  417   1HZ   LYS  56           HZ1      LYS  56  12.493  10.193  10.193
  418   2HZ   LYS  56           HZ2      LYS  56  12.985  10.975  10.975
  419   3HZ   LYS  56           HZ3      LYS  56  11.361  10.516  10.516
  420    H    LYS  57           HN       LYS  57   8.551  10.108  10.108
  421    HA   LYS  57           HA       LYS  57   9.226   7.636   7.636
  422   1HB   LYS  57           HB1      LYS  57   6.797   9.474   9.474
  423   2HB   LYS  57           HB2      LYS  57   6.816   7.950   7.950
  424   1HG   LYS  57           HG1      LYS  57   8.978   8.725   8.725
  425   2HG   LYS  57           HG2      LYS  57   8.691  10.309  10.309
  426   1HD   LYS  57           HD1      LYS  57   6.539  10.504  10.504
  427   2HD   LYS  57           HD2      LYS  57   6.625   8.845   8.845
  428   1HE   LYS  57           HE1      LYS  57   8.664   9.435   9.435
  429   2HE   LYS  57           HE2      LYS  57   8.476  11.114  11.114
  430   1HZ   LYS  57           HZ1      LYS  57   6.018  10.170  10.170
  431   2HZ   LYS  57           HZ2      LYS  57   7.228   9.781   9.781
  432   3HZ   LYS  57           HZ3      LYS  57   7.011  11.394  11.394
  433    H    ALA  58           HN       ALA  58   6.477   8.618   8.618
  434    HA   ALA  58           HA       ALA  58   5.108   6.256   6.256
  435   1HB   ALA  58           HB1      ALA  58   5.782   8.251   8.251
  436   2HB   ALA  58           HB2      ALA  58   4.470   7.085   7.085
  437   3HB   ALA  58           HB3      ALA  58   4.445   8.377   8.377
  438    H    ALA  59           HN       ALA  59   7.875   7.254   7.254
  439    HA   ALA  59           HA       ALA  59   8.166   5.002   5.002
  440   1HB   ALA  59           HB1      ALA  59   9.398   7.140   7.140
  441   2HB   ALA  59           HB2      ALA  59  10.328   6.841   6.841
  442   3HB   ALA  59           HB3      ALA  59  10.533   5.801   5.801
  443    H    LYS  60           HN       LYS  60   9.986   5.738   5.738
  444    HA   LYS  60           HA       LYS  60  11.445   3.469   3.469
  445   1HB   LYS  60           HB1      LYS  60  11.017   5.740   5.740
  446   2HB   LYS  60           HB2      LYS  60  10.010   4.699   4.699
  447   1HG   LYS  60           HG1      LYS  60  12.227   4.792   4.792
  448   2HG   LYS  60           HG2      LYS  60  11.993   3.180   3.180
  449   1HD   LYS  60           HD1      LYS  60  13.501   3.518   3.518
  450   2HD   LYS  60           HD2      LYS  60  13.254   5.251   5.251
  451   1HE   LYS  60           HE1      LYS  60  15.505   4.685   4.685
  452   2HE   LYS  60           HE2      LYS  60  14.560   5.500   5.500
  453   1HZ   LYS  60           HZ1      LYS  60  14.114   2.743   2.743
  454   2HZ   LYS  60           HZ2      LYS  60  15.790   3.013   3.013
  455   3HZ   LYS  60           HZ3      LYS  60  14.865   3.792   3.792
  456    H    LEU  61           HN       LEU  61   8.091   4.005   4.005
  457    HA   LEU  61           HA       LEU  61   7.792   1.333   1.333
  458   1HB   LEU  61           HB1      LEU  61   5.644   3.206   3.206
  459   2HB   LEU  61           HB2      LEU  61   5.396   1.878   1.878
  460    HG   LEU  61           HG       LEU  61   6.916   4.473   4.473
  461   1HD1  LEU  61          HD11      LEU  61   4.654   3.115   3.115
  462   2HD1  LEU  61          HD12      LEU  61   5.394   4.643   4.643
  463   3HD1  LEU  61          HD13      LEU  61   4.543   4.515   4.515
  464   1HD2  LEU  61          HD21      LEU  61   7.044   2.014   2.014
  465   2HD2  LEU  61          HD22      LEU  61   8.395   2.708   2.708
  466   3HD2  LEU  61          HD23      LEU  61   7.654   3.615   3.615
  467    H    LYS  62           HN       LYS  62   6.435   2.636   2.636
  468    HA   LYS  62           HA       LYS  62   5.448   0.359   0.359
  469   1HB   LYS  62           HB1      LYS  62   5.419   2.528   2.528
  470   2HB   LYS  62           HB2      LYS  62   7.164   2.560   2.560
  471   1HG   LYS  62           HG1      LYS  62   7.213   0.817   0.817
  472   2HG   LYS  62           HG2      LYS  62   5.518   0.414   0.414
  473   1HD   LYS  62           HD1      LYS  62   4.792   2.542   2.542
  474   2HD   LYS  62           HD2      LYS  62   6.428   3.175   3.175
  475   1HE   LYS  62           HE1      LYS  62   5.527   0.781   0.781
  476   2HE   LYS  62           HE2      LYS  62   5.531   2.436   2.436
  477   1HZ   LYS  62           HZ1      LYS  62   8.027   1.929   1.929
  478   2HZ   LYS  62           HZ2      LYS  62   7.655   0.628   0.628
  479   3HZ   LYS  62           HZ3      LYS  62   7.637   2.215   2.215
  480    H    GLU  63           HN       GLU  63   8.811   1.280   1.280
  481    HA   GLU  63           HA       GLU  63   9.895  -0.926  -0.926
  482   1HB   GLU  63           HB1      GLU  63  10.870   1.501   1.501
  483   2HB   GLU  63           HB2      GLU  63  11.495   0.545   0.545
  484   1HG   GLU  63           HG1      GLU  63  12.052   0.127   0.127
  485   2HG   GLU  63           HG2      GLU  63  13.146   0.824   0.824
  486    H    LYS  64           HN       LYS  64   9.772  -0.293  -0.293
  487    HA   LYS  64           HA       LYS  64  10.804  -2.718  -2.718
  488   1HB   LYS  64           HB1      LYS  64  10.277  -0.697  -0.697
  489   2HB   LYS  64           HB2      LYS  64   8.564  -1.034  -1.034
  490   1HG   LYS  64           HG1      LYS  64   8.769  -3.088  -3.088
  491   2HG   LYS  64           HG2      LYS  64  10.527  -3.020  -3.020
  492   1HD   LYS  64           HD1      LYS  64  10.525  -0.940  -0.940
  493   2HD   LYS  64           HD2      LYS  64   8.772  -0.904  -0.904
  494   1HE   LYS  64           HE1      LYS  64  10.453  -3.148  -3.148
  495   2HE   LYS  64           HE2      LYS  64   9.729  -1.841  -1.841
  496   1HZ   LYS  64           HZ1      LYS  64   7.758  -2.970  -2.970
  497   2HZ   LYS  64           HZ2      LYS  64   8.558  -4.231  -4.231
  498   3HZ   LYS  64           HZ3      LYS  64   7.857  -2.954  -2.954
  499    H    TYR  65           HN       TYR  65   7.484  -1.912  -1.912
  500    HA   TYR  65           HA       TYR  65   6.095  -4.215  -4.215
  501   1HB   TYR  65           HB1      TYR  65   4.779  -2.431  -2.431
  502   2HB   TYR  65           HB2      TYR  65   5.855  -2.089  -2.089
  503    HD1  TYR  65           HD1      TYR  65   4.318  -5.423  -5.423
  504    HD2  TYR  65           HD2      TYR  65   4.220  -1.918  -1.918
  505    HE1  TYR  65           HE1      TYR  65   2.779  -6.525  -6.525
  506    HE2  TYR  65           HE2      TYR  65   2.681  -3.030  -3.030
  507    HH   TYR  65           HH       TYR  65   0.880  -5.439  -5.439
  508    H    GLU  66           HN       GLU  66   7.263  -3.534  -3.534
  509    HA   GLU  66           HA       GLU  66   6.918  -5.935  -5.935
  510   1HB   GLU  66           HB1      GLU  66   9.340  -4.162  -4.162
  511   2HB   GLU  66           HB2      GLU  66   8.891  -5.362  -5.362
  512   1HG   GLU  66           HG1      GLU  66   6.734  -3.379  -3.379
  513   2HG   GLU  66           HG2      GLU  66   8.098  -2.706  -2.706
  514    H    LYS  67           HN       LYS  67   9.476  -5.243  -5.243
  515    HA   LYS  67           HA       LYS  67  10.860  -7.764  -7.764
  516   1HB   LYS  67           HB1      LYS  67  11.372  -5.354  -5.354
  517   2HB   LYS  67           HB2      LYS  67  12.173  -6.831  -6.831
  518   1HG   LYS  67           HG1      LYS  67  13.609  -5.535  -5.535
  519   2HG   LYS  67           HG2      LYS  67  13.173  -7.057  -7.057
  520   1HD   LYS  67           HD1      LYS  67  11.520  -5.896  -5.896
  521   2HD   LYS  67           HD2      LYS  67  11.868  -4.363  -4.363
  522   1HE   LYS  67           HE1      LYS  67  14.207  -4.488  -4.488
  523   2HE   LYS  67           HE2      LYS  67  13.905  -6.064  -6.064
  524   1HZ   LYS  67           HZ1      LYS  67  11.981  -4.193  -4.193
  525   2HZ   LYS  67           HZ2      LYS  67  13.545  -3.584  -3.584
  526   3HZ   LYS  67           HZ3      LYS  67  13.104  -5.092  -5.092
  527    H    ASP  68           HN       ASP  68   8.849  -6.535  -6.535
  528    HA   ASP  68           HA       ASP  68   9.154  -8.748  -8.748
  529   1HB   ASP  68           HB1      ASP  68   7.339  -6.340  -6.340
  530   2HB   ASP  68           HB2      ASP  68   7.208  -7.572  -7.572
  531    H    ILE  69           HN       ILE  69   7.258  -7.910  -7.910
  532    HA   ILE  69           HA       ILE  69   5.127  -9.796  -9.796
  533    HB   ILE  69           HB       ILE  69   4.518  -7.713  -7.713
  534   1HG1  ILE  69          HG11      ILE  69   3.183  -8.617  -8.617
  535   2HG1  ILE  69          HG12      ILE  69   4.259  -9.991  -9.991
  536   1HG2  ILE  69          HG21      ILE  69   6.628  -7.535  -7.535
  537   2HG2  ILE  69          HG22      ILE  69   6.151  -8.868  -8.868
  538   3HG2  ILE  69          HG23      ILE  69   5.215  -7.376  -7.376
  539   1HD1  ILE  69          HD11      ILE  69   2.674  -9.477  -9.477
  540   2HD1  ILE  69          HD12      ILE  69   2.223 -10.630 -10.630
  541   3HD1  ILE  69          HD13      ILE  69   3.690 -10.867 -10.867
  542    H    ALA  70           HN       ALA  70   7.740  -9.406  -9.406
  543    HA   ALA  70           HA       ALA  70   7.592 -11.832 -11.832
  544   1HB   ALA  70           HB1      ALA  70   9.245  -9.990  -9.990
  545   2HB   ALA  70           HB2      ALA  70  10.125 -10.377 -10.377
  546   3HB   ALA  70           HB3      ALA  70  10.057 -11.541 -11.541
  547    H    ALA  71           HN       ALA  71   8.729 -11.034 -11.034
  548    HA   ALA  71           HA       ALA  71   9.763 -13.696 -13.696
  549   1HB   ALA  71           HB1      ALA  71  10.819 -11.679 -11.679
  550   2HB   ALA  71           HB2      ALA  71   9.307 -11.275 -11.275
  551   3HB   ALA  71           HB3      ALA  71  10.187 -12.729 -12.729
  552    H    TYR  72           HN       TYR  72   6.973 -11.694 -11.694
  553    HA   TYR  72           HA       TYR  72   5.623 -13.236 -13.236
  554   1HB   TYR  72           HB1      TYR  72   5.014 -10.985 -10.985
  555   2HB   TYR  72           HB2      TYR  72   4.382 -11.748 -11.748
  556    HD1  TYR  72           HD1      TYR  72   4.013 -11.885 -11.885
  557    HD2  TYR  72           HD2      TYR  72   2.137 -12.329 -12.329
  558    HE1  TYR  72           HE1      TYR  72   1.852 -12.190 -12.190
  559    HE2  TYR  72           HE2      TYR  72  -0.028 -12.637 -12.637
  560    HH   TYR  72           HH       TYR  72  -0.576 -13.546 -13.546
  561    H    ARG  73           HN       ARG  73   5.652 -13.508 -13.508
  562    HA   ARG  73           HA       ARG  73   3.854 -15.790 -15.790
  563   1HB   ARG  73           HB1      ARG  73   5.367 -14.243 -14.243
  564   2HB   ARG  73           HB2      ARG  73   4.498 -15.688 -15.688
  565   1HG   ARG  73           HG1      ARG  73   3.269 -13.211 -13.211
  566   2HG   ARG  73           HG2      ARG  73   3.217 -13.558 -13.558
  567   1HD   ARG  73           HD1      ARG  73   1.899 -15.200 -15.200
  568   2HD   ARG  73           HD2      ARG  73   1.096 -14.295 -14.295
  569    HE   ARG  73           HE       ARG  73   2.769 -16.733 -16.733
  570   1HH1  ARG  73          HH11      ARG  73   2.544 -15.615 -15.615
  571   2HH1  ARG  73          HH12      ARG  73   0.988 -16.072 -16.072
  572   1HH2  ARG  73          HH21      ARG  73  -0.244 -16.875 -16.875
  573   2HH2  ARG  73          HH22      ARG  73  -0.630 -16.805 -16.805
  574    H    ALA  74           HN       ALA  74   7.149 -15.141 -15.141
  575    HA   ALA  74           HA       ALA  74   7.959 -17.733 -17.733
  576   1HB   ALA  74           HB1      ALA  74   9.514 -15.723 -15.723
  577   2HB   ALA  74           HB2      ALA  74  10.217 -17.110 -17.110
  578   3HB   ALA  74           HB3      ALA  74   9.476 -15.831 -15.831
  579    H    LYS  75           HN       LYS  75   7.339 -16.489 -16.489
  580    HA   LYS  75           HA       LYS  75   7.497 -19.264 -19.264
  581   1HB   LYS  75           HB1      LYS  75   9.668 -17.648 -17.648
  582   2HB   LYS  75           HB2      LYS  75   8.745 -17.162 -17.162
  583   1HG   LYS  75           HG1      LYS  75  10.141 -18.961 -18.961
  584   2HG   LYS  75           HG2      LYS  75   8.530 -19.647 -19.647
  585   1HD   LYS  75           HD1      LYS  75   9.108 -20.552 -20.552
  586   2HD   LYS  75           HD2      LYS  75  10.700 -19.836 -19.836
  587   1HE   LYS  75           HE1      LYS  75  11.145 -21.267 -21.267
  588   2HE   LYS  75           HE2      LYS  75   9.557 -22.001 -22.001
  589   1HZ   LYS  75           HZ1      LYS  75  10.845 -22.093 -22.093
  590   2HZ   LYS  75           HZ2      LYS  75  11.940 -22.653 -22.653
  591   3HZ   LYS  75           HZ3      LYS  75  10.414 -23.383 -23.383
  592    H    GLY  76           HN       GLY  76   6.482 -16.049 -16.049
  593   1HA   GLY  76           HA1      GLY  76   5.290 -15.408 -15.408
  594   2HA   GLY  76           HA2      GLY  76   4.205 -15.509 -15.509
  595    H    LYS  77           HN       LYS  77   3.809 -18.164 -18.164
  596    HA   LYS  77           HA       LYS  77   1.610 -18.911 -18.911
  597   1HB   LYS  77           HB1      LYS  77   3.765 -21.025 -21.025
  598   2HB   LYS  77           HB2      LYS  77   2.101 -21.169 -21.169
  599   1HG   LYS  77           HG1      LYS  77   2.670 -19.732 -19.732
  600   2HG   LYS  77           HG2      LYS  77   4.351 -19.894 -19.894
  601   1HD   LYS  77           HD1      LYS  77   2.467 -22.126 -22.126
  602   2HD   LYS  77           HD2      LYS  77   3.929 -21.601 -21.601
  603   1HE   LYS  77           HE1      LYS  77   4.583 -23.607 -23.607
  604   2HE   LYS  77           HE2      LYS  77   5.189 -22.355 -22.355
  605   1HZ   LYS  77           HZ1      LYS  77   2.539 -22.959 -22.959
  606   2HZ   LYS  77           HZ2      LYS  77   3.419 -24.401 -24.401
  607   3HZ   LYS  77           HZ3      LYS  77   3.958 -23.157 -23.157
  608    HA   PRO  78           HA       PRO  78   2.171 -19.438 -19.438
  609   1HB   PRO  78           HB1      PRO  78   0.777 -21.720 -21.720
  610   2HB   PRO  78           HB2      PRO  78  -0.049 -20.256 -20.256
  611   1HG   PRO  78           HG1      PRO  78   0.840 -22.620 -22.620
  612   2HG   PRO  78           HG2      PRO  78  -0.788 -21.949 -21.949
  613   1HD   PRO  78           HD1      PRO  78   0.741 -21.103 -21.103
  614   2HD   PRO  78           HD2      PRO  78  -0.156 -19.875 -19.875
  615    H    ASP  79           HN       ASP  79   4.031 -20.922 -20.922
  616    HA   ASP  79           HA       ASP  79   5.511 -22.519 -22.519
  617   1HB   ASP  79           HB1      ASP  79   4.297 -23.790 -23.790
  618   2HB   ASP  79           HB2      ASP  79   5.478 -23.047 -23.047
  619    H    ALA  80           HN       ALA  80   5.785 -19.856 -19.856
  620    HA   ALA  80           HA       ALA  80   8.023 -19.157 -19.157
  621   1HB   ALA  80           HB1      ALA  80   6.480 -17.539 -17.539
  622   2HB   ALA  80           HB2      ALA  80   7.669 -16.878 -16.878
  623   3HB   ALA  80           HB3      ALA  80   6.164 -17.549 -17.549
  624    H    ALA  81           HN       ALA  81   9.314 -20.759 -20.759
  625    HA   ALA  81           HA       ALA  81  10.640 -21.732 -21.732
  626   1HB   ALA  81           HB1      ALA  81  11.967 -20.731 -20.731
  627   2HB   ALA  81           HB2      ALA  81  11.947 -19.171 -19.171
  628   3HB   ALA  81           HB3      ALA  81  12.817 -20.522 -20.522
  629   1H1   BME  16           HE1      MER  16  -6.489  10.387  10.387
  630   2H1   BME  16           HE2      MER  16  -6.131   8.738   8.738
  631   1H2   BME  16           HZ1      MER  16  -7.297   9.270   9.270
  632   2H2   BME  16           HZ2      MER  16  -7.513  10.919  10.919
  633    HO1  BME  16           HH       MER  16  -8.113   8.271   8.271

  Start of MODEL   15
    1    H    ASN   3           HN       ASN   3  -3.956 -11.453 -11.453
    2    HA   ASN   3           HA       ASN   3  -1.044 -11.881 -11.881
    3   1HB   ASN   3           HB1      ASN   3  -3.199 -13.427 -13.427
    4   2HB   ASN   3           HB2      ASN   3  -1.492 -13.712 -13.712
    5   1HD2  ASN   3          HD21      ASN   3  -3.175 -15.439 -15.439
    6   2HD2  ASN   3          HD22      ASN   3  -4.073 -14.712 -14.712
    7    H    ALA   4           HN       ALA   4   0.222 -11.762 -11.762
    8    HA   ALA   4           HA       ALA   4   0.995 -10.947 -10.947
    9   1HB   ALA   4           HB1      ALA   4  -1.190 -11.359 -11.359
   10   2HB   ALA   4           HB2      ALA   4  -1.787  -9.800  -9.800
   11   3HB   ALA   4           HB3      ALA   4  -0.444  -9.866  -9.866
   12    HA   PRO   5           HA       PRO   5   1.737  -6.814  -6.814
   13   1HB   PRO   5           HB1      PRO   5   3.934  -6.198  -6.198
   14   2HB   PRO   5           HB2      PRO   5   4.018  -7.325  -7.325
   15   1HG   PRO   5           HG1      PRO   5   3.547  -8.024  -8.024
   16   2HG   PRO   5           HG2      PRO   5   4.842  -8.641  -8.641
   17   1HD   PRO   5           HD1      PRO   5   2.593 -10.074 -10.074
   18   2HD   PRO   5           HD2      PRO   5   3.201  -9.927  -9.927
   19    H    LYS   6           HN       LYS   6  -0.052  -5.835  -5.835
   20    HA   LYS   6           HA       LYS   6  -0.910  -5.477  -5.477
   21   1HB   LYS   6           HB1      LYS   6  -2.561  -3.963  -3.963
   22   2HB   LYS   6           HB2      LYS   6  -2.321  -5.236  -5.236
   23   1HG   LYS   6           HG1      LYS   6  -1.074  -2.449  -2.449
   24   2HG   LYS   6           HG2      LYS   6  -2.464  -3.011  -3.011
   25   1HD   LYS   6           HD1      LYS   6  -1.014  -4.776  -4.776
   26   2HD   LYS   6           HD2      LYS   6   0.380  -4.096  -4.096
   27   1HE   LYS   6           HE1      LYS   6   0.262  -3.198  -3.198
   28   2HE   LYS   6           HE2      LYS   6   0.000  -1.910  -1.910
   29   1HZ   LYS   6           HZ1      LYS   6  -2.469  -3.077  -3.077
   30   2HZ   LYS   6           HZ2      LYS   6  -1.663  -2.735  -2.735
   31   3HZ   LYS   6           HZ3      LYS   6  -1.932  -1.497  -1.497
   32    H    ARG   7           HN       ARG   7  -1.380  -2.886  -2.886
   33    HA   ARG   7           HA       ARG   7   1.383  -1.887  -1.887
   34   1HB   ARG   7           HB1      ARG   7   0.728  -1.342  -1.342
   35   2HB   ARG   7           HB2      ARG   7  -0.714  -2.268  -2.268
   36   1HG   ARG   7           HG1      ARG   7  -1.784  -0.067  -0.067
   37   2HG   ARG   7           HG2      ARG   7  -0.371   0.745   0.745
   38   1HD   ARG   7           HD1      ARG   7  -2.204   0.809   0.809
   39   2HD   ARG   7           HD2      ARG   7  -0.934  -0.233  -0.233
   40    HE   ARG   7           HE       ARG   7  -2.272  -2.189  -2.189
   41   1HH1  ARG   7          HH11      ARG   7  -4.211  -2.348  -2.348
   42   2HH1  ARG   7          HH12      ARG   7  -5.634  -1.580  -1.580
   43   1HH2  ARG   7          HH21      ARG   7  -3.844   0.238   0.238
   44   2HH2  ARG   7          HH22      ARG   7  -5.420  -0.076  -0.076
   45    HA   PRO   8           HA       PRO   8   0.459   1.249   1.249
   46   1HB   PRO   8           HB1      PRO   8   2.707   2.781   2.781
   47   2HB   PRO   8           HB2      PRO   8   2.797   1.117   1.117
   48   1HG   PRO   8           HG1      PRO   8   3.144   2.139   2.139
   49   2HG   PRO   8           HG2      PRO   8   4.279   1.168   1.168
   50   1HD   PRO   8           HD1      PRO   8   2.543  -0.042  -0.042
   51   2HD   PRO   8           HD2      PRO   8   2.915  -0.794  -0.794
   52    HA   PRO   9           HA       PRO   9  -1.033   5.371   5.371
   53   1HB   PRO   9           HB1      PRO   9   1.412   6.822   6.822
   54   2HB   PRO   9           HB2      PRO   9  -0.084   6.753   6.753
   55   1HG   PRO   9           HG1      PRO   9   2.376   4.990   4.990
   56   2HG   PRO   9           HG2      PRO   9   1.358   5.657   5.657
   57   1HD   PRO   9           HD1      PRO   9   0.978   3.115   3.115
   58   2HD   PRO   9           HD2      PRO   9  -0.470   4.140   4.140
   59    H    SER  10           HN       SER  10  -0.136   7.409   7.409
   60    HA   SER  10           HA       SER  10   0.884   6.465   6.465
   61   1HB   SER  10           HB1      SER  10  -1.003   8.769   8.769
   62   2HB   SER  10           HB2      SER  10  -0.474   8.297   8.297
   63    HG   SER  10           HG       SER  10  -1.887   6.775   6.775
   64    H    ALA  11           HN       ALA  11   0.802   9.330   9.330
   65    HA   ALA  11           HA       ALA  11   3.280  10.230  10.230
   66   1HB   ALA  11           HB1      ALA  11   2.482  11.152  11.152
   67   2HB   ALA  11           HB2      ALA  11   3.855  11.751  11.751
   68   3HB   ALA  11           HB3      ALA  11   3.860  10.104  10.104
   69    H    PHE  12           HN       PHE  12   0.548  10.972  10.972
   70    HA   PHE  12           HA       PHE  12  -0.226  13.554  13.554
   71   1HB   PHE  12           HB1      PHE  12  -1.140  12.763  12.763
   72   2HB   PHE  12           HB2      PHE  12  -1.406  11.133  11.133
   73    HD1  PHE  12           HD1      PHE  12  -3.044  13.601  13.601
   74    HD2  PHE  12           HD2      PHE  12  -3.343  11.421  11.421
   75    HE1  PHE  12           HE1      PHE  12  -5.467  13.903  13.903
   76    HE2  PHE  12           HE2      PHE  12  -5.770  11.742  11.742
   77    HZ   PHE  12           HZ       PHE  12  -6.846  12.980  12.980
   78    H    PHE  13           HN       PHE  13  -1.040  10.280  10.280
   79    HA   PHE  13           HA       PHE  13  -2.937  10.635  10.635
   80   1HB   PHE  13           HB1      PHE  13  -1.488   8.512   8.512
   81   2HB   PHE  13           HB2      PHE  13  -0.660   8.843   8.843
   82    HD1  PHE  13           HD1      PHE  13  -2.313   9.330   9.330
   83    HD2  PHE  13           HD2      PHE  13  -3.443   7.252   7.252
   84    HE1  PHE  13           HE1      PHE  13  -4.238   8.358   8.358
   85    HE2  PHE  13           HE2      PHE  13  -5.362   6.282   6.282
   86    HZ   PHE  13           HZ       PHE  13  -5.765   6.832   6.832
   87    H    LEU  14           HN       LEU  14   0.550  11.048  11.048
   88    HA   LEU  14           HA       LEU  14   0.344  11.655  11.655
   89   1HB   LEU  14           HB1      LEU  14   2.343  12.830  12.830
   90   2HB   LEU  14           HB2      LEU  14   2.546  12.817  12.817
   91    HG   LEU  14           HG       LEU  14   3.983  11.150  11.150
   92   1HD1  LEU  14          HD11      LEU  14   2.639  10.122  10.122
   93   2HD1  LEU  14          HD12      LEU  14   1.501   9.504   9.504
   94   3HD1  LEU  14          HD13      LEU  14   3.162   8.934   8.934
   95   1HD2  LEU  14          HD21      LEU  14   3.551  11.040  11.040
   96   2HD2  LEU  14          HD22      LEU  14   3.671   9.430   9.430
   97   3HD2  LEU  14          HD23      LEU  14   2.096  10.079  10.079
   98    H    PHE  15           HN       PHE  15   0.726  13.952  13.952
   99    HA   PHE  15           HA       PHE  15   0.193  16.324  16.324
  100   1HB   PHE  15           HB1      PHE  15   1.030  16.940  16.940
  101   2HB   PHE  15           HB2      PHE  15   0.583  15.368  15.368
  102    HD1  PHE  15           HD1      PHE  15  -1.671  15.103  15.103
  103    HD2  PHE  15           HD2      PHE  15  -0.100  18.922  18.922
  104    HE1  PHE  15           HE1      PHE  15  -3.235  16.166  16.166
  105    HE2  PHE  15           HE2      PHE  15  -1.682  19.983  19.983
  106    HZ   PHE  15           HZ       PHE  15  -3.248  18.599  18.599
  107    H    CYS  16           HN       MER  16  -2.090  14.324  14.324
  108    HA   CYS  16           HA       MER  16  -4.468  15.705  15.705
  109   1HB   CYS  16           HB1      MER  16  -4.897  13.849  13.849
  110   2HB   CYS  16           HB2      MER  16  -3.727  12.855  12.855
  111    H    SER  17           HN       SER  17  -3.251  13.181  13.181
  112    HA   SER  17           HA       SER  17  -5.108  13.291  13.291
  113   1HB   SER  17           HB1      SER  17  -2.082  12.952  12.952
  114   2HB   SER  17           HB2      SER  17  -3.296  12.564  12.564
  115    HG   SER  17           HG       SER  17  -2.609  11.206  11.206
  116    H    GLU  18           HN       GLU  18  -2.150  15.084  15.084
  117    HA   GLU  18           HA       GLU  18  -2.167  16.601  16.601
  118   1HB   GLU  18           HB1      GLU  18  -0.477  16.551  16.551
  119   2HB   GLU  18           HB2      GLU  18  -1.497  17.625  17.625
  120   1HG   GLU  18           HG1      GLU  18  -1.284  19.425  19.425
  121   2HG   GLU  18           HG2      GLU  18  -0.550  18.385  18.385
  122    H    TYR  19           HN       TYR  19  -4.031  17.481  17.481
  123    HA   TYR  19           HA       TYR  19  -5.649  19.252  19.252
  124   1HB   TYR  19           HB1      TYR  19  -5.552  21.068  21.068
  125   2HB   TYR  19           HB2      TYR  19  -3.877  20.487  20.487
  126    HD1  TYR  19           HD1      TYR  19  -3.285  18.541  18.541
  127    HD2  TYR  19           HD2      TYR  19  -6.272  21.529  21.529
  128    HE1  TYR  19           HE1      TYR  19  -3.212  18.269  18.269
  129    HE2  TYR  19           HE2      TYR  19  -6.201  21.271  21.271
  130    HH   TYR  19           HH       TYR  19  -4.201  20.370  20.370
  131    H    ARG  20           HN       ARG  20  -6.382  16.652  16.652
  132    HA   ARG  20           HA       ARG  20  -8.283  16.988  16.988
  133   1HB   ARG  20           HB1      ARG  20  -7.263  14.767  14.767
  134   2HB   ARG  20           HB2      ARG  20  -8.036  14.722  14.722
  135   1HG   ARG  20           HG1      ARG  20 -10.286  14.952  14.952
  136   2HG   ARG  20           HG2      ARG  20  -9.291  14.597  14.597
  137   1HD   ARG  20           HD1      ARG  20  -8.533  12.476  12.476
  138   2HD   ARG  20           HD2      ARG  20  -9.497  12.827  12.827
  139    HE   ARG  20           HE       ARG  20 -11.514  12.785  12.785
  140   1HH1  ARG  20          HH11      ARG  20 -10.174  12.403  12.403
  141   2HH1  ARG  20          HH12      ARG  20 -10.183  10.684  10.684
  142   1HH2  ARG  20          HH21      ARG  20 -10.846  10.076  10.076
  143   2HH2  ARG  20          HH22      ARG  20 -10.577   9.326   9.326
  144    HA   PRO  21           HA       PRO  21 -11.505  16.865  16.865
  145   1HB   PRO  21           HB1      PRO  21 -10.607  17.694  17.694
  146   2HB   PRO  21           HB2      PRO  21 -10.697  16.003  16.003
  147   1HG   PRO  21           HG1      PRO  21  -8.291  17.886  17.886
  148   2HG   PRO  21           HG2      PRO  21  -8.349  16.305  16.305
  149   1HD   PRO  21           HD1      PRO  21  -7.476  16.367  16.367
  150   2HD   PRO  21           HD2      PRO  21  -8.730  15.157  15.157
  151    H    LYS  22           HN       LYS  22  -8.953  19.176  19.176
  152    HA   LYS  22           HA       LYS  22 -10.454  21.494  21.494
  153   1HB   LYS  22           HB1      LYS  22  -7.930  21.274  21.274
  154   2HB   LYS  22           HB2      LYS  22  -7.951  21.413  21.413
  155   1HG   LYS  22           HG1      LYS  22  -8.995  23.633  23.633
  156   2HG   LYS  22           HG2      LYS  22  -9.210  23.467  23.467
  157   1HD   LYS  22           HD1      LYS  22  -6.696  23.358  23.358
  158   2HD   LYS  22           HD2      LYS  22  -6.565  23.681  23.681
  159   1HE   LYS  22           HE1      LYS  22  -7.779  25.820  25.820
  160   2HE   LYS  22           HE2      LYS  22  -7.999  25.488  25.488
  161   1HZ   LYS  22           HZ1      LYS  22  -5.285  25.230  25.230
  162   2HZ   LYS  22           HZ2      LYS  22  -5.837  26.701  26.701
  163   3HZ   LYS  22           HZ3      LYS  22  -6.051  26.366  26.366
  164    H    ILE  23           HN       ILE  23 -10.003  19.978  19.978
  165    HA   ILE  23           HA       ILE  23 -11.297  22.333  22.333
  166    HB   ILE  23           HB       ILE  23 -11.060  20.908  20.908
  167   1HG1  ILE  23          HG11      ILE  23  -9.143  19.205  19.205
  168   2HG1  ILE  23          HG12      ILE  23 -10.769  18.652  18.652
  169   1HG2  ILE  23          HG21      ILE  23  -9.508  22.735  22.735
  170   2HG2  ILE  23          HG22      ILE  23  -8.559  21.627  21.627
  171   3HG2  ILE  23          HG23      ILE  23  -8.614  21.440  21.440
  172   1HD1  ILE  23          HD11      ILE  23 -10.286  18.888  18.888
  173   2HD1  ILE  23          HD12      ILE  23  -8.637  19.365  19.365
  174   3HD1  ILE  23          HD13      ILE  23  -9.206  17.753  17.753
  175    H    LYS  24           HN       LYS  24 -11.805  19.077  19.077
  176    HA   LYS  24           HA       LYS  24 -14.337  18.574  18.574
  177   1HB   LYS  24           HB1      LYS  24 -12.555  17.020  17.020
  178   2HB   LYS  24           HB2      LYS  24 -12.914  17.499  17.499
  179   1HG   LYS  24           HG1      LYS  24 -15.236  16.460  16.460
  180   2HG   LYS  24           HG2      LYS  24 -14.069  15.280  15.280
  181   1HD   LYS  24           HD1      LYS  24 -15.466  17.204  17.204
  182   2HD   LYS  24           HD2      LYS  24 -16.081  15.612  15.612
  183   1HE   LYS  24           HE1      LYS  24 -13.864  14.647  14.647
  184   2HE   LYS  24           HE2      LYS  24 -13.406  16.266  16.266
  185   1HZ   LYS  24           HZ1      LYS  24 -15.933  15.771  15.771
  186   2HZ   LYS  24           HZ2      LYS  24 -14.967  14.417  14.417
  187   3HZ   LYS  24           HZ3      LYS  24 -14.469  15.962  15.962
  188    H    GLY  25           HN       GLY  25 -13.254  20.331  20.331
  189   1HA   GLY  25           HA1      GLY  25 -15.807  20.401  20.401
  190   2HA   GLY  25           HA2      GLY  25 -14.318  21.255  21.255
  191    H    GLU  26           HN       GLU  26 -13.782  22.575  22.575
  192    HA   GLU  26           HA       GLU  26 -15.455  24.874  24.874
  193   1HB   GLU  26           HB1      GLU  26 -13.354  24.049  24.049
  194   2HB   GLU  26           HB2      GLU  26 -14.079  25.642  25.642
  195   1HG   GLU  26           HG1      GLU  26 -12.664  24.373  24.373
  196   2HG   GLU  26           HG2      GLU  26 -11.865  25.453  25.453
  197    H    HIS  27           HN       HIS  27 -15.212  22.285  22.285
  198    HA   HIS  27           HA       HIS  27 -17.660  23.247  23.247
  199   1HB   HIS  27           HB1      HIS  27 -15.337  21.636  21.636
  200   2HB   HIS  27           HB2      HIS  27 -16.715  22.279  22.279
  201    HD1  HIS  27           HD1      HIS  27 -16.899  25.030  25.030
  202    HD2  HIS  27           HD2      HIS  27 -13.212  23.385  23.385
  203    HE1  HIS  27           HE1      HIS  27 -15.281  26.888  26.888
  204    HA   PRO  28           HA       PRO  28 -18.926  19.142  19.142
  205   1HB   PRO  28           HB1      PRO  28 -21.116  19.938  19.938
  206   2HB   PRO  28           HB2      PRO  28 -19.509  20.147  20.147
  207   1HG   PRO  28           HG1      PRO  28 -21.117  22.220  22.220
  208   2HG   PRO  28           HG2      PRO  28 -20.436  22.412  22.412
  209   1HD   PRO  28           HD1      PRO  28 -19.040  23.247  23.247
  210   2HD   PRO  28           HD2      PRO  28 -18.171  22.543  22.543
  211    H    GLY  29           HN       GLY  29 -18.960  20.125  20.125
  212   1HA   GLY  29           HA1      GLY  29 -21.650  19.588  19.588
  213   2HA   GLY  29           HA2      GLY  29 -20.587  20.821  20.821
  214    H    LEU  30           HN       LEU  30 -18.259  19.016  19.016
  215    HA   LEU  30           HA       LEU  30 -18.115  17.520  17.520
  216   1HB   LEU  30           HB1      LEU  30 -16.145  17.622  17.622
  217   2HB   LEU  30           HB2      LEU  30 -15.748  17.130  17.130
  218    HG   LEU  30           HG       LEU  30 -16.438  19.875  19.875
  219   1HD1  LEU  30          HD11      LEU  30 -13.919  18.738  18.738
  220   2HD1  LEU  30          HD12      LEU  30 -14.135  20.421  20.421
  221   3HD1  LEU  30          HD13      LEU  30 -14.135  19.177  19.177
  222   1HD2  LEU  30          HD21      LEU  30 -17.452  19.614  19.614
  223   2HD2  LEU  30          HD22      LEU  30 -16.117  20.747  20.747
  224   3HD2  LEU  30          HD23      LEU  30 -15.881  19.126  19.126
  225    H    SER  31           HN       SER  31 -17.470  15.338  15.338
  226    HA   SER  31           HA       SER  31 -18.511  13.633  13.633
  227   1HB   SER  31           HB1      SER  31 -18.329  12.931  12.931
  228   2HB   SER  31           HB2      SER  31 -19.160  12.015  12.015
  229    HG   SER  31           HG       SER  31 -20.804  13.255  13.255
  230    H    ILE  32           HN       ILE  32 -17.365  11.381  11.381
  231    HA   ILE  32           HA       ILE  32 -14.585  11.826  11.826
  232    HB   ILE  32           HB       ILE  32 -15.995   9.961   9.961
  233   1HG1  ILE  32          HG11      ILE  32 -14.395   8.066   8.066
  234   2HG1  ILE  32          HG12      ILE  32 -13.670   8.798   8.798
  235   1HG2  ILE  32          HG21      ILE  32 -15.967   8.874   8.874
  236   2HG2  ILE  32          HG22      ILE  32 -16.566   7.987   7.987
  237   3HG2  ILE  32          HG23      ILE  32 -17.367   9.460   9.460
  238   1HD1  ILE  32          HD11      ILE  32 -13.601   9.950   9.950
  239   2HD1  ILE  32          HD12      ILE  32 -12.264   9.176   9.176
  240   3HD1  ILE  32          HD13      ILE  32 -12.878  10.714  10.714
  241    H    GLY  33           HN       GLY  33 -16.200  11.791  11.791
  242   1HA   GLY  33           HA1      GLY  33 -13.868  10.914  10.914
  243   2HA   GLY  33           HA2      GLY  33 -15.524  11.017  11.017
  244    H    ASP  34           HN       ASP  34 -15.148  13.682  13.682
  245    HA   ASP  34           HA       ASP  34 -14.334  15.392  15.392
  246   1HB   ASP  34           HB1      ASP  34 -16.112  15.900  15.900
  247   2HB   ASP  34           HB2      ASP  34 -15.748  17.166  17.166
  248    H    VAL  35           HN       VAL  35 -14.334  14.964  14.964
  249    HA   VAL  35           HA       VAL  35 -12.368  16.925  16.925
  250    HB   VAL  35           HB       VAL  35 -13.084  14.240  14.240
  251   1HG1  VAL  35          HG11      VAL  35 -11.610  16.655  16.655
  252   2HG1  VAL  35          HG12      VAL  35 -12.081  15.213  15.213
  253   3HG1  VAL  35          HG13      VAL  35 -10.867  15.112  15.112
  254   1HG2  VAL  35          HG21      VAL  35 -14.059  17.050  17.050
  255   2HG2  VAL  35          HG22      VAL  35 -15.019  15.763  15.763
  256   3HG2  VAL  35          HG23      VAL  35 -14.433  15.605  15.605
  257    H    ALA  36           HN       ALA  36 -12.340  13.764  13.764
  258    HA   ALA  36           HA       ALA  36  -9.479  13.381  13.381
  259   1HB   ALA  36           HB1      ALA  36 -11.674  11.819  11.819
  260   2HB   ALA  36           HB2      ALA  36 -10.035  11.200  11.200
  261   3HB   ALA  36           HB3      ALA  36 -11.046  11.523  11.523
  262    H    LYS  37           HN       LYS  37 -11.803  13.817  13.817
  263    HA   LYS  37           HA       LYS  37  -9.633  13.880  13.880
  264   1HB   LYS  37           HB1      LYS  37 -12.558  14.349  14.349
  265   2HB   LYS  37           HB2      LYS  37 -11.669  15.186  15.186
  266   1HG   LYS  37           HG1      LYS  37 -11.146  12.258  12.258
  267   2HG   LYS  37           HG2      LYS  37 -12.399  12.760  12.760
  268   1HD   LYS  37           HD1      LYS  37  -9.595  13.877  13.877
  269   2HD   LYS  37           HD2      LYS  37  -9.906  12.263  12.263
  270   1HE   LYS  37           HE1      LYS  37 -11.557  14.701  14.701
  271   2HE   LYS  37           HE2      LYS  37 -10.182  14.108  14.108
  272   1HZ   LYS  37           HZ1      LYS  37 -11.824  11.936  11.936
  273   2HZ   LYS  37           HZ2      LYS  37 -12.808  13.184  13.184
  274   3HZ   LYS  37           HZ3      LYS  37 -11.471  12.647  12.647
  275    H    LYS  38           HN       LYS  38 -10.868  16.314  16.314
  276    HA   LYS  38           HA       LYS  38  -9.812  18.444  18.444
  277   1HB   LYS  38           HB1      LYS  38 -11.960  18.599  18.599
  278   2HB   LYS  38           HB2      LYS  38 -10.945  18.684  18.684
  279   1HG   LYS  38           HG1      LYS  38  -9.772  20.669  20.669
  280   2HG   LYS  38           HG2      LYS  38 -10.707  20.571  20.571
  281   1HD   LYS  38           HD1      LYS  38 -11.894  21.073  21.073
  282   2HD   LYS  38           HD2      LYS  38 -11.589  22.308  22.308
  283   1HE   LYS  38           HE1      LYS  38 -13.115  21.067  21.067
  284   2HE   LYS  38           HE2      LYS  38 -13.514  19.952  19.952
  285   1HZ   LYS  38           HZ1      LYS  38 -13.825  22.563  22.563
  286   2HZ   LYS  38           HZ2      LYS  38 -14.639  22.419  22.419
  287   3HZ   LYS  38           HZ3      LYS  38 -14.994  21.348  21.348
  288    H    LEU  39           HN       LEU  39  -9.228  17.147  17.147
  289    HA   LEU  39           HA       LEU  39  -6.796  18.682  18.682
  290   1HB   LEU  39           HB1      LEU  39  -7.200  18.113  18.113
  291   2HB   LEU  39           HB2      LEU  39  -8.535  17.128  17.128
  292    HG   LEU  39           HG       LEU  39  -6.596  15.396  15.396
  293   1HD1  LEU  39          HD11      LEU  39  -4.877  17.197  17.197
  294   2HD1  LEU  39          HD12      LEU  39  -5.445  17.225  17.225
  295   3HD1  LEU  39          HD13      LEU  39  -4.659  15.786  15.786
  296   1HD2  LEU  39          HD21      LEU  39  -7.444  16.179  16.179
  297   2HD2  LEU  39          HD22      LEU  39  -8.352  15.101  15.101
  298   3HD2  LEU  39          HD23      LEU  39  -6.785  14.617  14.617
  299    H    GLY  40           HN       GLY  40  -7.643  15.666  15.666
  300   1HA   GLY  40           HA1      GLY  40  -4.944  14.604  14.604
  301   2HA   GLY  40           HA2      GLY  40  -6.324  13.996  13.996
  302    H    GLU  41           HN       GLU  41  -6.974  16.635  16.635
  303    HA   GLU  41           HA       GLU  41  -5.139  16.564  16.564
  304   1HB   GLU  41           HB1      GLU  41  -7.588  17.974  17.974
  305   2HB   GLU  41           HB2      GLU  41  -6.565  18.918  18.918
  306   1HG   GLU  41           HG1      GLU  41  -8.235  17.592  17.592
  307   2HG   GLU  41           HG2      GLU  41  -6.576  17.286  17.286
  308    H    MET  42           HN       MET  42  -5.859  18.791  18.791
  309    HA   MET  42           HA       MET  42  -3.985  20.810  20.810
  310   1HB   MET  42           HB1      MET  42  -4.833  19.577  19.577
  311   2HB   MET  42           HB2      MET  42  -3.801  21.002  21.002
  312   1HG   MET  42           HG1      MET  42  -5.703  21.925  21.925
  313   2HG   MET  42           HG2      MET  42  -6.670  20.700  20.700
  314   1HE   MET  42           HE1      MET  42  -7.876  20.676  20.676
  315   2HE   MET  42           HE2      MET  42  -8.090  21.938  21.938
  316   3HE   MET  42           HE3      MET  42  -8.652  22.200  22.200
  317    H    TRP  43           HN       TRP  43  -3.561  17.738  17.738
  318    HA   TRP  43           HA       TRP  43  -0.910  17.855  17.855
  319   1HB   TRP  43           HB1      TRP  43  -2.190  15.888  15.888
  320   2HB   TRP  43           HB2      TRP  43  -2.557  15.604  15.604
  321    HD1  TRP  43           HD1      TRP  43  -1.091  13.932  13.932
  322    HE1  TRP  43           HE1      TRP  43   1.151  12.989  12.989
  323    HE3  TRP  43           HE3      TRP  43   0.074  16.595  16.595
  324    HZ2  TRP  43           HZ2      TRP  43   3.301  13.230  13.230
  325    HZ3  TRP  43           HZ3      TRP  43   2.199  16.248  16.248
  326    HH2  TRP  43           HH2      TRP  43   3.821  14.563  14.563
  327    H    ASN  44           HN       ASN  44  -2.144  16.971  16.971
  328    HA   ASN  44           HA       ASN  44   0.511  16.580  16.580
  329   1HB   ASN  44           HB1      ASN  44  -0.484  16.015  16.015
  330   2HB   ASN  44           HB2      ASN  44  -1.751  15.651  15.651
  331   1HD2  ASN  44          HD21      ASN  44  -4.079  17.614  17.614
  332   2HD2  ASN  44          HD22      ASN  44  -3.752  16.373  16.373
  333    H    ASN  45           HN       ASN  45  -0.838  19.289  19.289
  334    HA   ASN  45           HA       ASN  45   0.877  21.065  21.065
  335   1HB   ASN  45           HB1      ASN  45  -1.915  21.904  21.904
  336   2HB   ASN  45           HB2      ASN  45  -0.880  22.694  22.694
  337   1HD2  ASN  45          HD21      ASN  45  -3.451  19.811  19.811
  338   2HD2  ASN  45          HD22      ASN  45  -3.363  20.469  20.469
  339    H    THR  46           HN       THR  46   1.160  19.865  19.865
  340    HA   THR  46           HA       THR  46   0.494  21.942  21.942
  341    HB   THR  46           HB       THR  46   0.805  19.573  19.573
  342    HG1  THR  46           HG1      THR  46   1.463  20.520  20.520
  343   1HG2  THR  46          HG21      THR  46   2.799  18.882  18.882
  344   2HG2  THR  46          HG22      THR  46   3.823  19.910  19.910
  345   3HG2  THR  46          HG23      THR  46   2.997  18.541  18.541
  346    H    ALA  47           HN       ALA  47   3.441  20.873  20.873
  347    HA   ALA  47           HA       ALA  47   4.524  23.431  23.431
  348   1HB   ALA  47           HB1      ALA  47   4.927  23.502  23.502
  349   2HB   ALA  47           HB2      ALA  47   5.793  21.981  21.981
  350   3HB   ALA  47           HB3      ALA  47   6.440  23.428  23.428
  351    H    ALA  48           HN       ALA  48   5.302  20.312  20.312
  352    HA   ALA  48           HA       ALA  48   5.952  18.381  18.381
  353   1HB   ALA  48           HB1      ALA  48   6.237  19.685  19.685
  354   2HB   ALA  48           HB2      ALA  48   7.734  20.359  20.359
  355   3HB   ALA  48           HB3      ALA  48   7.595  18.633  18.633
  356    H    ASP  49           HN       ASP  49   7.696  21.227  21.227
  357    HA   ASP  49           HA       ASP  49  10.067  19.973  19.973
  358   1HB   ASP  49           HB1      ASP  49   9.040  22.828  22.828
  359   2HB   ASP  49           HB2      ASP  49  10.680  22.276  22.276
  360    H    ASP  50           HN       ASP  50   6.953  20.269  20.269
  361    HA   ASP  50           HA       ASP  50   7.573  20.147  20.147
  362   1HB   ASP  50           HB1      ASP  50   5.156  21.217  21.217
  363   2HB   ASP  50           HB2      ASP  50   5.002  20.776  20.776
  364    H    LYS  51           HN       LYS  51   6.937  18.354  18.354
  365    HA   LYS  51           HA       LYS  51   5.122  16.406  16.406
  366   1HB   LYS  51           HB1      LYS  51   6.588  16.253  16.253
  367   2HB   LYS  51           HB2      LYS  51   5.574  14.985  14.985
  368   1HG   LYS  51           HG1      LYS  51   3.645  16.541  16.541
  369   2HG   LYS  51           HG2      LYS  51   4.688  17.732  17.732
  370   1HD   LYS  51           HD1      LYS  51   5.152  16.183  16.183
  371   2HD   LYS  51           HD2      LYS  51   4.266  14.900  14.900
  372   1HE   LYS  51           HE1      LYS  51   2.190  16.174  16.174
  373   2HE   LYS  51           HE2      LYS  51   3.028  17.519  17.519
  374   1HZ   LYS  51           HZ1      LYS  51   3.638  15.163  15.163
  375   2HZ   LYS  51           HZ2      LYS  51   1.960  15.214  15.214
  376   3HZ   LYS  51           HZ3      LYS  51   2.750  16.496  16.496
  377    H    GLN  52           HN       GLN  52   8.297  16.641  16.641
  378    HA   GLN  52           HA       GLN  52   9.659  14.444  14.444
  379   1HB   GLN  52           HB1      GLN  52  10.349  17.222  17.222
  380   2HB   GLN  52           HB2      GLN  52  11.214  16.577  16.577
  381   1HG   GLN  52           HG1      GLN  52  12.596  16.418  16.418
  382   2HG   GLN  52           HG2      GLN  52  12.228  14.822  14.822
  383   1HE2  GLN  52          HE21      GLN  52   9.682  15.126  15.126
  384   2HE2  GLN  52          HE22      GLN  52   9.359  15.756  15.756
  385    HA   PRO  53           HA       PRO  53  10.354  14.867  14.867
  386   1HB   PRO  53           HB1      PRO  53   8.232  16.219  16.219
  387   2HB   PRO  53           HB2      PRO  53   9.824  16.897  16.897
  388   1HG   PRO  53           HG1      PRO  53   7.339  17.014  17.014
  389   2HG   PRO  53           HG2      PRO  53   8.341  18.371  18.371
  390   1HD   PRO  53           HD1      PRO  53   8.863  17.394  17.394
  391   2HD   PRO  53           HD2      PRO  53  10.255  17.566  17.566
  392    H    TYR  54           HN       TYR  54   7.004  14.984  14.984
  393    HA   TYR  54           HA       TYR  54   6.110  12.798  12.798
  394   1HB   TYR  54           HB1      TYR  54   4.830  14.115  14.115
  395   2HB   TYR  54           HB2      TYR  54   4.011  12.993  12.993
  396    HD1  TYR  54           HD1      TYR  54   4.540  13.780  13.780
  397    HD2  TYR  54           HD2      TYR  54   4.243  16.322  16.322
  398    HE1  TYR  54           HE1      TYR  54   3.978  15.668  15.668
  399    HE2  TYR  54           HE2      TYR  54   3.683  18.209  18.209
  400    HH   TYR  54           HH       TYR  54   4.290  18.481  18.481
  401    H    GLU  55           HN       GLU  55   6.667  13.201  13.201
  402    HA   GLU  55           HA       GLU  55   6.089  10.647  10.647
  403   1HB   GLU  55           HB1      GLU  55   7.347  13.051  13.051
  404   2HB   GLU  55           HB2      GLU  55   8.448  11.763  11.763
  405   1HG   GLU  55           HG1      GLU  55   6.458  10.516  10.516
  406   2HG   GLU  55           HG2      GLU  55   5.479  11.935  11.935
  407    H    LYS  56           HN       LYS  56   9.271  11.788  11.788
  408    HA   LYS  56           HA       LYS  56  10.765   9.517   9.517
  409   1HB   LYS  56           HB1      LYS  56  10.793  11.694  11.694
  410   2HB   LYS  56           HB2      LYS  56  11.974  10.407  10.407
  411   1HG   LYS  56           HG1      LYS  56  11.545  12.044  12.044
  412   2HG   LYS  56           HG2      LYS  56  12.626  12.591  12.591
  413   1HD   LYS  56           HD1      LYS  56  12.885   9.838   9.838
  414   2HD   LYS  56           HD2      LYS  56  13.707  11.256  11.256
  415   1HE   LYS  56           HE1      LYS  56  14.046  10.156  10.156
  416   2HE   LYS  56           HE2      LYS  56  15.164   9.901   9.901
  417   1HZ   LYS  56           HZ1      LYS  56  14.685  12.636  12.636
  418   2HZ   LYS  56           HZ2      LYS  56  15.002  12.080  12.080
  419   3HZ   LYS  56           HZ3      LYS  56  16.120  11.795  11.795
  420    H    LYS  57           HN       LYS  57   8.489  10.211  10.211
  421    HA   LYS  57           HA       LYS  57   9.200   7.878   7.878
  422   1HB   LYS  57           HB1      LYS  57   6.515   9.355   9.355
  423   2HB   LYS  57           HB2      LYS  57   7.023   8.194   8.194
  424   1HG   LYS  57           HG1      LYS  57   9.030   9.783   9.783
  425   2HG   LYS  57           HG2      LYS  57   8.127  10.963  10.963
  426   1HD   LYS  57           HD1      LYS  57   6.148  10.615  10.615
  427   2HD   LYS  57           HD2      LYS  57   7.105   9.500   9.500
  428   1HE   LYS  57           HE1      LYS  57   7.160  11.684  11.684
  429   2HE   LYS  57           HE2      LYS  57   8.754  11.357  11.357
  430   1HZ   LYS  57           HZ1      LYS  57   7.243  12.589  12.589
  431   2HZ   LYS  57           HZ2      LYS  57   7.038  13.488  13.488
  432   3HZ   LYS  57           HZ3      LYS  57   8.599  13.199  13.199
  433    H    ALA  58           HN       ALA  58   6.442   8.626   8.626
  434    HA   ALA  58           HA       ALA  58   5.122   6.209   6.209
  435   1HB   ALA  58           HB1      ALA  58   5.776   8.003   8.003
  436   2HB   ALA  58           HB2      ALA  58   4.510   6.787   6.787
  437   3HB   ALA  58           HB3      ALA  58   4.405   8.203   8.203
  438    H    ALA  59           HN       ALA  59   7.801   7.144   7.144
  439    HA   ALA  59           HA       ALA  59   8.247   4.794   4.794
  440   1HB   ALA  59           HB1      ALA  59   9.425   6.948   6.948
  441   2HB   ALA  59           HB2      ALA  59  10.335   6.785   6.785
  442   3HB   ALA  59           HB3      ALA  59  10.587   5.651   5.651
  443    H    LYS  60           HN       LYS  60   9.983   5.752   5.752
  444    HA   LYS  60           HA       LYS  60  11.477   3.482   3.482
  445   1HB   LYS  60           HB1      LYS  60  11.469   5.728   5.728
  446   2HB   LYS  60           HB2      LYS  60  10.095   5.170   5.170
  447   1HG   LYS  60           HG1      LYS  60  11.391   3.420   3.420
  448   2HG   LYS  60           HG2      LYS  60  12.703   3.607   3.607
  449   1HD   LYS  60           HD1      LYS  60  13.095   5.940   5.940
  450   2HD   LYS  60           HD2      LYS  60  11.831   5.698   5.698
  451   1HE   LYS  60           HE1      LYS  60  14.342   3.979   3.979
  452   2HE   LYS  60           HE2      LYS  60  14.142   5.324   5.324
  453   1HZ   LYS  60           HZ1      LYS  60  11.912   3.658   3.658
  454   2HZ   LYS  60           HZ2      LYS  60  13.304   2.687   2.687
  455   3HZ   LYS  60           HZ3      LYS  60  13.116   3.990   3.990
  456    H    LEU  61           HN       LEU  61   8.101   4.042   4.042
  457    HA   LEU  61           HA       LEU  61   7.916   1.447   1.447
  458   1HB   LEU  61           HB1      LEU  61   5.653   3.157   3.157
  459   2HB   LEU  61           HB2      LEU  61   5.520   1.952   1.952
  460    HG   LEU  61           HG       LEU  61   7.125   4.550   4.550
  461   1HD1  LEU  61          HD11      LEU  61   4.651   3.657   3.657
  462   2HD1  LEU  61          HD12      LEU  61   5.534   5.158   5.158
  463   3HD1  LEU  61          HD13      LEU  61   4.753   4.868   4.868
  464   1HD2  LEU  61          HD21      LEU  61   6.875   2.366   2.366
  465   2HD2  LEU  61          HD22      LEU  61   8.345   2.756   2.756
  466   3HD2  LEU  61          HD23      LEU  61   7.660   3.926   3.926
  467    H    LYS  62           HN       LYS  62   6.659   2.610   2.610
  468    HA   LYS  62           HA       LYS  62   5.556   0.375   0.375
  469   1HB   LYS  62           HB1      LYS  62   6.543   2.876   2.876
  470   2HB   LYS  62           HB2      LYS  62   7.496   1.723   1.723
  471   1HG   LYS  62           HG1      LYS  62   4.468   1.870   1.870
  472   2HG   LYS  62           HG2      LYS  62   5.524   2.435   2.435
  473   1HD   LYS  62           HD1      LYS  62   6.328  -0.236  -0.236
  474   2HD   LYS  62           HD2      LYS  62   4.604  -0.316  -0.316
  475   1HE   LYS  62           HE1      LYS  62   5.953   0.829   0.829
  476   2HE   LYS  62           HE2      LYS  62   4.934  -0.599  -0.599
  477   1HZ   LYS  62           HZ1      LYS  62   3.495   1.552   1.552
  478   2HZ   LYS  62           HZ2      LYS  62   4.179   2.049   2.049
  479   3HZ   LYS  62           HZ3      LYS  62   3.191   0.669   0.669
  480    H    GLU  63           HN       GLU  63   8.919   1.244   1.244
  481    HA   GLU  63           HA       GLU  63  10.107  -0.976  -0.976
  482   1HB   GLU  63           HB1      GLU  63  11.295   1.146   1.146
  483   2HB   GLU  63           HB2      GLU  63  11.076   1.018   1.018
  484   1HG   GLU  63           HG1      GLU  63  12.590  -1.017  -1.017
  485   2HG   GLU  63           HG2      GLU  63  12.877  -0.736  -0.736
  486    H    LYS  64           HN       LYS  64   9.731  -0.307  -0.307
  487    HA   LYS  64           HA       LYS  64  10.811  -2.640  -2.640
  488   1HB   LYS  64           HB1      LYS  64  10.010  -0.785  -0.785
  489   2HB   LYS  64           HB2      LYS  64   8.342  -1.113  -1.113
  490   1HG   LYS  64           HG1      LYS  64   8.480  -3.348  -3.348
  491   2HG   LYS  64           HG2      LYS  64  10.153  -3.060  -3.060
  492   1HD   LYS  64           HD1      LYS  64   9.478  -1.154  -1.154
  493   2HD   LYS  64           HD2      LYS  64   7.812  -1.321  -1.321
  494   1HE   LYS  64           HE1      LYS  64   9.364  -3.461  -3.461
  495   2HE   LYS  64           HE2      LYS  64   8.181  -2.376  -2.376
  496   1HZ   LYS  64           HZ1      LYS  64   7.037  -3.563  -3.563
  497   2HZ   LYS  64           HZ2      LYS  64   7.734  -4.792  -4.792
  498   3HZ   LYS  64           HZ3      LYS  64   6.592  -3.737  -3.737
  499    H    TYR  65           HN       TYR  65   7.526  -2.131  -2.131
  500    HA   TYR  65           HA       TYR  65   6.400  -4.644  -4.644
  501   1HB   TYR  65           HB1      TYR  65   4.865  -3.006  -3.006
  502   2HB   TYR  65           HB2      TYR  65   5.897  -2.392  -2.392
  503    HD1  TYR  65           HD1      TYR  65   4.845  -5.979  -5.979
  504    HD2  TYR  65           HD2      TYR  65   4.211  -2.236  -2.236
  505    HE1  TYR  65           HE1      TYR  65   3.462  -7.074  -7.074
  506    HE2  TYR  65           HE2      TYR  65   2.828  -3.339  -3.339
  507    HH   TYR  65           HH       TYR  65   2.778  -5.965  -5.965
  508    H    GLU  66           HN       GLU  66   7.707  -3.600  -3.600
  509    HA   GLU  66           HA       GLU  66   7.487  -5.937  -5.937
  510   1HB   GLU  66           HB1      GLU  66  10.015  -4.301  -4.301
  511   2HB   GLU  66           HB2      GLU  66   9.294  -5.230  -5.230
  512   1HG   GLU  66           HG1      GLU  66   7.254  -3.627  -3.627
  513   2HG   GLU  66           HG2      GLU  66   8.255  -2.691  -2.691
  514    H    LYS  67           HN       LYS  67   9.871  -5.302  -5.302
  515    HA   LYS  67           HA       LYS  67  11.365  -7.746  -7.746
  516   1HB   LYS  67           HB1      LYS  67  11.867  -6.073  -6.073
  517   2HB   LYS  67           HB2      LYS  67  13.024  -7.012  -7.012
  518   1HG   LYS  67           HG1      LYS  67  11.743  -4.366  -4.366
  519   2HG   LYS  67           HG2      LYS  67  13.429  -4.663  -4.663
  520   1HD   LYS  67           HD1      LYS  67  11.869  -5.831  -5.831
  521   2HD   LYS  67           HD2      LYS  67  12.847  -4.396  -4.396
  522   1HE   LYS  67           HE1      LYS  67  13.863  -7.205  -7.205
  523   2HE   LYS  67           HE2      LYS  67  14.105  -6.385  -6.385
  524   1HZ   LYS  67           HZ1      LYS  67  14.974  -4.648  -4.648
  525   2HZ   LYS  67           HZ2      LYS  67  15.608  -6.175  -6.175
  526   3HZ   LYS  67           HZ3      LYS  67  15.907  -5.489  -5.489
  527    H    ASP  68           HN       ASP  68   8.884  -6.863  -6.863
  528    HA   ASP  68           HA       ASP  68   9.227  -9.043  -9.043
  529   1HB   ASP  68           HB1      ASP  68   8.431  -6.733  -6.733
  530   2HB   ASP  68           HB2      ASP  68   6.912  -7.104  -7.104
  531    H    ILE  69           HN       ILE  69   7.631  -8.202  -8.202
  532    HA   ILE  69           HA       ILE  69   5.685 -10.397 -10.397
  533    HB   ILE  69           HB       ILE  69   4.908  -8.402  -8.402
  534   1HG1  ILE  69          HG11      ILE  69   4.200  -9.352  -9.352
  535   2HG1  ILE  69          HG12      ILE  69   5.536 -10.495 -10.495
  536   1HG2  ILE  69          HG21      ILE  69   7.047  -7.564  -7.564
  537   2HG2  ILE  69          HG22      ILE  69   7.185  -8.822  -8.822
  538   3HG2  ILE  69          HG23      ILE  69   5.911  -7.625  -7.625
  539   1HD1  ILE  69          HD11      ILE  69   3.309 -10.417 -10.417
  540   2HD1  ILE  69          HD12      ILE  69   3.449 -11.578 -11.578
  541   3HD1  ILE  69          HD13      ILE  69   4.622 -11.590 -11.590
  542    H    ALA  70           HN       ALA  70   8.454  -9.439  -9.439
  543    HA   ALA  70           HA       ALA  70   8.869 -11.755 -11.755
  544   1HB   ALA  70           HB1      ALA  70  10.982  -9.914  -9.914
  545   2HB   ALA  70           HB2      ALA  70  11.283 -11.002 -11.002
  546   3HB   ALA  70           HB3      ALA  70  10.196  -9.641  -9.641
  547    H    ALA  71           HN       ALA  71   9.506 -11.022 -11.022
  548    HA   ALA  71           HA       ALA  71  10.937 -13.532 -13.532
  549   1HB   ALA  71           HB1      ALA  71  10.007 -11.364 -11.364
  550   2HB   ALA  71           HB2      ALA  71  11.036 -12.723 -12.723
  551   3HB   ALA  71           HB3      ALA  71  11.619 -11.503 -11.503
  552    H    TYR  72           HN       TYR  72   7.782 -12.099 -12.099
  553    HA   TYR  72           HA       TYR  72   6.678 -14.095 -14.095
  554   1HB   TYR  72           HB1      TYR  72   5.587 -12.013 -12.013
  555   2HB   TYR  72           HB2      TYR  72   5.507 -12.180 -12.180
  556    HD1  TYR  72           HD1      TYR  72   3.864 -13.611 -13.611
  557    HD2  TYR  72           HD2      TYR  72   3.938 -13.120 -13.120
  558    HE1  TYR  72           HE1      TYR  72   1.622 -14.578 -14.578
  559    HE2  TYR  72           HE2      TYR  72   1.690 -14.089 -14.089
  560    HH   TYR  72           HH       TYR  72   0.326 -15.890 -15.890
  561    H    ARG  73           HN       ARG  73   6.851 -13.854 -13.854
  562    HA   ARG  73           HA       ARG  73   5.382 -16.328 -16.328
  563   1HB   ARG  73           HB1      ARG  73   5.572 -15.788 -15.788
  564   2HB   ARG  73           HB2      ARG  73   5.305 -14.273 -14.273
  565   1HG   ARG  73           HG1      ARG  73   7.156 -13.369 -13.369
  566   2HG   ARG  73           HG2      ARG  73   8.168 -14.630 -14.630
  567   1HD   ARG  73           HD1      ARG  73   8.366 -14.542 -14.542
  568   2HD   ARG  73           HD2      ARG  73   7.632 -16.069 -16.069
  569    HE   ARG  73           HE       ARG  73   5.406 -15.015 -15.015
  570   1HH1  ARG  73          HH11      ARG  73   6.364 -12.242 -12.242
  571   2HH1  ARG  73          HH12      ARG  73   6.494 -12.122 -12.122
  572   1HH2  ARG  73          HH21      ARG  73   6.421 -15.600 -15.600
  573   2HH2  ARG  73          HH22      ARG  73   6.527 -14.081 -14.081
  574    H    ALA  74           HN       ALA  74   8.588 -15.195 -15.195
  575    HA   ALA  74           HA       ALA  74  10.000 -17.371 -17.371
  576   1HB   ALA  74           HB1      ALA  74  10.787 -15.796 -15.796
  577   2HB   ALA  74           HB2      ALA  74  11.877 -16.774 -16.774
  578   3HB   ALA  74           HB3      ALA  74  11.171 -15.331 -15.331
  579    H    LYS  75           HN       LYS  75   8.586 -16.811 -16.811
  580    HA   LYS  75           HA       LYS  75   7.336 -18.270 -18.270
  581   1HB   LYS  75           HB1      LYS  75   8.174 -20.260 -20.260
  582   2HB   LYS  75           HB2      LYS  75   9.307 -20.573 -20.573
  583   1HG   LYS  75           HG1      LYS  75   7.385 -21.969 -21.969
  584   2HG   LYS  75           HG2      LYS  75   7.243 -20.676 -20.676
  585   1HD   LYS  75           HD1      LYS  75   5.558 -19.527 -19.527
  586   2HD   LYS  75           HD2      LYS  75   5.944 -20.439 -20.439
  587   1HE   LYS  75           HE1      LYS  75   5.068 -22.518 -22.518
  588   2HE   LYS  75           HE2      LYS  75   4.608 -21.520 -21.520
  589   1HZ   LYS  75           HZ1      LYS  75   3.614 -20.283 -20.283
  590   2HZ   LYS  75           HZ2      LYS  75   3.236 -21.932 -21.932
  591   3HZ   LYS  75           HZ3      LYS  75   2.749 -21.057 -21.057
  592    H    GLY  76           HN       GLY  76   9.253 -16.407 -16.407
  593   1HA   GLY  76           HA1      GLY  76  10.903 -17.472 -17.472
  594   2HA   GLY  76           HA2      GLY  76  11.298 -16.041 -16.041
  595    H    LYS  77           HN       LYS  77   8.290 -17.078 -17.078
  596    HA   LYS  77           HA       LYS  77   8.315 -14.833 -14.833
  597   1HB   LYS  77           HB1      LYS  77   6.459 -15.279 -15.279
  598   2HB   LYS  77           HB2      LYS  77   5.618 -14.938 -14.938
  599   1HG   LYS  77           HG1      LYS  77   7.836 -13.202 -13.202
  600   2HG   LYS  77           HG2      LYS  77   6.121 -12.900 -12.900
  601   1HD   LYS  77           HD1      LYS  77   5.911 -12.845 -12.845
  602   2HD   LYS  77           HD2      LYS  77   7.659 -12.931 -12.931
  603   1HE   LYS  77           HE1      LYS  77   7.850 -10.831 -10.831
  604   2HE   LYS  77           HE2      LYS  77   6.092 -10.723 -10.723
  605   1HZ   LYS  77           HZ1      LYS  77   6.893 -11.139 -11.139
  606   2HZ   LYS  77           HZ2      LYS  77   7.786  -9.847  -9.847
  607   3HZ   LYS  77           HZ3      LYS  77   6.089  -9.806  -9.806
  608    HA   PRO  78           HA       PRO  78   5.578 -18.017 -18.017
  609   1HB   PRO  78           HB1      PRO  78   4.105 -19.799 -19.799
  610   2HB   PRO  78           HB2      PRO  78   3.820 -18.079 -18.079
  611   1HG   PRO  78           HG1      PRO  78   5.418 -20.039 -20.039
  612   2HG   PRO  78           HG2      PRO  78   4.252 -18.830 -18.830
  613   1HD   PRO  78           HD1      PRO  78   7.081 -18.441 -18.441
  614   2HD   PRO  78           HD2      PRO  78   5.864 -17.158 -17.158
  615    H    ASP  79           HN       ASP  79   8.094 -18.346 -18.346
  616    HA   ASP  79           HA       ASP  79   9.932 -19.920 -19.920
  617   1HB   ASP  79           HB1      ASP  79   8.554 -20.268 -20.268
  618   2HB   ASP  79           HB2      ASP  79  10.235 -20.639 -20.639
  619    H    ALA  80           HN       ALA  80   8.845 -21.319 -21.319
  620    HA   ALA  80           HA       ALA  80   7.490 -23.564 -23.564
  621   1HB   ALA  80           HB1      ALA  80  10.356 -23.411 -23.411
  622   2HB   ALA  80           HB2      ALA  80   9.167 -24.593 -24.593
  623   3HB   ALA  80           HB3      ALA  80   8.924 -22.888 -22.888
  624    H    ALA  81           HN       ALA  81  10.785 -23.674 -23.674
  625    HA   ALA  81           HA       ALA  81  10.147 -26.132 -26.132
  626   1HB   ALA  81           HB1      ALA  81  11.741 -26.564 -26.564
  627   2HB   ALA  81           HB2      ALA  81  12.801 -25.303 -25.303
  628   3HB   ALA  81           HB3      ALA  81  12.537 -26.756 -26.756
  629   1H1   BME  16           HE1      MER  16  -7.898  10.059  10.059
  630   2H1   BME  16           HE2      MER  16  -8.455   9.395   9.395
  631   1H2   BME  16           HZ1      MER  16  -6.332   9.966   9.966
  632   2H2   BME  16           HZ2      MER  16  -5.692  10.597  10.597
  633    HO1  BME  16           HH       MER  16  -6.832   8.293   8.293

  Start of MODEL   16
    1    H    ASN   3           HN       ASN   3   3.724 -10.472 -10.472
    2    HA   ASN   3           HA       ASN   3   5.151 -11.044 -11.044
    3   1HB   ASN   3           HB1      ASN   3   2.929 -12.561 -12.561
    4   2HB   ASN   3           HB2      ASN   3   3.630 -13.078 -13.078
    5   1HD2  ASN   3          HD21      ASN   3   5.507 -14.037 -14.037
    6   2HD2  ASN   3          HD22      ASN   3   3.914 -13.449 -13.449
    7    H    ALA   4           HN       ALA   4   3.710 -11.158 -11.158
    8    HA   ALA   4           HA       ALA   4   2.439  -9.716  -9.716
    9   1HB   ALA   4           HB1      ALA   4   1.011 -11.727 -11.727
   10   2HB   ALA   4           HB2      ALA   4   0.379 -10.875 -10.875
   11   3HB   ALA   4           HB3      ALA   4   0.022 -10.296 -10.296
   12    HA   PRO   5           HA       PRO   5   2.813  -6.065  -6.065
   13   1HB   PRO   5           HB1      PRO   5   3.723  -5.293  -5.293
   14   2HB   PRO   5           HB2      PRO   5   4.248  -4.669  -4.669
   15   1HG   PRO   5           HG1      PRO   5   5.722  -6.531  -6.531
   16   2HG   PRO   5           HG2      PRO   5   5.251  -6.835  -6.835
   17   1HD   PRO   5           HD1      PRO   5   3.927  -7.923  -7.923
   18   2HD   PRO   5           HD2      PRO   5   4.428  -8.795  -8.795
   19    H    LYS   6           HN       LYS   6   2.330  -4.109  -4.109
   20    HA   LYS   6           HA       LYS   6  -0.635  -4.145  -4.145
   21   1HB   LYS   6           HB1      LYS   6  -0.764  -1.731  -1.731
   22   2HB   LYS   6           HB2      LYS   6  -0.386  -2.920  -2.920
   23   1HG   LYS   6           HG1      LYS   6   1.995  -1.690  -1.690
   24   2HG   LYS   6           HG2      LYS   6   1.037  -0.593  -0.593
   25   1HD   LYS   6           HD1      LYS   6   2.030  -3.268  -3.268
   26   2HD   LYS   6           HD2      LYS   6   2.951  -1.785  -1.785
   27   1HE   LYS   6           HE1      LYS   6   0.108  -2.190  -2.190
   28   2HE   LYS   6           HE2      LYS   6   1.577  -2.195  -2.195
   29   1HZ   LYS   6           HZ1      LYS   6   1.595   0.128   0.128
   30   2HZ   LYS   6           HZ2      LYS   6   0.045  -0.010  -0.010
   31   3HZ   LYS   6           HZ3      LYS   6   1.412  -0.019  -0.019
   32    H    ARG   7           HN       ARG   7  -1.636  -2.789  -2.789
   33    HA   ARG   7           HA       ARG   7  -0.434  -2.411  -2.411
   34   1HB   ARG   7           HB1      ARG   7  -2.757  -2.927  -2.927
   35   2HB   ARG   7           HB2      ARG   7  -3.025  -1.495  -1.495
   36   1HG   ARG   7           HG1      ARG   7  -3.947  -1.027  -1.027
   37   2HG   ARG   7           HG2      ARG   7  -2.461  -0.108  -0.108
   38   1HD   ARG   7           HD1      ARG   7  -1.289  -1.858  -1.858
   39   2HD   ARG   7           HD2      ARG   7  -2.757  -2.834  -2.834
   40    HE   ARG   7           HE       ARG   7  -3.850  -0.922  -0.922
   41   1HH1  ARG   7          HH11      ARG   7  -1.370   0.849   0.849
   42   2HH1  ARG   7          HH12      ARG   7  -0.685   0.817   0.817
   43   1HH2  ARG   7          HH21      ARG   7  -2.614  -1.934  -1.934
   44   2HH2  ARG   7          HH22      ARG   7  -1.408  -0.804  -0.804
   45    HA   PRO   8           HA       PRO   8   1.738   1.103   1.103
   46   1HB   PRO   8           HB1      PRO   8   3.153   1.912   1.912
   47   2HB   PRO   8           HB2      PRO   8   3.584   0.509   0.509
   48   1HG   PRO   8           HG1      PRO   8   1.844   0.549   0.549
   49   2HG   PRO   8           HG2      PRO   8   3.282  -0.439  -0.439
   50   1HD   PRO   8           HD1      PRO   8   0.915  -1.528  -1.528
   51   2HD   PRO   8           HD2      PRO   8   2.153  -1.721  -1.721
   52    HA   PRO   9           HA       PRO   9  -0.443   4.818   4.818
   53   1HB   PRO   9           HB1      PRO   9   1.332   6.800   6.800
   54   2HB   PRO   9           HB2      PRO   9   0.785   5.709   5.709
   55   1HG   PRO   9           HG1      PRO   9   3.289   5.412   5.412
   56   2HG   PRO   9           HG2      PRO   9   3.215   5.496   5.496
   57   1HD   PRO   9           HD1      PRO   9   3.243   3.080   3.080
   58   2HD   PRO   9           HD2      PRO   9   2.150   3.329   3.329
   59    H    SER  10           HN       SER  10   0.234   7.134   7.134
   60    HA   SER  10           HA       SER  10   0.999   6.453   6.453
   61   1HB   SER  10           HB1      SER  10  -0.960   8.576   8.576
   62   2HB   SER  10           HB2      SER  10  -0.580   8.237   8.237
   63    HG   SER  10           HG       SER  10  -1.116   5.940   5.940
   64    H    ALA  11           HN       ALA  11   1.071   8.903   8.903
   65    HA   ALA  11           HA       ALA  11   3.317  10.035  10.035
   66   1HB   ALA  11           HB1      ALA  11   2.654  11.052  11.052
   67   2HB   ALA  11           HB2      ALA  11   3.959  11.633  11.633
   68   3HB   ALA  11           HB3      ALA  11   4.038  10.023  10.023
   69    H    PHE  12           HN       PHE  12   0.643  10.799  10.799
   70    HA   PHE  12           HA       PHE  12  -0.208  13.311  13.311
   71   1HB   PHE  12           HB1      PHE  12  -1.013  12.624  12.624
   72   2HB   PHE  12           HB2      PHE  12  -1.346  10.971  10.971
   73    HD1  PHE  12           HD1      PHE  12  -3.154  13.239  13.239
   74    HD2  PHE  12           HD2      PHE  12  -3.117  11.499  11.499
   75    HE1  PHE  12           HE1      PHE  12  -5.575  13.594  13.594
   76    HE2  PHE  12           HE2      PHE  12  -5.525  11.866  11.866
   77    HZ   PHE  12           HZ       PHE  12  -6.759  12.910  12.910
   78    H    PHE  13           HN       PHE  13  -0.766   9.942   9.942
   79    HA   PHE  13           HA       PHE  13  -2.788  10.078  10.078
   80   1HB   PHE  13           HB1      PHE  13  -1.283   8.069   8.069
   81   2HB   PHE  13           HB2      PHE  13  -0.288   8.519   8.519
   82    HD1  PHE  13           HD1      PHE  13  -1.580   8.784   8.784
   83    HD2  PHE  13           HD2      PHE  13  -3.197   6.780   6.780
   84    HE1  PHE  13           HE1      PHE  13  -3.227   7.666   7.666
   85    HE2  PHE  13           HE2      PHE  13  -4.843   5.669   5.669
   86    HZ   PHE  13           HZ       PHE  13  -4.856   6.105   6.105
   87    H    LEU  14           HN       LEU  14   0.627  10.691  10.691
   88    HA   LEU  14           HA       LEU  14   0.299  11.265  11.265
   89   1HB   LEU  14           HB1      LEU  14   2.265  12.601  12.601
   90   2HB   LEU  14           HB2      LEU  14   2.388  12.586  12.586
   91    HG   LEU  14           HG       LEU  14   3.952  11.036  11.036
   92   1HD1  LEU  14          HD11      LEU  14   2.573   9.986   9.986
   93   2HD1  LEU  14          HD12      LEU  14   1.537   9.271   9.271
   94   3HD1  LEU  14          HD13      LEU  14   3.224   8.791   8.791
   95   1HD2  LEU  14          HD21      LEU  14   3.540  10.922  10.922
   96   2HD2  LEU  14          HD22      LEU  14   3.768   9.312   9.312
   97   3HD2  LEU  14          HD23      LEU  14   2.156   9.864   9.864
   98    H    PHE  15           HN       PHE  15   0.683  13.649  13.649
   99    HA   PHE  15           HA       PHE  15  -0.075  15.931  15.931
  100   1HB   PHE  15           HB1      PHE  15   0.869  16.671  16.671
  101   2HB   PHE  15           HB2      PHE  15   0.583  15.094  15.094
  102    HD1  PHE  15           HD1      PHE  15  -1.390  14.696  14.696
  103    HD2  PHE  15           HD2      PHE  15  -0.494  18.595  18.595
  104    HE1  PHE  15           HE1      PHE  15  -2.917  15.656  15.656
  105    HE2  PHE  15           HE2      PHE  15  -2.042  19.562  19.562
  106    HZ   PHE  15           HZ       PHE  15  -3.248  18.082  18.082
  107    H    CYS  16           HN       MER  16  -2.183  13.877  13.877
  108    HA   CYS  16           HA       MER  16  -4.582  15.273  15.273
  109   1HB   CYS  16           HB1      MER  16  -4.745  13.581  13.581
  110   2HB   CYS  16           HB2      MER  16  -3.937  12.400  12.400
  111    H    SER  17           HN       SER  17  -3.217  12.688  12.688
  112    HA   SER  17           HA       SER  17  -5.302  12.403  12.403
  113   1HB   SER  17           HB1      SER  17  -2.285  12.385  12.385
  114   2HB   SER  17           HB2      SER  17  -3.540  11.650  11.650
  115    HG   SER  17           HG       SER  17  -3.511  10.034  10.034
  116    H    GLU  18           HN       GLU  18  -2.677  14.646  14.646
  117    HA   GLU  18           HA       GLU  18  -3.514  16.100  16.100
  118   1HB   GLU  18           HB1      GLU  18  -1.197  15.947  15.947
  119   2HB   GLU  18           HB2      GLU  18  -1.581  16.714  16.714
  120   1HG   GLU  18           HG1      GLU  18  -2.101  18.834  18.834
  121   2HG   GLU  18           HG2      GLU  18  -1.972  18.102  18.102
  122    H    TYR  19           HN       TYR  19  -4.649  16.212  16.212
  123    HA   TYR  19           HA       TYR  19  -5.574  19.021  19.021
  124   1HB   TYR  19           HB1      TYR  19  -5.218  16.955  16.955
  125   2HB   TYR  19           HB2      TYR  19  -6.553  18.113  18.113
  126    HD1  TYR  19           HD1      TYR  19  -3.093  18.277  18.277
  127    HD2  TYR  19           HD2      TYR  19  -5.928  19.884  19.884
  128    HE1  TYR  19           HE1      TYR  19  -1.444  19.931  19.931
  129    HE2  TYR  19           HE2      TYR  19  -4.284  21.547  21.547
  130    HH   TYR  19           HH       TYR  19  -1.852  21.829  21.829
  131    H    ARG  20           HN       ARG  20  -6.980  15.879  15.879
  132    HA   ARG  20           HA       ARG  20  -9.542  16.079  16.079
  133   1HB   ARG  20           HB1      ARG  20  -8.205  14.556  14.556
  134   2HB   ARG  20           HB2      ARG  20  -9.941  14.380  14.380
  135   1HG   ARG  20           HG1      ARG  20  -9.342  13.894  13.894
  136   2HG   ARG  20           HG2      ARG  20  -7.668  13.876  13.876
  137   1HD   ARG  20           HD1      ARG  20  -8.450  11.585  11.585
  138   2HD   ARG  20           HD2      ARG  20  -8.254  12.029  12.029
  139    HE   ARG  20           HE       ARG  20 -10.939  12.576  12.576
  140   1HH1  ARG  20          HH11      ARG  20  -9.836   9.679   9.679
  141   2HH1  ARG  20          HH12      ARG  20 -10.592   8.851   8.851
  142   1HH2  ARG  20          HH21      ARG  20 -11.463  11.845  11.845
  143   2HH2  ARG  20          HH22      ARG  20 -11.536  10.117  10.117
  144    HA   PRO  21           HA       PRO  21 -11.474  17.420  17.420
  145   1HB   PRO  21           HB1      PRO  21 -10.016  18.215  18.215
  146   2HB   PRO  21           HB2      PRO  21 -10.231  16.491  16.491
  147   1HG   PRO  21           HG1      PRO  21  -7.907  18.305  18.305
  148   2HG   PRO  21           HG2      PRO  21  -7.814  16.806  16.806
  149   1HD   PRO  21           HD1      PRO  21  -7.522  16.660  16.660
  150   2HD   PRO  21           HD2      PRO  21  -8.576  15.470  15.470
  151    H    LYS  22           HN       LYS  22  -8.999  19.248  19.248
  152    HA   LYS  22           HA       LYS  22 -10.007  21.861  21.861
  153   1HB   LYS  22           HB1      LYS  22  -7.731  21.262  21.262
  154   2HB   LYS  22           HB2      LYS  22  -8.080  22.794  22.794
  155   1HG   LYS  22           HG1      LYS  22  -7.673  21.634  21.634
  156   2HG   LYS  22           HG2      LYS  22  -7.120  20.238  20.238
  157   1HD   LYS  22           HD1      LYS  22  -5.392  21.602  21.602
  158   2HD   LYS  22           HD2      LYS  22  -5.924  23.036  23.036
  159   1HE   LYS  22           HE1      LYS  22  -4.753  20.521  20.521
  160   2HE   LYS  22           HE2      LYS  22  -3.953  22.074  22.074
  161   1HZ   LYS  22           HZ1      LYS  22  -6.356  22.603  22.603
  162   2HZ   LYS  22           HZ2      LYS  22  -5.694  21.247  21.247
  163   3HZ   LYS  22           HZ3      LYS  22  -4.791  22.679  22.679
  164    H    ILE  23           HN       ILE  23 -10.032  19.777  19.777
  165    HA   ILE  23           HA       ILE  23 -11.024  21.990  21.990
  166    HB   ILE  23           HB       ILE  23 -11.216  19.034  19.034
  167   1HG1  ILE  23          HG11      ILE  23  -8.761  20.809  20.809
  168   2HG1  ILE  23          HG12      ILE  23  -8.829  19.528  19.528
  169   1HG2  ILE  23          HG21      ILE  23 -12.314  20.835  20.835
  170   2HG2  ILE  23          HG22      ILE  23 -10.753  21.617  21.617
  171   3HG2  ILE  23          HG23      ILE  23 -11.038  20.043  20.043
  172   1HD1  ILE  23          HD11      ILE  23  -9.336  17.874  17.874
  173   2HD1  ILE  23          HD12      ILE  23  -9.261  19.126  19.126
  174   3HD1  ILE  23          HD13      ILE  23  -7.823  18.691  18.691
  175    H    LYS  24           HN       LYS  24 -11.951  19.069  19.069
  176    HA   LYS  24           HA       LYS  24 -14.709  18.960  18.960
  177   1HB   LYS  24           HB1      LYS  24 -13.101  17.214  17.214
  178   2HB   LYS  24           HB2      LYS  24 -13.128  17.956  17.956
  179   1HG   LYS  24           HG1      LYS  24 -15.704  17.590  17.590
  180   2HG   LYS  24           HG2      LYS  24 -15.488  16.674  16.674
  181   1HD   LYS  24           HD1      LYS  24 -15.448  15.020  15.020
  182   2HD   LYS  24           HD2      LYS  24 -13.762  15.247  15.247
  183   1HE   LYS  24           HE1      LYS  24 -13.732  15.275  15.275
  184   2HE   LYS  24           HE2      LYS  24 -13.749  16.990  16.990
  185   1HZ   LYS  24           HZ1      LYS  24 -16.397  16.109  16.109
  186   2HZ   LYS  24           HZ2      LYS  24 -15.633  15.517  15.517
  187   3HZ   LYS  24           HZ3      LYS  24 -15.623  17.184  17.184
  188    H    GLY  25           HN       GLY  25 -12.787  20.586  20.586
  189   1HA   GLY  25           HA1      GLY  25 -14.844  21.293  21.293
  190   2HA   GLY  25           HA2      GLY  25 -13.271  22.085  22.085
  191    H    GLU  26           HN       GLU  26 -13.349  22.940  22.940
  192    HA   GLU  26           HA       GLU  26 -14.896  25.349  25.349
  193   1HB   GLU  26           HB1      GLU  26 -13.214  24.140  24.140
  194   2HB   GLU  26           HB2      GLU  26 -13.813  25.785  25.785
  195   1HG   GLU  26           HG1      GLU  26 -12.125  24.643  24.643
  196   2HG   GLU  26           HG2      GLU  26 -11.396  25.435  25.435
  197    H    HIS  27           HN       HIS  27 -14.930  22.557  22.557
  198    HA   HIS  27           HA       HIS  27 -17.675  23.147  23.147
  199   1HB   HIS  27           HB1      HIS  27 -15.586  21.579  21.579
  200   2HB   HIS  27           HB2      HIS  27 -17.047  22.369  22.369
  201    HD1  HIS  27           HD1      HIS  27 -16.887  25.111  25.111
  202    HD2  HIS  27           HD2      HIS  27 -13.320  23.109  23.109
  203    HE1  HIS  27           HE1      HIS  27 -15.144  26.797  26.797
  204    HA   PRO  28           HA       PRO  28 -18.124  18.985  18.985
  205   1HB   PRO  28           HB1      PRO  28 -19.957  19.555  19.555
  206   2HB   PRO  28           HB2      PRO  28 -18.254  19.902  19.902
  207   1HG   PRO  28           HG1      PRO  28 -20.392  21.835  21.835
  208   2HG   PRO  28           HG2      PRO  28 -19.317  22.063  22.063
  209   1HD   PRO  28           HD1      PRO  28 -18.689  23.052  23.052
  210   2HD   PRO  28           HD2      PRO  28 -17.414  22.514  22.514
  211    H    GLY  29           HN       GLY  29 -18.750  19.954  19.954
  212   1HA   GLY  29           HA1      GLY  29 -21.628  19.464  19.464
  213   2HA   GLY  29           HA2      GLY  29 -20.727  20.662  20.662
  214    H    LEU  30           HN       LEU  30 -18.305  18.856  18.856
  215    HA   LEU  30           HA       LEU  30 -19.147  17.253  17.253
  216   1HB   LEU  30           HB1      LEU  30 -16.333  16.960  16.960
  217   2HB   LEU  30           HB2      LEU  30 -17.131  17.746  17.746
  218    HG   LEU  30           HG       LEU  30 -16.480  19.173  19.173
  219   1HD1  LEU  30          HD11      LEU  30 -14.432  18.312  18.312
  220   2HD1  LEU  30          HD12      LEU  30 -14.958  19.061  19.061
  221   3HD1  LEU  30          HD13      LEU  30 -14.523  20.055  20.055
  222   1HD2  LEU  30          HD21      LEU  30 -17.196  20.150  20.150
  223   2HD2  LEU  30          HD22      LEU  30 -18.272  20.231  20.231
  224   3HD2  LEU  30          HD23      LEU  30 -16.803  21.183  21.183
  225    H    SER  31           HN       SER  31 -17.651  15.210  15.210
  226    HA   SER  31           HA       SER  31 -18.071  13.553  13.553
  227   1HB   SER  31           HB1      SER  31 -18.434  11.635  11.635
  228   2HB   SER  31           HB2      SER  31 -19.534  12.938  12.938
  229    HG   SER  31           HG       SER  31 -17.460  11.907  11.907
  230    H    ILE  32           HN       ILE  32 -16.762  11.497  11.497
  231    HA   ILE  32           HA       ILE  32 -14.010  12.153  12.153
  232    HB   ILE  32           HB       ILE  32 -15.786   9.717   9.717
  233   1HG1  ILE  32          HG11      ILE  32 -14.636   9.186   9.186
  234   2HG1  ILE  32          HG12      ILE  32 -13.455  10.457  10.457
  235   1HG2  ILE  32          HG21      ILE  32 -12.843   9.326   9.326
  236   2HG2  ILE  32          HG22      ILE  32 -13.981   8.054   8.054
  237   3HG2  ILE  32          HG23      ILE  32 -14.182   8.906   8.906
  238   1HD1  ILE  32          HD11      ILE  32 -16.462  10.859  10.859
  239   2HD1  ILE  32          HD12      ILE  32 -15.221  11.218  11.218
  240   3HD1  ILE  32          HD13      ILE  32 -15.310  12.154  12.154
  241    H    GLY  33           HN       GLY  33 -15.910  11.539  11.539
  242   1HA   GLY  33           HA1      GLY  33 -13.629  10.882  10.882
  243   2HA   GLY  33           HA2      GLY  33 -15.323  10.867  10.867
  244    H    ASP  34           HN       ASP  34 -14.989  13.702  13.702
  245    HA   ASP  34           HA       ASP  34 -14.397  15.223  15.223
  246   1HB   ASP  34           HB1      ASP  34 -16.093  15.756  15.756
  247   2HB   ASP  34           HB2      ASP  34 -15.827  17.020  17.020
  248    H    VAL  35           HN       VAL  35 -14.034  14.987  14.987
  249    HA   VAL  35           HA       VAL  35 -12.200  17.178  17.178
  250    HB   VAL  35           HB       VAL  35 -12.743  14.607  14.607
  251   1HG1  VAL  35          HG11      VAL  35 -10.500  15.589  15.589
  252   2HG1  VAL  35          HG12      VAL  35 -11.272  17.137  17.137
  253   3HG1  VAL  35          HG13      VAL  35 -11.610  15.761  15.761
  254   1HG2  VAL  35          HG21      VAL  35 -14.701  16.157  16.157
  255   2HG2  VAL  35          HG22      VAL  35 -14.064  16.100  16.100
  256   3HG2  VAL  35          HG23      VAL  35 -13.704  17.468  17.468
  257    H    ALA  36           HN       ALA  36 -12.070  13.857  13.857
  258    HA   ALA  36           HA       ALA  36  -9.174  13.689  13.689
  259   1HB   ALA  36           HB1      ALA  36 -10.564  11.745  11.745
  260   2HB   ALA  36           HB2      ALA  36 -11.296  11.825  11.825
  261   3HB   ALA  36           HB3      ALA  36  -9.596  11.409  11.409
  262    H    LYS  37           HN       LYS  37 -11.782  13.709  13.709
  263    HA   LYS  37           HA       LYS  37  -9.848  13.661  13.661
  264   1HB   LYS  37           HB1      LYS  37 -12.755  14.430  14.430
  265   2HB   LYS  37           HB2      LYS  37 -11.859  14.783  14.783
  266   1HG   LYS  37           HG1      LYS  37 -11.098  12.443  12.443
  267   2HG   LYS  37           HG2      LYS  37 -11.988  12.029  12.029
  268   1HD   LYS  37           HD1      LYS  37 -14.129  12.530  12.530
  269   2HD   LYS  37           HD2      LYS  37 -13.272  13.142  13.142
  270   1HE   LYS  37           HE1      LYS  37 -12.319  10.909  10.909
  271   2HE   LYS  37           HE2      LYS  37 -13.054  10.271  10.271
  272   1HZ   LYS  37           HZ1      LYS  37 -15.078  11.475  11.475
  273   2HZ   LYS  37           HZ2      LYS  37 -14.174  10.546  10.546
  274   3HZ   LYS  37           HZ3      LYS  37 -14.835   9.820   9.820
  275    H    LYS  38           HN       LYS  38 -11.052  16.346  16.346
  276    HA   LYS  38           HA       LYS  38 -10.037  18.295  18.295
  277   1HB   LYS  38           HB1      LYS  38 -11.949  18.695  18.695
  278   2HB   LYS  38           HB2      LYS  38 -10.714  18.814  18.814
  279   1HG   LYS  38           HG1      LYS  38  -9.563  20.562  20.562
  280   2HG   LYS  38           HG2      LYS  38 -11.089  20.584  20.584
  281   1HD   LYS  38           HD1      LYS  38 -10.618  21.348  21.348
  282   2HD   LYS  38           HD2      LYS  38 -11.046  22.415  22.415
  283   1HE   LYS  38           HE1      LYS  38 -13.251  21.261  21.261
  284   2HE   LYS  38           HE2      LYS  38 -12.840  20.226  20.226
  285   1HZ   LYS  38           HZ1      LYS  38 -12.383  22.867  22.867
  286   2HZ   LYS  38           HZ2      LYS  38 -13.924  22.788  22.788
  287   3HZ   LYS  38           HZ3      LYS  38 -13.536  21.780  21.780
  288    H    LEU  39           HN       LEU  39  -9.061  17.287  17.287
  289    HA   LEU  39           HA       LEU  39  -6.624  18.766  18.766
  290   1HB   LEU  39           HB1      LEU  39  -6.570  18.122  18.122
  291   2HB   LEU  39           HB2      LEU  39  -8.160  17.496  17.496
  292    HG   LEU  39           HG       LEU  39  -6.917  15.315  15.315
  293   1HD1  LEU  39          HD11      LEU  39  -4.922  16.895  16.895
  294   2HD1  LEU  39          HD12      LEU  39  -4.710  15.218  15.218
  295   3HD1  LEU  39          HD13      LEU  39  -4.739  16.382  16.382
  296   1HD2  LEU  39          HD21      LEU  39  -8.327  15.677  15.677
  297   2HD2  LEU  39          HD22      LEU  39  -6.924  14.682  14.682
  298   3HD2  LEU  39          HD23      LEU  39  -6.903  16.378  16.378
  299    H    GLY  40           HN       GLY  40  -7.478  15.550  15.550
  300   1HA   GLY  40           HA1      GLY  40  -4.814  14.625  14.625
  301   2HA   GLY  40           HA2      GLY  40  -6.196  14.056  14.056
  302    H    GLU  41           HN       GLU  41  -6.947  16.557  16.557
  303    HA   GLU  41           HA       GLU  41  -5.094  16.669  16.669
  304   1HB   GLU  41           HB1      GLU  41  -7.187  18.605  18.605
  305   2HB   GLU  41           HB2      GLU  41  -6.318  18.835  18.835
  306   1HG   GLU  41           HG1      GLU  41  -7.991  16.368  16.368
  307   2HG   GLU  41           HG2      GLU  41  -8.536  17.688  17.688
  308    H    MET  42           HN       MET  42  -5.713  18.748  18.748
  309    HA   MET  42           HA       MET  42  -3.852  20.795  20.795
  310   1HB   MET  42           HB1      MET  42  -4.541  19.431  19.431
  311   2HB   MET  42           HB2      MET  42  -3.724  20.975  20.975
  312   1HG   MET  42           HG1      MET  42  -6.461  20.401  20.401
  313   2HG   MET  42           HG2      MET  42  -6.291  21.063  21.063
  314   1HE   MET  42           HE1      MET  42  -5.694  21.500  21.500
  315   2HE   MET  42           HE2      MET  42  -7.385  21.752  21.752
  316   3HE   MET  42           HE3      MET  42  -6.441  23.075  23.075
  317    H    TRP  43           HN       TRP  43  -3.380  17.719  17.719
  318    HA   TRP  43           HA       TRP  43  -0.713  17.789  17.789
  319   1HB   TRP  43           HB1      TRP  43  -2.132  15.914  15.914
  320   2HB   TRP  43           HB2      TRP  43  -2.368  15.535  15.535
  321    HD1  TRP  43           HD1      TRP  43  -0.846  13.879  13.879
  322    HE1  TRP  43           HE1      TRP  43   1.341  12.890  12.890
  323    HE3  TRP  43           HE3      TRP  43   0.025  16.546  16.546
  324    HZ2  TRP  43           HZ2      TRP  43   3.314  13.102  13.102
  325    HZ3  TRP  43           HZ3      TRP  43   2.033  16.162  16.162
  326    HH2  TRP  43           HH2      TRP  43   3.687  14.438  14.438
  327    H    ASN  44           HN       ASN  44  -2.036  16.746  16.746
  328    HA   ASN  44           HA       ASN  44   0.411  16.230  16.230
  329   1HB   ASN  44           HB1      ASN  44  -2.199  17.216  17.216
  330   2HB   ASN  44           HB2      ASN  44  -0.859  16.440  16.440
  331   1HD2  ASN  44          HD21      ASN  44  -3.558  14.048  14.048
  332   2HD2  ASN  44          HD22      ASN  44  -3.834  15.646  15.646
  333    H    ASN  45           HN       ASN  45  -1.042  19.160  19.160
  334    HA   ASN  45           HA       ASN  45   1.094  20.753  20.753
  335   1HB   ASN  45           HB1      ASN  45  -1.628  21.982  21.982
  336   2HB   ASN  45           HB2      ASN  45  -0.468  22.374  22.374
  337   1HD2  ASN  45          HD21      ASN  45  -3.446  19.771  19.771
  338   2HD2  ASN  45          HD22      ASN  45  -3.302  20.735  20.735
  339    H    THR  46           HN       THR  46   1.159  19.742  19.742
  340    HA   THR  46           HA       THR  46   0.422  21.915  21.915
  341    HB   THR  46           HB       THR  46   0.691  19.545  19.545
  342    HG1  THR  46           HG1      THR  46   1.117  20.628  20.628
  343   1HG2  THR  46          HG21      THR  46   2.876  18.891  18.891
  344   2HG2  THR  46          HG22      THR  46   3.729  20.033  20.033
  345   3HG2  THR  46          HG23      THR  46   2.924  18.656  18.656
  346    H    ALA  47           HN       ALA  47   3.366  20.779  20.779
  347    HA   ALA  47           HA       ALA  47   4.575  23.262  23.262
  348   1HB   ALA  47           HB1      ALA  47   4.861  23.438  23.438
  349   2HB   ALA  47           HB2      ALA  47   5.698  21.898  21.898
  350   3HB   ALA  47           HB3      ALA  47   6.400  23.295  23.295
  351    H    ALA  48           HN       ALA  48   5.236  20.145  20.145
  352    HA   ALA  48           HA       ALA  48   5.944  18.166  18.166
  353   1HB   ALA  48           HB1      ALA  48   6.183  19.333  19.333
  354   2HB   ALA  48           HB2      ALA  48   7.695  20.049  20.049
  355   3HB   ALA  48           HB3      ALA  48   7.546  18.306  18.306
  356    H    ASP  49           HN       ASP  49   7.583  21.033  21.033
  357    HA   ASP  49           HA       ASP  49   9.978  19.784  19.784
  358   1HB   ASP  49           HB1      ASP  49   9.984  21.959  21.959
  359   2HB   ASP  49           HB2      ASP  49   8.998  22.682  22.682
  360    H    ASP  50           HN       ASP  50   6.834  20.452  20.452
  361    HA   ASP  50           HA       ASP  50   7.328  20.581  20.581
  362   1HB   ASP  50           HB1      ASP  50   5.876  22.403  22.403
  363   2HB   ASP  50           HB2      ASP  50   4.794  21.177  21.177
  364    H    LYS  51           HN       LYS  51   6.931  18.444  18.444
  365    HA   LYS  51           HA       LYS  51   5.049  16.598  16.598
  366   1HB   LYS  51           HB1      LYS  51   6.671  16.267  16.267
  367   2HB   LYS  51           HB2      LYS  51   5.622  15.039  15.039
  368   1HG   LYS  51           HG1      LYS  51   3.676  16.562  16.562
  369   2HG   LYS  51           HG2      LYS  51   4.753  17.759  17.759
  370   1HD   LYS  51           HD1      LYS  51   5.403  16.077  16.077
  371   2HD   LYS  51           HD2      LYS  51   4.281  14.941  14.941
  372   1HE   LYS  51           HE1      LYS  51   2.388  16.217  16.217
  373   2HE   LYS  51           HE2      LYS  51   3.338  17.632  17.632
  374   1HZ   LYS  51           HZ1      LYS  51   4.233  15.446  15.446
  375   2HZ   LYS  51           HZ2      LYS  51   2.541  15.489  15.489
  376   3HZ   LYS  51           HZ3      LYS  51   3.457  16.852  16.852
  377    H    GLN  52           HN       GLN  52   8.314  16.943  16.943
  378    HA   GLN  52           HA       GLN  52   9.822  14.920  14.920
  379   1HB   GLN  52           HB1      GLN  52  10.208  17.785  17.785
  380   2HB   GLN  52           HB2      GLN  52  11.056  17.102  17.102
  381   1HG   GLN  52           HG1      GLN  52  12.557  17.279  17.279
  382   2HG   GLN  52           HG2      GLN  52  12.323  15.596  15.596
  383   1HE2  GLN  52          HE21      GLN  52   9.940  15.991  15.991
  384   2HE2  GLN  52          HE22      GLN  52   9.473  16.402  16.402
  385    HA   PRO  53           HA       PRO  53   9.989  15.276  15.276
  386   1HB   PRO  53           HB1      PRO  53   7.656  16.434  16.434
  387   2HB   PRO  53           HB2      PRO  53   9.216  17.247  17.247
  388   1HG   PRO  53           HG1      PRO  53   6.890  17.212  17.212
  389   2HG   PRO  53           HG2      PRO  53   7.757  18.619  18.619
  390   1HD   PRO  53           HD1      PRO  53   8.534  17.714  17.714
  391   2HD   PRO  53           HD2      PRO  53   9.815  17.990  17.990
  392    H    TYR  54           HN       TYR  54   6.807  15.133  15.133
  393    HA   TYR  54           HA       TYR  54   5.907  12.846  12.846
  394   1HB   TYR  54           HB1      TYR  54   4.745  14.147  14.147
  395   2HB   TYR  54           HB2      TYR  54   3.912  12.962  12.962
  396    HD1  TYR  54           HD1      TYR  54   4.152  13.742  13.742
  397    HD2  TYR  54           HD2      TYR  54   4.021  16.313  16.313
  398    HE1  TYR  54           HE1      TYR  54   3.344  15.566  15.566
  399    HE2  TYR  54           HE2      TYR  54   3.210  18.138  18.138
  400    HH   TYR  54           HH       TYR  54   1.911  17.746  17.746
  401    H    GLU  55           HN       GLU  55   6.638  13.420  13.420
  402    HA   GLU  55           HA       GLU  55   6.332  10.843  10.843
  403   1HB   GLU  55           HB1      GLU  55   7.448  13.359  13.359
  404   2HB   GLU  55           HB2      GLU  55   8.618  12.136  12.136
  405   1HG   GLU  55           HG1      GLU  55   6.712  10.827  10.827
  406   2HG   GLU  55           HG2      GLU  55   5.642  12.155  12.155
  407    H    LYS  56           HN       LYS  56   9.421  12.170  12.170
  408    HA   LYS  56           HA       LYS  56  11.057  10.016  10.016
  409   1HB   LYS  56           HB1      LYS  56  11.802  12.231  12.231
  410   2HB   LYS  56           HB2      LYS  56  10.938  11.962  11.962
  411   1HG   LYS  56           HG1      LYS  56  13.363  11.617  11.617
  412   2HG   LYS  56           HG2      LYS  56  12.486  10.137  10.137
  413   1HD   LYS  56           HD1      LYS  56  13.084   9.236   9.236
  414   2HD   LYS  56           HD2      LYS  56  13.834  10.758  10.758
  415   1HE   LYS  56           HE1      LYS  56  14.739   9.045   9.045
  416   2HE   LYS  56           HE2      LYS  56  15.499   9.006   9.006
  417   1HZ   LYS  56           HZ1      LYS  56  15.270  11.673  11.673
  418   2HZ   LYS  56           HZ2      LYS  56  15.978  10.772  10.772
  419   3HZ   LYS  56           HZ3      LYS  56  16.675  10.771  10.771
  420    H    LYS  57           HN       LYS  57   8.698  10.429  10.429
  421    HA   LYS  57           HA       LYS  57   9.553   8.043   8.043
  422   1HB   LYS  57           HB1      LYS  57   8.467   9.947   9.947
  423   2HB   LYS  57           HB2      LYS  57   7.030   9.749   9.749
  424   1HG   LYS  57           HG1      LYS  57   6.321   7.836   7.836
  425   2HG   LYS  57           HG2      LYS  57   7.937   7.311   7.311
  426   1HD   LYS  57           HD1      LYS  57   6.621   9.761   9.761
  427   2HD   LYS  57           HD2      LYS  57   6.464   8.159   8.159
  428   1HE   LYS  57           HE1      LYS  57   9.133   9.583   9.583
  429   2HE   LYS  57           HE2      LYS  57   8.343   9.425   9.425
  430   1HZ   LYS  57           HZ1      LYS  57   8.501   6.883   6.883
  431   2HZ   LYS  57           HZ2      LYS  57  10.030   7.610   7.610
  432   3HZ   LYS  57           HZ3      LYS  57   9.282   7.468   7.468
  433    H    ALA  58           HN       ALA  58   6.728   8.926   8.926
  434    HA   ALA  58           HA       ALA  58   5.349   6.533   6.533
  435   1HB   ALA  58           HB1      ALA  58   5.933   8.379   8.379
  436   2HB   ALA  58           HB2      ALA  58   4.631   7.199   7.199
  437   3HB   ALA  58           HB3      ALA  58   4.636   8.567   8.567
  438    H    ALA  59           HN       ALA  59   8.100   7.471   7.471
  439    HA   ALA  59           HA       ALA  59   8.423   5.231   5.231
  440   1HB   ALA  59           HB1      ALA  59  10.611   6.947   6.947
  441   2HB   ALA  59           HB2      ALA  59  10.841   5.924   5.924
  442   3HB   ALA  59           HB3      ALA  59   9.790   7.326   7.326
  443    H    LYS  60           HN       LYS  60  10.195   5.835   5.835
  444    HA   LYS  60           HA       LYS  60  11.473   3.447   3.447
  445   1HB   LYS  60           HB1      LYS  60  11.678   5.402   5.402
  446   2HB   LYS  60           HB2      LYS  60  10.048   5.162   5.162
  447   1HG   LYS  60           HG1      LYS  60  11.512   4.216   4.216
  448   2HG   LYS  60           HG2      LYS  60  10.667   2.903   2.903
  449   1HD   LYS  60           HD1      LYS  60  12.926   2.152   2.152
  450   2HD   LYS  60           HD2      LYS  60  12.752   2.620   2.620
  451   1HE   LYS  60           HE1      LYS  60  14.859   3.519   3.519
  452   2HE   LYS  60           HE2      LYS  60  13.781   4.873   4.873
  453   1HZ   LYS  60           HZ1      LYS  60  13.359   3.916   3.916
  454   2HZ   LYS  60           HZ2      LYS  60  15.024   4.152   4.152
  455   3HZ   LYS  60           HZ3      LYS  60  13.940   5.431   5.431
  456    H    LEU  61           HN       LEU  61   8.194   4.185   4.185
  457    HA   LEU  61           HA       LEU  61   7.600   1.615   1.615
  458   1HB   LEU  61           HB1      LEU  61   5.688   3.693   3.693
  459   2HB   LEU  61           HB2      LEU  61   5.266   2.425   2.425
  460    HG   LEU  61           HG       LEU  61   7.328   4.633   4.633
  461   1HD1  LEU  61          HD11      LEU  61   4.524   4.302   4.302
  462   2HD1  LEU  61          HD12      LEU  61   5.696   5.516   5.516
  463   3HD1  LEU  61          HD13      LEU  61   5.101   5.522   5.522
  464   1HD2  LEU  61          HD21      LEU  61   6.275   2.462   2.462
  465   2HD2  LEU  61          HD22      LEU  61   7.907   2.557   2.557
  466   3HD2  LEU  61          HD23      LEU  61   7.340   3.785   3.785
  467    H    LYS  62           HN       LYS  62   6.488   2.868   2.868
  468    HA   LYS  62           HA       LYS  62   5.277   0.512   0.512
  469   1HB   LYS  62           HB1      LYS  62   7.136   2.299   2.299
  470   2HB   LYS  62           HB2      LYS  62   5.972   1.145   1.145
  471   1HG   LYS  62           HG1      LYS  62   4.113   2.482   2.482
  472   2HG   LYS  62           HG2      LYS  62   5.277   3.628   3.628
  473   1HD   LYS  62           HD1      LYS  62   4.353   4.498   4.498
  474   2HD   LYS  62           HD2      LYS  62   6.034   4.089   4.089
  475   1HE   LYS  62           HE1      LYS  62   4.565   3.306   3.306
  476   2HE   LYS  62           HE2      LYS  62   5.395   1.965   1.965
  477   1HZ   LYS  62           HZ1      LYS  62   2.967   2.410   2.410
  478   2HZ   LYS  62           HZ2      LYS  62   2.664   2.337   2.337
  479   3HZ   LYS  62           HZ3      LYS  62   3.463   1.054   1.054
  480    H    GLU  63           HN       GLU  63   8.592   1.466   1.466
  481    HA   GLU  63           HA       GLU  63   9.736  -0.769  -0.769
  482   1HB   GLU  63           HB1      GLU  63  10.838   1.469   1.469
  483   2HB   GLU  63           HB2      GLU  63  10.848   1.295   1.295
  484   1HG   GLU  63           HG1      GLU  63  12.449  -0.618  -0.618
  485   2HG   GLU  63           HG2      GLU  63  12.470  -0.362  -0.362
  486    H    LYS  64           HN       LYS  64   9.215  -0.092  -0.092
  487    HA   LYS  64           HA       LYS  64  10.634  -2.404  -2.404
  488   1HB   LYS  64           HB1      LYS  64   9.932  -0.314  -0.314
  489   2HB   LYS  64           HB2      LYS  64   8.335  -1.031  -1.031
  490   1HG   LYS  64           HG1      LYS  64   9.321  -3.063  -3.063
  491   2HG   LYS  64           HG2      LYS  64  10.923  -2.365  -2.365
  492   1HD   LYS  64           HD1      LYS  64  10.204  -1.991  -1.991
  493   2HD   LYS  64           HD2      LYS  64  10.111  -0.440  -0.440
  494   1HE   LYS  64           HE1      LYS  64   7.652  -0.749  -0.749
  495   2HE   LYS  64           HE2      LYS  64   7.752  -2.331  -2.331
  496   1HZ   LYS  64           HZ1      LYS  64   8.948  -0.458  -0.458
  497   2HZ   LYS  64           HZ2      LYS  64   7.442   0.158   0.158
  498   3HZ   LYS  64           HZ3      LYS  64   7.538  -1.365  -1.365
  499    H    TYR  65           HN       TYR  65   7.178  -1.832  -1.832
  500    HA   TYR  65           HA       TYR  65   6.319  -4.439  -4.439
  501   1HB   TYR  65           HB1      TYR  65   4.610  -2.796  -2.796
  502   2HB   TYR  65           HB2      TYR  65   5.174  -2.204  -2.204
  503    HD1  TYR  65           HD1      TYR  65   4.782  -3.643  -3.643
  504    HD2  TYR  65           HD2      TYR  65   2.828  -4.453  -4.453
  505    HE1  TYR  65           HE1      TYR  65   3.150  -5.027  -5.027
  506    HE2  TYR  65           HE2      TYR  65   1.194  -5.845  -5.845
  507    HH   TYR  65           HH       TYR  65   0.271  -5.955  -5.955
  508    H    GLU  66           HN       GLU  66   7.016  -3.201  -3.201
  509    HA   GLU  66           HA       GLU  66   6.547  -5.688  -5.688
  510   1HB   GLU  66           HB1      GLU  66   8.464  -3.571  -3.571
  511   2HB   GLU  66           HB2      GLU  66   7.805  -4.853  -4.853
  512   1HG   GLU  66           HG1      GLU  66   5.467  -3.868  -3.868
  513   2HG   GLU  66           HG2      GLU  66   6.399  -2.430  -2.430
  514    H    LYS  67           HN       LYS  67   9.293  -4.764  -4.764
  515    HA   LYS  67           HA       LYS  67  10.933  -6.875  -6.875
  516   1HB   LYS  67           HB1      LYS  67  11.528  -4.450  -4.450
  517   2HB   LYS  67           HB2      LYS  67  12.589  -5.815  -5.815
  518   1HG   LYS  67           HG1      LYS  67  13.536  -4.513  -4.513
  519   2HG   LYS  67           HG2      LYS  67  12.919  -5.998  -5.998
  520   1HD   LYS  67           HD1      LYS  67  10.747  -4.383  -4.383
  521   2HD   LYS  67           HD2      LYS  67  11.991  -3.154  -3.154
  522   1HE   LYS  67           HE1      LYS  67  11.999  -5.554  -5.554
  523   2HE   LYS  67           HE2      LYS  67  11.696  -3.886  -3.886
  524   1HZ   LYS  67           HZ1      LYS  67  14.114  -3.986  -3.986
  525   2HZ   LYS  67           HZ2      LYS  67  14.133  -5.209  -5.209
  526   3HZ   LYS  67           HZ3      LYS  67  13.851  -3.597  -3.597
  527    H    ASP  68           HN       ASP  68   9.195  -6.212  -6.212
  528    HA   ASP  68           HA       ASP  68  10.306  -8.390  -8.390
  529   1HB   ASP  68           HB1      ASP  68   8.027  -6.455  -6.455
  530   2HB   ASP  68           HB2      ASP  68   8.530  -7.704  -7.704
  531    H    ILE  69           HN       ILE  69   7.791  -7.680  -7.680
  532    HA   ILE  69           HA       ILE  69   6.239 -10.054 -10.054
  533    HB   ILE  69           HB       ILE  69   5.192  -7.801  -7.801
  534   1HG1  ILE  69          HG11      ILE  69   3.335  -8.730  -8.730
  535   2HG1  ILE  69          HG12      ILE  69   4.140  -9.619  -9.619
  536   1HG2  ILE  69          HG21      ILE  69   6.819  -7.443  -7.443
  537   2HG2  ILE  69          HG22      ILE  69   6.094  -8.749  -8.749
  538   3HG2  ILE  69          HG23      ILE  69   5.148  -7.312  -7.312
  539   1HD1  ILE  69          HD11      ILE  69   4.075 -10.413 -10.413
  540   2HD1  ILE  69          HD12      ILE  69   3.125 -11.151 -11.151
  541   3HD1  ILE  69          HD13      ILE  69   4.866 -11.305 -11.305
  542    H    ALA  70           HN       ALA  70   8.259  -8.800  -8.800
  543    HA   ALA  70           HA       ALA  70   8.208 -11.049 -11.049
  544   1HB   ALA  70           HB1      ALA  70  10.484  -9.057  -9.057
  545   2HB   ALA  70           HB2      ALA  70  10.379 -10.137 -10.137
  546   3HB   ALA  70           HB3      ALA  70   9.201  -8.862  -8.862
  547    H    ALA  71           HN       ALA  71   9.847 -10.332 -10.332
  548    HA   ALA  71           HA       ALA  71  11.659 -12.629 -12.629
  549   1HB   ALA  71           HB1      ALA  71  11.090 -10.643 -10.643
  550   2HB   ALA  71           HB2      ALA  71  12.373 -11.847 -11.847
  551   3HB   ALA  71           HB3      ALA  71  12.417 -10.534 -10.534
  552    H    TYR  72           HN       TYR  72   8.703 -11.586 -11.586
  553    HA   TYR  72           HA       TYR  72   8.272 -13.619 -13.619
  554   1HB   TYR  72           HB1      TYR  72   6.863 -11.673 -11.673
  555   2HB   TYR  72           HB2      TYR  72   6.296 -12.108 -12.108
  556    HD1  TYR  72           HD1      TYR  72   6.515 -13.713 -13.713
  557    HD2  TYR  72           HD2      TYR  72   4.217 -13.076 -13.076
  558    HE1  TYR  72           HE1      TYR  72   4.682 -15.031 -15.031
  559    HE2  TYR  72           HE2      TYR  72   2.386 -14.393 -14.393
  560    HH   TYR  72           HH       TYR  72   2.506 -16.460 -16.460
  561    H    ARG  73           HN       ARG  73   7.173 -13.386 -13.386
  562    HA   ARG  73           HA       ARG  73   6.006 -15.968 -15.968
  563   1HB   ARG  73           HB1      ARG  73   6.984 -13.954 -13.954
  564   2HB   ARG  73           HB2      ARG  73   6.157 -15.425 -15.425
  565   1HG   ARG  73           HG1      ARG  73   4.790 -13.763 -13.763
  566   2HG   ARG  73           HG2      ARG  73   4.891 -13.028 -13.028
  567   1HD   ARG  73           HD1      ARG  73   3.829 -15.862 -15.862
  568   2HD   ARG  73           HD2      ARG  73   2.797 -14.435 -14.435
  569    HE   ARG  73           HE       ARG  73   3.671 -14.040 -14.040
  570   1HH1  ARG  73          HH11      ARG  73   5.824 -15.747 -15.747
  571   2HH1  ARG  73          HH12      ARG  73   5.144 -17.206 -17.206
  572   1HH2  ARG  73          HH21      ARG  73   1.932 -16.470 -16.470
  573   2HH2  ARG  73          HH22      ARG  73   2.889 -17.624 -17.624
  574    H    ALA  74           HN       ALA  74   9.011 -14.598 -14.598
  575    HA   ALA  74           HA       ALA  74  10.268 -16.661 -16.661
  576   1HB   ALA  74           HB1      ALA  74  11.506 -14.795 -14.795
  577   2HB   ALA  74           HB2      ALA  74  12.405 -15.748 -15.748
  578   3HB   ALA  74           HB3      ALA  74  11.312 -14.498 -14.498
  579    H    LYS  75           HN       LYS  75   9.674 -16.593 -16.593
  580    HA   LYS  75           HA       LYS  75  10.969 -19.284 -19.284
  581   1HB   LYS  75           HB1      LYS  75  12.405 -17.556 -17.556
  582   2HB   LYS  75           HB2      LYS  75  11.135 -17.049 -17.049
  583   1HG   LYS  75           HG1      LYS  75  11.151 -19.247 -19.247
  584   2HG   LYS  75           HG2      LYS  75  12.324 -19.863 -19.863
  585   1HD   LYS  75           HD1      LYS  75  12.822 -17.533 -17.533
  586   2HD   LYS  75           HD2      LYS  75  13.313 -19.183 -19.183
  587   1HE   LYS  75           HE1      LYS  75  14.730 -19.131 -19.131
  588   2HE   LYS  75           HE2      LYS  75  14.303 -17.445 -17.445
  589   1HZ   LYS  75           HZ1      LYS  75  15.199 -17.863 -17.863
  590   2HZ   LYS  75           HZ2      LYS  75  16.344 -18.445 -18.445
  591   3HZ   LYS  75           HZ3      LYS  75  15.823 -16.833 -16.833
  592    H    GLY  76           HN       GLY  76   8.338 -17.342 -17.342
  593   1HA   GLY  76           HA1      GLY  76   7.504 -19.191 -19.191
  594   2HA   GLY  76           HA2      GLY  76   6.506 -17.943 -17.943
  595    H    LYS  77           HN       LYS  77   4.954 -18.502 -18.502
  596    HA   LYS  77           HA       LYS  77   3.380 -19.891 -19.891
  597   1HB   LYS  77           HB1      LYS  77   6.004 -21.364 -21.364
  598   2HB   LYS  77           HB2      LYS  77   4.479 -21.735 -21.735
  599   1HG   LYS  77           HG1      LYS  77   4.279 -19.288 -19.288
  600   2HG   LYS  77           HG2      LYS  77   5.925 -19.087 -19.087
  601   1HD   LYS  77           HD1      LYS  77   6.814 -20.613 -20.613
  602   2HD   LYS  77           HD2      LYS  77   5.219 -21.210 -21.210
  603   1HE   LYS  77           HE1      LYS  77   6.144 -18.337 -18.337
  604   2HE   LYS  77           HE2      LYS  77   6.099 -19.581 -19.581
  605   1HZ   LYS  77           HZ1      LYS  77   3.622 -19.517 -19.517
  606   2HZ   LYS  77           HZ2      LYS  77   4.037 -17.934 -17.934
  607   3HZ   LYS  77           HZ3      LYS  77   3.970 -19.150 -19.150
  608    HA   PRO  78           HA       PRO  78   2.899 -23.627 -23.627
  609   1HB   PRO  78           HB1      PRO  78   2.407 -25.503 -25.503
  610   2HB   PRO  78           HB2      PRO  78   1.314 -25.018 -25.018
  611   1HG   PRO  78           HG1      PRO  78   0.909 -24.112 -24.112
  612   2HG   PRO  78           HG2      PRO  78   0.617 -23.034 -23.034
  613   1HD   PRO  78           HD1      PRO  78   3.162 -23.274 -23.274
  614   2HD   PRO  78           HD2      PRO  78   2.226 -21.791 -21.791
  615    H    ASP  79           HN       ASP  79   5.323 -23.024 -23.024
  616    HA   ASP  79           HA       ASP  79   7.596 -23.553 -23.553
  617   1HB   ASP  79           HB1      ASP  79   6.380 -26.180 -26.180
  618   2HB   ASP  79           HB2      ASP  79   8.054 -25.705 -25.705
  619    H    ALA  80           HN       ALA  80   6.868 -23.447 -23.447
  620    HA   ALA  80           HA       ALA  80   6.759 -24.201 -24.201
  621   1HB   ALA  80           HB1      ALA  80   8.995 -23.299 -23.299
  622   2HB   ALA  80           HB2      ALA  80   9.558 -24.876 -24.876
  623   3HB   ALA  80           HB3      ALA  80   9.121 -24.617 -24.617
  624    H    ALA  81           HN       ALA  81   5.716 -26.340 -26.340
  625    HA   ALA  81           HA       ALA  81   6.266 -28.634 -28.634
  626   1HB   ALA  81           HB1      ALA  81   6.175 -28.739 -28.739
  627   2HB   ALA  81           HB2      ALA  81   6.301 -30.144 -30.144
  628   3HB   ALA  81           HB3      ALA  81   7.607 -28.971 -28.971
  629   1H1   BME  16           HE1      MER  16  -8.246   8.948   8.948
  630   2H1   BME  16           HE2      MER  16  -7.907   9.344   9.344
  631   1H2   BME  16           HZ1      MER  16  -5.783   8.918   8.918
  632   2H2   BME  16           HZ2      MER  16  -5.836  10.522  10.522
  633    HO1  BME  16           HH       MER  16  -8.726  11.201  11.201

  Start of MODEL   17
    1    H    ASN   3           HN       ASN   3   1.426 -10.986 -10.986
    2    HA   ASN   3           HA       ASN   3   1.979 -13.263 -13.263
    3   1HB   ASN   3           HB1      ASN   3  -0.369 -14.074 -14.074
    4   2HB   ASN   3           HB2      ASN   3   0.913 -14.216 -14.216
    5   1HD2  ASN   3          HD21      ASN   3  -0.869 -12.353 -12.353
    6   2HD2  ASN   3          HD22      ASN   3   0.286 -13.550 -13.550
    7    H    ALA   4           HN       ALA   4   2.173 -11.461 -11.461
    8    HA   ALA   4           HA       ALA   4   1.416 -10.554 -10.554
    9   1HB   ALA   4           HB1      ALA   4  -0.277 -12.393 -12.393
   10   2HB   ALA   4           HB2      ALA   4  -1.412 -11.479 -11.479
   11   3HB   ALA   4           HB3      ALA   4  -0.916 -10.869 -10.869
   12    HA   PRO   5           HA       PRO   5   0.717  -6.524  -6.524
   13   1HB   PRO   5           HB1      PRO   5   2.286  -6.152  -6.152
   14   2HB   PRO   5           HB2      PRO   5   2.344  -5.216  -5.216
   15   1HG   PRO   5           HG1      PRO   5   4.190  -7.074  -7.074
   16   2HG   PRO   5           HG2      PRO   5   3.262  -7.156  -7.156
   17   1HD   PRO   5           HD1      PRO   5   2.784  -8.734  -8.734
   18   2HD   PRO   5           HD2      PRO   5   2.900  -9.369  -9.369
   19    H    LYS   6           HN       LYS   6   0.842  -5.298  -5.298
   20    HA   LYS   6           HA       LYS   6  -1.371  -5.495  -5.495
   21   1HB   LYS   6           HB1      LYS   6  -2.240  -4.445  -4.445
   22   2HB   LYS   6           HB2      LYS   6  -2.552  -3.258  -3.258
   23   1HG   LYS   6           HG1      LYS   6  -3.470  -6.147  -6.147
   24   2HG   LYS   6           HG2      LYS   6  -4.460  -4.846  -4.846
   25   1HD   LYS   6           HD1      LYS   6  -4.203  -3.611  -3.611
   26   2HD   LYS   6           HD2      LYS   6  -3.258  -4.940  -4.940
   27   1HE   LYS   6           HE1      LYS   6  -5.189  -6.478  -6.478
   28   2HE   LYS   6           HE2      LYS   6  -6.140  -5.163  -5.163
   29   1HZ   LYS   6           HZ1      LYS   6  -5.057  -4.330  -4.330
   30   2HZ   LYS   6           HZ2      LYS   6  -5.800  -5.841  -5.841
   31   3HZ   LYS   6           HZ3      LYS   6  -6.687  -4.547  -4.547
   32    H    ARG   7           HN       ARG   7  -2.146  -2.869  -2.869
   33    HA   ARG   7           HA       ARG   7   0.443  -1.652  -1.652
   34   1HB   ARG   7           HB1      ARG   7  -1.132  -2.298  -2.298
   35   2HB   ARG   7           HB2      ARG   7  -2.345  -1.225  -1.225
   36   1HG   ARG   7           HG1      ARG   7   0.332   0.011   0.011
   37   2HG   ARG   7           HG2      ARG   7  -0.518  -0.553  -0.553
   38   1HD   ARG   7           HD1      ARG   7  -1.726   1.394   1.394
   39   2HD   ARG   7           HD2      ARG   7  -0.961   1.858   1.858
   40    HE   ARG   7           HE       ARG   7  -2.727   0.361   0.361
   41   1HH1  ARG   7          HH11      ARG   7  -3.814  -0.138  -0.138
   42   2HH1  ARG   7          HH12      ARG   7  -5.249   0.828   0.828
   43   1HH2  ARG   7          HH21      ARG   7  -4.236   2.491   2.491
   44   2HH2  ARG   7          HH22      ARG   7  -5.494   2.357   2.357
   45    HA   PRO   8           HA       PRO   8  -0.629   0.996   0.996
   46   1HB   PRO   8           HB1      PRO   8   1.823   2.247   2.247
   47   2HB   PRO   8           HB2      PRO   8   1.558   0.572   0.572
   48   1HG   PRO   8           HG1      PRO   8   2.555   1.597   1.597
   49   2HG   PRO   8           HG2      PRO   8   3.362   0.457   0.457
   50   1HD   PRO   8           HD1      PRO   8   1.865  -0.503  -0.503
   51   2HD   PRO   8           HD2      PRO   8   1.671  -1.250  -1.250
   52    HA   PRO   9           HA       PRO   9  -1.225   5.529   5.529
   53   1HB   PRO   9           HB1      PRO   9   1.487   6.249   6.249
   54   2HB   PRO   9           HB2      PRO   9  -0.060   6.579   6.579
   55   1HG   PRO   9           HG1      PRO   9   1.798   4.228   4.228
   56   2HG   PRO   9           HG2      PRO   9   0.723   4.995   4.995
   57   1HD   PRO   9           HD1      PRO   9  -0.032   2.643   2.643
   58   2HD   PRO   9           HD2      PRO   9  -1.240   3.942   3.942
   59    H    SER  10           HN       SER  10  -0.122   7.447   7.447
   60    HA   SER  10           HA       SER  10   1.137   6.595   6.595
   61   1HB   SER  10           HB1      SER  10  -0.873   8.816   8.816
   62   2HB   SER  10           HB2      SER  10  -0.139   8.420   8.420
   63    HG   SER  10           HG       SER  10  -1.479   6.831   6.831
   64    H    ALA  11           HN       ALA  11   0.851   9.404   9.404
   65    HA   ALA  11           HA       ALA  11   3.281  10.343  10.343
   66   1HB   ALA  11           HB1      ALA  11   2.646  11.337  11.337
   67   2HB   ALA  11           HB2      ALA  11   3.960  11.919  11.919
   68   3HB   ALA  11           HB3      ALA  11   4.015  10.298  10.298
   69    H    PHE  12           HN       PHE  12   0.585  10.992  10.992
   70    HA   PHE  12           HA       PHE  12  -0.241  13.583  13.583
   71   1HB   PHE  12           HB1      PHE  12  -0.994  12.873  12.873
   72   2HB   PHE  12           HB2      PHE  12  -1.323  11.221  11.221
   73    HD1  PHE  12           HD1      PHE  12  -2.505  14.717  14.717
   74    HD2  PHE  12           HD2      PHE  12  -3.482  10.622  10.622
   75    HE1  PHE  12           HE1      PHE  12  -4.887  15.243  15.243
   76    HE2  PHE  12           HE2      PHE  12  -5.846  11.133  11.133
   77    HZ   PHE  12           HZ       PHE  12  -6.565  13.449  13.449
   78    H    PHE  13           HN       PHE  13  -0.481  10.412  10.412
   79    HA   PHE  13           HA       PHE  13  -2.838  10.768  10.768
   80   1HB   PHE  13           HB1      PHE  13  -1.546   8.576   8.576
   81   2HB   PHE  13           HB2      PHE  13  -0.566   8.978   8.978
   82    HD1  PHE  13           HD1      PHE  13  -3.959   8.209   8.209
   83    HD2  PHE  13           HD2      PHE  13  -1.561   8.852   8.852
   84    HE1  PHE  13           HE1      PHE  13  -5.794   7.403   7.403
   85    HE2  PHE  13           HE2      PHE  13  -3.398   8.040   8.040
   86    HZ   PHE  13           HZ       PHE  13  -5.518   7.317   7.317
   87    H    LEU  14           HN       LEU  14   0.628  11.124  11.124
   88    HA   LEU  14           HA       LEU  14   0.413  11.814  11.814
   89   1HB   LEU  14           HB1      LEU  14   2.388  12.995  12.995
   90   2HB   LEU  14           HB2      LEU  14   2.606  12.974  12.974
   91    HG   LEU  14           HG       LEU  14   4.067  11.317  11.317
   92   1HD1  LEU  14          HD11      LEU  14   2.823  10.364  10.364
   93   2HD1  LEU  14          HD12      LEU  14   1.619   9.699   9.699
   94   3HD1  LEU  14          HD13      LEU  14   3.278   9.122   9.122
   95   1HD2  LEU  14          HD21      LEU  14   3.464  11.183  11.183
   96   2HD2  LEU  14          HD22      LEU  14   3.662   9.581   9.581
   97   3HD2  LEU  14          HD23      LEU  14   2.055  10.193  10.193
   98    H    PHE  15           HN       PHE  15   0.731  13.972  13.972
   99    HA   PHE  15           HA       PHE  15   0.122  16.432  16.432
  100   1HB   PHE  15           HB1      PHE  15   1.196  16.635  16.635
  101   2HB   PHE  15           HB2      PHE  15   0.396  15.188  15.188
  102    HD1  PHE  15           HD1      PHE  15  -1.905  15.396  15.396
  103    HD2  PHE  15           HD2      PHE  15   0.560  18.791  18.791
  104    HE1  PHE  15           HE1      PHE  15  -3.228  16.730  16.730
  105    HE2  PHE  15           HE2      PHE  15  -0.794  20.124  20.124
  106    HZ   PHE  15           HZ       PHE  15  -2.683  19.082  19.082
  107    H    CYS  16           HN       MER  16  -2.139  14.279  14.279
  108    HA   CYS  16           HA       MER  16  -4.471  15.791  15.791
  109   1HB   CYS  16           HB1      MER  16  -4.704  13.829  13.829
  110   2HB   CYS  16           HB2      MER  16  -3.964  12.811  12.811
  111    H    SER  17           HN       SER  17  -3.186  13.293  13.293
  112    HA   SER  17           HA       SER  17  -5.126  13.428  13.428
  113   1HB   SER  17           HB1      SER  17  -2.122  12.920  12.920
  114   2HB   SER  17           HB2      SER  17  -3.325  12.630  12.630
  115    HG   SER  17           HG       SER  17  -2.790  11.206  11.206
  116    H    GLU  18           HN       GLU  18  -2.069  15.115  15.115
  117    HA   GLU  18           HA       GLU  18  -1.928  16.650  16.650
  118   1HB   GLU  18           HB1      GLU  18  -0.364  16.681  16.681
  119   2HB   GLU  18           HB2      GLU  18  -1.482  17.732  17.732
  120   1HG   GLU  18           HG1      GLU  18  -1.277  19.472  19.472
  121   2HG   GLU  18           HG2      GLU  18  -0.225  18.430  18.430
  122    H    TYR  19           HN       TYR  19  -3.929  17.590  17.590
  123    HA   TYR  19           HA       TYR  19  -5.476  19.310  19.310
  124   1HB   TYR  19           HB1      TYR  19  -5.513  21.088  21.088
  125   2HB   TYR  19           HB2      TYR  19  -3.823  20.603  20.603
  126    HD1  TYR  19           HD1      TYR  19  -2.614  19.277  19.277
  127    HD2  TYR  19           HD2      TYR  19  -6.513  20.886  20.886
  128    HE1  TYR  19           HE1      TYR  19  -2.371  19.017  19.017
  129    HE2  TYR  19           HE2      TYR  19  -6.265  20.620  20.620
  130    HH   TYR  19           HH       TYR  19  -3.775  20.483  20.483
  131    H    ARG  20           HN       ARG  20  -6.180  16.756  16.756
  132    HA   ARG  20           HA       ARG  20  -8.167  16.693  16.693
  133   1HB   ARG  20           HB1      ARG  20  -7.079  14.640  14.640
  134   2HB   ARG  20           HB2      ARG  20  -8.109  14.917  14.917
  135   1HG   ARG  20           HG1      ARG  20 -10.115  14.829  14.829
  136   2HG   ARG  20           HG2      ARG  20  -9.012  14.262  14.262
  137   1HD   ARG  20           HD1      ARG  20  -9.599  12.920  12.920
  138   2HD   ARG  20           HD2      ARG  20 -10.027  12.315  12.315
  139    HE   ARG  20           HE       ARG  20  -7.520  12.136  12.136
  140   1HH1  ARG  20          HH11      ARG  20  -7.121  13.426  13.426
  141   2HH1  ARG  20          HH12      ARG  20  -6.595  12.032  12.032
  142   1HH2  ARG  20          HH21      ARG  20  -7.605   9.795   9.795
  143   2HH2  ARG  20          HH22      ARG  20  -6.871   9.938   9.938
  144    HA   PRO  21           HA       PRO  21 -11.177  17.319  17.319
  145   1HB   PRO  21           HB1      PRO  21  -9.396  18.993  18.993
  146   2HB   PRO  21           HB2      PRO  21 -10.608  17.786  17.786
  147   1HG   PRO  21           HG1      PRO  21  -8.048  17.047  17.047
  148   2HG   PRO  21           HG2      PRO  21  -9.173  15.939  15.939
  149   1HD   PRO  21           HD1      PRO  21  -7.403  18.063  18.063
  150   2HD   PRO  21           HD2      PRO  21  -7.463  16.327  16.327
  151    H    LYS  22           HN       LYS  22  -8.821  19.900  19.900
  152    HA   LYS  22           HA       LYS  22 -10.532  22.115  22.115
  153   1HB   LYS  22           HB1      LYS  22  -8.102  22.363  22.363
  154   2HB   LYS  22           HB2      LYS  22  -8.055  21.620  21.620
  155   1HG   LYS  22           HG1      LYS  22  -9.217  23.479  23.479
  156   2HG   LYS  22           HG2      LYS  22  -9.652  24.171  24.171
  157   1HD   LYS  22           HD1      LYS  22  -6.756  23.844  23.844
  158   2HD   LYS  22           HD2      LYS  22  -7.690  25.266  25.266
  159   1HE   LYS  22           HE1      LYS  22  -7.196  24.299  24.299
  160   2HE   LYS  22           HE2      LYS  22  -6.335  25.612  25.612
  161   1HZ   LYS  22           HZ1      LYS  22  -9.068  26.073  26.073
  162   2HZ   LYS  22           HZ2      LYS  22  -8.797  25.695  25.695
  163   3HZ   LYS  22           HZ3      LYS  22  -7.943  26.968  26.968
  164    H    ILE  23           HN       ILE  23 -10.143  19.774  19.774
  165    HA   ILE  23           HA       ILE  23 -11.615  21.537  21.537
  166    HB   ILE  23           HB       ILE  23 -11.264  18.522  18.522
  167   1HG1  ILE  23          HG11      ILE  23  -9.267  20.667  20.667
  168   2HG1  ILE  23          HG12      ILE  23  -9.017  19.553  19.553
  169   1HG2  ILE  23          HG21      ILE  23 -12.842  19.745  19.745
  170   2HG2  ILE  23          HG22      ILE  23 -11.559  20.842  20.842
  171   3HG2  ILE  23          HG23      ILE  23 -11.479  19.144  19.144
  172   1HD1  ILE  23          HD11      ILE  23  -9.239  17.627  17.627
  173   2HD1  ILE  23          HD12      ILE  23  -9.443  18.723  18.723
  174   3HD1  ILE  23          HD13      ILE  23  -7.928  18.698  18.698
  175    H    LYS  24           HN       LYS  24 -12.040  18.600  18.600
  176    HA   LYS  24           HA       LYS  24 -14.633  17.863  17.863
  177   1HB   LYS  24           HB1      LYS  24 -12.717  16.729  16.729
  178   2HB   LYS  24           HB2      LYS  24 -13.000  17.714  17.714
  179   1HG   LYS  24           HG1      LYS  24 -15.371  16.787  16.787
  180   2HG   LYS  24           HG2      LYS  24 -14.976  15.681  15.681
  181   1HD   LYS  24           HD1      LYS  24 -13.661  15.816  15.816
  182   2HD   LYS  24           HD2      LYS  24 -14.733  14.561  14.561
  183   1HE   LYS  24           HE1      LYS  24 -11.942  15.147  15.147
  184   2HE   LYS  24           HE2      LYS  24 -12.421  13.758  13.758
  185   1HZ   LYS  24           HZ1      LYS  24 -14.137  13.926  13.926
  186   2HZ   LYS  24           HZ2      LYS  24 -12.539  14.060  14.060
  187   3HZ   LYS  24           HZ3      LYS  24 -13.000  12.720  12.720
  188    H    GLY  25           HN       GLY  25 -13.481  20.251  20.251
  189   1HA   GLY  25           HA1      GLY  25 -15.949  20.689  20.689
  190   2HA   GLY  25           HA2      GLY  25 -14.477  21.659  21.659
  191    H    GLU  26           HN       GLU  26 -14.159  22.413  22.413
  192    HA   GLU  26           HA       GLU  26 -16.019  24.583  24.583
  193   1HB   GLU  26           HB1      GLU  26 -13.855  23.604  23.604
  194   2HB   GLU  26           HB2      GLU  26 -14.635  25.168  25.168
  195   1HG   GLU  26           HG1      GLU  26 -13.172  24.271  24.271
  196   2HG   GLU  26           HG2      GLU  26 -12.327  25.060  25.060
  197    H    HIS  27           HN       HIS  27 -15.566  21.598  21.598
  198    HA   HIS  27           HA       HIS  27 -18.083  22.084  22.084
  199   1HB   HIS  27           HB1      HIS  27 -15.604  20.586  20.586
  200   2HB   HIS  27           HB2      HIS  27 -17.031  20.984  20.984
  201    HD1  HIS  27           HD1      HIS  27 -17.459  23.746  23.746
  202    HD2  HIS  27           HD2      HIS  27 -13.632  22.482  22.482
  203    HE1  HIS  27           HE1      HIS  27 -16.007  25.698  25.698
  204    HA   PRO  28           HA       PRO  28 -18.637  18.156  18.156
  205   1HB   PRO  28           HB1      PRO  28 -20.844  18.835  18.835
  206   2HB   PRO  28           HB2      PRO  28 -19.259  19.425  19.425
  207   1HG   PRO  28           HG1      PRO  28 -21.293  20.866  20.866
  208   2HG   PRO  28           HG2      PRO  28 -20.567  21.471  21.471
  209   1HD   PRO  28           HD1      PRO  28 -19.461  22.095  22.095
  210   2HD   PRO  28           HD2      PRO  28 -18.407  21.796  21.796
  211    H    GLY  29           HN       GLY  29 -19.112  18.752  18.752
  212   1HA   GLY  29           HA1      GLY  29 -21.685  17.439  17.439
  213   2HA   GLY  29           HA2      GLY  29 -21.100  18.784  18.784
  214    H    LEU  30           HN       LEU  30 -18.298  17.572  17.572
  215    HA   LEU  30           HA       LEU  30 -18.061  16.021  16.021
  216   1HB   LEU  30           HB1      LEU  30 -16.035  16.558  16.558
  217   2HB   LEU  30           HB2      LEU  30 -15.624  16.022  16.022
  218    HG   LEU  30           HG       LEU  30 -16.697  18.684  18.684
  219   1HD1  LEU  30          HD11      LEU  30 -14.094  17.882  17.882
  220   2HD1  LEU  30          HD12      LEU  30 -14.545  19.535  19.535
  221   3HD1  LEU  30          HD13      LEU  30 -14.304  18.381  18.381
  222   1HD2  LEU  30          HD21      LEU  30 -17.800  18.178  18.178
  223   2HD2  LEU  30          HD22      LEU  30 -16.617  19.456  19.456
  224   3HD2  LEU  30          HD23      LEU  30 -16.238  17.834  17.834
  225    H    SER  31           HN       SER  31 -16.936  14.004  14.004
  226    HA   SER  31           HA       SER  31 -17.618  12.127  12.127
  227   1HB   SER  31           HB1      SER  31 -17.351  11.537  11.537
  228   2HB   SER  31           HB2      SER  31 -17.918  10.411  10.411
  229    HG   SER  31           HG       SER  31 -19.252  12.376  12.376
  230    H    ILE  32           HN       ILE  32 -16.035  10.147  10.147
  231    HA   ILE  32           HA       ILE  32 -13.386  11.147  11.147
  232    HB   ILE  32           HB       ILE  32 -14.367   9.034   9.034
  233   1HG1  ILE  32          HG11      ILE  32 -12.396   7.534   7.534
  234   2HG1  ILE  32          HG12      ILE  32 -11.875   8.386   8.386
  235   1HG2  ILE  32          HG21      ILE  32 -14.147   7.926   7.926
  236   2HG2  ILE  32          HG22      ILE  32 -14.529   6.968   6.968
  237   3HG2  ILE  32          HG23      ILE  32 -15.630   8.223   8.223
  238   1HD1  ILE  32          HD11      ILE  32 -12.012   9.584   9.584
  239   2HD1  ILE  32          HD12      ILE  32 -10.552   9.089   9.089
  240   3HD1  ILE  32          HD13      ILE  32 -11.483  10.450  10.450
  241    H    GLY  33           HN       GLY  33 -15.082  10.647  10.647
  242   1HA   GLY  33           HA1      GLY  33 -12.688  10.218  10.218
  243   2HA   GLY  33           HA2      GLY  33 -14.363  10.022  10.022
  244    H    ASP  34           HN       ASP  34 -14.490  12.734  12.734
  245    HA   ASP  34           HA       ASP  34 -14.022  14.483  14.483
  246   1HB   ASP  34           HB1      ASP  34 -15.781  14.780  14.780
  247   2HB   ASP  34           HB2      ASP  34 -15.745  16.007  16.007
  248    H    VAL  35           HN       VAL  35 -13.797  14.179  14.179
  249    HA   VAL  35           HA       VAL  35 -12.212  16.501  16.501
  250    HB   VAL  35           HB       VAL  35 -12.405  13.800  13.800
  251   1HG1  VAL  35          HG11      VAL  35 -11.278  16.462  16.462
  252   2HG1  VAL  35          HG12      VAL  35 -11.462  15.012  15.012
  253   3HG1  VAL  35          HG13      VAL  35 -10.322  15.034  15.034
  254   1HG2  VAL  35          HG21      VAL  35 -13.806  16.430  16.430
  255   2HG2  VAL  35          HG22      VAL  35 -14.552  14.960  14.960
  256   3HG2  VAL  35          HG23      VAL  35 -13.887  14.987  14.987
  257    H    ALA  36           HN       ALA  36 -11.617  13.314  13.314
  258    HA   ALA  36           HA       ALA  36  -8.735  13.521  13.521
  259   1HB   ALA  36           HB1      ALA  36  -9.884  11.397  11.397
  260   2HB   ALA  36           HB2      ALA  36 -10.566  11.450  11.450
  261   3HB   ALA  36           HB3      ALA  36  -8.834  11.214  11.214
  262    H    LYS  37           HN       LYS  37 -11.220  13.467  13.467
  263    HA   LYS  37           HA       LYS  37  -9.316  13.609  13.609
  264   1HB   LYS  37           HB1      LYS  37 -11.558  12.798  12.798
  265   2HB   LYS  37           HB2      LYS  37 -12.241  14.352  14.352
  266   1HG   LYS  37           HG1      LYS  37 -11.472  15.396  15.396
  267   2HG   LYS  37           HG2      LYS  37 -10.304  14.125  14.125
  268   1HD   LYS  37           HD1      LYS  37 -13.170  13.252  13.252
  269   2HD   LYS  37           HD2      LYS  37 -12.762  14.334  14.334
  270   1HE   LYS  37           HE1      LYS  37 -12.433  11.989  11.989
  271   2HE   LYS  37           HE2      LYS  37 -10.885  12.809  12.809
  272   1HZ   LYS  37           HZ1      LYS  37 -11.386  11.679  11.679
  273   2HZ   LYS  37           HZ2      LYS  37 -11.646  10.496  10.496
  274   3HZ   LYS  37           HZ3      LYS  37 -10.155  11.310  11.310
  275    H    LYS  38           HN       LYS  38 -10.805  16.147  16.147
  276    HA   LYS  38           HA       LYS  38  -9.868  18.253  18.253
  277   1HB   LYS  38           HB1      LYS  38 -11.341  18.134  18.134
  278   2HB   LYS  38           HB2      LYS  38 -10.490  19.622  19.622
  279   1HG   LYS  38           HG1      LYS  38 -11.667  19.737  19.737
  280   2HG   LYS  38           HG2      LYS  38 -12.551  18.271  18.271
  281   1HD   LYS  38           HD1      LYS  38 -13.615  19.380  19.380
  282   2HD   LYS  38           HD2      LYS  38 -12.581  20.784  20.784
  283   1HE   LYS  38           HE1      LYS  38 -14.813  21.244  21.244
  284   2HE   LYS  38           HE2      LYS  38 -13.593  21.288  21.288
  285   1HZ   LYS  38           HZ1      LYS  38 -14.542  18.663  18.663
  286   2HZ   LYS  38           HZ2      LYS  38 -15.874  19.710  19.710
  287   3HZ   LYS  38           HZ3      LYS  38 -14.679  19.737  19.737
  288    H    LEU  39           HN       LEU  39  -9.076  17.252  17.252
  289    HA   LEU  39           HA       LEU  39  -6.796  19.005  19.005
  290   1HB   LEU  39           HB1      LEU  39  -7.066  18.411  18.411
  291   2HB   LEU  39           HB2      LEU  39  -8.383  17.380  17.380
  292    HG   LEU  39           HG       LEU  39  -6.487  15.676  15.676
  293   1HD1  LEU  39          HD11      LEU  39  -4.792  17.512  17.512
  294   2HD1  LEU  39          HD12      LEU  39  -5.297  17.490  17.490
  295   3HD1  LEU  39          HD13      LEU  39  -4.509  16.080  16.080
  296   1HD2  LEU  39          HD21      LEU  39  -8.186  15.386  15.386
  297   2HD2  LEU  39          HD22      LEU  39  -6.580  14.853  14.853
  298   3HD2  LEU  39          HD23      LEU  39  -7.149  16.392  16.392
  299    H    GLY  40           HN       GLY  40  -7.457  15.949  15.949
  300   1HA   GLY  40           HA1      GLY  40  -4.739  14.986  14.986
  301   2HA   GLY  40           HA2      GLY  40  -6.142  14.438  14.438
  302    H    GLU  41           HN       GLU  41  -6.943  16.960  16.960
  303    HA   GLU  41           HA       GLU  41  -5.240  17.172  17.172
  304   1HB   GLU  41           HB1      GLU  41  -7.331  18.908  18.908
  305   2HB   GLU  41           HB2      GLU  41  -6.456  19.506  19.506
  306   1HG   GLU  41           HG1      GLU  41  -8.083  16.921  16.921
  307   2HG   GLU  41           HG2      GLU  41  -8.583  18.413  18.413
  308    H    MET  42           HN       MET  42  -5.725  19.184  19.184
  309    HA   MET  42           HA       MET  42  -3.796  21.180  21.180
  310   1HB   MET  42           HB1      MET  42  -4.573  19.921  19.921
  311   2HB   MET  42           HB2      MET  42  -3.687  21.439  21.439
  312   1HG   MET  42           HG1      MET  42  -5.666  22.163  22.163
  313   2HG   MET  42           HG2      MET  42  -6.501  20.805  20.805
  314   1HE   MET  42           HE1      MET  42  -8.585  21.817  21.817
  315   2HE   MET  42           HE2      MET  42  -7.897  20.741  20.741
  316   3HE   MET  42           HE3      MET  42  -8.591  22.286  22.286
  317    H    TRP  43           HN       TRP  43  -3.400  18.084  18.084
  318    HA   TRP  43           HA       TRP  43  -0.735  18.147  18.147
  319   1HB   TRP  43           HB1      TRP  43  -2.044  16.287  16.287
  320   2HB   TRP  43           HB2      TRP  43  -2.448  15.918  15.918
  321    HD1  TRP  43           HD1      TRP  43  -0.954  14.261  14.261
  322    HE1  TRP  43           HE1      TRP  43   1.238  13.254  13.254
  323    HE3  TRP  43           HE3      TRP  43   0.149  16.789  16.789
  324    HZ2  TRP  43           HZ2      TRP  43   3.344  13.375  13.375
  325    HZ3  TRP  43           HZ3      TRP  43   2.232  16.353  16.353
  326    HH2  TRP  43           HH2      TRP  43   3.837  14.646  14.646
  327    H    ASN  44           HN       ASN  44  -2.019  17.302  17.302
  328    HA   ASN  44           HA       ASN  44   0.646  16.865  16.865
  329   1HB   ASN  44           HB1      ASN  44  -0.366  16.454  16.454
  330   2HB   ASN  44           HB2      ASN  44  -1.419  15.787  15.787
  331   1HD2  ASN  44          HD21      ASN  44  -4.186  17.424  17.424
  332   2HD2  ASN  44          HD22      ASN  44  -3.544  16.101  16.101
  333    H    ASN  45           HN       ASN  45  -0.490  19.563  19.563
  334    HA   ASN  45           HA       ASN  45   1.137  21.309  21.309
  335   1HB   ASN  45           HB1      ASN  45  -1.607  22.221  22.221
  336   2HB   ASN  45           HB2      ASN  45  -0.579  22.997  22.997
  337   1HD2  ASN  45          HD21      ASN  45  -3.370  20.413  20.413
  338   2HD2  ASN  45          HD22      ASN  45  -3.252  21.090  21.090
  339    H    THR  46           HN       THR  46   1.442  20.113  20.113
  340    HA   THR  46           HA       THR  46   0.908  22.284  22.284
  341    HB   THR  46           HB       THR  46   1.055  19.896  19.896
  342    HG1  THR  46           HG1      THR  46   1.684  20.871  20.871
  343   1HG2  THR  46          HG21      THR  46   3.069  19.108  19.108
  344   2HG2  THR  46          HG22      THR  46   4.091  20.145  20.145
  345   3HG2  THR  46          HG23      THR  46   3.234  18.815  18.815
  346    H    ALA  47           HN       ALA  47   3.737  21.016  21.016
  347    HA   ALA  47           HA       ALA  47   5.054  23.454  23.454
  348   1HB   ALA  47           HB1      ALA  47   5.440  23.530  23.530
  349   2HB   ALA  47           HB2      ALA  47   6.238  21.973  21.973
  350   3HB   ALA  47           HB3      ALA  47   6.929  23.383  23.383
  351    H    ALA  48           HN       ALA  48   5.614  20.284  20.284
  352    HA   ALA  48           HA       ALA  48   6.153  18.305  18.305
  353   1HB   ALA  48           HB1      ALA  48   6.406  19.555  19.555
  354   2HB   ALA  48           HB2      ALA  48   7.970  20.154  20.154
  355   3HB   ALA  48           HB3      ALA  48   7.720  18.434  18.434
  356    H    ASP  49           HN       ASP  49   8.158  21.049  21.049
  357    HA   ASP  49           HA       ASP  49  10.393  19.533  19.533
  358   1HB   ASP  49           HB1      ASP  49  10.744  21.657  21.657
  359   2HB   ASP  49           HB2      ASP  49   9.779  22.529  22.529
  360    H    ASP  50           HN       ASP  50   7.413  20.211  20.211
  361    HA   ASP  50           HA       ASP  50   8.045  20.439  20.439
  362   1HB   ASP  50           HB1      ASP  50   6.554  22.270  22.270
  363   2HB   ASP  50           HB2      ASP  50   5.450  21.053  21.053
  364    H    LYS  51           HN       LYS  51   7.063  18.432  18.432
  365    HA   LYS  51           HA       LYS  51   5.353  16.627  16.627
  366   1HB   LYS  51           HB1      LYS  51   6.777  16.211  16.211
  367   2HB   LYS  51           HB2      LYS  51   5.672  15.070  15.070
  368   1HG   LYS  51           HG1      LYS  51   3.848  16.743  16.743
  369   2HG   LYS  51           HG2      LYS  51   4.969  17.857  17.857
  370   1HD   LYS  51           HD1      LYS  51   5.372  16.225  16.225
  371   2HD   LYS  51           HD2      LYS  51   4.319  15.063  15.063
  372   1HE   LYS  51           HE1      LYS  51   2.399  16.428  16.428
  373   2HE   LYS  51           HE2      LYS  51   3.345  17.781  17.781
  374   1HZ   LYS  51           HZ1      LYS  51   3.941  15.468  15.468
  375   2HZ   LYS  51           HZ2      LYS  51   2.252  15.632  15.632
  376   3HZ   LYS  51           HZ3      LYS  51   3.203  16.903  16.903
  377    H    GLN  52           HN       GLN  52   8.538  16.654  16.654
  378    HA   GLN  52           HA       GLN  52   9.903  14.534  14.534
  379   1HB   GLN  52           HB1      GLN  52  10.547  17.330  17.330
  380   2HB   GLN  52           HB2      GLN  52  11.400  16.618  16.618
  381   1HG   GLN  52           HG1      GLN  52  12.827  16.595  16.595
  382   2HG   GLN  52           HG2      GLN  52  12.437  14.948  14.948
  383   1HE2  GLN  52          HE21      GLN  52   9.945  15.583  15.583
  384   2HE2  GLN  52          HE22      GLN  52   9.612  16.051  16.051
  385    HA   PRO  53           HA       PRO  53  10.424  14.732  14.732
  386   1HB   PRO  53           HB1      PRO  53   8.303  16.093  16.093
  387   2HB   PRO  53           HB2      PRO  53   9.921  16.748  16.748
  388   1HG   PRO  53           HG1      PRO  53   7.483  16.998  16.998
  389   2HG   PRO  53           HG2      PRO  53   8.514  18.301  18.301
  390   1HD   PRO  53           HD1      PRO  53   9.048  17.396  17.396
  391   2HD   PRO  53           HD2      PRO  53  10.426  17.508  17.508
  392    H    TYR  54           HN       TYR  54   7.148  14.977  14.977
  393    HA   TYR  54           HA       TYR  54   6.107  12.750  12.750
  394   1HB   TYR  54           HB1      TYR  54   4.928  14.206  14.206
  395   2HB   TYR  54           HB2      TYR  54   4.047  13.119  13.119
  396    HD1  TYR  54           HD1      TYR  54   4.555  13.870  13.870
  397    HD2  TYR  54           HD2      TYR  54   4.507  16.431  16.431
  398    HE1  TYR  54           HE1      TYR  54   4.079  15.791  15.791
  399    HE2  TYR  54           HE2      TYR  54   4.032  18.347  18.347
  400    HH   TYR  54           HH       TYR  54   4.474  18.359  18.359
  401    H    GLU  55           HN       GLU  55   6.730  13.371  13.371
  402    HA   GLU  55           HA       GLU  55   6.136  10.922  10.922
  403   1HB   GLU  55           HB1      GLU  55   7.680  13.326  13.326
  404   2HB   GLU  55           HB2      GLU  55   8.420  11.940  11.940
  405   1HG   GLU  55           HG1      GLU  55   6.182  11.337  11.337
  406   2HG   GLU  55           HG2      GLU  55   5.470  12.730  12.730
  407    H    LYS  56           HN       LYS  56   9.401  11.830  11.830
  408    HA   LYS  56           HA       LYS  56  10.666   9.417   9.417
  409   1HB   LYS  56           HB1      LYS  56  11.735  11.626  11.626
  410   2HB   LYS  56           HB2      LYS  56  11.300  11.275  11.275
  411   1HG   LYS  56           HG1      LYS  56  12.652   9.175   9.175
  412   2HG   LYS  56           HG2      LYS  56  13.065   9.513   9.513
  413   1HD   LYS  56           HD1      LYS  56  14.129  11.685  11.685
  414   2HD   LYS  56           HD2      LYS  56  13.805  11.220  11.220
  415   1HE   LYS  56           HE1      LYS  56  15.530   9.644   9.644
  416   2HE   LYS  56           HE2      LYS  56  16.129  10.630  10.630
  417   1HZ   LYS  56           HZ1      LYS  56  14.228   8.861   8.861
  418   2HZ   LYS  56           HZ2      LYS  56  15.310   7.974   7.974
  419   3HZ   LYS  56           HZ3      LYS  56  15.894   8.927   8.927
  420    H    LYS  57           HN       LYS  57   8.586  10.293  10.293
  421    HA   LYS  57           HA       LYS  57   9.311   8.010   8.010
  422   1HB   LYS  57           HB1      LYS  57   8.264  10.224  10.224
  423   2HB   LYS  57           HB2      LYS  57   6.745   9.669   9.669
  424   1HG   LYS  57           HG1      LYS  57   6.742   7.708   7.708
  425   2HG   LYS  57           HG2      LYS  57   8.341   8.113   8.113
  426   1HD   LYS  57           HD1      LYS  57   7.349  10.341  10.341
  427   2HD   LYS  57           HD2      LYS  57   5.774   9.730   9.730
  428   1HE   LYS  57           HE1      LYS  57   6.164   9.356   9.356
  429   2HE   LYS  57           HE2      LYS  57   6.032   7.809   7.809
  430   1HZ   LYS  57           HZ1      LYS  57   8.718   8.697   8.697
  431   2HZ   LYS  57           HZ2      LYS  57   8.107   8.724   8.724
  432   3HZ   LYS  57           HZ3      LYS  57   8.057   7.288   7.288
  433    H    ALA  58           HN       ALA  58   6.446   8.865   8.865
  434    HA   ALA  58           HA       ALA  58   4.986   6.510   6.510
  435   1HB   ALA  58           HB1      ALA  58   5.510   8.275   8.275
  436   2HB   ALA  58           HB2      ALA  58   4.255   7.049   7.049
  437   3HB   ALA  58           HB3      ALA  58   4.197   8.433   8.433
  438    H    ALA  59           HN       ALA  59   7.601   7.251   7.251
  439    HA   ALA  59           HA       ALA  59   7.828   4.885   4.885
  440   1HB   ALA  59           HB1      ALA  59   9.220   6.915   6.915
  441   2HB   ALA  59           HB2      ALA  59  10.121   6.608   6.608
  442   3HB   ALA  59           HB3      ALA  59  10.233   5.486   5.486
  443    H    LYS  60           HN       LYS  60   9.678   5.651   5.651
  444    HA   LYS  60           HA       LYS  60  10.946   3.317   3.317
  445   1HB   LYS  60           HB1      LYS  60  10.920   5.424   5.424
  446   2HB   LYS  60           HB2      LYS  60   9.382   4.913   4.913
  447   1HG   LYS  60           HG1      LYS  60  10.610   2.682   2.682
  448   2HG   LYS  60           HG2      LYS  60  12.082   3.582   3.582
  449   1HD   LYS  60           HD1      LYS  60   9.909   4.269   4.269
  450   2HD   LYS  60           HD2      LYS  60  11.510   3.666   3.666
  451   1HE   LYS  60           HE1      LYS  60  12.505   5.758   5.758
  452   2HE   LYS  60           HE2      LYS  60  10.879   6.365   6.365
  453   1HZ   LYS  60           HZ1      LYS  60  11.004   5.491   5.491
  454   2HZ   LYS  60           HZ2      LYS  60  12.372   6.455   6.455
  455   3HZ   LYS  60           HZ3      LYS  60  10.819   7.077   7.077
  456    H    LEU  61           HN       LEU  61   7.633   4.048   4.048
  457    HA   LEU  61           HA       LEU  61   6.981   1.558   1.558
  458   1HB   LEU  61           HB1      LEU  61   5.051   3.297   3.297
  459   2HB   LEU  61           HB2      LEU  61   4.655   2.205   2.205
  460    HG   LEU  61           HG       LEU  61   6.323   4.749   4.749
  461   1HD1  LEU  61          HD11      LEU  61   3.627   4.026   4.026
  462   2HD1  LEU  61          HD12      LEU  61   4.518   5.516   5.516
  463   3HD1  LEU  61          HD13      LEU  61   3.953   5.147   5.147
  464   1HD2  LEU  61          HD21      LEU  61   5.714   2.729   2.729
  465   2HD2  LEU  61          HD22      LEU  61   7.295   3.054   3.054
  466   3HD2  LEU  61          HD23      LEU  61   6.478   4.298   4.298
  467    H    LYS  62           HN       LYS  62   6.231   2.542   2.542
  468    HA   LYS  62           HA       LYS  62   5.139   0.149   0.149
  469   1HB   LYS  62           HB1      LYS  62   5.605   2.404   2.404
  470   2HB   LYS  62           HB2      LYS  62   7.202   1.756   1.756
  471   1HG   LYS  62           HG1      LYS  62   6.085  -0.293  -0.293
  472   2HG   LYS  62           HG2      LYS  62   4.537   0.517   0.517
  473   1HD   LYS  62           HD1      LYS  62   5.591   2.470   2.470
  474   2HD   LYS  62           HD2      LYS  62   6.879   1.343   1.343
  475   1HE   LYS  62           HE1      LYS  62   3.922   0.935   0.935
  476   2HE   LYS  62           HE2      LYS  62   5.188   1.293   1.293
  477   1HZ   LYS  62           HZ1      LYS  62   5.970  -0.944  -0.944
  478   2HZ   LYS  62           HZ2      LYS  62   4.378  -1.190  -1.190
  479   3HZ   LYS  62           HZ3      LYS  62   5.606  -0.844  -0.844
  480    H    GLU  63           HN       GLU  63   8.446   1.154   1.154
  481    HA   GLU  63           HA       GLU  63   9.811  -1.093  -1.093
  482   1HB   GLU  63           HB1      GLU  63  10.454   1.454   1.454
  483   2HB   GLU  63           HB2      GLU  63  11.184   0.355   0.355
  484   1HG   GLU  63           HG1      GLU  63  11.654   0.436   0.436
  485   2HG   GLU  63           HG2      GLU  63  12.773   0.944   0.944
  486    H    LYS  64           HN       LYS  64   8.870  -0.287  -0.287
  487    HA   LYS  64           HA       LYS  64   9.952  -2.455  -2.455
  488   1HB   LYS  64           HB1      LYS  64   8.624  -0.375  -0.375
  489   2HB   LYS  64           HB2      LYS  64   7.184  -1.319  -1.319
  490   1HG   LYS  64           HG1      LYS  64   7.586  -1.868  -1.868
  491   2HG   LYS  64           HG2      LYS  64   8.381  -3.198  -3.198
  492   1HD   LYS  64           HD1      LYS  64   9.971  -2.437  -2.437
  493   2HD   LYS  64           HD2      LYS  64  10.561  -1.799  -1.799
  494   1HE   LYS  64           HE1      LYS  64  10.601  -0.034  -0.034
  495   2HE   LYS  64           HE2      LYS  64   9.444   0.408   0.408
  496   1HZ   LYS  64           HZ1      LYS  64   8.154  -1.175  -1.175
  497   2HZ   LYS  64           HZ2      LYS  64   8.995   0.066   0.066
  498   3HZ   LYS  64           HZ3      LYS  64   7.861   0.444   0.444
  499    H    TYR  65           HN       TYR  65   6.760  -2.155  -2.155
  500    HA   TYR  65           HA       TYR  65   5.661  -4.669  -4.669
  501   1HB   TYR  65           HB1      TYR  65   4.226  -3.030  -3.030
  502   2HB   TYR  65           HB2      TYR  65   5.369  -2.619  -2.619
  503    HD1  TYR  65           HD1      TYR  65   4.439  -6.159  -6.159
  504    HD2  TYR  65           HD2      TYR  65   3.570  -2.587  -2.587
  505    HE1  TYR  65           HE1      TYR  65   3.123  -7.443  -7.443
  506    HE2  TYR  65           HE2      TYR  65   2.258  -3.873  -3.873
  507    HH   TYR  65           HH       TYR  65   2.444  -7.108  -7.108
  508    H    GLU  66           HN       GLU  66   7.229  -3.701  -3.701
  509    HA   GLU  66           HA       GLU  66   7.426  -6.071  -6.071
  510   1HB   GLU  66           HB1      GLU  66   9.565  -3.970  -3.970
  511   2HB   GLU  66           HB2      GLU  66   9.410  -5.143  -5.143
  512   1HG   GLU  66           HG1      GLU  66   7.071  -3.307  -3.307
  513   2HG   GLU  66           HG2      GLU  66   8.353  -2.701  -2.701
  514    H    LYS  67           HN       LYS  67   9.355  -5.157  -5.157
  515    HA   LYS  67           HA       LYS  67  11.274  -7.316  -7.316
  516   1HB   LYS  67           HB1      LYS  67  10.990  -4.929  -4.929
  517   2HB   LYS  67           HB2      LYS  67  11.842  -6.277  -6.277
  518   1HG   LYS  67           HG1      LYS  67  13.393  -4.799  -4.799
  519   2HG   LYS  67           HG2      LYS  67  13.356  -6.363  -6.363
  520   1HD   LYS  67           HD1      LYS  67  11.884  -5.355  -5.355
  521   2HD   LYS  67           HD2      LYS  67  11.999  -3.810  -3.810
  522   1HE   LYS  67           HE1      LYS  67  13.668  -3.969  -3.969
  523   2HE   LYS  67           HE2      LYS  67  14.475  -3.827  -3.827
  524   1HZ   LYS  67           HZ1      LYS  67  14.019  -6.532  -6.532
  525   2HZ   LYS  67           HZ2      LYS  67  14.690  -5.846  -5.846
  526   3HZ   LYS  67           HZ3      LYS  67  15.500  -5.707  -5.707
  527    H    ASP  68           HN       ASP  68   8.510  -6.803  -6.803
  528    HA   ASP  68           HA       ASP  68   8.930  -9.073  -9.073
  529   1HB   ASP  68           HB1      ASP  68   6.692  -7.058  -7.058
  530   2HB   ASP  68           HB2      ASP  68   6.545  -8.453  -8.453
  531    H    ILE  69           HN       ILE  69   7.475  -8.234  -8.234
  532    HA   ILE  69           HA       ILE  69   5.799 -10.653 -10.653
  533    HB   ILE  69           HB       ILE  69   4.915  -8.674  -8.674
  534   1HG1  ILE  69          HG11      ILE  69   4.394  -9.661  -9.661
  535   2HG1  ILE  69          HG12      ILE  69   5.840 -10.661 -10.661
  536   1HG2  ILE  69          HG21      ILE  69   7.077  -7.726  -7.726
  537   2HG2  ILE  69          HG22      ILE  69   7.326  -8.961  -8.961
  538   3HG2  ILE  69          HG23      ILE  69   6.008  -7.807  -7.807
  539   1HD1  ILE  69          HD11      ILE  69   3.547 -10.873 -10.873
  540   2HD1  ILE  69          HD12      ILE  69   3.840 -11.969 -11.969
  541   3HD1  ILE  69          HD13      ILE  69   4.977 -11.898 -11.898
  542    H    ALA  70           HN       ALA  70   8.633  -9.377  -9.377
  543    HA   ALA  70           HA       ALA  70   9.398 -11.620 -11.620
  544   1HB   ALA  70           HB1      ALA  70  11.219  -9.635  -9.635
  545   2HB   ALA  70           HB2      ALA  70  11.733 -10.697 -10.697
  546   3HB   ALA  70           HB3      ALA  70  10.580  -9.418  -9.418
  547    H    ALA  71           HN       ALA  71   9.696 -10.858 -10.858
  548    HA   ALA  71           HA       ALA  71  11.353 -13.140 -13.140
  549   1HB   ALA  71           HB1      ALA  71   9.804 -11.183 -11.183
  550   2HB   ALA  71           HB2      ALA  71  10.971 -12.360 -12.360
  551   3HB   ALA  71           HB3      ALA  71  11.501 -11.043 -11.043
  552    H    TYR  72           HN       TYR  72   7.982 -12.308 -12.308
  553    HA   TYR  72           HA       TYR  72   7.028 -14.547 -14.547
  554   1HB   TYR  72           HB1      TYR  72   5.701 -12.578 -12.578
  555   2HB   TYR  72           HB2      TYR  72   5.743 -12.710 -12.710
  556    HD1  TYR  72           HD1      TYR  72   4.842 -15.027 -15.027
  557    HD2  TYR  72           HD2      TYR  72   3.731 -13.285 -13.285
  558    HE1  TYR  72           HE1      TYR  72   2.763 -16.318 -16.318
  559    HE2  TYR  72           HE2      TYR  72   1.653 -14.574 -14.574
  560    HH   TYR  72           HH       TYR  72   0.373 -15.980 -15.980
  561    H    ARG  73           HN       ARG  73   7.243 -13.939 -13.939
  562    HA   ARG  73           HA       ARG  73   6.162 -16.360 -16.360
  563   1HB   ARG  73           HB1      ARG  73   8.290 -14.544 -14.544
  564   2HB   ARG  73           HB2      ARG  73   7.346 -15.719 -15.719
  565   1HG   ARG  73           HG1      ARG  73   5.609 -13.870 -13.870
  566   2HG   ARG  73           HG2      ARG  73   6.698 -13.002 -13.002
  567   1HD   ARG  73           HD1      ARG  73   4.537 -13.531 -13.531
  568   2HD   ARG  73           HD2      ARG  73   5.901 -14.257 -14.257
  569    HE   ARG  73           HE       ARG  73   4.206 -15.825 -15.825
  570   1HH1  ARG  73          HH11      ARG  73   6.330 -17.443 -17.443
  571   2HH1  ARG  73          HH12      ARG  73   5.814 -18.111 -18.111
  572   1HH2  ARG  73          HH21      ARG  73   3.290 -15.713 -15.713
  573   2HH2  ARG  73          HH22      ARG  73   4.042 -17.102 -17.102
  574    H    ALA  74           HN       ALA  74   9.246 -15.279 -15.279
  575    HA   ALA  74           HA       ALA  74  10.914 -17.401 -17.401
  576   1HB   ALA  74           HB1      ALA  74  11.162 -15.595 -15.595
  577   2HB   ALA  74           HB2      ALA  74  12.463 -16.569 -16.569
  578   3HB   ALA  74           HB3      ALA  74  11.764 -15.279 -15.279
  579    H    LYS  75           HN       LYS  75   8.482 -17.548 -17.548
  580    HA   LYS  75           HA       LYS  75   7.592 -19.559 -19.559
  581   1HB   LYS  75           HB1      LYS  75   9.572 -20.908 -20.908
  582   2HB   LYS  75           HB2      LYS  75  10.471 -20.491 -20.491
  583   1HG   LYS  75           HG1      LYS  75   8.985 -21.718 -21.718
  584   2HG   LYS  75           HG2      LYS  75   7.765 -21.850 -21.850
  585   1HD   LYS  75           HD1      LYS  75   8.942 -23.995 -23.995
  586   2HD   LYS  75           HD2      LYS  75   9.266 -23.312 -23.312
  587   1HE   LYS  75           HE1      LYS  75  11.350 -24.195 -24.195
  588   2HE   LYS  75           HE2      LYS  75  11.483 -22.449 -22.449
  589   1HZ   LYS  75           HZ1      LYS  75  10.307 -23.175 -23.175
  590   2HZ   LYS  75           HZ2      LYS  75  11.687 -24.136 -24.136
  591   3HZ   LYS  75           HZ3      LYS  75  11.815 -22.441 -22.441
  592    H    GLY  76           HN       GLY  76   7.175 -17.566 -17.566
  593   1HA   GLY  76           HA1      GLY  76   8.412 -17.649 -17.649
  594   2HA   GLY  76           HA2      GLY  76   7.680 -16.210 -16.210
  595    H    LYS  77           HN       LYS  77   6.565 -19.434 -19.434
  596    HA   LYS  77           HA       LYS  77   3.984 -18.754 -18.754
  597   1HB   LYS  77           HB1      LYS  77   4.906 -20.679 -20.679
  598   2HB   LYS  77           HB2      LYS  77   3.959 -21.495 -21.495
  599   1HG   LYS  77           HG1      LYS  77   2.484 -19.132 -19.132
  600   2HG   LYS  77           HG2      LYS  77   3.112 -19.640 -19.640
  601   1HD   LYS  77           HD1      LYS  77   2.224 -21.937 -21.937
  602   2HD   LYS  77           HD2      LYS  77   1.652 -21.447 -21.447
  603   1HE   LYS  77           HE1      LYS  77  -0.222 -21.410 -21.410
  604   2HE   LYS  77           HE2      LYS  77   0.129 -19.775 -19.775
  605   1HZ   LYS  77           HZ1      LYS  77   1.716 -20.300 -20.300
  606   2HZ   LYS  77           HZ2      LYS  77   0.132 -20.781 -20.781
  607   3HZ   LYS  77           HZ3      LYS  77   0.436 -19.193 -19.193
  608    HA   PRO  78           HA       PRO  78   5.474 -21.949 -21.949
  609   1HB   PRO  78           HB1      PRO  78   7.919 -23.124 -23.124
  610   2HB   PRO  78           HB2      PRO  78   6.567 -23.749 -23.749
  611   1HG   PRO  78           HG1      PRO  78   8.736 -21.765 -21.765
  612   2HG   PRO  78           HG2      PRO  78   8.249 -23.264 -23.264
  613   1HD   PRO  78           HD1      PRO  78   7.231 -20.855 -20.855
  614   2HD   PRO  78           HD2      PRO  78   6.219 -22.308 -22.308
  615    H    ASP  79           HN       ASP  79   6.237 -19.201 -19.201
  616    HA   ASP  79           HA       ASP  79   7.971 -18.450 -18.450
  617   1HB   ASP  79           HB1      ASP  79   9.190 -18.246 -18.246
  618   2HB   ASP  79           HB2      ASP  79   7.920 -17.161 -17.161
  619    H    ALA  80           HN       ALA  80   5.551 -18.764 -18.764
  620    HA   ALA  80           HA       ALA  80   3.980 -16.266 -16.266
  621   1HB   ALA  80           HB1      ALA  80   2.934 -18.434 -18.434
  622   2HB   ALA  80           HB2      ALA  80   3.089 -18.996 -18.996
  623   3HB   ALA  80           HB3      ALA  80   2.031 -17.641 -17.641
  624    H    ALA  81           HN       ALA  81   5.610 -18.092 -18.092
  625    HA   ALA  81           HA       ALA  81   4.305 -16.677 -16.677
  626   1HB   ALA  81           HB1      ALA  81   4.777 -19.103 -19.103
  627   2HB   ALA  81           HB2      ALA  81   6.490 -18.792 -18.792
  628   3HB   ALA  81           HB3      ALA  81   5.688 -18.193 -18.193
  629   1H1   BME  16           HE1      MER  16  -5.814   8.972   8.972
  630   2H1   BME  16           HE2      MER  16  -7.173   9.338   9.338
  631   1H2   BME  16           HZ1      MER  16  -6.247  11.423  11.423
  632   2H2   BME  16           HZ2      MER  16  -7.874  11.165  11.165
  633    HO1  BME  16           HH       MER  16  -8.394   8.313   8.313

  Start of MODEL   18
    1    H    ASN   3           HN       ASN   3   0.235 -12.522 -12.522
    2    HA   ASN   3           HA       ASN   3   0.536 -12.834 -12.834
    3   1HB   ASN   3           HB1      ASN   3  -1.157 -14.050 -14.050
    4   2HB   ASN   3           HB2      ASN   3  -2.190 -12.630 -12.630
    5   1HD2  ASN   3          HD21      ASN   3  -2.119 -14.990 -14.990
    6   2HD2  ASN   3          HD22      ASN   3  -1.122 -15.309 -15.309
    7    H    ALA   4           HN       ALA   4   0.941 -11.449 -11.449
    8    HA   ALA   4           HA       ALA   4   0.709  -9.738  -9.738
    9   1HB   ALA   4           HB1      ALA   4  -1.397 -10.896 -10.896
   10   2HB   ALA   4           HB2      ALA   4  -2.235  -9.980  -9.980
   11   3HB   ALA   4           HB3      ALA   4  -1.607  -9.163  -9.163
   12    HA   PRO   5           HA       PRO   5   0.941  -6.397  -6.397
   13   1HB   PRO   5           HB1      PRO   5   3.297  -5.817  -5.817
   14   2HB   PRO   5           HB2      PRO   5   3.183  -5.759  -5.759
   15   1HG   PRO   5           HG1      PRO   5   4.389  -7.877  -7.877
   16   2HG   PRO   5           HG2      PRO   5   3.219  -8.183  -8.183
   17   1HD   PRO   5           HD1      PRO   5   2.713  -8.314  -8.314
   18   2HD   PRO   5           HD2      PRO   5   2.360  -9.534  -9.534
   19    H    LYS   6           HN       LYS   6  -1.011  -5.767  -5.767
   20    HA   LYS   6           HA       LYS   6  -1.702  -4.532  -4.532
   21   1HB   LYS   6           HB1      LYS   6  -3.303  -4.949  -4.949
   22   2HB   LYS   6           HB2      LYS   6  -2.524  -3.735  -3.735
   23   1HG   LYS   6           HG1      LYS   6  -3.159  -1.969  -1.969
   24   2HG   LYS   6           HG2      LYS   6  -3.973  -3.206  -3.206
   25   1HD   LYS   6           HD1      LYS   6  -5.572  -3.612  -3.612
   26   2HD   LYS   6           HD2      LYS   6  -4.671  -2.586  -2.586
   27   1HE   LYS   6           HE1      LYS   6  -6.610  -1.346  -1.346
   28   2HE   LYS   6           HE2      LYS   6  -5.127  -0.616  -0.616
   29   1HZ   LYS   6           HZ1      LYS   6  -5.902  -2.623  -2.623
   30   2HZ   LYS   6           HZ2      LYS   6  -7.251  -1.642  -1.642
   31   3HZ   LYS   6           HZ3      LYS   6  -5.812  -0.945  -0.945
   32    H    ARG   7           HN       ARG   7  -0.837  -3.129  -3.129
   33    HA   ARG   7           HA       ARG   7   1.151  -1.529  -1.529
   34   1HB   ARG   7           HB1      ARG   7  -1.406  -0.320  -0.320
   35   2HB   ARG   7           HB2      ARG   7   0.233  -0.099  -0.099
   36   1HG   ARG   7           HG1      ARG   7   0.096  -2.812  -2.812
   37   2HG   ARG   7           HG2      ARG   7  -1.612  -2.447  -2.447
   38   1HD   ARG   7           HD1      ARG   7   0.475  -1.296  -1.296
   39   2HD   ARG   7           HD2      ARG   7  -0.689  -2.552  -2.552
   40    HE   ARG   7           HE       ARG   7  -2.463  -0.750  -0.750
   41   1HH1  ARG   7          HH11      ARG   7  -0.893   1.546   1.546
   42   2HH1  ARG   7          HH12      ARG   7  -0.583   2.315   2.315
   43   1HH2  ARG   7          HH21      ARG   7  -1.394  -0.558  -0.558
   44   2HH2  ARG   7          HH22      ARG   7  -0.873   1.090   1.090
   45    HA   PRO   8           HA       PRO   8   0.171   1.170   1.170
   46   1HB   PRO   8           HB1      PRO   8   2.769   2.065   2.065
   47   2HB   PRO   8           HB2      PRO   8   2.254   0.436   0.436
   48   1HG   PRO   8           HG1      PRO   8   3.586   1.455   1.455
   49   2HG   PRO   8           HG2      PRO   8   4.114   0.143   0.143
   50   1HD   PRO   8           HD1      PRO   8   2.677  -0.380  -0.380
   51   2HD   PRO   8           HD2      PRO   8   2.371  -1.328  -1.328
   52    HA   PRO   9           HA       PRO   9  -0.619   5.343   5.343
   53   1HB   PRO   9           HB1      PRO   9   2.137   6.204   6.204
   54   2HB   PRO   9           HB2      PRO   9   0.613   7.091   7.091
   55   1HG   PRO   9           HG1      PRO   9   1.303   5.646   5.646
   56   2HG   PRO   9           HG2      PRO   9  -0.346   5.411   5.411
   57   1HD   PRO   9           HD1      PRO   9   2.123   3.740   3.740
   58   2HD   PRO   9           HD2      PRO   9   0.477   3.151   3.151
   59    H    SER  10           HN       SER  10  -0.064   7.388   7.388
   60    HA   SER  10           HA       SER  10   0.994   6.672   6.672
   61   1HB   SER  10           HB1      SER  10  -0.963   8.848   8.848
   62   2HB   SER  10           HB2      SER  10  -0.507   8.452   8.452
   63    HG   SER  10           HG       SER  10  -2.208   7.187   7.187
   64    H    ALA  11           HN       ALA  11   0.972   9.369   9.369
   65    HA   ALA  11           HA       ALA  11   3.345  10.414  10.414
   66   1HB   ALA  11           HB1      ALA  11   2.558  11.317  11.317
   67   2HB   ALA  11           HB2      ALA  11   3.906  11.944  11.944
   68   3HB   ALA  11           HB3      ALA  11   3.955  10.303  10.303
   69    H    PHE  12           HN       PHE  12   0.608  11.035  11.035
   70    HA   PHE  12           HA       PHE  12  -0.291  13.590  13.590
   71   1HB   PHE  12           HB1      PHE  12  -1.065  12.678  12.678
   72   2HB   PHE  12           HB2      PHE  12  -1.365  11.087  11.087
   73    HD1  PHE  12           HD1      PHE  12  -3.198  13.229  13.229
   74    HD2  PHE  12           HD2      PHE  12  -3.121  11.699  11.699
   75    HE1  PHE  12           HE1      PHE  12  -5.612  13.545  13.545
   76    HE2  PHE  12           HE2      PHE  12  -5.542  12.013  12.013
   77    HZ   PHE  12           HZ       PHE  12  -6.799  12.933  12.933
   78    H    PHE  13           HN       PHE  13  -0.857  10.258  10.258
   79    HA   PHE  13           HA       PHE  13  -2.803  10.562  10.562
   80   1HB   PHE  13           HB1      PHE  13  -1.406   8.462   8.462
   81   2HB   PHE  13           HB2      PHE  13  -0.363   8.914   8.914
   82    HD1  PHE  13           HD1      PHE  13  -1.605   9.362   9.362
   83    HD2  PHE  13           HD2      PHE  13  -3.364   7.257   7.257
   84    HE1  PHE  13           HE1      PHE  13  -3.274   8.400   8.400
   85    HE2  PHE  13           HE2      PHE  13  -5.028   6.292   6.292
   86    HZ   PHE  13           HZ       PHE  13  -4.993   6.866   6.866
   87    H    LEU  14           HN       LEU  14   0.678  11.060  11.060
   88    HA   LEU  14           HA       LEU  14   0.460  11.780  11.780
   89   1HB   LEU  14           HB1      LEU  14   2.407  12.943  12.943
   90   2HB   LEU  14           HB2      LEU  14   2.620  12.980  12.980
   91    HG   LEU  14           HG       LEU  14   4.081  11.350  11.350
   92   1HD1  LEU  14          HD11      LEU  14   1.663   9.603   9.603
   93   2HD1  LEU  14          HD12      LEU  14   3.327   9.078   9.078
   94   3HD1  LEU  14          HD13      LEU  14   2.818  10.244  10.244
   95   1HD2  LEU  14          HD21      LEU  14   3.691  11.188  11.188
   96   2HD2  LEU  14          HD22      LEU  14   3.834   9.576   9.576
   97   3HD2  LEU  14          HD23      LEU  14   2.251  10.196  10.196
   98    H    PHE  15           HN       PHE  15   0.638  13.891  13.891
   99    HA   PHE  15           HA       PHE  15   0.089  16.395  16.395
  100   1HB   PHE  15           HB1      PHE  15   0.903  16.604  16.604
  101   2HB   PHE  15           HB2      PHE  15   0.177  15.059  15.059
  102    HD1  PHE  15           HD1      PHE  15  -2.211  15.044  15.044
  103    HD2  PHE  15           HD2      PHE  15   0.023  18.647  18.647
  104    HE1  PHE  15           HE1      PHE  15  -3.763  16.204  16.204
  105    HE2  PHE  15           HE2      PHE  15  -1.547  19.808  19.808
  106    HZ   PHE  15           HZ       PHE  15  -3.434  18.579  18.579
  107    H    CYS  16           HN       MER  16  -2.221  14.158  14.158
  108    HA   CYS  16           HA       MER  16  -4.568  15.622  15.622
  109   1HB   CYS  16           HB1      MER  16  -4.748  13.498  13.498
  110   2HB   CYS  16           HB2      MER  16  -4.066  12.599  12.599
  111    H    SER  17           HN       SER  17  -3.092  13.246  13.246
  112    HA   SER  17           HA       SER  17  -4.836  13.447  13.447
  113   1HB   SER  17           HB1      SER  17  -1.783  13.163  13.163
  114   2HB   SER  17           HB2      SER  17  -2.901  12.880  12.880
  115    HG   SER  17           HG       SER  17  -3.284  11.008  11.008
  116    H    GLU  18           HN       GLU  18  -1.896  15.274  15.274
  117    HA   GLU  18           HA       GLU  18  -1.671  16.977  16.977
  118   1HB   GLU  18           HB1      GLU  18  -0.274  17.019  17.019
  119   2HB   GLU  18           HB2      GLU  18  -1.563  17.870  17.870
  120   1HG   GLU  18           HG1      GLU  18   0.153  19.467  19.467
  121   2HG   GLU  18           HG2      GLU  18  -1.412  19.782  19.782
  122    H    TYR  19           HN       TYR  19  -3.960  17.648  17.648
  123    HA   TYR  19           HA       TYR  19  -5.509  19.266  19.266
  124   1HB   TYR  19           HB1      TYR  19  -5.625  21.135  21.135
  125   2HB   TYR  19           HB2      TYR  19  -3.920  20.720  20.720
  126    HD1  TYR  19           HD1      TYR  19  -2.550  19.697  19.697
  127    HD2  TYR  19           HD2      TYR  19  -6.597  20.819  20.819
  128    HE1  TYR  19           HE1      TYR  19  -2.185  19.547  19.547
  129    HE2  TYR  19           HE2      TYR  19  -6.237  20.671  20.671
  130    HH   TYR  19           HH       TYR  19  -3.900  20.935  20.935
  131    H    ARG  20           HN       ARG  20  -6.248  16.759  16.759
  132    HA   ARG  20           HA       ARG  20  -8.326  17.038  17.038
  133   1HB   ARG  20           HB1      ARG  20  -7.327  14.838  14.838
  134   2HB   ARG  20           HB2      ARG  20  -7.930  14.864  14.864
  135   1HG   ARG  20           HG1      ARG  20 -10.225  14.706  14.706
  136   2HG   ARG  20           HG2      ARG  20  -9.759  14.993  14.993
  137   1HD   ARG  20           HD1      ARG  20  -8.477  12.873  12.873
  138   2HD   ARG  20           HD2      ARG  20  -8.843  12.609  12.609
  139    HE   ARG  20           HE       ARG  20 -11.025  12.759  12.759
  140   1HH1  ARG  20          HH11      ARG  20 -11.083  12.235  12.235
  141   2HH1  ARG  20          HH12      ARG  20 -11.470  10.549  10.549
  142   1HH2  ARG  20          HH21      ARG  20 -10.738  10.192  10.192
  143   2HH2  ARG  20          HH22      ARG  20 -11.272   9.356   9.356
  144    HA   PRO  21           HA       PRO  21 -11.194  17.195  17.195
  145   1HB   PRO  21           HB1      PRO  21  -9.338  18.558  18.558
  146   2HB   PRO  21           HB2      PRO  21 -10.561  17.324  17.324
  147   1HG   PRO  21           HG1      PRO  21  -8.004  16.558  16.558
  148   2HG   PRO  21           HG2      PRO  21  -9.170  15.564  15.564
  149   1HD   PRO  21           HD1      PRO  21  -7.383  17.783  17.783
  150   2HD   PRO  21           HD2      PRO  21  -7.529  16.109  16.109
  151    H    LYS  22           HN       LYS  22  -8.866  19.675  19.675
  152    HA   LYS  22           HA       LYS  22 -10.642  21.893  21.893
  153   1HB   LYS  22           HB1      LYS  22  -8.065  21.824  21.824
  154   2HB   LYS  22           HB2      LYS  22  -8.953  23.267  23.267
  155   1HG   LYS  22           HG1      LYS  22  -8.737  22.529  22.529
  156   2HG   LYS  22           HG2      LYS  22  -7.714  21.218  21.218
  157   1HD   LYS  22           HD1      LYS  22  -6.242  22.955  22.955
  158   2HD   LYS  22           HD2      LYS  22  -6.139  22.948  22.948
  159   1HE   LYS  22           HE1      LYS  22  -8.018  24.829  24.829
  160   2HE   LYS  22           HE2      LYS  22  -6.359  25.269  25.269
  161   1HZ   LYS  22           HZ1      LYS  22  -7.512  24.314  24.314
  162   2HZ   LYS  22           HZ2      LYS  22  -8.568  25.453  25.453
  163   3HZ   LYS  22           HZ3      LYS  22  -6.957  25.875  25.875
  164    H    ILE  23           HN       ILE  23  -9.964  20.065  20.065
  165    HA   ILE  23           HA       ILE  23 -11.351  22.152  22.152
  166    HB   ILE  23           HB       ILE  23 -11.293  20.309  20.309
  167   1HG1  ILE  23          HG11      ILE  23  -9.258  18.996  18.996
  168   2HG1  ILE  23          HG12      ILE  23 -10.872  18.356  18.356
  169   1HG2  ILE  23          HG21      ILE  23  -9.808  22.253  22.253
  170   2HG2  ILE  23          HG22      ILE  23  -8.724  21.433  21.433
  171   3HG2  ILE  23          HG23      ILE  23  -8.895  20.863  20.863
  172   1HD1  ILE  23          HD11      ILE  23 -10.433  18.139  18.139
  173   2HD1  ILE  23          HD12      ILE  23  -8.802  18.746  18.746
  174   3HD1  ILE  23          HD13      ILE  23  -9.280  17.217  17.217
  175    H    LYS  24           HN       LYS  24 -11.871  19.083  19.083
  176    HA   LYS  24           HA       LYS  24 -14.444  18.452  18.452
  177   1HB   LYS  24           HB1      LYS  24 -12.733  17.033  17.033
  178   2HB   LYS  24           HB2      LYS  24 -12.931  17.881  17.881
  179   1HG   LYS  24           HG1      LYS  24 -15.203  17.127  17.127
  180   2HG   LYS  24           HG2      LYS  24 -15.367  16.566  16.566
  181   1HD   LYS  24           HD1      LYS  24 -13.493  15.341  15.341
  182   2HD   LYS  24           HD2      LYS  24 -15.076  14.707  14.707
  183   1HE   LYS  24           HE1      LYS  24 -14.254  14.600  14.600
  184   2HE   LYS  24           HE2      LYS  24 -12.649  14.934  14.934
  185   1HZ   LYS  24           HZ1      LYS  24 -13.732  12.909  12.909
  186   2HZ   LYS  24           HZ2      LYS  24 -13.992  12.502  12.502
  187   3HZ   LYS  24           HZ3      LYS  24 -12.423  12.850  12.850
  188    H    GLY  25           HN       GLY  25 -13.222  20.454  20.454
  189   1HA   GLY  25           HA1      GLY  25 -15.592  20.887  20.887
  190   2HA   GLY  25           HA2      GLY  25 -14.167  21.935  21.935
  191    H    GLU  26           HN       GLU  26 -14.041  22.729  22.729
  192    HA   GLU  26           HA       GLU  26 -16.008  24.802  24.802
  193   1HB   GLU  26           HB1      GLU  26 -14.095  23.900  23.900
  194   2HB   GLU  26           HB2      GLU  26 -14.883  25.465  25.465
  195   1HG   GLU  26           HG1      GLU  26 -13.692  25.753  25.753
  196   2HG   GLU  26           HG2      GLU  26 -12.832  24.288  24.288
  197    H    HIS  27           HN       HIS  27 -15.468  21.885  21.885
  198    HA   HIS  27           HA       HIS  27 -18.121  22.175  22.175
  199   1HB   HIS  27           HB1      HIS  27 -15.665  20.700  20.700
  200   2HB   HIS  27           HB2      HIS  27 -17.144  21.070  21.070
  201    HD1  HIS  27           HD1      HIS  27 -17.541  23.738  23.738
  202    HD2  HIS  27           HD2      HIS  27 -13.745  22.692  22.692
  203    HE1  HIS  27           HE1      HIS  27 -16.120  25.706  25.706
  204    HA   PRO  28           HA       PRO  28 -18.710  18.183  18.183
  205   1HB   PRO  28           HB1      PRO  28 -20.650  18.849  18.849
  206   2HB   PRO  28           HB2      PRO  28 -18.986  19.323  19.323
  207   1HG   PRO  28           HG1      PRO  28 -21.136  21.027  21.027
  208   2HG   PRO  28           HG2      PRO  28 -20.184  21.446  21.446
  209   1HD   PRO  28           HD1      PRO  28 -19.380  22.210  22.210
  210   2HD   PRO  28           HD2      PRO  28 -18.200  21.844  21.844
  211    H    GLY  29           HN       GLY  29 -19.257  19.068  19.068
  212   1HA   GLY  29           HA1      GLY  29 -22.057  18.251  18.251
  213   2HA   GLY  29           HA2      GLY  29 -21.347  19.596  19.596
  214    H    LEU  30           HN       LEU  30 -18.722  17.817  17.817
  215    HA   LEU  30           HA       LEU  30 -19.268  16.464  16.464
  216   1HB   LEU  30           HB1      LEU  30 -16.655  16.268  16.268
  217   2HB   LEU  30           HB2      LEU  30 -17.389  17.782  17.782
  218    HG   LEU  30           HG       LEU  30 -17.012  18.653  18.653
  219   1HD1  LEU  30          HD11      LEU  30 -16.254  15.826  15.826
  220   2HD1  LEU  30          HD12      LEU  30 -15.945  17.258  17.258
  221   3HD1  LEU  30          HD13      LEU  30 -17.577  16.760  16.760
  222   1HD2  LEU  30          HD21      LEU  30 -14.584  17.158  17.158
  223   2HD2  LEU  30          HD22      LEU  30 -15.116  18.750  18.750
  224   3HD2  LEU  30          HD23      LEU  30 -14.547  18.492  18.492
  225    H    SER  31           HN       SER  31 -17.694  14.494  14.494
  226    HA   SER  31           HA       SER  31 -18.149  12.557  12.557
  227   1HB   SER  31           HB1      SER  31 -18.270  12.069  12.069
  228   2HB   SER  31           HB2      SER  31 -18.533  10.846  10.846
  229    HG   SER  31           HG       SER  31 -20.204  12.758  12.758
  230    H    ILE  32           HN       ILE  32 -16.821  10.507  10.507
  231    HA   ILE  32           HA       ILE  32 -14.080  11.168  11.168
  232    HB   ILE  32           HB       ILE  32 -15.638   9.095   9.095
  233   1HG1  ILE  32          HG11      ILE  32 -13.436   9.213   9.213
  234   2HG1  ILE  32          HG12      ILE  32 -13.763   7.598   7.598
  235   1HG2  ILE  32          HG21      ILE  32 -16.132   8.365   8.365
  236   2HG2  ILE  32          HG22      ILE  32 -14.432   8.071   8.071
  237   3HG2  ILE  32          HG23      ILE  32 -15.286   7.088   7.088
  238   1HD1  ILE  32          HD11      ILE  32 -12.298   8.033   8.033
  239   2HD1  ILE  32          HD12      ILE  32 -11.934   9.627   9.627
  240   3HD1  ILE  32          HD13      ILE  32 -11.444   8.196   8.196
  241    H    GLY  33           HN       GLY  33 -15.783  11.189  11.189
  242   1HA   GLY  33           HA1      GLY  33 -13.458  10.554  10.554
  243   2HA   GLY  33           HA2      GLY  33 -15.142  10.590  10.590
  244    H    ASP  34           HN       ASP  34 -14.933  13.108  13.108
  245    HA   ASP  34           HA       ASP  34 -14.282  15.041  15.041
  246   1HB   ASP  34           HB1      ASP  34 -16.100  15.005  15.005
  247   2HB   ASP  34           HB2      ASP  34 -15.903  16.512  16.512
  248    H    VAL  35           HN       VAL  35 -14.177  14.399  14.399
  249    HA   VAL  35           HA       VAL  35 -12.353  16.452  16.452
  250    HB   VAL  35           HB       VAL  35 -12.726  13.622  13.622
  251   1HG1  VAL  35          HG11      VAL  35 -11.584  16.151  16.151
  252   2HG1  VAL  35          HG12      VAL  35 -11.795  14.601  14.601
  253   3HG1  VAL  35          HG13      VAL  35 -10.612  14.774  14.774
  254   1HG2  VAL  35          HG21      VAL  35 -14.779  14.958  14.958
  255   2HG2  VAL  35          HG22      VAL  35 -14.237  14.653  14.653
  256   3HG2  VAL  35          HG23      VAL  35 -13.974  16.224  16.224
  257    H    ALA  36           HN       ALA  36 -12.127  13.347  13.347
  258    HA   ALA  36           HA       ALA  36  -9.258  13.090  13.090
  259   1HB   ALA  36           HB1      ALA  36 -11.417  11.553  11.553
  260   2HB   ALA  36           HB2      ALA  36  -9.746  11.003  11.003
  261   3HB   ALA  36           HB3      ALA  36 -10.727  11.161  11.161
  262    H    LYS  37           HN       LYS  37 -11.634  13.770  13.770
  263    HA   LYS  37           HA       LYS  37  -9.364  14.097  14.097
  264   1HB   LYS  37           HB1      LYS  37 -12.346  14.413  14.413
  265   2HB   LYS  37           HB2      LYS  37 -11.259  14.948  14.948
  266   1HG   LYS  37           HG1      LYS  37 -10.228  12.675  12.675
  267   2HG   LYS  37           HG2      LYS  37 -11.384  12.119  12.119
  268   1HD   LYS  37           HD1      LYS  37 -13.252  12.547  12.547
  269   2HD   LYS  37           HD2      LYS  37 -12.227  13.400  13.400
  270   1HE   LYS  37           HE1      LYS  37 -10.979  11.292  11.292
  271   2HE   LYS  37           HE2      LYS  37 -11.995  10.429  10.429
  272   1HZ   LYS  37           HZ1      LYS  37 -13.646  11.807  11.807
  273   2HZ   LYS  37           HZ2      LYS  37 -12.478  10.977  10.977
  274   3HZ   LYS  37           HZ3      LYS  37 -13.454  10.128  10.128
  275    H    LYS  38           HN       LYS  38 -10.669  16.050  16.050
  276    HA   LYS  38           HA       LYS  38 -10.315  18.578  18.578
  277   1HB   LYS  38           HB1      LYS  38 -12.222  18.511  18.511
  278   2HB   LYS  38           HB2      LYS  38 -11.187  17.899  17.899
  279   1HG   LYS  38           HG1      LYS  38  -9.963  19.977  19.977
  280   2HG   LYS  38           HG2      LYS  38 -10.798  20.647  20.647
  281   1HD   LYS  38           HD1      LYS  38 -12.213  19.756  19.756
  282   2HD   LYS  38           HD2      LYS  38 -11.610  21.384  21.384
  283   1HE   LYS  38           HE1      LYS  38 -13.643  20.043  20.043
  284   2HE   LYS  38           HE2      LYS  38 -14.040  21.187  21.187
  285   1HZ   LYS  38           HZ1      LYS  38 -12.009  22.297  22.297
  286   2HZ   LYS  38           HZ2      LYS  38 -13.201  21.715  21.715
  287   3HZ   LYS  38           HZ3      LYS  38 -13.615  22.816  22.816
  288    H    LEU  39           HN       LEU  39  -9.268  16.902  16.902
  289    HA   LEU  39           HA       LEU  39  -6.960  18.460  18.460
  290   1HB   LEU  39           HB1      LEU  39  -8.220  17.175  17.175
  291   2HB   LEU  39           HB2      LEU  39  -7.939  15.724  15.724
  292    HG   LEU  39           HG       LEU  39  -5.732  15.814  15.814
  293   1HD1  LEU  39          HD11      LEU  39  -6.234  18.074  18.074
  294   2HD1  LEU  39          HD12      LEU  39  -4.697  17.250  17.250
  295   3HD1  LEU  39          HD13      LEU  39  -5.304  18.213  18.213
  296   1HD2  LEU  39          HD21      LEU  39  -7.149  14.480  14.480
  297   2HD2  LEU  39          HD22      LEU  39  -5.777  15.122  15.122
  298   3HD2  LEU  39          HD23      LEU  39  -7.335  15.861  15.861
  299    H    GLY  40           HN       GLY  40  -7.534  15.383  15.383
  300   1HA   GLY  40           HA1      GLY  40  -4.928  14.641  14.641
  301   2HA   GLY  40           HA2      GLY  40  -6.331  14.194  14.194
  302    H    GLU  41           HN       GLU  41  -7.149  16.675  16.675
  303    HA   GLU  41           HA       GLU  41  -5.363  17.060  17.060
  304   1HB   GLU  41           HB1      GLU  41  -7.484  18.762  18.762
  305   2HB   GLU  41           HB2      GLU  41  -6.594  19.369  19.369
  306   1HG   GLU  41           HG1      GLU  41  -8.119  16.719  16.719
  307   2HG   GLU  41           HG2      GLU  41  -8.745  18.201  18.201
  308    H    MET  42           HN       MET  42  -5.835  19.079  19.079
  309    HA   MET  42           HA       MET  42  -3.811  20.963  20.963
  310   1HB   MET  42           HB1      MET  42  -4.630  19.737  19.737
  311   2HB   MET  42           HB2      MET  42  -3.708  21.232  21.232
  312   1HG   MET  42           HG1      MET  42  -5.706  21.899  21.899
  313   2HG   MET  42           HG2      MET  42  -6.526  20.619  20.619
  314   1HE   MET  42           HE1      MET  42  -8.514  21.591  21.591
  315   2HE   MET  42           HE2      MET  42  -7.740  20.643  20.643
  316   3HE   MET  42           HE3      MET  42  -8.492  22.192  22.192
  317    H    TRP  43           HN       TRP  43  -3.545  17.856  17.856
  318    HA   TRP  43           HA       TRP  43  -0.841  17.883  17.883
  319   1HB   TRP  43           HB1      TRP  43  -2.187  15.939  15.939
  320   2HB   TRP  43           HB2      TRP  43  -2.596  15.604  15.604
  321    HD1  TRP  43           HD1      TRP  43  -1.039  13.978  13.978
  322    HE1  TRP  43           HE1      TRP  43   1.199  13.067  13.067
  323    HE3  TRP  43           HE3      TRP  43  -0.020  16.579  16.579
  324    HZ2  TRP  43           HZ2      TRP  43   3.314  13.306  13.306
  325    HZ3  TRP  43           HZ3      TRP  43   2.095  16.248  16.248
  326    HH2  TRP  43           HH2      TRP  43   3.771  14.622  14.622
  327    H    ASN  44           HN       ASN  44  -2.315  16.880  16.880
  328    HA   ASN  44           HA       ASN  44   0.081  16.289  16.289
  329   1HB   ASN  44           HB1      ASN  44  -2.615  17.185  17.185
  330   2HB   ASN  44           HB2      ASN  44  -1.323  16.435  16.435
  331   1HD2  ASN  44          HD21      ASN  44  -3.840  14.003  14.003
  332   2HD2  ASN  44          HD22      ASN  44  -4.191  15.595  15.595
  333    H    ASN  45           HN       ASN  45  -0.971  19.212  19.212
  334    HA   ASN  45           HA       ASN  45   0.908  20.735  20.735
  335   1HB   ASN  45           HB1      ASN  45  -1.727  21.918  21.918
  336   2HB   ASN  45           HB2      ASN  45  -0.655  22.539  22.539
  337   1HD2  ASN  45          HD21      ASN  45  -3.635  20.050  20.050
  338   2HD2  ASN  45          HD22      ASN  45  -3.427  20.809  20.809
  339    H    THR  46           HN       THR  46   1.376  19.693  19.693
  340    HA   THR  46           HA       THR  46   0.973  22.028  22.028
  341    HB   THR  46           HB       THR  46   1.056  19.657  19.657
  342    HG1  THR  46           HG1      THR  46   3.166  20.849  20.849
  343   1HG2  THR  46          HG21      THR  46   4.100  19.862  19.862
  344   2HG2  THR  46          HG22      THR  46   3.225  18.634  18.634
  345   3HG2  THR  46          HG23      THR  46   3.065  18.723  18.723
  346    H    ALA  47           HN       ALA  47   3.643  20.476  20.476
  347    HA   ALA  47           HA       ALA  47   4.988  22.830  22.830
  348   1HB   ALA  47           HB1      ALA  47   6.246  21.484  21.484
  349   2HB   ALA  47           HB2      ALA  47   6.989  22.764  22.764
  350   3HB   ALA  47           HB3      ALA  47   5.563  23.096  23.096
  351    H    ALA  48           HN       ALA  48   5.654  19.690  19.690
  352    HA   ALA  48           HA       ALA  48   6.238  17.664  17.664
  353   1HB   ALA  48           HB1      ALA  48   6.112  18.728  18.728
  354   2HB   ALA  48           HB2      ALA  48   7.692  19.452  19.452
  355   3HB   ALA  48           HB3      ALA  48   7.524  17.711  17.711
  356    H    ASP  49           HN       ASP  49   7.778  20.453  20.453
  357    HA   ASP  49           HA       ASP  49  10.349  19.237  19.237
  358   1HB   ASP  49           HB1      ASP  49   9.465  22.162  22.162
  359   2HB   ASP  49           HB2      ASP  49  11.104  21.604  21.604
  360    H    ASP  50           HN       ASP  50   7.300  19.922  19.922
  361    HA   ASP  50           HA       ASP  50   8.067  20.210  20.210
  362   1HB   ASP  50           HB1      ASP  50   6.671  22.121  22.121
  363   2HB   ASP  50           HB2      ASP  50   5.442  20.954  20.954
  364    H    LYS  51           HN       LYS  51   7.271  18.066  18.066
  365    HA   LYS  51           HA       LYS  51   5.364  16.438  16.438
  366   1HB   LYS  51           HB1      LYS  51   6.735  15.903  15.903
  367   2HB   LYS  51           HB2      LYS  51   5.581  14.828  14.828
  368   1HG   LYS  51           HG1      LYS  51   3.887  16.664  16.664
  369   2HG   LYS  51           HG2      LYS  51   5.055  17.643  17.643
  370   1HD   LYS  51           HD1      LYS  51   5.203  15.860  15.860
  371   2HD   LYS  51           HD2      LYS  51   4.060  14.891  14.891
  372   1HE   LYS  51           HE1      LYS  51   2.840  16.044  16.044
  373   2HE   LYS  51           HE2      LYS  51   2.408  16.674  16.674
  374   1HZ   LYS  51           HZ1      LYS  51   4.521  18.210  18.210
  375   2HZ   LYS  51           HZ2      LYS  51   3.432  18.054  18.054
  376   3HZ   LYS  51           HZ3      LYS  51   2.902  18.677  18.677
  377    H    GLN  52           HN       GLN  52   8.498  16.341  16.341
  378    HA   GLN  52           HA       GLN  52   9.770  14.144  14.144
  379   1HB   GLN  52           HB1      GLN  52  10.564  16.853  16.853
  380   2HB   GLN  52           HB2      GLN  52  11.424  16.360  16.360
  381   1HG   GLN  52           HG1      GLN  52  12.787  15.908  15.908
  382   2HG   GLN  52           HG2      GLN  52  12.360  14.402  14.402
  383   1HE2  GLN  52          HE21      GLN  52   9.787  14.566  14.566
  384   2HE2  GLN  52          HE22      GLN  52   9.546  15.401  15.401
  385    HA   PRO  53           HA       PRO  53  10.477  14.993  14.993
  386   1HB   PRO  53           HB1      PRO  53   8.327  16.495  16.495
  387   2HB   PRO  53           HB2      PRO  53   9.945  17.109  17.109
  388   1HG   PRO  53           HG1      PRO  53   7.551  17.130  17.130
  389   2HG   PRO  53           HG2      PRO  53   8.581  18.498  18.498
  390   1HD   PRO  53           HD1      PRO  53   9.148  17.297  17.297
  391   2HD   PRO  53           HD2      PRO  53  10.507  17.517  17.517
  392    H    TYR  54           HN       TYR  54   7.102  15.137  15.137
  393    HA   TYR  54           HA       TYR  54   6.141  13.095  13.095
  394   1HB   TYR  54           HB1      TYR  54   4.982  14.239  14.239
  395   2HB   TYR  54           HB2      TYR  54   4.103  13.153  13.153
  396    HD1  TYR  54           HD1      TYR  54   4.434  14.042  14.042
  397    HD2  TYR  54           HD2      TYR  54   4.345  16.464  16.464
  398    HE1  TYR  54           HE1      TYR  54   3.766  15.974  15.974
  399    HE2  TYR  54           HE2      TYR  54   3.680  18.393  18.393
  400    HH   TYR  54           HH       TYR  54   3.768  19.174  19.174
  401    H    GLU  55           HN       GLU  55   6.758  13.211  13.211
  402    HA   GLU  55           HA       GLU  55   6.218  10.633  10.633
  403   1HB   GLU  55           HB1      GLU  55   7.548  12.966  12.966
  404   2HB   GLU  55           HB2      GLU  55   8.655  11.652  11.652
  405   1HG   GLU  55           HG1      GLU  55   6.824  10.397  10.397
  406   2HG   GLU  55           HG2      GLU  55   5.710  11.703  11.703
  407    H    LYS  56           HN       LYS  56   9.433  11.722  11.722
  408    HA   LYS  56           HA       LYS  56  10.874   9.445   9.445
  409   1HB   LYS  56           HB1      LYS  56  10.859  11.712  11.712
  410   2HB   LYS  56           HB2      LYS  56  11.681  10.268  10.268
  411   1HG   LYS  56           HG1      LYS  56  13.075  10.288  10.288
  412   2HG   LYS  56           HG2      LYS  56  12.266  11.738  11.738
  413   1HD   LYS  56           HD1      LYS  56  14.236  12.600  12.600
  414   2HD   LYS  56           HD2      LYS  56  13.070  12.770  12.770
  415   1HE   LYS  56           HE1      LYS  56  14.954  10.379  10.379
  416   2HE   LYS  56           HE2      LYS  56  15.308  11.802  11.802
  417   1HZ   LYS  56           HZ1      LYS  56  12.770  10.942  10.942
  418   2HZ   LYS  56           HZ2      LYS  56  13.785   9.577   9.577
  419   3HZ   LYS  56           HZ3      LYS  56  14.192  10.927  10.927
  420    H    LYS  57           HN       LYS  57   8.468  10.103  10.103
  421    HA   LYS  57           HA       LYS  57   9.087   7.757   7.757
  422   1HB   LYS  57           HB1      LYS  57   7.737   9.861   9.861
  423   2HB   LYS  57           HB2      LYS  57   6.374   9.148   9.148
  424   1HG   LYS  57           HG1      LYS  57   6.980   6.987   6.987
  425   2HG   LYS  57           HG2      LYS  57   7.854   8.137   8.137
  426   1HD   LYS  57           HD1      LYS  57   5.653   9.513   9.513
  427   2HD   LYS  57           HD2      LYS  57   4.912   8.095   8.095
  428   1HE   LYS  57           HE1      LYS  57   4.547   7.906   7.906
  429   2HE   LYS  57           HE2      LYS  57   5.757   6.708   6.708
  430   1HZ   LYS  57           HZ1      LYS  57   7.050   9.117   9.117
  431   2HZ   LYS  57           HZ2      LYS  57   5.964   8.782   8.782
  432   3HZ   LYS  57           HZ3      LYS  57   7.148   7.642   7.642
  433    H    ALA  58           HN       ALA  58   6.360   8.569   8.569
  434    HA   ALA  58           HA       ALA  58   5.052   6.151   6.151
  435   1HB   ALA  58           HB1      ALA  58   4.319   8.223   8.223
  436   2HB   ALA  58           HB2      ALA  58   5.647   8.046   8.046
  437   3HB   ALA  58           HB3      ALA  58   4.361   6.846   6.846
  438    H    ALA  59           HN       ALA  59   7.770   7.198   7.198
  439    HA   ALA  59           HA       ALA  59   8.207   4.960   4.960
  440   1HB   ALA  59           HB1      ALA  59   9.425   7.136   7.136
  441   2HB   ALA  59           HB2      ALA  59  10.292   6.852   6.852
  442   3HB   ALA  59           HB3      ALA  59  10.571   5.814   5.814
  443    H    LYS  60           HN       LYS  60  10.003   5.686   5.686
  444    HA   LYS  60           HA       LYS  60  11.405   3.354   3.354
  445   1HB   LYS  60           HB1      LYS  60  11.354   5.486   5.486
  446   2HB   LYS  60           HB2      LYS  60  10.021   4.750   4.750
  447   1HG   LYS  60           HG1      LYS  60  11.459   2.778   2.778
  448   2HG   LYS  60           HG2      LYS  60  12.782   3.496   3.496
  449   1HD   LYS  60           HD1      LYS  60  12.680   5.498   5.498
  450   2HD   LYS  60           HD2      LYS  60  11.465   4.665   4.665
  451   1HE   LYS  60           HE1      LYS  60  14.344   3.722   3.722
  452   2HE   LYS  60           HE2      LYS  60  13.687   4.381   4.381
  453   1HZ   LYS  60           HZ1      LYS  60  12.030   2.285   2.285
  454   2HZ   LYS  60           HZ2      LYS  60  13.620   1.730   1.730
  455   3HZ   LYS  60           HZ3      LYS  60  13.150   2.356   2.356
  456    H    LEU  61           HN       LEU  61   8.015   3.880   3.880
  457    HA   LEU  61           HA       LEU  61   7.809   1.183   1.183
  458   1HB   LEU  61           HB1      LEU  61   5.564   3.035   3.035
  459   2HB   LEU  61           HB2      LEU  61   5.437   1.732   1.732
  460    HG   LEU  61           HG       LEU  61   7.040   4.316   4.316
  461   1HD1  LEU  61          HD11      LEU  61   4.683   4.533   4.533
  462   2HD1  LEU  61          HD12      LEU  61   4.750   3.191   3.191
  463   3HD1  LEU  61          HD13      LEU  61   5.616   4.686   4.686
  464   1HD2  LEU  61          HD21      LEU  61   7.075   1.932   1.932
  465   2HD2  LEU  61          HD22      LEU  61   8.434   2.494   2.494
  466   3HD2  LEU  61          HD23      LEU  61   7.799   3.504   3.504
  467    H    LYS  62           HN       LYS  62   6.425   2.603   2.603
  468    HA   LYS  62           HA       LYS  62   5.379   0.373   0.373
  469   1HB   LYS  62           HB1      LYS  62   5.275   2.490   2.490
  470   2HB   LYS  62           HB2      LYS  62   7.007   2.715   2.715
  471   1HG   LYS  62           HG1      LYS  62   7.295   0.814   0.814
  472   2HG   LYS  62           HG2      LYS  62   5.551   0.616   0.616
  473   1HD   LYS  62           HD1      LYS  62   5.257   2.778   2.778
  474   2HD   LYS  62           HD2      LYS  62   6.890   3.280   3.280
  475   1HE   LYS  62           HE1      LYS  62   6.216   1.045   1.045
  476   2HE   LYS  62           HE2      LYS  62   6.661   2.687   2.687
  477   1HZ   LYS  62           HZ1      LYS  62   8.564   1.726   1.726
  478   2HZ   LYS  62           HZ2      LYS  62   8.342   0.550   0.550
  479   3HZ   LYS  62           HZ3      LYS  62   8.763   2.138   2.138
  480    H    GLU  63           HN       GLU  63   8.752   1.354   1.354
  481    HA   GLU  63           HA       GLU  63   9.965  -0.675  -0.675
  482   1HB   GLU  63           HB1      GLU  63  11.039   1.474   1.474
  483   2HB   GLU  63           HB2      GLU  63  11.038   0.820   0.820
  484   1HG   GLU  63           HG1      GLU  63  12.617  -0.999  -0.999
  485   2HG   GLU  63           HG2      GLU  63  12.650  -0.237  -0.237
  486    H    LYS  64           HN       LYS  64   9.427  -0.516  -0.516
  487    HA   LYS  64           HA       LYS  64  10.541  -2.993  -2.993
  488   1HB   LYS  64           HB1      LYS  64   9.534  -1.143  -1.143
  489   2HB   LYS  64           HB2      LYS  64   7.960  -1.833  -1.833
  490   1HG   LYS  64           HG1      LYS  64   8.752  -2.693  -2.693
  491   2HG   LYS  64           HG2      LYS  64   8.709  -4.005  -4.005
  492   1HD   LYS  64           HD1      LYS  64  11.051  -4.118  -4.118
  493   2HD   LYS  64           HD2      LYS  64  11.294  -2.456  -2.456
  494   1HE   LYS  64           HE1      LYS  64  11.995  -4.061  -4.061
  495   2HE   LYS  64           HE2      LYS  64  10.658  -3.064  -3.064
  496   1HZ   LYS  64           HZ1      LYS  64   9.611  -5.339  -5.339
  497   2HZ   LYS  64           HZ2      LYS  64  10.797  -5.837  -5.837
  498   3HZ   LYS  64           HZ3      LYS  64   9.501  -4.871  -4.871
  499    H    TYR  65           HN       TYR  65   7.215  -2.305  -2.305
  500    HA   TYR  65           HA       TYR  65   6.082  -4.869  -4.869
  501   1HB   TYR  65           HB1      TYR  65   4.620  -3.064  -3.064
  502   2HB   TYR  65           HB2      TYR  65   5.608  -2.300  -2.300
  503    HD1  TYR  65           HD1      TYR  65   4.337  -5.843  -5.843
  504    HD2  TYR  65           HD2      TYR  65   3.874  -1.778  -1.778
  505    HE1  TYR  65           HE1      TYR  65   2.756  -6.512  -6.512
  506    HE2  TYR  65           HE2      TYR  65   2.309  -2.450  -2.450
  507    HH   TYR  65           HH       TYR  65   1.993  -5.513  -5.513
  508    H    GLU  66           HN       GLU  66   7.330  -3.201  -3.201
  509    HA   GLU  66           HA       GLU  66   7.167  -5.054  -5.054
  510   1HB   GLU  66           HB1      GLU  66   9.618  -3.393  -3.393
  511   2HB   GLU  66           HB2      GLU  66   9.210  -4.113  -4.113
  512   1HG   GLU  66           HG1      GLU  66   7.100  -2.353  -2.353
  513   2HG   GLU  66           HG2      GLU  66   8.511  -1.534  -1.534
  514    H    LYS  67           HN       LYS  67   9.507  -5.171  -5.171
  515    HA   LYS  67           HA       LYS  67  10.999  -7.373  -7.373
  516   1HB   LYS  67           HB1      LYS  67  11.211  -5.741  -5.741
  517   2HB   LYS  67           HB2      LYS  67  11.974  -7.315  -7.315
  518   1HG   LYS  67           HG1      LYS  67  13.537  -5.600  -5.600
  519   2HG   LYS  67           HG2      LYS  67  13.274  -6.781  -6.781
  520   1HD   LYS  67           HD1      LYS  67  11.760  -5.182  -5.182
  521   2HD   LYS  67           HD2      LYS  67  11.959  -4.024  -4.024
  522   1HE   LYS  67           HE1      LYS  67  13.446  -3.494  -3.494
  523   2HE   LYS  67           HE2      LYS  67  14.391  -3.882  -3.882
  524   1HZ   LYS  67           HZ1      LYS  67  13.866  -6.252  -6.252
  525   2HZ   LYS  67           HZ2      LYS  67  14.460  -5.107  -5.107
  526   3HZ   LYS  67           HZ3      LYS  67  15.359  -5.494  -5.494
  527    H    ASP  68           HN       ASP  68   8.588  -7.030  -7.030
  528    HA   ASP  68           HA       ASP  68   8.707  -9.749  -9.749
  529   1HB   ASP  68           HB1      ASP  68   6.788  -7.450  -7.450
  530   2HB   ASP  68           HB2      ASP  68   6.580  -9.023  -9.023
  531    H    ILE  69           HN       ILE  69   7.192  -7.990  -7.990
  532    HA   ILE  69           HA       ILE  69   5.102 -10.041 -10.041
  533    HB   ILE  69           HB       ILE  69   4.511  -7.678  -7.678
  534   1HG1  ILE  69          HG11      ILE  69   3.517  -7.836  -7.836
  535   2HG1  ILE  69          HG12      ILE  69   4.715  -8.994  -8.994
  536   1HG2  ILE  69          HG21      ILE  69   6.696  -6.916  -6.916
  537   2HG2  ILE  69          HG22      ILE  69   6.595  -7.782  -7.782
  538   3HG2  ILE  69          HG23      ILE  69   5.495  -6.449  -6.449
  539   1HD1  ILE  69          HD11      ILE  69   2.735  -9.523  -9.523
  540   2HD1  ILE  69          HD12      ILE  69   2.566 -10.099 -10.099
  541   3HD1  ILE  69          HD13      ILE  69   3.886 -10.665 -10.665
  542    H    ALA  70           HN       ALA  70   8.001  -8.880  -8.880
  543    HA   ALA  70           HA       ALA  70   8.176 -10.599 -10.599
  544   1HB   ALA  70           HB1      ALA  70  10.469  -9.532  -9.532
  545   2HB   ALA  70           HB2      ALA  70  10.645 -10.173 -10.173
  546   3HB   ALA  70           HB3      ALA  70   9.762  -8.678  -8.678
  547    H    ALA  71           HN       ALA  71   8.887 -10.885 -10.885
  548    HA   ALA  71           HA       ALA  71  10.035 -13.546 -13.546
  549   1HB   ALA  71           HB1      ALA  71   9.031 -11.874 -11.874
  550   2HB   ALA  71           HB2      ALA  71   9.962 -13.358 -13.358
  551   3HB   ALA  71           HB3      ALA  71  10.692 -11.937 -11.937
  552    H    TYR  72           HN       TYR  72   6.938 -12.056 -12.056
  553    HA   TYR  72           HA       TYR  72   5.532 -14.308 -14.308
  554   1HB   TYR  72           HB1      TYR  72   4.661 -12.070 -12.070
  555   2HB   TYR  72           HB2      TYR  72   4.555 -11.956 -11.956
  556    HD1  TYR  72           HD1      TYR  72   3.242 -13.921 -13.921
  557    HD2  TYR  72           HD2      TYR  72   2.598 -12.568 -12.568
  558    HE1  TYR  72           HE1      TYR  72   0.966 -14.828 -14.828
  559    HE2  TYR  72           HE2      TYR  72   0.322 -13.472 -13.472
  560    HH   TYR  72           HH       TYR  72  -0.773 -15.589 -15.589
  561    H    ARG  73           HN       ARG  73   5.882 -13.072 -13.072
  562    HA   ARG  73           HA       ARG  73   4.292 -15.041 -15.041
  563   1HB   ARG  73           HB1      ARG  73   6.434 -13.052 -13.052
  564   2HB   ARG  73           HB2      ARG  73   5.791 -14.174 -14.174
  565   1HG   ARG  73           HG1      ARG  73   3.826 -12.564 -12.564
  566   2HG   ARG  73           HG2      ARG  73   4.707 -11.748 -11.748
  567   1HD   ARG  73           HD1      ARG  73   2.507 -12.725 -12.725
  568   2HD   ARG  73           HD2      ARG  73   3.893 -13.341 -13.341
  569    HE   ARG  73           HE       ARG  73   3.765 -15.382 -15.382
  570   1HH1  ARG  73          HH11      ARG  73   1.840 -14.680 -14.680
  571   2HH1  ARG  73          HH12      ARG  73   0.330 -15.255 -15.255
  572   1HH2  ARG  73          HH21      ARG  73   1.571 -15.507 -15.507
  573   2HH2  ARG  73          HH22      ARG  73   0.171 -15.739 -15.739
  574    H    ALA  74           HN       ALA  74   7.491 -14.733 -14.733
  575    HA   ALA  74           HA       ALA  74   8.490 -17.106 -17.106
  576   1HB   ALA  74           HB1      ALA  74   9.949 -15.199 -15.199
  577   2HB   ALA  74           HB2      ALA  74   9.680 -15.408 -15.408
  578   3HB   ALA  74           HB3      ALA  74  10.550 -16.636 -16.636
  579    H    LYS  75           HN       LYS  75   6.899 -16.444 -16.444
  580    HA   LYS  75           HA       LYS  75   6.874 -19.309 -19.309
  581   1HB   LYS  75           HB1      LYS  75   9.027 -18.233 -18.233
  582   2HB   LYS  75           HB2      LYS  75   7.947 -17.414 -17.414
  583   1HG   LYS  75           HG1      LYS  75   8.330 -19.370 -19.370
  584   2HG   LYS  75           HG2      LYS  75   6.940 -19.895 -19.895
  585   1HD   LYS  75           HD1      LYS  75   8.405 -20.906 -20.906
  586   2HD   LYS  75           HD2      LYS  75   9.824 -20.384 -20.384
  587   1HE   LYS  75           HE1      LYS  75   9.434 -22.703 -22.703
  588   2HE   LYS  75           HE2      LYS  75   8.965 -21.739 -21.739
  589   1HZ   LYS  75           HZ1      LYS  75   6.745 -21.943 -21.943
  590   2HZ   LYS  75           HZ2      LYS  75   7.404 -23.500 -23.500
  591   3HZ   LYS  75           HZ3      LYS  75   6.967 -22.619 -22.619
  592    H    GLY  76           HN       GLY  76   4.687 -18.165 -18.165
  593   1HA   GLY  76           HA1      GLY  76   3.222 -17.454 -17.454
  594   2HA   GLY  76           HA2      GLY  76   2.784 -16.811 -16.811
  595    H    LYS  77           HN       LYS  77   2.850 -18.898 -18.898
  596    HA   LYS  77           HA       LYS  77   0.622 -20.111 -20.111
  597   1HB   LYS  77           HB1      LYS  77   3.371 -21.164 -21.164
  598   2HB   LYS  77           HB2      LYS  77   2.164 -22.430 -22.430
  599   1HG   LYS  77           HG1      LYS  77   1.955 -19.883 -19.883
  600   2HG   LYS  77           HG2      LYS  77   2.708 -21.351 -21.351
  601   1HD   LYS  77           HD1      LYS  77   0.642 -22.620 -22.620
  602   2HD   LYS  77           HD2      LYS  77  -0.158 -21.327 -21.327
  603   1HE   LYS  77           HE1      LYS  77   0.779 -21.134 -21.134
  604   2HE   LYS  77           HE2      LYS  77  -0.876 -21.414 -21.414
  605   1HZ   LYS  77           HZ1      LYS  77   0.093 -19.200 -19.200
  606   2HZ   LYS  77           HZ2      LYS  77   0.473 -18.982 -18.982
  607   3HZ   LYS  77           HZ3      LYS  77  -1.135 -19.261 -19.261
  608    HA   PRO  78           HA       PRO  78   0.377 -23.683 -23.683
  609   1HB   PRO  78           HB1      PRO  78   2.543 -23.238 -23.238
  610   2HB   PRO  78           HB2      PRO  78   2.133 -24.736 -24.736
  611   1HG   PRO  78           HG1      PRO  78   4.375 -23.426 -23.426
  612   2HG   PRO  78           HG2      PRO  78   3.320 -24.060 -24.060
  613   1HD   PRO  78           HD1      PRO  78   3.300 -21.228 -21.228
  614   2HD   PRO  78           HD2      PRO  78   3.538 -21.677 -21.677
  615    H    ASP  79           HN       ASP  79   0.449 -20.613 -20.613
  616    HA   ASP  79           HA       ASP  79  -0.055 -19.155 -19.155
  617   1HB   ASP  79           HB1      ASP  79  -2.538 -18.744 -18.744
  618   2HB   ASP  79           HB2      ASP  79  -1.391 -18.705 -18.705
  619    H    ALA  80           HN       ALA  80   0.452 -21.015 -21.015
  620    HA   ALA  80           HA       ALA  80  -1.411 -20.712 -20.712
  621   1HB   ALA  80           HB1      ALA  80  -1.368 -23.499 -23.499
  622   2HB   ALA  80           HB2      ALA  80  -2.154 -23.106 -23.106
  623   3HB   ALA  80           HB3      ALA  80  -2.750 -22.424 -22.424
  624    H    ALA  81           HN       ALA  81   0.502 -23.503 -23.503
  625    HA   ALA  81           HA       ALA  81   2.578 -22.842 -22.842
  626   1HB   ALA  81           HB1      ALA  81   1.187 -25.548 -25.548
  627   2HB   ALA  81           HB2      ALA  81   2.536 -25.217 -25.217
  628   3HB   ALA  81           HB3      ALA  81   0.990 -24.436 -24.436
  629   1H1   BME  16           HE1      MER  16  -8.050  10.084  10.084
  630   2H1   BME  16           HE2      MER  16  -7.705   8.556   8.556
  631   1H2   BME  16           HZ1      MER  16  -5.987  10.223  10.223
  632   2H2   BME  16           HZ2      MER  16  -6.961   9.829   9.829
  633    HO1  BME  16           HH       MER  16  -9.519   8.797   8.797

  Start of MODEL   19
    1    H    ASN   3           HN       ASN   3   0.891 -10.292 -10.292
    2    HA   ASN   3           HA       ASN   3   0.628 -12.372 -12.372
    3   1HB   ASN   3           HB1      ASN   3  -2.404 -11.995 -11.995
    4   2HB   ASN   3           HB2      ASN   3  -1.586 -13.477 -13.477
    5   1HD2  ASN   3          HD21      ASN   3  -1.072 -14.335 -14.335
    6   2HD2  ASN   3          HD22      ASN   3  -1.414 -14.822 -14.822
    7    H    ALA   4           HN       ALA   4   1.127 -10.304 -10.304
    8    HA   ALA   4           HA       ALA   4   1.401 -10.213 -10.213
    9   1HB   ALA   4           HB1      ALA   4  -1.668 -10.011 -10.011
   10   2HB   ALA   4           HB2      ALA   4  -0.634  -9.862  -9.862
   11   3HB   ALA   4           HB3      ALA   4  -0.760 -11.399 -11.399
   12    HA   PRO   5           HA       PRO   5   1.318  -5.851  -5.851
   13   1HB   PRO   5           HB1      PRO   5   3.555  -6.078  -6.078
   14   2HB   PRO   5           HB2      PRO   5   3.490  -5.118  -5.118
   15   1HG   PRO   5           HG1      PRO   5   4.857  -7.403  -7.403
   16   2HG   PRO   5           HG2      PRO   5   3.720  -7.098  -7.098
   17   1HD   PRO   5           HD1      PRO   5   3.261  -8.794  -8.794
   18   2HD   PRO   5           HD2      PRO   5   2.916  -9.227  -9.227
   19    H    LYS   6           HN       LYS   6  -0.446  -5.194  -5.194
   20    HA   LYS   6           HA       LYS   6  -1.099  -5.322  -5.322
   21   1HB   LYS   6           HB1      LYS   6  -2.762  -5.833  -5.833
   22   2HB   LYS   6           HB2      LYS   6  -2.660  -4.152  -4.152
   23   1HG   LYS   6           HG1      LYS   6  -3.442  -3.571  -3.571
   24   2HG   LYS   6           HG2      LYS   6  -3.752  -5.285  -5.285
   25   1HD   LYS   6           HD1      LYS   6  -5.219  -5.197  -5.197
   26   2HD   LYS   6           HD2      LYS   6  -4.988  -3.464  -3.464
   27   1HE   LYS   6           HE1      LYS   6  -7.106  -3.921  -3.921
   28   2HE   LYS   6           HE2      LYS   6  -5.972  -3.359  -3.359
   29   1HZ   LYS   6           HZ1      LYS   6  -5.696  -6.125  -6.125
   30   2HZ   LYS   6           HZ2      LYS   6  -7.352  -5.781  -5.781
   31   3HZ   LYS   6           HZ3      LYS   6  -6.293  -5.231  -5.231
   32    H    ARG   7           HN       ARG   7  -0.781  -3.660  -3.660
   33    HA   ARG   7           HA       ARG   7   0.856  -1.732  -1.732
   34   1HB   ARG   7           HB1      ARG   7  -2.004  -1.468  -1.468
   35   2HB   ARG   7           HB2      ARG   7  -0.840  -0.196  -0.196
   36   1HG   ARG   7           HG1      ARG   7   0.690  -2.036  -2.036
   37   2HG   ARG   7           HG2      ARG   7  -0.703  -3.100  -3.100
   38   1HD   ARG   7           HD1      ARG   7  -1.974  -1.704  -1.704
   39   2HD   ARG   7           HD2      ARG   7  -0.790  -0.406  -0.406
   40    HE   ARG   7           HE       ARG   7  -0.249  -3.064  -3.064
   41   1HH1  ARG   7          HH11      ARG   7   2.212  -1.700  -1.700
   42   2HH1  ARG   7          HH12      ARG   7   2.463  -0.660  -0.660
   43   1HH2  ARG   7          HH21      ARG   7  -0.876  -0.885  -0.885
   44   2HH2  ARG   7          HH22      ARG   7   0.668  -0.185  -0.185
   45    HA   PRO   8           HA       PRO   8   0.099   0.893   0.893
   46   1HB   PRO   8           HB1      PRO   8   2.447   2.342   2.342
   47   2HB   PRO   8           HB2      PRO   8   2.410   0.663   0.663
   48   1HG   PRO   8           HG1      PRO   8   2.928   1.720   1.720
   49   2HG   PRO   8           HG2      PRO   8   3.964   0.656   0.656
   50   1HD   PRO   8           HD1      PRO   8   2.272  -0.405  -0.405
   51   2HD   PRO   8           HD2      PRO   8   2.411  -1.204  -1.204
   52    HA   PRO   9           HA       PRO   9  -1.100   5.200   5.200
   53   1HB   PRO   9           HB1      PRO   9   1.334   6.526   6.526
   54   2HB   PRO   9           HB2      PRO   9  -0.181   6.397   6.397
   55   1HG   PRO   9           HG1      PRO   9   2.232   4.544   4.544
   56   2HG   PRO   9           HG2      PRO   9   1.267   5.163   5.163
   57   1HD   PRO   9           HD1      PRO   9   0.753   2.691   2.691
   58   2HD   PRO   9           HD2      PRO   9  -0.652   3.771   3.771
   59    H    SER  10           HN       SER  10  -0.154   7.205   7.205
   60    HA   SER  10           HA       SER  10   1.158   6.341   6.341
   61   1HB   SER  10           HB1      SER  10  -0.911   8.524   8.524
   62   2HB   SER  10           HB2      SER  10  -0.186   8.112   8.112
   63    HG   SER  10           HG       SER  10  -1.528   6.502   6.502
   64    H    ALA  11           HN       ALA  11   0.859   9.001   9.001
   65    HA   ALA  11           HA       ALA  11   3.123  10.111  10.111
   66   1HB   ALA  11           HB1      ALA  11   2.682  11.041  11.041
   67   2HB   ALA  11           HB2      ALA  11   3.892  11.684  11.684
   68   3HB   ALA  11           HB3      ALA  11   4.053  10.058  10.058
   69    H    PHE  12           HN       PHE  12   0.504  10.636  10.636
   70    HA   PHE  12           HA       PHE  12  -0.460  13.199  13.199
   71   1HB   PHE  12           HB1      PHE  12  -1.062  12.524  12.524
   72   2HB   PHE  12           HB2      PHE  12  -1.392  10.852  10.852
   73    HD1  PHE  12           HD1      PHE  12  -2.706  14.332  14.332
   74    HD2  PHE  12           HD2      PHE  12  -3.561  10.184  10.184
   75    HE1  PHE  12           HE1      PHE  12  -5.104  14.828  14.828
   76    HE2  PHE  12           HE2      PHE  12  -5.949  10.671  10.671
   77    HZ   PHE  12           HZ       PHE  12  -6.737  13.004  13.004
   78    H    PHE  13           HN       PHE  13  -0.371  10.206  10.206
   79    HA   PHE  13           HA       PHE  13  -2.935  10.405  10.405
   80   1HB   PHE  13           HB1      PHE  13  -1.915   8.197   8.197
   81   2HB   PHE  13           HB2      PHE  13  -0.608   8.526   8.526
   82    HD1  PHE  13           HD1      PHE  13  -1.147   8.719   8.719
   83    HD2  PHE  13           HD2      PHE  13  -4.123   7.612   7.612
   84    HE1  PHE  13           HE1      PHE  13  -2.609   7.966   7.966
   85    HE2  PHE  13           HE2      PHE  13  -5.585   6.862   6.862
   86    HZ   PHE  13           HZ       PHE  13  -4.833   7.041   7.041
   87    H    LEU  14           HN       LEU  14   0.553  10.702  10.702
   88    HA   LEU  14           HA       LEU  14   0.241  11.374  11.374
   89   1HB   LEU  14           HB1      LEU  14   2.243  12.706  12.706
   90   2HB   LEU  14           HB2      LEU  14   2.379  12.622  12.622
   91    HG   LEU  14           HG       LEU  14   3.921  11.115  11.115
   92   1HD1  LEU  14          HD11      LEU  14   2.572  10.013  10.013
   93   2HD1  LEU  14          HD12      LEU  14   1.483   9.371   9.371
   94   3HD1  LEU  14          HD13      LEU  14   3.155   8.834   8.834
   95   1HD2  LEU  14          HD21      LEU  14   3.452  11.070  11.070
   96   2HD2  LEU  14          HD22      LEU  14   3.700   9.439   9.439
   97   3HD2  LEU  14          HD23      LEU  14   2.080   9.995   9.995
   98    H    PHE  15           HN       PHE  15   0.544  13.387  13.387
   99    HA   PHE  15           HA       PHE  15  -0.098  15.929  15.929
  100   1HB   PHE  15           HB1      PHE  15   0.925  15.833  15.833
  101   2HB   PHE  15           HB2      PHE  15  -0.069  14.450  14.450
  102    HD1  PHE  15           HD1      PHE  15  -2.178  14.753  14.753
  103    HD2  PHE  15           HD2      PHE  15   0.204  18.138  18.138
  104    HE1  PHE  15           HE1      PHE  15  -3.506  16.141  16.141
  105    HE2  PHE  15           HE2      PHE  15  -1.157  19.532  19.532
  106    HZ   PHE  15           HZ       PHE  15  -3.007  18.525  18.525
  107    H    CYS  16           HN       MER  16  -2.399  13.755  13.755
  108    HA   CYS  16           HA       MER  16  -4.700  15.297  15.297
  109   1HB   CYS  16           HB1      MER  16  -4.740  13.369  13.369
  110   2HB   CYS  16           HB2      MER  16  -4.519  12.271  12.271
  111    H    SER  17           HN       SER  17  -3.297  12.799  12.799
  112    HA   SER  17           HA       SER  17  -5.355  12.645  12.645
  113   1HB   SER  17           HB1      SER  17  -3.297  11.200  11.200
  114   2HB   SER  17           HB2      SER  17  -2.340  12.552  12.552
  115    HG   SER  17           HG       SER  17  -3.105  12.147  12.147
  116    H    GLU  18           HN       GLU  18  -2.609  14.763  14.763
  117    HA   GLU  18           HA       GLU  18  -3.257  16.321  16.321
  118   1HB   GLU  18           HB1      GLU  18  -1.019  16.056  16.056
  119   2HB   GLU  18           HB2      GLU  18  -1.512  16.885  16.885
  120   1HG   GLU  18           HG1      GLU  18  -1.907  18.971  18.971
  121   2HG   GLU  18           HG2      GLU  18  -1.537  18.167  18.167
  122    H    TYR  19           HN       TYR  19  -4.554  16.382  16.382
  123    HA   TYR  19           HA       TYR  19  -5.483  19.195  19.195
  124   1HB   TYR  19           HB1      TYR  19  -5.229  17.150  17.150
  125   2HB   TYR  19           HB2      TYR  19  -6.528  18.358  18.358
  126    HD1  TYR  19           HD1      TYR  19  -2.848  18.193  18.193
  127    HD2  TYR  19           HD2      TYR  19  -6.047  20.355  20.355
  128    HE1  TYR  19           HE1      TYR  19  -1.255  19.846  19.846
  129    HE2  TYR  19           HE2      TYR  19  -4.459  22.013  22.013
  130    HH   TYR  19           HH       TYR  19  -1.574  22.523  22.523
  131    H    ARG  20           HN       ARG  20  -6.856  16.018  16.018
  132    HA   ARG  20           HA       ARG  20  -9.417  16.089  16.089
  133   1HB   ARG  20           HB1      ARG  20  -7.804  14.593  14.593
  134   2HB   ARG  20           HB2      ARG  20  -9.410  14.842  14.842
  135   1HG   ARG  20           HG1      ARG  20 -10.433  13.990  13.990
  136   2HG   ARG  20           HG2      ARG  20  -8.840  13.729  13.729
  137   1HD   ARG  20           HD1      ARG  20  -9.877  12.361  12.361
  138   2HD   ARG  20           HD2      ARG  20  -9.904  11.632  11.632
  139    HE   ARG  20           HE       ARG  20  -7.308  12.068  12.068
  140   1HH1  ARG  20          HH11      ARG  20  -9.106   9.891   9.891
  141   2HH1  ARG  20          HH12      ARG  20  -8.076   9.641   9.641
  142   1HH2  ARG  20          HH21      ARG  20  -6.070  12.416  12.416
  143   2HH2  ARG  20          HH22      ARG  20  -6.320  11.103  11.103
  144    HA   PRO  21           HA       PRO  21 -11.212  17.670  17.670
  145   1HB   PRO  21           HB1      PRO  21  -9.691  18.802  18.802
  146   2HB   PRO  21           HB2      PRO  21  -9.807  17.042  17.042
  147   1HG   PRO  21           HG1      PRO  21  -7.654  18.899  18.899
  148   2HG   PRO  21           HG2      PRO  21  -7.419  17.486  17.486
  149   1HD   PRO  21           HD1      PRO  21  -7.261  17.172  17.172
  150   2HD   PRO  21           HD2      PRO  21  -8.152  15.960  15.960
  151    H    LYS  22           HN       LYS  22  -8.750  19.606  19.606
  152    HA   LYS  22           HA       LYS  22  -9.998  22.175  22.175
  153   1HB   LYS  22           HB1      LYS  22  -7.726  21.436  21.436
  154   2HB   LYS  22           HB2      LYS  22  -8.202  23.073  23.073
  155   1HG   LYS  22           HG1      LYS  22  -7.848  22.011  22.011
  156   2HG   LYS  22           HG2      LYS  22  -6.727  21.038  21.038
  157   1HD   LYS  22           HD1      LYS  22  -5.506  22.972  22.972
  158   2HD   LYS  22           HD2      LYS  22  -5.668  23.129  23.129
  159   1HE   LYS  22           HE1      LYS  22  -7.630  24.688  24.688
  160   2HE   LYS  22           HE2      LYS  22  -7.451  24.501  24.501
  161   1HZ   LYS  22           HZ1      LYS  22  -4.971  25.217  25.217
  162   2HZ   LYS  22           HZ2      LYS  22  -6.123  26.241  26.241
  163   3HZ   LYS  22           HZ3      LYS  22  -6.011  26.134  26.134
  164    H    ILE  23           HN       ILE  23 -10.002  19.923  19.923
  165    HA   ILE  23           HA       ILE  23 -11.324  22.008  22.008
  166    HB   ILE  23           HB       ILE  23 -11.403  19.160  19.160
  167   1HG1  ILE  23          HG11      ILE  23  -8.760  20.704  20.704
  168   2HG1  ILE  23          HG12      ILE  23  -9.123  19.254  19.254
  169   1HG2  ILE  23          HG21      ILE  23 -12.161  21.180  21.180
  170   2HG2  ILE  23          HG22      ILE  23 -10.540  21.840  21.840
  171   3HG2  ILE  23          HG23      ILE  23 -10.843  20.390  20.390
  172   1HD1  ILE  23          HD11      ILE  23  -9.502  17.979  17.979
  173   2HD1  ILE  23          HD12      ILE  23  -9.106  19.386  19.386
  174   3HD1  ILE  23          HD13      ILE  23  -7.889  18.654  18.654
  175    H    LYS  24           HN       LYS  24 -11.869  19.084  19.084
  176    HA   LYS  24           HA       LYS  24 -14.644  18.737  18.737
  177   1HB   LYS  24           HB1      LYS  24 -12.869  17.086  17.086
  178   2HB   LYS  24           HB2      LYS  24 -12.856  17.722  17.722
  179   1HG   LYS  24           HG1      LYS  24 -15.048  16.943  16.943
  180   2HG   LYS  24           HG2      LYS  24 -15.506  16.750  16.750
  181   1HD   LYS  24           HD1      LYS  24 -15.137  14.555  14.555
  182   2HD   LYS  24           HD2      LYS  24 -13.928  14.841  14.841
  183   1HE   LYS  24           HE1      LYS  24 -12.282  15.486  15.486
  184   2HE   LYS  24           HE2      LYS  24 -13.503  15.127  15.127
  185   1HZ   LYS  24           HZ1      LYS  24 -13.337  12.958  12.958
  186   2HZ   LYS  24           HZ2      LYS  24 -11.759  13.375  13.375
  187   3HZ   LYS  24           HZ3      LYS  24 -12.938  13.023  13.023
  188    H    GLY  25           HN       GLY  25 -12.888  20.758  20.758
  189   1HA   GLY  25           HA1      GLY  25 -15.004  21.183  21.183
  190   2HA   GLY  25           HA2      GLY  25 -13.409  21.939  21.939
  191    H    GLU  26           HN       GLU  26 -13.574  22.712  22.712
  192    HA   GLU  26           HA       GLU  26 -15.138  25.164  25.164
  193   1HB   GLU  26           HB1      GLU  26 -13.175  24.234  24.234
  194   2HB   GLU  26           HB2      GLU  26 -13.913  25.823  25.823
  195   1HG   GLU  26           HG1      GLU  26 -12.241  24.703  24.703
  196   2HG   GLU  26           HG2      GLU  26 -11.610  25.762  25.762
  197    H    HIS  27           HN       HIS  27 -14.905  22.448  22.448
  198    HA   HIS  27           HA       HIS  27 -17.556  23.039  23.039
  199   1HB   HIS  27           HB1      HIS  27 -15.223  21.718  21.718
  200   2HB   HIS  27           HB2      HIS  27 -16.677  22.441  22.441
  201    HD1  HIS  27           HD1      HIS  27 -16.768  25.156  25.156
  202    HD2  HIS  27           HD2      HIS  27 -13.072  23.410  23.410
  203    HE1  HIS  27           HE1      HIS  27 -15.133  26.996  26.996
  204    HA   PRO  28           HA       PRO  28 -17.828  18.791  18.791
  205   1HB   PRO  28           HB1      PRO  28 -19.791  19.133  19.133
  206   2HB   PRO  28           HB2      PRO  28 -18.143  19.619  19.619
  207   1HG   PRO  28           HG1      PRO  28 -20.382  21.391  21.391
  208   2HG   PRO  28           HG2      PRO  28 -19.427  21.665  21.665
  209   1HD   PRO  28           HD1      PRO  28 -18.710  22.798  22.798
  210   2HD   PRO  28           HD2      PRO  28 -17.470  22.302  22.302
  211    H    GLY  29           HN       GLY  29 -18.583  20.095  20.095
  212   1HA   GLY  29           HA1      GLY  29 -21.200  18.868  18.868
  213   2HA   GLY  29           HA2      GLY  29 -20.890  20.515  20.515
  214    H    LEU  30           HN       LEU  30 -18.408  18.050  18.050
  215    HA   LEU  30           HA       LEU  30 -18.239  18.084  18.084
  216   1HB   LEU  30           HB1      LEU  30 -16.227  17.530  17.530
  217   2HB   LEU  30           HB2      LEU  30 -15.819  17.216  17.216
  218    HG   LEU  30           HG       LEU  30 -16.462  19.835  19.835
  219   1HD1  LEU  30          HD11      LEU  30 -13.968  18.809  18.809
  220   2HD1  LEU  30          HD12      LEU  30 -14.156  20.442  20.442
  221   3HD1  LEU  30          HD13      LEU  30 -14.194  19.080  19.080
  222   1HD2  LEU  30          HD21      LEU  30 -15.946  19.370  19.370
  223   2HD2  LEU  30          HD22      LEU  30 -17.471  19.918  19.918
  224   3HD2  LEU  30          HD23      LEU  30 -16.061  20.951  20.951
  225    H    SER  31           HN       SER  31 -16.803  15.701  15.701
  226    HA   SER  31           HA       SER  31 -18.240  13.498  13.498
  227   1HB   SER  31           HB1      SER  31 -19.134  13.543  13.543
  228   2HB   SER  31           HB2      SER  31 -17.451  13.288  13.288
  229    HG   SER  31           HG       SER  31 -17.683  11.325  11.325
  230    H    ILE  32           HN       ILE  32 -16.868  11.425  11.425
  231    HA   ILE  32           HA       ILE  32 -14.114  12.119  12.119
  232    HB   ILE  32           HB       ILE  32 -15.581  10.345  10.345
  233   1HG1  ILE  32          HG11      ILE  32 -13.756   8.641   8.641
  234   2HG1  ILE  32          HG12      ILE  32 -12.869   9.381   9.381
  235   1HG2  ILE  32          HG21      ILE  32 -15.012   8.781   8.781
  236   2HG2  ILE  32          HG22      ILE  32 -15.740   8.105   8.105
  237   3HG2  ILE  32          HG23      ILE  32 -16.581   9.356   9.356
  238   1HD1  ILE  32          HD11      ILE  32 -13.593  10.749  10.749
  239   2HD1  ILE  32          HD12      ILE  32 -11.994  10.186  10.186
  240   3HD1  ILE  32          HD13      ILE  32 -12.728  11.528  11.528
  241    H    GLY  33           HN       GLY  33 -15.699  11.905  11.905
  242   1HA   GLY  33           HA1      GLY  33 -13.517  10.803  10.803
  243   2HA   GLY  33           HA2      GLY  33 -15.219  10.889  10.889
  244    H    ASP  34           HN       ASP  34 -14.885  13.619  13.619
  245    HA   ASP  34           HA       ASP  34 -14.131  15.223  15.223
  246   1HB   ASP  34           HB1      ASP  34 -16.027  15.557  15.557
  247   2HB   ASP  34           HB2      ASP  34 -15.607  16.981  16.981
  248    H    VAL  35           HN       VAL  35 -14.009  15.033  15.033
  249    HA   VAL  35           HA       VAL  35 -12.051  17.052  17.052
  250    HB   VAL  35           HB       VAL  35 -12.804  14.483  14.483
  251   1HG1  VAL  35          HG11      VAL  35 -10.509  15.241  15.241
  252   2HG1  VAL  35          HG12      VAL  35 -11.166  16.835  16.835
  253   3HG1  VAL  35          HG13      VAL  35 -11.675  15.454  15.454
  254   1HG2  VAL  35          HG21      VAL  35 -13.529  17.389  17.389
  255   2HG2  VAL  35          HG22      VAL  35 -14.616  16.172  16.172
  256   3HG2  VAL  35          HG23      VAL  35 -14.005  16.018  16.018
  257    H    ALA  36           HN       ALA  36 -12.016  13.832  13.832
  258    HA   ALA  36           HA       ALA  36  -9.156  13.404  13.404
  259   1HB   ALA  36           HB1      ALA  36 -11.403  11.780  11.780
  260   2HB   ALA  36           HB2      ALA  36  -9.759  11.181  11.181
  261   3HB   ALA  36           HB3      ALA  36 -10.728  11.599  11.599
  262    H    LYS  37           HN       LYS  37 -11.520  13.829  13.829
  263    HA   LYS  37           HA       LYS  37  -9.291  13.732  13.732
  264   1HB   LYS  37           HB1      LYS  37 -12.259  14.194  14.194
  265   2HB   LYS  37           HB2      LYS  37 -11.139  14.337  14.337
  266   1HG   LYS  37           HG1      LYS  37 -10.355  11.990  11.990
  267   2HG   LYS  37           HG2      LYS  37 -11.610  11.832  11.832
  268   1HD   LYS  37           HD1      LYS  37 -13.364  12.229  12.229
  269   2HD   LYS  37           HD2      LYS  37 -12.176  12.636  12.636
  270   1HE   LYS  37           HE1      LYS  37 -11.265  10.303  10.303
  271   2HE   LYS  37           HE2      LYS  37 -12.499   9.902   9.902
  272   1HZ   LYS  37           HZ1      LYS  37 -13.777  11.070  11.070
  273   2HZ   LYS  37           HZ2      LYS  37 -12.689   9.915   9.915
  274   3HZ   LYS  37           HZ3      LYS  37 -13.862   9.460   9.460
  275    H    LYS  38           HN       LYS  38 -10.520  16.171  16.171
  276    HA   LYS  38           HA       LYS  38 -10.040  18.322  18.322
  277   1HB   LYS  38           HB1      LYS  38 -12.006  18.524  18.524
  278   2HB   LYS  38           HB2      LYS  38 -10.893  18.388  18.388
  279   1HG   LYS  38           HG1      LYS  38  -9.813  20.470  20.470
  280   2HG   LYS  38           HG2      LYS  38 -10.683  20.594  20.594
  281   1HD   LYS  38           HD1      LYS  38 -12.837  20.768  20.768
  282   2HD   LYS  38           HD2      LYS  38 -11.993  20.602  20.602
  283   1HE   LYS  38           HE1      LYS  38 -11.482  22.836  22.836
  284   2HE   LYS  38           HE2      LYS  38 -12.486  23.001  23.001
  285   1HZ   LYS  38           HZ1      LYS  38 -10.033  21.913  21.913
  286   2HZ   LYS  38           HZ2      LYS  38  -9.717  23.255  23.255
  287   3HZ   LYS  38           HZ3      LYS  38 -10.694  23.425  23.425
  288    H    LEU  39           HN       LEU  39  -9.112  16.957  16.957
  289    HA   LEU  39           HA       LEU  39  -6.751  18.510  18.510
  290   1HB   LEU  39           HB1      LEU  39  -7.939  17.271  17.271
  291   2HB   LEU  39           HB2      LEU  39  -7.571  15.763  15.763
  292    HG   LEU  39           HG       LEU  39  -5.267  16.544  16.544
  293   1HD1  LEU  39          HD11      LEU  39  -6.166  18.302  18.302
  294   2HD1  LEU  39          HD12      LEU  39  -4.492  17.923  17.923
  295   3HD1  LEU  39          HD13      LEU  39  -5.411  18.856  18.856
  296   1HD2  LEU  39          HD21      LEU  39  -5.991  14.637  14.637
  297   2HD2  LEU  39          HD22      LEU  39  -4.747  15.530  15.530
  298   3HD2  LEU  39          HD23      LEU  39  -6.438  15.681  15.681
  299    H    GLY  40           HN       GLY  40  -7.389  15.306  15.306
  300   1HA   GLY  40           HA1      GLY  40  -4.883  14.385  14.385
  301   2HA   GLY  40           HA2      GLY  40  -6.303  14.073  14.073
  302    H    GLU  41           HN       GLU  41  -6.940  16.410  16.410
  303    HA   GLU  41           HA       GLU  41  -5.174  16.757  16.757
  304   1HB   GLU  41           HB1      GLU  41  -7.123  18.556  18.556
  305   2HB   GLU  41           HB2      GLU  41  -6.300  19.051  19.051
  306   1HG   GLU  41           HG1      GLU  41  -8.022  16.544  16.544
  307   2HG   GLU  41           HG2      GLU  41  -8.548  17.990  17.990
  308    H    MET  42           HN       MET  42  -5.533  18.917  18.917
  309    HA   MET  42           HA       MET  42  -3.449  20.675  20.675
  310   1HB   MET  42           HB1      MET  42  -4.280  19.746  19.746
  311   2HB   MET  42           HB2      MET  42  -3.434  21.241  21.241
  312   1HG   MET  42           HG1      MET  42  -5.506  21.650  21.650
  313   2HG   MET  42           HG2      MET  42  -6.271  20.433  20.433
  314   1HE   MET  42           HE1      MET  42  -6.086  20.558  20.558
  315   2HE   MET  42           HE2      MET  42  -7.202  21.796  21.796
  316   3HE   MET  42           HE3      MET  42  -7.675  20.732  20.732
  317    H    TRP  43           HN       TRP  43  -3.331  17.681  17.681
  318    HA   TRP  43           HA       TRP  43  -0.664  17.746  17.746
  319   1HB   TRP  43           HB1      TRP  43  -2.045  16.022  16.022
  320   2HB   TRP  43           HB2      TRP  43  -2.482  15.489  15.489
  321    HD1  TRP  43           HD1      TRP  43  -0.924  13.744  13.744
  322    HE1  TRP  43           HE1      TRP  43   1.237  12.752  12.752
  323    HE3  TRP  43           HE3      TRP  43  -0.013  16.512  16.512
  324    HZ2  TRP  43           HZ2      TRP  43   3.249  13.027  13.027
  325    HZ3  TRP  43           HZ3      TRP  43   1.973  16.170  16.170
  326    HH2  TRP  43           HH2      TRP  43   3.630  14.422  14.422
  327    H    ASN  44           HN       ASN  44  -2.000  16.645  16.645
  328    HA   ASN  44           HA       ASN  44   0.464  15.838  15.838
  329   1HB   ASN  44           HB1      ASN  44  -2.029  16.893  16.893
  330   2HB   ASN  44           HB2      ASN  44  -0.726  15.967  15.967
  331   1HD2  ASN  44          HD21      ASN  44  -3.640  13.921  13.921
  332   2HD2  ASN  44          HD22      ASN  44  -3.777  15.519  15.519
  333    H    ASN  45           HN       ASN  45  -0.932  18.901  18.901
  334    HA   ASN  45           HA       ASN  45   1.402  20.301  20.301
  335   1HB   ASN  45           HB1      ASN  45  -1.264  21.714  21.714
  336   2HB   ASN  45           HB2      ASN  45   0.029  21.839  21.839
  337   1HD2  ASN  45          HD21      ASN  45  -3.085  19.349  19.349
  338   2HD2  ASN  45          HD22      ASN  45  -2.958  20.465  20.465
  339    H    THR  46           HN       THR  46   1.392  19.588  19.588
  340    HA   THR  46           HA       THR  46   0.394  21.893  21.893
  341    HB   THR  46           HB       THR  46   0.513  19.643  19.643
  342    HG1  THR  46           HG1      THR  46   0.805  20.839  20.839
  343   1HG2  THR  46          HG21      THR  46   3.574  19.983  19.983
  344   2HG2  THR  46          HG22      THR  46   2.631  18.733  18.733
  345   3HG2  THR  46          HG23      THR  46   2.735  18.787  18.787
  346    H    ALA  47           HN       ALA  47   3.622  20.653  20.653
  347    HA   ALA  47           HA       ALA  47   4.679  23.296  23.296
  348   1HB   ALA  47           HB1      ALA  47   4.739  23.230  23.230
  349   2HB   ALA  47           HB2      ALA  47   5.691  21.758  21.758
  350   3HB   ALA  47           HB3      ALA  47   6.355  23.274  23.274
  351    H    ALA  48           HN       ALA  48   5.385  20.085  20.085
  352    HA   ALA  48           HA       ALA  48   6.371  18.279  18.279
  353   1HB   ALA  48           HB1      ALA  48   6.369  19.518  19.518
  354   2HB   ALA  48           HB2      ALA  48   7.831  20.371  20.371
  355   3HB   ALA  48           HB3      ALA  48   7.856  18.634  18.634
  356    H    ASP  49           HN       ASP  49   7.471  21.026  21.026
  357    HA   ASP  49           HA       ASP  49  10.047  19.936  19.936
  358   1HB   ASP  49           HB1      ASP  49   9.004  22.777  22.777
  359   2HB   ASP  49           HB2      ASP  49  10.536  22.420  22.420
  360    H    ASP  50           HN       ASP  50   6.923  20.162  20.162
  361    HA   ASP  50           HA       ASP  50   7.318  20.535  20.535
  362   1HB   ASP  50           HB1      ASP  50   5.823  22.267  22.267
  363   2HB   ASP  50           HB2      ASP  50   4.758  20.947  20.947
  364    H    LYS  51           HN       LYS  51   6.745  18.524  18.524
  365    HA   LYS  51           HA       LYS  51   5.066  16.546  16.546
  366   1HB   LYS  51           HB1      LYS  51   6.631  16.267  16.267
  367   2HB   LYS  51           HB2      LYS  51   5.345  15.223  15.223
  368   1HG   LYS  51           HG1      LYS  51   3.746  17.056  17.056
  369   2HG   LYS  51           HG2      LYS  51   5.013  18.158  18.158
  370   1HD   LYS  51           HD1      LYS  51   3.959  17.416  17.416
  371   2HD   LYS  51           HD2      LYS  51   5.436  16.469  16.469
  372   1HE   LYS  51           HE1      LYS  51   4.188  14.607  14.607
  373   2HE   LYS  51           HE2      LYS  51   2.712  15.571  15.571
  374   1HZ   LYS  51           HZ1      LYS  51   3.987  15.514  15.514
  375   2HZ   LYS  51           HZ2      LYS  51   3.902  13.921  13.921
  376   3HZ   LYS  51           HZ3      LYS  51   2.484  14.849  14.849
  377    H    GLN  52           HN       GLN  52   8.282  16.810  16.810
  378    HA   GLN  52           HA       GLN  52   9.706  14.706  14.706
  379   1HB   GLN  52           HB1      GLN  52  10.331  17.445  17.445
  380   2HB   GLN  52           HB2      GLN  52  11.056  17.004  17.004
  381   1HG   GLN  52           HG1      GLN  52  12.710  16.687  16.687
  382   2HG   GLN  52           HG2      GLN  52  12.251  15.108  15.108
  383   1HE2  GLN  52          HE21      GLN  52  10.116  15.398  15.398
  384   2HE2  GLN  52          HE22      GLN  52   9.633  16.099  16.099
  385    HA   PRO  53           HA       PRO  53  10.115  15.105  15.105
  386   1HB   PRO  53           HB1      PRO  53   7.886  16.396  16.396
  387   2HB   PRO  53           HB2      PRO  53   9.479  17.124  17.124
  388   1HG   PRO  53           HG1      PRO  53   7.108  17.183  17.183
  389   2HG   PRO  53           HG2      PRO  53   8.031  18.564  18.564
  390   1HD   PRO  53           HD1      PRO  53   8.722  17.629  17.629
  391   2HD   PRO  53           HD2      PRO  53  10.044  17.836  17.836
  392    H    TYR  54           HN       TYR  54   6.767  15.236  15.236
  393    HA   TYR  54           HA       TYR  54   5.850  12.986  12.986
  394   1HB   TYR  54           HB1      TYR  54   4.686  14.292  14.292
  395   2HB   TYR  54           HB2      TYR  54   3.841  13.096  13.096
  396    HD1  TYR  54           HD1      TYR  54   4.125  13.848  13.848
  397    HD2  TYR  54           HD2      TYR  54   3.934  16.440  16.440
  398    HE1  TYR  54           HE1      TYR  54   3.317  15.655  15.655
  399    HE2  TYR  54           HE2      TYR  54   3.126  18.247  18.247
  400    HH   TYR  54           HH       TYR  54   3.363  18.806  18.806
  401    H    GLU  55           HN       GLU  55   6.578  13.467  13.467
  402    HA   GLU  55           HA       GLU  55   6.157  10.909  10.909
  403   1HB   GLU  55           HB1      GLU  55   7.335  13.376  13.376
  404   2HB   GLU  55           HB2      GLU  55   8.488  12.135  12.135
  405   1HG   GLU  55           HG1      GLU  55   6.546  10.822  10.822
  406   2HG   GLU  55           HG2      GLU  55   5.513  12.194  12.194
  407    H    LYS  56           HN       LYS  56   9.300  12.090  12.090
  408    HA   LYS  56           HA       LYS  56  10.823   9.836   9.836
  409   1HB   LYS  56           HB1      LYS  56  10.764  11.901  11.901
  410   2HB   LYS  56           HB2      LYS  56  11.780  10.495  10.495
  411   1HG   LYS  56           HG1      LYS  56  12.866  10.958  10.958
  412   2HG   LYS  56           HG2      LYS  56  11.947  12.438  12.438
  413   1HD   LYS  56           HD1      LYS  56  13.819  11.837  11.837
  414   2HD   LYS  56           HD2      LYS  56  14.359  12.662  12.662
  415   1HE   LYS  56           HE1      LYS  56  12.089  13.672  13.672
  416   2HE   LYS  56           HE2      LYS  56  13.749  14.248  14.248
  417   1HZ   LYS  56           HZ1      LYS  56  12.974  14.301  14.301
  418   2HZ   LYS  56           HZ2      LYS  56  11.689  14.974  14.974
  419   3HZ   LYS  56           HZ3      LYS  56  13.255  15.621  15.621
  420    H    LYS  57           HN       LYS  57   8.438  10.359  10.359
  421    HA   LYS  57           HA       LYS  57   8.948   7.885   7.885
  422   1HB   LYS  57           HB1      LYS  57   6.330   9.476   9.476
  423   2HB   LYS  57           HB2      LYS  57   6.666   8.221   8.221
  424   1HG   LYS  57           HG1      LYS  57   8.142  10.875  10.875
  425   2HG   LYS  57           HG2      LYS  57   6.952  10.453  10.453
  426   1HD   LYS  57           HD1      LYS  57   8.524   8.448   8.448
  427   2HD   LYS  57           HD2      LYS  57   9.743   9.299   9.299
  428   1HE   LYS  57           HE1      LYS  57   8.287  10.368  10.368
  429   2HE   LYS  57           HE2      LYS  57   9.975   9.903   9.903
  430   1HZ   LYS  57           HZ1      LYS  57   9.537  11.777  11.777
  431   2HZ   LYS  57           HZ2      LYS  57   8.806  12.373  12.373
  432   3HZ   LYS  57           HZ3      LYS  57  10.448  11.948  11.948
  433    H    ALA  58           HN       ALA  58   6.342   8.827   8.827
  434    HA   ALA  58           HA       ALA  58   5.050   6.443   6.443
  435   1HB   ALA  58           HB1      ALA  58   4.427   8.564   8.564
  436   2HB   ALA  58           HB2      ALA  58   5.801   8.460   8.460
  437   3HB   ALA  58           HB3      ALA  58   4.504   7.283   7.283
  438    H    ALA  59           HN       ALA  59   7.858   7.534   7.534
  439    HA   ALA  59           HA       ALA  59   8.299   5.335   5.335
  440   1HB   ALA  59           HB1      ALA  59   9.543   7.490   7.490
  441   2HB   ALA  59           HB2      ALA  59  10.388   7.140   7.140
  442   3HB   ALA  59           HB3      ALA  59  10.674   6.151   6.151
  443    H    LYS  60           HN       LYS  60   9.887   5.997   5.997
  444    HA   LYS  60           HA       LYS  60  11.301   3.682   3.682
  445   1HB   LYS  60           HB1      LYS  60  10.900   5.927   5.927
  446   2HB   LYS  60           HB2      LYS  60   9.805   4.896   4.896
  447   1HG   LYS  60           HG1      LYS  60  11.673   3.237   3.237
  448   2HG   LYS  60           HG2      LYS  60  12.739   4.297   4.297
  449   1HD   LYS  60           HD1      LYS  60  12.231   6.125   6.125
  450   2HD   LYS  60           HD2      LYS  60  11.420   4.898   4.898
  451   1HE   LYS  60           HE1      LYS  60  13.534   3.565   3.565
  452   2HE   LYS  60           HE2      LYS  60  14.342   4.805   4.805
  453   1HZ   LYS  60           HZ1      LYS  60  13.059   5.972   5.972
  454   2HZ   LYS  60           HZ2      LYS  60  14.054   4.692   4.692
  455   3HZ   LYS  60           HZ3      LYS  60  14.708   5.960   5.960
  456    H    LEU  61           HN       LEU  61   7.906   4.258   4.258
  457    HA   LEU  61           HA       LEU  61   7.442   1.627   1.627
  458   1HB   LEU  61           HB1      LEU  61   5.447   3.534   3.534
  459   2HB   LEU  61           HB2      LEU  61   5.044   2.225   2.225
  460    HG   LEU  61           HG       LEU  61   6.801   4.631   4.631
  461   1HD1  LEU  61          HD11      LEU  61   3.989   3.929   3.929
  462   2HD1  LEU  61          HD12      LEU  61   4.937   5.300   5.300
  463   3HD1  LEU  61          HD13      LEU  61   4.463   5.208   5.208
  464   1HD2  LEU  61          HD21      LEU  61   5.880   2.354   2.354
  465   2HD2  LEU  61          HD22      LEU  61   7.532   2.637   2.637
  466   3HD2  LEU  61          HD23      LEU  61   6.750   3.795   3.795
  467    H    LYS  62           HN       LYS  62   6.599   2.942   2.942
  468    HA   LYS  62           HA       LYS  62   5.564   0.732   0.732
  469   1HB   LYS  62           HB1      LYS  62   6.268   3.210   3.210
  470   2HB   LYS  62           HB2      LYS  62   7.743   2.417   2.417
  471   1HG   LYS  62           HG1      LYS  62   6.339   2.497   2.497
  472   2HG   LYS  62           HG2      LYS  62   6.377   0.826   0.826
  473   1HD   LYS  62           HD1      LYS  62   4.174   0.925   0.925
  474   2HD   LYS  62           HD2      LYS  62   4.169   2.680   2.680
  475   1HE   LYS  62           HE1      LYS  62   2.779   1.848   1.848
  476   2HE   LYS  62           HE2      LYS  62   4.143   2.790   2.790
  477   1HZ   LYS  62           HZ1      LYS  62   4.968   0.138   0.138
  478   2HZ   LYS  62           HZ2      LYS  62   3.479   0.147   0.147
  479   3HZ   LYS  62           HZ3      LYS  62   4.778   1.067   1.067
  480    H    GLU  63           HN       GLU  63   8.913   1.580   1.580
  481    HA   GLU  63           HA       GLU  63  10.137  -0.696  -0.696
  482   1HB   GLU  63           HB1      GLU  63  11.254   1.520   1.520
  483   2HB   GLU  63           HB2      GLU  63  11.071   1.330   1.330
  484   1HG   GLU  63           HG1      GLU  63  12.665  -0.590  -0.590
  485   2HG   GLU  63           HG2      GLU  63  12.828  -0.412  -0.412
  486    H    LYS  64           HN       LYS  64   9.468   0.098   0.098
  487    HA   LYS  64           HA       LYS  64  10.471  -2.130  -2.130
  488   1HB   LYS  64           HB1      LYS  64   7.936  -0.515  -0.515
  489   2HB   LYS  64           HB2      LYS  64   8.469  -1.770  -1.770
  490   1HG   LYS  64           HG1      LYS  64  10.505   0.282   0.282
  491   2HG   LYS  64           HG2      LYS  64   9.212   0.804   0.804
  492   1HD   LYS  64           HD1      LYS  64   9.807  -1.091  -1.091
  493   2HD   LYS  64           HD2      LYS  64  11.094  -1.564  -1.564
  494   1HE   LYS  64           HE1      LYS  64  11.955  -0.136  -0.136
  495   2HE   LYS  64           HE2      LYS  64  12.186   0.641   0.641
  496   1HZ   LYS  64           HZ1      LYS  64   9.662   1.349   1.349
  497   2HZ   LYS  64           HZ2      LYS  64  10.779   1.588   1.588
  498   3HZ   LYS  64           HZ3      LYS  64  11.014   2.343   2.343
  499    H    TYR  65           HN       TYR  65   7.222  -1.744  -1.744
  500    HA   TYR  65           HA       TYR  65   6.092  -4.220  -4.220
  501   1HB   TYR  65           HB1      TYR  65   4.681  -2.559  -2.559
  502   2HB   TYR  65           HB2      TYR  65   5.825  -2.168  -2.168
  503    HD1  TYR  65           HD1      TYR  65   4.760  -5.670  -5.670
  504    HD2  TYR  65           HD2      TYR  65   4.106  -2.140  -2.140
  505    HE1  TYR  65           HE1      TYR  65   3.422  -6.950  -6.950
  506    HE2  TYR  65           HE2      TYR  65   2.760  -3.422  -3.422
  507    HH   TYR  65           HH       TYR  65   1.355  -5.607  -5.607
  508    H    GLU  66           HN       GLU  66   7.636  -3.414  -3.414
  509    HA   GLU  66           HA       GLU  66   7.638  -5.929  -5.929
  510   1HB   GLU  66           HB1      GLU  66   9.746  -3.798  -3.798
  511   2HB   GLU  66           HB2      GLU  66   9.517  -5.100  -5.100
  512   1HG   GLU  66           HG1      GLU  66   7.054  -3.463  -3.463
  513   2HG   GLU  66           HG2      GLU  66   8.321  -2.597  -2.597
  514    H    LYS  67           HN       LYS  67   9.789  -4.822  -4.822
  515    HA   LYS  67           HA       LYS  67  11.594  -7.141  -7.141
  516   1HB   LYS  67           HB1      LYS  67  11.781  -4.545  -4.545
  517   2HB   LYS  67           HB2      LYS  67  12.808  -5.880  -5.880
  518   1HG   LYS  67           HG1      LYS  67  14.043  -4.586  -4.586
  519   2HG   LYS  67           HG2      LYS  67  13.580  -6.074  -6.074
  520   1HD   LYS  67           HD1      LYS  67  11.634  -4.733  -4.733
  521   2HD   LYS  67           HD2      LYS  67  12.371  -3.295  -3.295
  522   1HE   LYS  67           HE1      LYS  67  13.045  -3.595  -3.595
  523   2HE   LYS  67           HE2      LYS  67  14.455  -3.804  -3.804
  524   1HZ   LYS  67           HZ1      LYS  67  13.155  -6.275  -6.275
  525   2HZ   LYS  67           HZ2      LYS  67  13.366  -5.594  -5.594
  526   3HZ   LYS  67           HZ3      LYS  67  14.706  -5.825  -5.825
  527    H    ASP  68           HN       ASP  68   9.156  -6.032  -6.032
  528    HA   ASP  68           HA       ASP  68   9.622  -7.823  -7.823
  529   1HB   ASP  68           HB1      ASP  68   7.381  -5.909  -5.909
  530   2HB   ASP  68           HB2      ASP  68   7.289  -6.991  -6.991
  531    H    ILE  69           HN       ILE  69   8.002  -7.653  -7.653
  532    HA   ILE  69           HA       ILE  69   6.238  -9.910  -9.910
  533    HB   ILE  69           HB       ILE  69   5.388  -8.199  -8.199
  534   1HG1  ILE  69          HG11      ILE  69   4.728  -9.620  -9.620
  535   2HG1  ILE  69          HG12      ILE  69   6.141 -10.651 -10.651
  536   1HG2  ILE  69          HG21      ILE  69   7.599  -7.541  -7.541
  537   2HG2  ILE  69          HG22      ILE  69   7.679  -9.020  -9.020
  538   3HG2  ILE  69          HG23      ILE  69   6.424  -7.844  -7.844
  539   1HD1  ILE  69          HD11      ILE  69   3.963 -10.355 -10.355
  540   2HD1  ILE  69          HD12      ILE  69   4.150 -11.713 -11.713
  541   3HD1  ILE  69          HD13      ILE  69   5.356 -11.421 -11.421
  542    H    ALA  70           HN       ALA  70   9.022  -9.052  -9.052
  543    HA   ALA  70           HA       ALA  70   9.750 -11.540 -11.540
  544   1HB   ALA  70           HB1      ALA  70  11.622  -9.337  -9.337
  545   2HB   ALA  70           HB2      ALA  70  12.072 -10.620 -10.620
  546   3HB   ALA  70           HB3      ALA  70  10.917  -9.401  -9.401
  547    H    ALA  71           HN       ALA  71   9.991 -10.334 -10.334
  548    HA   ALA  71           HA       ALA  71  11.680 -12.535 -12.535
  549   1HB   ALA  71           HB1      ALA  71  10.393 -10.207 -10.207
  550   2HB   ALA  71           HB2      ALA  71  11.533 -11.348 -11.348
  551   3HB   ALA  71           HB3      ALA  71  12.055 -10.260 -10.260
  552    H    TYR  72           HN       TYR  72   8.429 -11.283 -11.283
  553    HA   TYR  72           HA       TYR  72   7.258 -13.024 -13.024
  554   1HB   TYR  72           HB1      TYR  72   6.120 -11.092 -11.092
  555   2HB   TYR  72           HB2      TYR  72   6.148 -11.737 -11.737
  556    HD1  TYR  72           HD1      TYR  72   4.597 -12.026 -12.026
  557    HD2  TYR  72           HD2      TYR  72   4.599 -13.445 -13.445
  558    HE1  TYR  72           HE1      TYR  72   2.434 -13.108 -13.108
  559    HE2  TYR  72           HE2      TYR  72   2.436 -14.517 -14.517
  560    HH   TYR  72           HH       TYR  72   0.385 -13.906 -13.906
  561    H    ARG  73           HN       ARG  73   7.840 -13.392 -13.392
  562    HA   ARG  73           HA       ARG  73   6.646 -16.038 -16.038
  563   1HB   ARG  73           HB1      ARG  73   7.199 -15.880 -15.880
  564   2HB   ARG  73           HB2      ARG  73   6.606 -14.303 -14.303
  565   1HG   ARG  73           HG1      ARG  73   8.900 -13.458 -13.458
  566   2HG   ARG  73           HG2      ARG  73   9.565 -15.014 -15.014
  567   1HD   ARG  73           HD1      ARG  73   7.881 -13.354 -13.354
  568   2HD   ARG  73           HD2      ARG  73   9.641 -13.455 -13.455
  569    HE   ARG  73           HE       ARG  73   9.236 -15.999 -15.999
  570   1HH1  ARG  73          HH11      ARG  73   6.281 -15.830 -15.830
  571   2HH1  ARG  73          HH12      ARG  73   5.989 -15.712 -15.712
  572   1HH2  ARG  73          HH21      ARG  73   9.310 -14.835 -14.835
  573   2HH2  ARG  73          HH22      ARG  73   7.755 -15.130 -15.130
  574    H    ALA  74           HN       ALA  74   9.718 -14.527 -14.527
  575    HA   ALA  74           HA       ALA  74  11.495 -16.604 -16.604
  576   1HB   ALA  74           HB1      ALA  74  12.290 -14.366 -14.366
  577   2HB   ALA  74           HB2      ALA  74  11.785 -14.726 -14.726
  578   3HB   ALA  74           HB3      ALA  74  13.071 -15.645 -15.645
  579    H    LYS  75           HN       LYS  75   9.818 -16.019 -16.019
  580    HA   LYS  75           HA       LYS  75   9.578 -18.829 -18.829
  581   1HB   LYS  75           HB1      LYS  75  11.056 -19.024 -19.024
  582   2HB   LYS  75           HB2      LYS  75  12.028 -18.309 -18.309
  583   1HG   LYS  75           HG1      LYS  75  11.369 -15.994 -15.994
  584   2HG   LYS  75           HG2      LYS  75  10.719 -16.924 -16.924
  585   1HD   LYS  75           HD1      LYS  75  12.913 -16.269 -16.269
  586   2HD   LYS  75           HD2      LYS  75  12.971 -17.989 -17.989
  587   1HE   LYS  75           HE1      LYS  75  13.969 -17.537 -17.537
  588   2HE   LYS  75           HE2      LYS  75  13.863 -15.808 -15.808
  589   1HZ   LYS  75           HZ1      LYS  75  15.146 -17.003 -17.003
  590   2HZ   LYS  75           HZ2      LYS  75  15.873 -17.584 -17.584
  591   3HZ   LYS  75           HZ3      LYS  75  15.780 -15.911 -15.911
  592    H    GLY  76           HN       GLY  76   9.017 -15.529 -15.529
  593   1HA   GLY  76           HA1      GLY  76   7.667 -15.831 -15.831
  594   2HA   GLY  76           HA2      GLY  76   7.610 -14.421 -14.421
  595    H    LYS  77           HN       LYS  77   6.422 -17.670 -17.670
  596    HA   LYS  77           HA       LYS  77   3.690 -16.877 -16.877
  597   1HB   LYS  77           HB1      LYS  77   5.445 -19.196 -19.196
  598   2HB   LYS  77           HB2      LYS  77   3.720 -19.321 -19.321
  599   1HG   LYS  77           HG1      LYS  77   4.283 -16.802 -16.802
  600   2HG   LYS  77           HG2      LYS  77   5.724 -17.717 -17.717
  601   1HD   LYS  77           HD1      LYS  77   4.361 -19.479 -19.479
  602   2HD   LYS  77           HD2      LYS  77   2.885 -18.669 -18.669
  603   1HE   LYS  77           HE1      LYS  77   3.736 -16.621 -16.621
  604   2HE   LYS  77           HE2      LYS  77   4.932 -17.721 -17.721
  605   1HZ   LYS  77           HZ1      LYS  77   2.467 -18.992 -18.992
  606   2HZ   LYS  77           HZ2      LYS  77   2.250 -17.409 -17.409
  607   3HZ   LYS  77           HZ3      LYS  77   3.425 -18.409 -18.409
  608    HA   PRO  78           HA       PRO  78   2.807 -19.460 -19.460
  609   1HB   PRO  78           HB1      PRO  78   0.593 -20.903 -20.903
  610   2HB   PRO  78           HB2      PRO  78   0.523 -19.138 -19.138
  611   1HG   PRO  78           HG1      PRO  78   0.944 -20.862 -20.862
  612   2HG   PRO  78           HG2      PRO  78  -0.308 -19.649 -19.649
  613   1HD   PRO  78           HD1      PRO  78   1.971 -18.961 -18.961
  614   2HD   PRO  78           HD2      PRO  78   1.253 -17.824 -17.824
  615    H    ASP  79           HN       ASP  79   4.936 -20.329 -20.329
  616    HA   ASP  79           HA       ASP  79   5.230 -23.050 -23.050
  617   1HB   ASP  79           HB1      ASP  79   5.555 -23.896 -23.896
  618   2HB   ASP  79           HB2      ASP  79   3.901 -23.620 -23.620
  619    H    ALA  80           HN       ALA  80   6.570 -20.893 -20.893
  620    HA   ALA  80           HA       ALA  80   8.932 -20.399 -20.399
  621   1HB   ALA  80           HB1      ALA  80   8.218 -19.552 -19.552
  622   2HB   ALA  80           HB2      ALA  80   9.573 -18.922 -18.922
  623   3HB   ALA  80           HB3      ALA  80   7.930 -18.610 -18.610
  624    H    ALA  81           HN       ALA  81   9.456 -22.624 -22.624
  625    HA   ALA  81           HA       ALA  81  10.968 -24.335 -24.335
  626   1HB   ALA  81           HB1      ALA  81  12.556 -22.585 -22.585
  627   2HB   ALA  81           HB2      ALA  81  11.937 -22.707 -22.707
  628   3HB   ALA  81           HB3      ALA  81  12.772 -24.062 -24.062
  629   1H1   BME  16           HE1      MER  16  -9.135   9.175   9.175
  630   2H1   BME  16           HE2      MER  16  -8.038   8.039   8.039
  631   1H2   BME  16           HZ1      MER  16  -7.649  10.348  10.348
  632   2H2   BME  16           HZ2      MER  16  -6.229   9.729   9.729
  633    HO1  BME  16           HH       MER  16  -8.197   8.685   8.685

  Start of MODEL   20
    1    H    ASN   3           HN       ASN   3  -1.299 -11.570 -11.570
    2    HA   ASN   3           HA       ASN   3   0.888 -11.493 -11.493
    3   1HB   ASN   3           HB1      ASN   3   0.179 -13.825 -13.825
    4   2HB   ASN   3           HB2      ASN   3   1.771 -13.264 -13.264
    5   1HD2  ASN   3          HD21      ASN   3  -0.034 -15.915 -15.915
    6   2HD2  ASN   3          HD22      ASN   3  -0.650 -15.483 -15.483
    7    H    ALA   4           HN       ALA   4   1.955 -11.560 -11.560
    8    HA   ALA   4           HA       ALA   4   2.162 -10.477 -10.477
    9   1HB   ALA   4           HB1      ALA   4   0.054 -11.555 -11.555
   10   2HB   ALA   4           HB2      ALA   4  -0.890 -10.253 -10.253
   11   3HB   ALA   4           HB3      ALA   4   0.178  -9.922  -9.922
   12    HA   PRO   5           HA       PRO   5   2.053  -6.437  -6.437
   13   1HB   PRO   5           HB1      PRO   5   4.421  -5.528  -5.528
   14   2HB   PRO   5           HB2      PRO   5   4.350  -6.707  -6.707
   15   1HG   PRO   5           HG1      PRO   5   4.742  -7.267  -7.267
   16   2HG   PRO   5           HG2      PRO   5   5.699  -7.870  -7.870
   17   1HD   PRO   5           HD1      PRO   5   3.705  -9.297  -9.297
   18   2HD   PRO   5           HD2      PRO   5   4.002  -9.483  -9.483
   19    H    LYS   6           HN       LYS   6   0.385  -5.493  -5.493
   20    HA   LYS   6           HA       LYS   6  -0.185  -5.191  -5.191
   21   1HB   LYS   6           HB1      LYS   6  -1.042  -3.659  -3.659
   22   2HB   LYS   6           HB2      LYS   6  -1.580  -3.073  -3.073
   23   1HG   LYS   6           HG1      LYS   6  -3.307  -4.461  -4.461
   24   2HG   LYS   6           HG2      LYS   6  -2.658  -5.256  -5.256
   25   1HD   LYS   6           HD1      LYS   6  -1.356  -6.771  -6.771
   26   2HD   LYS   6           HD2      LYS   6  -1.704  -5.915  -5.915
   27   1HE   LYS   6           HE1      LYS   6  -3.728  -7.402  -7.402
   28   2HE   LYS   6           HE2      LYS   6  -3.096  -7.959  -7.959
   29   1HZ   LYS   6           HZ1      LYS   6  -4.097  -5.389  -5.389
   30   2HZ   LYS   6           HZ2      LYS   6  -5.266  -6.268  -6.268
   31   3HZ   LYS   6           HZ3      LYS   6  -4.684  -6.854  -6.854
   32    H    ARG   7           HN       ARG   7  -0.689  -2.837  -2.837
   33    HA   ARG   7           HA       ARG   7   1.983  -1.782  -1.782
   34   1HB   ARG   7           HB1      ARG   7  -0.713  -1.135  -1.135
   35   2HB   ARG   7           HB2      ARG   7   0.775  -0.355  -0.355
   36   1HG   ARG   7           HG1      ARG   7   1.729  -2.463  -2.463
   37   2HG   ARG   7           HG2      ARG   7   0.416  -3.386  -3.386
   38   1HD   ARG   7           HD1      ARG   7  -0.018  -1.319  -1.319
   39   2HD   ARG   7           HD2      ARG   7   0.217  -3.036  -3.036
   40    HE   ARG   7           HE       ARG   7  -1.842  -3.459  -3.459
   41   1HH1  ARG   7          HH11      ARG   7  -3.056  -1.686  -1.686
   42   2HH1  ARG   7          HH12      ARG   7  -3.907  -0.576  -0.576
   43   1HH2  ARG   7          HH21      ARG   7  -2.079  -1.470  -1.470
   44   2HH2  ARG   7          HH22      ARG   7  -3.341  -0.452  -0.452
   45    HA   PRO   8           HA       PRO   8   1.333   1.333   1.333
   46   1HB   PRO   8           HB1      PRO   8   3.481   2.968   2.968
   47   2HB   PRO   8           HB2      PRO   8   3.681   1.362   1.362
   48   1HG   PRO   8           HG1      PRO   8   3.768   2.146   2.146
   49   2HG   PRO   8           HG2      PRO   8   4.985   1.290   1.290
   50   1HD   PRO   8           HD1      PRO   8   3.228  -0.106  -0.106
   51   2HD   PRO   8           HD2      PRO   8   3.624  -0.705  -0.705
   52    HA   PRO   9           HA       PRO   9  -0.839   4.991   4.991
   53   1HB   PRO   9           HB1      PRO   9   0.949   7.114   7.114
   54   2HB   PRO   9           HB2      PRO   9  -0.264   6.410   6.410
   55   1HG   PRO   9           HG1      PRO   9   2.676   5.616   5.616
   56   2HG   PRO   9           HG2      PRO   9   1.756   5.965   5.965
   57   1HD   PRO   9           HD1      PRO   9   2.028   3.412   3.412
   58   2HD   PRO   9           HD2      PRO   9   0.373   3.962   3.962
   59    H    SER  10           HN       SER  10  -0.801   6.880   6.880
   60    HA   SER  10           HA       SER  10   0.335   6.227   6.227
   61   1HB   SER  10           HB1      SER  10  -1.534   8.473   8.473
   62   2HB   SER  10           HB2      SER  10  -1.144   8.085   8.085
   63    HG   SER  10           HG       SER  10  -2.862   6.879   6.879
   64    H    ALA  11           HN       ALA  11   0.639   8.852   8.852
   65    HA   ALA  11           HA       ALA  11   2.974   9.856   9.856
   66   1HB   ALA  11           HB1      ALA  11   2.213  10.764  10.764
   67   2HB   ALA  11           HB2      ALA  11   3.603  11.298  11.298
   68   3HB   ALA  11           HB3      ALA  11   3.541   9.657   9.657
   69    H    PHE  12           HN       PHE  12   0.272  10.643  10.643
   70    HA   PHE  12           HA       PHE  12  -0.389  13.254  13.254
   71   1HB   PHE  12           HB1      PHE  12  -1.247  12.607  12.607
   72   2HB   PHE  12           HB2      PHE  12  -1.667  10.978  10.978
   73    HD1  PHE  12           HD1      PHE  12  -3.344  13.253  13.253
   74    HD2  PHE  12           HD2      PHE  12  -3.406  11.694  11.694
   75    HE1  PHE  12           HE1      PHE  12  -5.744  13.713  13.713
   76    HE2  PHE  12           HE2      PHE  12  -5.799  12.168  12.168
   77    HZ   PHE  12           HZ       PHE  12  -6.977  13.177  13.177
   78    H    PHE  13           HN       PHE  13  -1.226   9.923   9.923
   79    HA   PHE  13           HA       PHE  13  -3.207  10.318  10.318
   80   1HB   PHE  13           HB1      PHE  13  -1.547   8.178   8.178
   81   2HB   PHE  13           HB2      PHE  13  -1.316   8.334   8.334
   82    HD1  PHE  13           HD1      PHE  13  -3.970   8.224   8.224
   83    HD2  PHE  13           HD2      PHE  13  -3.045   7.567   7.567
   84    HE1  PHE  13           HE1      PHE  13  -6.217   7.301   7.301
   85    HE2  PHE  13           HE2      PHE  13  -5.296   6.648   6.648
   86    HZ   PHE  13           HZ       PHE  13  -6.884   6.515   6.515
   87    H    LEU  14           HN       LEU  14   0.287  10.483  10.483
   88    HA   LEU  14           HA       LEU  14   0.026  10.901  10.901
   89   1HB   LEU  14           HB1      LEU  14   1.995  12.342  12.342
   90   2HB   LEU  14           HB2      LEU  14   2.150  12.188  12.188
   91    HG   LEU  14           HG       LEU  14   3.684  10.742  10.742
   92   1HD1  LEU  14          HD11      LEU  14   2.399   9.518   9.518
   93   2HD1  LEU  14          HD12      LEU  14   1.293   8.914   8.914
   94   3HD1  LEU  14          HD13      LEU  14   2.975   8.408   8.408
   95   1HD2  LEU  14          HD21      LEU  14   3.242  10.732  10.732
   96   2HD2  LEU  14          HD22      LEU  14   3.470   9.086   9.086
   97   3HD2  LEU  14          HD23      LEU  14   1.853   9.669   9.669
   98    H    PHE  15           HN       PHE  15   0.300  13.320  13.320
   99    HA   PHE  15           HA       PHE  15  -0.302  15.627  15.627
  100   1HB   PHE  15           HB1      PHE  15   0.692  16.166  16.166
  101   2HB   PHE  15           HB2      PHE  15   0.076  14.692  14.692
  102    HD1  PHE  15           HD1      PHE  15  -0.867  18.245  18.245
  103    HD2  PHE  15           HD2      PHE  15  -1.581  14.731  14.731
  104    HE1  PHE  15           HE1      PHE  15  -2.393  19.496  19.496
  105    HE2  PHE  15           HE2      PHE  15  -3.090  15.974  15.974
  106    HZ   PHE  15           HZ       PHE  15  -3.501  18.355  18.355
  107    H    CYS  16           HN       MER  16  -2.491  13.716  13.716
  108    HA   CYS  16           HA       MER  16  -4.904  15.042  15.042
  109   1HB   CYS  16           HB1      MER  16  -5.946  13.159  13.159
  110   2HB   CYS  16           HB2      MER  16  -4.310  12.869  12.869
  111    H    SER  17           HN       SER  17  -3.545  12.481  12.481
  112    HA   SER  17           HA       SER  17  -5.623  12.249  12.249
  113   1HB   SER  17           HB1      SER  17  -3.616  10.747  10.747
  114   2HB   SER  17           HB2      SER  17  -2.618  12.051  12.051
  115    HG   SER  17           HG       SER  17  -3.402  11.597  11.597
  116    H    GLU  18           HN       GLU  18  -2.792  14.275  14.275
  117    HA   GLU  18           HA       GLU  18  -3.461  15.731  15.731
  118   1HB   GLU  18           HB1      GLU  18  -1.196  15.422  15.422
  119   2HB   GLU  18           HB2      GLU  18  -1.587  16.298  16.298
  120   1HG   GLU  18           HG1      GLU  18  -2.191  17.857  17.857
  121   2HG   GLU  18           HG2      GLU  18  -0.506  17.396  17.396
  122    H    TYR  19           HN       TYR  19  -4.813  15.907  15.907
  123    HA   TYR  19           HA       TYR  19  -5.598  18.765  18.765
  124   1HB   TYR  19           HB1      TYR  19  -5.357  16.791  16.791
  125   2HB   TYR  19           HB2      TYR  19  -6.672  17.985  17.985
  126    HD1  TYR  19           HD1      TYR  19  -3.157  17.983  17.983
  127    HD2  TYR  19           HD2      TYR  19  -6.059  19.863  19.863
  128    HE1  TYR  19           HE1      TYR  19  -1.494  19.648  19.648
  129    HE2  TYR  19           HE2      TYR  19  -4.407  21.532  21.532
  130    HH   TYR  19           HH       TYR  19  -2.168  21.986  21.986
  131    H    ARG  20           HN       ARG  20  -6.829  15.581  15.581
  132    HA   ARG  20           HA       ARG  20  -9.455  15.562  15.562
  133   1HB   ARG  20           HB1      ARG  20  -8.418  13.670  13.670
  134   2HB   ARG  20           HB2      ARG  20  -8.091  14.483  14.483
  135   1HG   ARG  20           HG1      ARG  20 -10.599  14.702  14.702
  136   2HG   ARG  20           HG2      ARG  20 -10.859  13.883  13.883
  137   1HD   ARG  20           HD1      ARG  20  -9.458  12.687  12.687
  138   2HD   ARG  20           HD2      ARG  20 -11.102  12.318  12.318
  139    HE   ARG  20           HE       ARG  20  -9.943  11.536  11.536
  140   1HH1  ARG  20          HH11      ARG  20  -7.285  12.108  12.108
  141   2HH1  ARG  20          HH12      ARG  20  -6.820  10.482  10.482
  142   1HH2  ARG  20          HH21      ARG  20  -9.973   9.185   9.185
  143   2HH2  ARG  20          HH22      ARG  20  -8.389   8.771   8.771
  144    HA   PRO  21           HA       PRO  21 -11.170  17.709  17.709
  145   1HB   PRO  21           HB1      PRO  21  -9.746  18.682  18.682
  146   2HB   PRO  21           HB2      PRO  21  -9.943  16.934  16.934
  147   1HG   PRO  21           HG1      PRO  21  -7.606  18.650  18.650
  148   2HG   PRO  21           HG2      PRO  21  -7.543  17.218  17.218
  149   1HD   PRO  21           HD1      PRO  21  -7.213  16.979  16.979
  150   2HD   PRO  21           HD2      PRO  21  -8.116  15.774  15.774
  151    H    LYS  22           HN       LYS  22  -8.545  19.326  19.326
  152    HA   LYS  22           HA       LYS  22  -9.400  22.030  22.030
  153   1HB   LYS  22           HB1      LYS  22  -7.243  20.894  20.894
  154   2HB   LYS  22           HB2      LYS  22  -7.711  22.566  22.566
  155   1HG   LYS  22           HG1      LYS  22  -5.918  22.645  22.645
  156   2HG   LYS  22           HG2      LYS  22  -7.341  22.884  22.884
  157   1HD   LYS  22           HD1      LYS  22  -7.145  20.191  20.191
  158   2HD   LYS  22           HD2      LYS  22  -5.472  20.539  20.539
  159   1HE   LYS  22           HE1      LYS  22  -5.785  20.556  20.556
  160   2HE   LYS  22           HE2      LYS  22  -5.426  22.186  22.186
  161   1HZ   LYS  22           HZ1      LYS  22  -8.192  21.802  21.802
  162   2HZ   LYS  22           HZ2      LYS  22  -7.671  21.295  21.295
  163   3HZ   LYS  22           HZ3      LYS  22  -7.317  22.867  22.867
  164    H    ILE  23           HN       ILE  23  -9.845  19.930  19.930
  165    HA   ILE  23           HA       ILE  23 -11.195  22.191  22.191
  166    HB   ILE  23           HB       ILE  23 -11.444  20.265  20.265
  167   1HG1  ILE  23          HG11      ILE  23  -8.944  19.302  19.302
  168   2HG1  ILE  23          HG12      ILE  23 -10.477  18.468  18.468
  169   1HG2  ILE  23          HG21      ILE  23 -10.143  22.347  22.347
  170   2HG2  ILE  23          HG22      ILE  23  -8.818  21.639  21.639
  171   3HG2  ILE  23          HG23      ILE  23  -9.229  21.015  21.015
  172   1HD1  ILE  23          HD11      ILE  23 -10.547  18.231  18.231
  173   2HD1  ILE  23          HD12      ILE  23  -8.953  18.955  18.955
  174   3HD1  ILE  23          HD13      ILE  23  -9.171  17.419  17.419
  175    H    LYS  24           HN       LYS  24 -11.715  19.268  19.268
  176    HA   LYS  24           HA       LYS  24 -14.478  18.843  18.843
  177   1HB   LYS  24           HB1      LYS  24 -12.820  17.191  17.191
  178   2HB   LYS  24           HB2      LYS  24 -12.764  18.010  18.010
  179   1HG   LYS  24           HG1      LYS  24 -15.409  17.565  17.565
  180   2HG   LYS  24           HG2      LYS  24 -15.069  16.408  16.408
  181   1HD   LYS  24           HD1      LYS  24 -15.030  15.183  15.183
  182   2HD   LYS  24           HD2      LYS  24 -13.365  15.312  15.312
  183   1HE   LYS  24           HE1      LYS  24 -13.451  15.856  15.856
  184   2HE   LYS  24           HE2      LYS  24 -13.123  17.347  17.347
  185   1HZ   LYS  24           HZ1      LYS  24 -15.887  17.037  17.037
  186   2HZ   LYS  24           HZ2      LYS  24 -15.246  16.787  16.787
  187   3HZ   LYS  24           HZ3      LYS  24 -14.909  18.227  18.227
  188    H    GLY  25           HN       GLY  25 -12.629  20.668  20.668
  189   1HA   GLY  25           HA1      GLY  25 -14.742  21.325  21.325
  190   2HA   GLY  25           HA2      GLY  25 -13.160  22.103  22.103
  191    H    GLU  26           HN       GLU  26 -13.121  22.995  22.995
  192    HA   GLU  26           HA       GLU  26 -14.722  25.366  25.366
  193   1HB   GLU  26           HB1      GLU  26 -13.099  24.198  24.198
  194   2HB   GLU  26           HB2      GLU  26 -13.701  25.843  25.843
  195   1HG   GLU  26           HG1      GLU  26 -11.921  24.748  24.748
  196   2HG   GLU  26           HG2      GLU  26 -11.225  25.402  25.402
  197    H    HIS  27           HN       HIS  27 -14.770  22.531  22.531
  198    HA   HIS  27           HA       HIS  27 -17.549  23.126  23.126
  199   1HB   HIS  27           HB1      HIS  27 -15.494  21.652  21.652
  200   2HB   HIS  27           HB2      HIS  27 -17.021  22.372  22.372
  201    HD1  HIS  27           HD1      HIS  27 -16.988  25.110  25.110
  202    HD2  HIS  27           HD2      HIS  27 -13.336  23.299  23.299
  203    HE1  HIS  27           HE1      HIS  27 -15.364  26.898  26.898
  204    HA   PRO  28           HA       PRO  28 -17.941  18.909  18.909
  205   1HB   PRO  28           HB1      PRO  28 -19.717  19.412  19.412
  206   2HB   PRO  28           HB2      PRO  28 -18.006  19.749  19.749
  207   1HG   PRO  28           HG1      PRO  28 -20.177  21.710  21.710
  208   2HG   PRO  28           HG2      PRO  28 -19.047  21.891  21.891
  209   1HD   PRO  28           HD1      PRO  28 -18.512  22.973  22.973
  210   2HD   PRO  28           HD2      PRO  28 -17.205  22.397  22.397
  211    H    GLY  29           HN       GLY  29 -18.697  20.022  20.022
  212   1HA   GLY  29           HA1      GLY  29 -21.564  19.389  19.389
  213   2HA   GLY  29           HA2      GLY  29 -20.852  20.764  20.764
  214    H    LEU  30           HN       LEU  30 -18.363  18.761  18.761
  215    HA   LEU  30           HA       LEU  30 -19.258  17.702  17.702
  216   1HB   LEU  30           HB1      LEU  30 -16.453  17.132  17.132
  217   2HB   LEU  30           HB2      LEU  30 -17.200  17.998  17.998
  218    HG   LEU  30           HG       LEU  30 -16.664  19.361  19.361
  219   1HD1  LEU  30          HD11      LEU  30 -14.957  19.254  19.254
  220   2HD1  LEU  30          HD12      LEU  30 -14.651  20.285  20.285
  221   3HD1  LEU  30          HD13      LEU  30 -14.536  18.544  18.544
  222   1HD2  LEU  30          HD21      LEU  30 -17.176  20.365  20.365
  223   2HD2  LEU  30          HD22      LEU  30 -18.359  20.419  20.419
  224   3HD2  LEU  30          HD23      LEU  30 -16.895  21.383  21.383
  225    H    SER  31           HN       SER  31 -17.907  15.616  15.616
  226    HA   SER  31           HA       SER  31 -18.555  13.562  13.562
  227   1HB   SER  31           HB1      SER  31 -18.858  12.006  12.006
  228   2HB   SER  31           HB2      SER  31 -19.883  13.429  13.429
  229    HG   SER  31           HG       SER  31 -17.727  12.626  12.626
  230    H    ILE  32           HN       ILE  32 -17.276  11.475  11.475
  231    HA   ILE  32           HA       ILE  32 -14.496  12.066  12.066
  232    HB   ILE  32           HB       ILE  32 -15.808  10.131  10.131
  233   1HG1  ILE  32          HG11      ILE  32 -14.098   8.351   8.351
  234   2HG1  ILE  32          HG12      ILE  32 -13.417   9.189   9.189
  235   1HG2  ILE  32          HG21      ILE  32 -15.732   9.081   9.081
  236   2HG2  ILE  32          HG22      ILE  32 -16.278   8.157   8.157
  237   3HG2  ILE  32          HG23      ILE  32 -17.162   9.586   9.586
  238   1HD1  ILE  32          HD11      ILE  32 -13.450  10.236  10.236
  239   2HD1  ILE  32          HD12      ILE  32 -12.053   9.600   9.600
  240   3HD1  ILE  32          HD13      ILE  32 -12.780  11.106  11.106
  241    H    GLY  33           HN       GLY  33 -16.255  12.195  12.195
  242   1HA   GLY  33           HA1      GLY  33 -14.144  11.388  11.388
  243   2HA   GLY  33           HA2      GLY  33 -15.845  11.629  11.629
  244    H    ASP  34           HN       ASP  34 -15.389  14.071  14.071
  245    HA   ASP  34           HA       ASP  34 -14.599  15.964  15.964
  246   1HB   ASP  34           HB1      ASP  34 -16.395  16.072  16.072
  247   2HB   ASP  34           HB2      ASP  34 -15.847  17.568  17.568
  248    H    VAL  35           HN       VAL  35 -14.343  15.176  15.176
  249    HA   VAL  35           HA       VAL  35 -12.353  17.127  17.127
  250    HB   VAL  35           HB       VAL  35 -13.142  14.398  14.398
  251   1HG1  VAL  35          HG11      VAL  35 -10.812  14.954  14.954
  252   2HG1  VAL  35          HG12      VAL  35 -11.383  16.496  16.496
  253   3HG1  VAL  35          HG13      VAL  35 -11.923  15.000  15.000
  254   1HG2  VAL  35          HG21      VAL  35 -13.798  17.215  17.215
  255   2HG2  VAL  35          HG22      VAL  35 -14.914  16.101  16.101
  256   3HG2  VAL  35          HG23      VAL  35 -14.270  15.732  15.732
  257    H    ALA  36           HN       ALA  36 -12.397  14.052  14.052
  258    HA   ALA  36           HA       ALA  36  -9.538  13.623  13.623
  259   1HB   ALA  36           HB1      ALA  36 -11.810  12.198  12.198
  260   2HB   ALA  36           HB2      ALA  36 -10.167  11.571  11.571
  261   3HB   ALA  36           HB3      ALA  36 -11.113  11.747  11.747
  262    H    LYS  37           HN       LYS  37 -11.976  14.357  14.357
  263    HA   LYS  37           HA       LYS  37  -9.925  14.464  14.464
  264   1HB   LYS  37           HB1      LYS  37 -12.768  15.493  15.493
  265   2HB   LYS  37           HB2      LYS  37 -11.723  15.817  15.817
  266   1HG   LYS  37           HG1      LYS  37 -11.297  13.333  13.333
  267   2HG   LYS  37           HG2      LYS  37 -12.554  13.058  13.058
  268   1HD   LYS  37           HD1      LYS  37 -14.173  14.284  14.284
  269   2HD   LYS  37           HD2      LYS  37 -12.868  14.533  14.533
  270   1HE   LYS  37           HE1      LYS  37 -12.593  11.894  11.894
  271   2HE   LYS  37           HE2      LYS  37 -14.236  11.969  11.969
  272   1HZ   LYS  37           HZ1      LYS  37 -14.209  13.644  13.644
  273   2HZ   LYS  37           HZ2      LYS  37 -13.327  12.273  12.273
  274   3HZ   LYS  37           HZ3      LYS  37 -14.918  12.102  12.102
  275    H    LYS  38           HN       LYS  38 -11.390  16.914  16.914
  276    HA   LYS  38           HA       LYS  38 -10.289  19.156  19.156
  277   1HB   LYS  38           HB1      LYS  38 -12.193  19.145  19.145
  278   2HB   LYS  38           HB2      LYS  38 -10.964  18.871  18.871
  279   1HG   LYS  38           HG1      LYS  38 -11.390  21.223  21.223
  280   2HG   LYS  38           HG2      LYS  38  -9.837  21.014  21.014
  281   1HD   LYS  38           HD1      LYS  38 -10.912  21.171  21.171
  282   2HD   LYS  38           HD2      LYS  38 -12.490  21.320  21.320
  283   1HE   LYS  38           HE1      LYS  38 -11.619  23.546  23.546
  284   2HE   LYS  38           HE2      LYS  38 -11.705  23.419  23.419
  285   1HZ   LYS  38           HZ1      LYS  38  -9.225  22.437  22.437
  286   2HZ   LYS  38           HZ2      LYS  38  -9.464  23.910  23.910
  287   3HZ   LYS  38           HZ3      LYS  38  -9.564  23.843  23.843
  288    H    LEU  39           HN       LEU  39  -9.273  17.469  17.469
  289    HA   LEU  39           HA       LEU  39  -6.766  18.923  18.923
  290   1HB   LEU  39           HB1      LEU  39  -6.801  18.190  18.190
  291   2HB   LEU  39           HB2      LEU  39  -8.387  17.567  17.567
  292    HG   LEU  39           HG       LEU  39  -7.162  15.424  15.424
  293   1HD1  LEU  39          HD11      LEU  39  -5.113  16.894  16.894
  294   2HD1  LEU  39          HD12      LEU  39  -4.942  15.216  15.216
  295   3HD1  LEU  39          HD13      LEU  39  -4.945  16.412  16.412
  296   1HD2  LEU  39          HD21      LEU  39  -8.541  15.747  15.747
  297   2HD2  LEU  39          HD22      LEU  39  -7.158  14.718  14.718
  298   3HD2  LEU  39          HD23      LEU  39  -7.097  16.404  16.404
  299    H    GLY  40           HN       GLY  40  -7.780  15.888  15.888
  300   1HA   GLY  40           HA1      GLY  40  -5.128  14.866  14.866
  301   2HA   GLY  40           HA2      GLY  40  -6.493  14.399  14.399
  302    H    GLU  41           HN       GLU  41  -7.104  17.088  17.088
  303    HA   GLU  41           HA       GLU  41  -5.256  17.260  17.260
  304   1HB   GLU  41           HB1      GLU  41  -7.215  19.231  19.231
  305   2HB   GLU  41           HB2      GLU  41  -6.368  19.513  19.513
  306   1HG   GLU  41           HG1      GLU  41  -7.398  17.635  17.635
  307   2HG   GLU  41           HG2      GLU  41  -8.057  17.012  17.012
  308    H    MET  42           HN       MET  42  -5.748  19.132  19.132
  309    HA   MET  42           HA       MET  42  -3.771  21.076  21.076
  310   1HB   MET  42           HB1      MET  42  -4.483  19.444  19.444
  311   2HB   MET  42           HB2      MET  42  -3.531  20.918  20.918
  312   1HG   MET  42           HG1      MET  42  -6.310  20.747  20.747
  313   2HG   MET  42           HG2      MET  42  -6.107  21.201  21.201
  314   1HE   MET  42           HE1      MET  42  -5.527  21.927  21.927
  315   2HE   MET  42           HE2      MET  42  -7.127  22.549  22.549
  316   3HE   MET  42           HE3      MET  42  -5.851  23.641  23.641
  317    H    TRP  43           HN       TRP  43  -3.405  17.879  17.879
  318    HA   TRP  43           HA       TRP  43  -0.681  17.694  17.694
  319   1HB   TRP  43           HB1      TRP  43  -2.229  15.894  15.894
  320   2HB   TRP  43           HB2      TRP  43  -2.555  15.616  15.616
  321    HD1  TRP  43           HD1      TRP  43  -1.106  13.917  13.917
  322    HE1  TRP  43           HE1      TRP  43   1.036  12.799  12.799
  323    HE3  TRP  43           HE3      TRP  43  -0.100  16.416  16.416
  324    HZ2  TRP  43           HZ2      TRP  43   3.029  12.858  12.858
  325    HZ3  TRP  43           HZ3      TRP  43   1.859  15.901  15.901
  326    HH2  TRP  43           HH2      TRP  43   3.443  14.121  14.121
  327    H    ASN  44           HN       ASN  44  -2.334  16.782  16.782
  328    HA   ASN  44           HA       ASN  44  -0.191  16.181  16.181
  329   1HB   ASN  44           HB1      ASN  44  -1.935  15.815  15.815
  330   2HB   ASN  44           HB2      ASN  44  -3.020  16.680  16.680
  331   1HD2  ASN  44          HD21      ASN  44  -3.628  19.136  19.136
  332   2HD2  ASN  44          HD22      ASN  44  -4.092  18.343  18.343
  333    H    ASN  45           HN       ASN  45  -1.419  19.323  19.323
  334    HA   ASN  45           HA       ASN  45   0.974  20.630  20.630
  335   1HB   ASN  45           HB1      ASN  45  -0.508  22.601  22.601
  336   2HB   ASN  45           HB2      ASN  45  -1.115  21.172  21.172
  337   1HD2  ASN  45          HD21      ASN  45  -4.178  21.248  21.248
  338   2HD2  ASN  45          HD22      ASN  45  -3.291  20.627  20.627
  339    H    THR  46           HN       THR  46   1.073  19.733  19.733
  340    HA   THR  46           HA       THR  46   0.400  21.893  21.893
  341    HB   THR  46           HB       THR  46   0.652  19.586  19.586
  342    HG1  THR  46           HG1      THR  46   1.391  20.572  20.572
  343   1HG2  THR  46          HG21      THR  46   2.605  18.703  18.703
  344   2HG2  THR  46          HG22      THR  46   3.677  19.767  19.767
  345   3HG2  THR  46          HG23      THR  46   2.829  18.491  18.491
  346    H    ALA  47           HN       ALA  47   3.358  20.767  20.767
  347    HA   ALA  47           HA       ALA  47   4.547  23.297  23.297
  348   1HB   ALA  47           HB1      ALA  47   4.921  23.311  23.311
  349   2HB   ALA  47           HB2      ALA  47   5.743  21.771  21.771
  350   3HB   ALA  47           HB3      ALA  47   6.430  23.209  23.209
  351    H    ALA  48           HN       ALA  48   5.086  20.113  20.113
  352    HA   ALA  48           HA       ALA  48   5.652  18.163  18.163
  353   1HB   ALA  48           HB1      ALA  48   6.089  19.464  19.464
  354   2HB   ALA  48           HB2      ALA  48   7.613  20.019  20.019
  355   3HB   ALA  48           HB3      ALA  48   7.352  18.310  18.310
  356    H    ASP  49           HN       ASP  49   7.585  20.885  20.885
  357    HA   ASP  49           HA       ASP  49   9.778  19.428  19.428
  358   1HB   ASP  49           HB1      ASP  49   9.120  22.410  22.410
  359   2HB   ASP  49           HB2      ASP  49  10.672  21.690  21.690
  360    H    ASP  50           HN       ASP  50   6.718  19.939  19.939
  361    HA   ASP  50           HA       ASP  50   7.192  20.204  20.204
  362   1HB   ASP  50           HB1      ASP  50   5.720  22.000  22.000
  363   2HB   ASP  50           HB2      ASP  50   4.654  20.757  20.757
  364    H    LYS  51           HN       LYS  51   6.486  18.124  18.124
  365    HA   LYS  51           HA       LYS  51   4.737  16.287  16.287
  366   1HB   LYS  51           HB1      LYS  51   6.223  15.826  15.826
  367   2HB   LYS  51           HB2      LYS  51   5.114  14.699  14.699
  368   1HG   LYS  51           HG1      LYS  51   3.278  16.369  16.369
  369   2HG   LYS  51           HG2      LYS  51   4.428  17.416  17.416
  370   1HD   LYS  51           HD1      LYS  51   4.891  15.614  15.614
  371   2HD   LYS  51           HD2      LYS  51   3.759  14.561  14.561
  372   1HE   LYS  51           HE1      LYS  51   1.908  16.005  16.005
  373   2HE   LYS  51           HE2      LYS  51   2.966  17.218  17.218
  374   1HZ   LYS  51           HZ1      LYS  51   3.466  14.763  14.763
  375   2HZ   LYS  51           HZ2      LYS  51   1.781  14.986  14.986
  376   3HZ   LYS  51           HZ3      LYS  51   2.778  16.162  16.162
  377    H    GLN  52           HN       GLN  52   7.898  16.457  16.457
  378    HA   GLN  52           HA       GLN  52   9.332  14.369  14.369
  379   1HB   GLN  52           HB1      GLN  52   9.967  17.063  17.063
  380   2HB   GLN  52           HB2      GLN  52  10.656  16.780  16.780
  381   1HG   GLN  52           HG1      GLN  52  12.372  16.329  16.329
  382   2HG   GLN  52           HG2      GLN  52  11.902  14.797  14.797
  383   1HE2  GLN  52          HE21      GLN  52   9.919  14.850  14.850
  384   2HE2  GLN  52          HE22      GLN  52   9.383  15.680  15.680
  385    HA   PRO  53           HA       PRO  53   9.841  14.958  14.958
  386   1HB   PRO  53           HB1      PRO  53   7.617  16.262  16.262
  387   2HB   PRO  53           HB2      PRO  53   9.196  17.000  17.000
  388   1HG   PRO  53           HG1      PRO  53   6.798  16.949  16.949
  389   2HG   PRO  53           HG2      PRO  53   7.708  18.369  18.369
  390   1HD   PRO  53           HD1      PRO  53   8.388  17.361  17.361
  391   2HD   PRO  53           HD2      PRO  53   9.716  17.625  17.625
  392    H    TYR  54           HN       TYR  54   6.457  14.973  14.973
  393    HA   TYR  54           HA       TYR  54   5.621  12.796  12.796
  394   1HB   TYR  54           HB1      TYR  54   4.413  13.911  13.911
  395   2HB   TYR  54           HB2      TYR  54   3.616  12.728  12.728
  396    HD1  TYR  54           HD1      TYR  54   3.654  13.519  13.519
  397    HD2  TYR  54           HD2      TYR  54   3.782  16.115  16.115
  398    HE1  TYR  54           HE1      TYR  54   2.776  15.336  15.336
  399    HE2  TYR  54           HE2      TYR  54   2.905  17.940  17.940
  400    HH   TYR  54           HH       TYR  54   1.375  17.573  17.573
  401    H    GLU  55           HN       GLU  55   6.342  13.099  13.099
  402    HA   GLU  55           HA       GLU  55   6.001  10.462  10.462
  403   1HB   GLU  55           HB1      GLU  55   7.106  12.940  12.940
  404   2HB   GLU  55           HB2      GLU  55   8.277  11.710  11.710
  405   1HG   GLU  55           HG1      GLU  55   6.430  10.376  10.376
  406   2HG   GLU  55           HG2      GLU  55   5.298  11.637  11.637
  407    H    LYS  56           HN       LYS  56   8.935  11.903  11.903
  408    HA   LYS  56           HA       LYS  56  10.774   9.877   9.877
  409   1HB   LYS  56           HB1      LYS  56  11.030  12.217  12.217
  410   2HB   LYS  56           HB2      LYS  56  10.415  11.445  11.445
  411   1HG   LYS  56           HG1      LYS  56  12.330   9.720   9.720
  412   2HG   LYS  56           HG2      LYS  56  12.940  10.758  10.758
  413   1HD   LYS  56           HD1      LYS  56  14.151  11.391  11.391
  414   2HD   LYS  56           HD2      LYS  56  12.979  12.667  12.667
  415   1HE   LYS  56           HE1      LYS  56  11.496  11.729  11.729
  416   2HE   LYS  56           HE2      LYS  56  12.524  10.318  10.318
  417   1HZ   LYS  56           HZ1      LYS  56  14.062  12.648  12.648
  418   2HZ   LYS  56           HZ2      LYS  56  12.695  12.736  12.736
  419   3HZ   LYS  56           HZ3      LYS  56  13.748  11.411  11.411
  420    H    LYS  57           HN       LYS  57   8.189  10.178  10.178
  421    HA   LYS  57           HA       LYS  57   8.952   7.819   7.819
  422   1HB   LYS  57           HB1      LYS  57   6.285   9.281   9.281
  423   2HB   LYS  57           HB2      LYS  57   6.497   7.844   7.844
  424   1HG   LYS  57           HG1      LYS  57   8.487   9.129   9.129
  425   2HG   LYS  57           HG2      LYS  57   7.775  10.562  10.562
  426   1HD   LYS  57           HD1      LYS  57   5.630  10.131  10.131
  427   2HD   LYS  57           HD2      LYS  57   6.214   8.591   8.591
  428   1HE   LYS  57           HE1      LYS  57   8.011   9.849   9.849
  429   2HE   LYS  57           HE2      LYS  57   7.216  11.348  11.348
  430   1HZ   LYS  57           HZ1      LYS  57   5.282   9.595   9.595
  431   2HZ   LYS  57           HZ2      LYS  57   6.570   9.643   9.643
  432   3HZ   LYS  57           HZ3      LYS  57   5.794  11.082  11.082
  433    H    ALA  58           HN       ALA  58   6.321   8.421   8.421
  434    HA   ALA  58           HA       ALA  58   5.289   5.900   5.900
  435   1HB   ALA  58           HB1      ALA  58   4.522   7.874   7.874
  436   2HB   ALA  58           HB2      ALA  58   5.997   7.814   7.814
  437   3HB   ALA  58           HB3      ALA  58   4.833   6.504   6.504
  438    H    ALA  59           HN       ALA  59   8.132   7.118   7.118
  439    HA   ALA  59           HA       ALA  59   8.858   4.759   4.759
  440   1HB   ALA  59           HB1      ALA  59   9.854   7.002   7.002
  441   2HB   ALA  59           HB2      ALA  59  10.684   6.955   6.955
  442   3HB   ALA  59           HB3      ALA  59  11.110   5.802   5.802
  443    H    LYS  60           HN       LYS  60  10.328   6.012   6.012
  444    HA   LYS  60           HA       LYS  60  11.952   3.901   3.901
  445   1HB   LYS  60           HB1      LYS  60  11.554   6.205   6.205
  446   2HB   LYS  60           HB2      LYS  60  10.357   5.348   5.348
  447   1HG   LYS  60           HG1      LYS  60  12.172   3.603   3.603
  448   2HG   LYS  60           HG2      LYS  60  13.311   4.664   4.664
  449   1HD   LYS  60           HD1      LYS  60  12.697   6.485   6.485
  450   2HD   LYS  60           HD2      LYS  60  11.701   5.301   5.301
  451   1HE   LYS  60           HE1      LYS  60  13.742   3.822   3.822
  452   2HE   LYS  60           HE2      LYS  60  14.707   5.108   5.108
  453   1HZ   LYS  60           HZ1      LYS  60  13.173   6.215   6.215
  454   2HZ   LYS  60           HZ2      LYS  60  13.918   4.813   4.813
  455   3HZ   LYS  60           HZ3      LYS  60  14.862   6.042   6.042
  456    H    LEU  61           HN       LEU  61   8.481   4.168   4.168
  457    HA   LEU  61           HA       LEU  61   8.464   1.658   1.658
  458   1HB   LEU  61           HB1      LEU  61   6.136   3.212   3.212
  459   2HB   LEU  61           HB2      LEU  61   6.032   2.021   2.021
  460    HG   LEU  61           HG       LEU  61   7.537   4.691   4.691
  461   1HD1  LEU  61          HD11      LEU  61   5.125   4.921   4.921
  462   2HD1  LEU  61          HD12      LEU  61   5.071   3.726   3.726
  463   3HD1  LEU  61          HD13      LEU  61   5.887   5.267   5.267
  464   1HD2  LEU  61          HD21      LEU  61   7.320   2.538   2.538
  465   2HD2  LEU  61          HD22      LEU  61   8.780   2.976   2.976
  466   3HD2  LEU  61          HD23      LEU  61   8.036   4.132   4.132
  467    H    LYS  62           HN       LYS  62   7.245   2.549   2.549
  468    HA   LYS  62           HA       LYS  62   6.386   0.053   0.053
  469   1HB   LYS  62           HB1      LYS  62   6.450   2.273   2.273
  470   2HB   LYS  62           HB2      LYS  62   8.132   1.932   1.932
  471   1HG   LYS  62           HG1      LYS  62   7.454  -0.242  -0.242
  472   2HG   LYS  62           HG2      LYS  62   5.769   0.118   0.118
  473   1HD   LYS  62           HD1      LYS  62   6.049   2.261   2.261
  474   2HD   LYS  62           HD2      LYS  62   7.645   1.685   1.685
  475   1HE   LYS  62           HE1      LYS  62   6.638  -0.330  -0.330
  476   2HE   LYS  62           HE2      LYS  62   5.031   0.205   0.205
  477   1HZ   LYS  62           HZ1      LYS  62   6.355   2.288   2.288
  478   2HZ   LYS  62           HZ2      LYS  62   6.418   0.878   0.878
  479   3HZ   LYS  62           HZ3      LYS  62   4.923   1.482   1.482
  480    H    GLU  63           HN       GLU  63   9.639   1.331   1.331
  481    HA   GLU  63           HA       GLU  63  11.135  -0.761  -0.761
  482   1HB   GLU  63           HB1      GLU  63  12.117   1.427   1.427
  483   2HB   GLU  63           HB2      GLU  63  11.659   1.406   1.406
  484   1HG   GLU  63           HG1      GLU  63  13.382  -0.441  -0.441
  485   2HG   GLU  63           HG2      GLU  63  13.883  -0.245  -0.245
  486    H    LYS  64           HN       LYS  64  10.397  -0.120  -0.120
  487    HA   LYS  64           HA       LYS  64  11.599  -2.402  -2.402
  488   1HB   LYS  64           HB1      LYS  64  10.494  -0.543  -0.543
  489   2HB   LYS  64           HB2      LYS  64   8.927  -1.164  -1.164
  490   1HG   LYS  64           HG1      LYS  64   9.931  -3.456  -3.456
  491   2HG   LYS  64           HG2      LYS  64  10.948  -2.354  -2.354
  492   1HD   LYS  64           HD1      LYS  64   7.901  -2.334  -2.334
  493   2HD   LYS  64           HD2      LYS  64   8.875  -2.990  -2.990
  494   1HE   LYS  64           HE1      LYS  64   8.854  -0.059  -0.059
  495   2HE   LYS  64           HE2      LYS  64   8.045  -0.720  -0.720
  496   1HZ   LYS  64           HZ1      LYS  64  10.719  -1.550  -1.550
  497   2HZ   LYS  64           HZ2      LYS  64  10.679   0.127   0.127
  498   3HZ   LYS  64           HZ3      LYS  64   9.899  -0.541  -0.541
  499    H    TYR  65           HN       TYR  65   8.307  -1.987  -1.987
  500    HA   TYR  65           HA       TYR  65   7.216  -4.525  -4.525
  501   1HB   TYR  65           HB1      TYR  65   5.670  -2.876  -2.876
  502   2HB   TYR  65           HB2      TYR  65   6.779  -2.103  -2.103
  503    HD1  TYR  65           HD1      TYR  65   5.188  -5.494  -5.494
  504    HD2  TYR  65           HD2      TYR  65   5.832  -2.007  -2.007
  505    HE1  TYR  65           HE1      TYR  65   3.956  -6.511  -6.511
  506    HE2  TYR  65           HE2      TYR  65   4.609  -3.021  -3.021
  507    HH   TYR  65           HH       TYR  65   3.599  -4.810  -4.810
  508    H    GLU  66           HN       GLU  66   8.482  -3.328  -3.328
  509    HA   GLU  66           HA       GLU  66   8.446  -5.537  -5.537
  510   1HB   GLU  66           HB1      GLU  66  10.710  -3.586  -3.586
  511   2HB   GLU  66           HB2      GLU  66  10.423  -4.667  -4.667
  512   1HG   GLU  66           HG1      GLU  66   8.027  -3.049  -3.049
  513   2HG   GLU  66           HG2      GLU  66   9.384  -2.049  -2.049
  514    H    LYS  67           HN       LYS  67  10.723  -5.032  -5.032
  515    HA   LYS  67           HA       LYS  67  12.373  -7.296  -7.296
  516   1HB   LYS  67           HB1      LYS  67  12.630  -5.123  -5.123
  517   2HB   LYS  67           HB2      LYS  67  13.464  -6.619  -6.619
  518   1HG   LYS  67           HG1      LYS  67  14.968  -5.200  -5.200
  519   2HG   LYS  67           HG2      LYS  67  14.527  -6.542  -6.542
  520   1HD   LYS  67           HD1      LYS  67  12.815  -5.019  -5.019
  521   2HD   LYS  67           HD2      LYS  67  13.447  -3.690  -3.690
  522   1HE   LYS  67           HE1      LYS  67  15.013  -5.389  -5.389
  523   2HE   LYS  67           HE2      LYS  67  14.486  -3.732  -3.732
  524   1HZ   LYS  67           HZ1      LYS  67  15.902  -3.789  -3.789
  525   2HZ   LYS  67           HZ2      LYS  67  16.808  -4.671  -4.671
  526   3HZ   LYS  67           HZ3      LYS  67  16.354  -3.071  -3.071
  527    H    ASP  68           HN       ASP  68  10.076  -6.611  -6.611
  528    HA   ASP  68           HA       ASP  68  10.462  -9.134  -9.134
  529   1HB   ASP  68           HB1      ASP  68   8.495  -6.840  -6.840
  530   2HB   ASP  68           HB2      ASP  68   8.491  -8.302  -8.302
  531    H    ILE  69           HN       ILE  69   8.715  -7.891  -7.891
  532    HA   ILE  69           HA       ILE  69   6.591  -9.943  -9.943
  533    HB   ILE  69           HB       ILE  69   6.417  -7.459  -7.459
  534   1HG1  ILE  69          HG11      ILE  69   4.438  -8.526  -8.526
  535   2HG1  ILE  69          HG12      ILE  69   4.845  -8.228  -8.228
  536   1HG2  ILE  69          HG21      ILE  69   8.269  -7.548  -7.548
  537   2HG2  ILE  69          HG22      ILE  69   7.496  -8.772  -8.772
  538   3HG2  ILE  69          HG23      ILE  69   6.806  -7.155  -7.155
  539   1HD1  ILE  69          HD11      ILE  69   5.680 -10.563 -10.563
  540   2HD1  ILE  69          HD12      ILE  69   5.233 -10.850 -10.850
  541   3HD1  ILE  69          HD13      ILE  69   3.990 -10.517 -10.517
  542    H    ALA  70           HN       ALA  70   9.478  -8.999  -8.999
  543    HA   ALA  70           HA       ALA  70   9.645 -11.150 -11.150
  544   1HB   ALA  70           HB1      ALA  70  11.906  -9.513  -9.513
  545   2HB   ALA  70           HB2      ALA  70  12.038 -10.529 -10.529
  546   3HB   ALA  70           HB3      ALA  70  11.029  -9.100  -9.100
  547    H    ALA  71           HN       ALA  71  10.325 -10.725 -10.725
  548    HA   ALA  71           HA       ALA  71  11.879 -13.194 -13.194
  549   1HB   ALA  71           HB1      ALA  71  10.829 -11.211 -11.211
  550   2HB   ALA  71           HB2      ALA  71  11.911 -12.551 -12.551
  551   3HB   ALA  71           HB3      ALA  71  12.461 -11.223 -11.223
  552    H    TYR  72           HN       TYR  72   8.682 -11.939 -11.939
  553    HA   TYR  72           HA       TYR  72   7.567 -14.057 -14.057
  554   1HB   TYR  72           HB1      TYR  72   6.360 -12.016 -12.016
  555   2HB   TYR  72           HB2      TYR  72   6.335 -12.033 -12.033
  556    HD1  TYR  72           HD1      TYR  72   5.333 -14.239 -14.239
  557    HD2  TYR  72           HD2      TYR  72   4.304 -12.740 -12.740
  558    HE1  TYR  72           HE1      TYR  72   3.210 -15.456 -15.456
  559    HE2  TYR  72           HE2      TYR  72   2.180 -13.958 -13.958
  560    HH   TYR  72           HH       TYR  72   1.009 -15.403 -15.403
  561    H    ARG  73           HN       ARG  73   7.567 -13.374 -13.374
  562    HA   ARG  73           HA       ARG  73   6.161 -15.729 -15.729
  563   1HB   ARG  73           HB1      ARG  73   6.351 -14.747 -14.747
  564   2HB   ARG  73           HB2      ARG  73   6.669 -13.322 -13.322
  565   1HG   ARG  73           HG1      ARG  73   9.189 -13.927 -13.927
  566   2HG   ARG  73           HG2      ARG  73   8.708 -15.098 -15.098
  567   1HD   ARG  73           HD1      ARG  73   8.575 -12.080 -12.080
  568   2HD   ARG  73           HD2      ARG  73   9.353 -13.203 -13.203
  569    HE   ARG  73           HE       ARG  73   7.006 -13.916 -13.916
  570   1HH1  ARG  73          HH11      ARG  73   6.540 -11.607 -11.607
  571   2HH1  ARG  73          HH12      ARG  73   5.694 -10.468 -10.468
  572   1HH2  ARG  73          HH21      ARG  73   6.446 -12.198 -12.198
  573   2HH2  ARG  73          HH22      ARG  73   5.643 -10.814 -10.814
  574    H    ALA  74           HN       ALA  74   9.408 -14.792 -14.792
  575    HA   ALA  74           HA       ALA  74  11.037 -16.582 -16.582
  576   1HB   ALA  74           HB1      ALA  74  11.802 -14.931 -14.931
  577   2HB   ALA  74           HB2      ALA  74  11.190 -15.968 -15.968
  578   3HB   ALA  74           HB3      ALA  74  12.522 -16.507 -16.507
  579    H    LYS  75           HN       LYS  75   9.230 -17.321 -17.321
  580    HA   LYS  75           HA       LYS  75   8.580 -19.996 -19.996
  581   1HB   LYS  75           HB1      LYS  75  11.137 -20.368 -20.368
  582   2HB   LYS  75           HB2      LYS  75  11.063 -19.840 -19.840
  583   1HG   LYS  75           HG1      LYS  75   9.573 -21.715 -21.715
  584   2HG   LYS  75           HG2      LYS  75   9.456 -22.169 -22.169
  585   1HD   LYS  75           HD1      LYS  75  12.246 -22.113 -22.113
  586   2HD   LYS  75           HD2      LYS  75  11.554 -22.707 -22.707
  587   1HE   LYS  75           HE1      LYS  75  12.034 -24.599 -24.599
  588   2HE   LYS  75           HE2      LYS  75  10.294 -24.456 -24.456
  589   1HZ   LYS  75           HZ1      LYS  75  11.070 -22.835 -22.835
  590   2HZ   LYS  75           HZ2      LYS  75  11.716 -24.388 -24.388
  591   3HZ   LYS  75           HZ3      LYS  75  10.044 -24.187 -24.187
  592    H    GLY  76           HN       GLY  76   6.858 -18.603 -18.603
  593   1HA   GLY  76           HA1      GLY  76   6.773 -18.952 -18.952
  594   2HA   GLY  76           HA2      GLY  76   6.133 -17.483 -17.483
  595    H    LYS  77           HN       LYS  77   4.939 -17.954 -17.954
  596    HA   LYS  77           HA       LYS  77   2.439 -18.820 -18.820
  597   1HB   LYS  77           HB1      LYS  77   2.867 -17.766 -17.766
  598   2HB   LYS  77           HB2      LYS  77   4.360 -18.548 -18.548
  599   1HG   LYS  77           HG1      LYS  77   2.833 -19.110 -19.110
  600   2HG   LYS  77           HG2      LYS  77   3.060 -20.559 -20.559
  601   1HD   LYS  77           HD1      LYS  77   0.896 -20.186 -20.186
  602   2HD   LYS  77           HD2      LYS  77   0.702 -18.640 -18.640
  603   1HE   LYS  77           HE1      LYS  77   0.615 -19.808 -19.808
  604   2HE   LYS  77           HE2      LYS  77   0.825 -21.355 -21.355
  605   1HZ   LYS  77           HZ1      LYS  77  -1.283 -20.026 -20.026
  606   2HZ   LYS  77           HZ2      LYS  77  -1.529 -19.918 -19.918
  607   3HZ   LYS  77           HZ3      LYS  77  -1.333 -21.438 -21.438
  608    HA   PRO  78           HA       PRO  78   2.866 -23.291 -23.291
  609   1HB   PRO  78           HB1      PRO  78   5.795 -24.005 -24.005
  610   2HB   PRO  78           HB2      PRO  78   4.629 -24.239 -24.239
  611   1HG   PRO  78           HG1      PRO  78   6.530 -22.316 -22.316
  612   2HG   PRO  78           HG2      PRO  78   4.893 -21.989 -21.989
  613   1HD   PRO  78           HD1      PRO  78   6.108 -21.312 -21.312
  614   2HD   PRO  78           HD2      PRO  78   5.335 -20.206 -20.206
  615    H    ASP  79           HN       ASP  79   4.947 -22.181 -22.181
  616    HA   ASP  79           HA       ASP  79   4.169 -24.329 -24.329
  617   1HB   ASP  79           HB1      ASP  79   6.453 -24.072 -24.072
  618   2HB   ASP  79           HB2      ASP  79   6.553 -24.610 -24.610
  619    H    ALA  80           HN       ALA  80   2.426 -22.717 -22.717
  620    HA   ALA  80           HA       ALA  80   3.168 -20.384 -20.384
  621   1HB   ALA  80           HB1      ALA  80   1.723 -19.946 -19.946
  622   2HB   ALA  80           HB2      ALA  80   0.536 -21.096 -21.096
  623   3HB   ALA  80           HB3      ALA  80   0.856 -19.619 -19.619
  624    H    ALA  81           HN       ALA  81   0.803 -23.030 -23.030
  625    HA   ALA  81           HA       ALA  81   0.666 -22.889 -22.889
  626   1HB   ALA  81           HB1      ALA  81  -1.447 -22.268 -22.268
  627   2HB   ALA  81           HB2      ALA  81  -1.450 -23.799 -23.799
  628   3HB   ALA  81           HB3      ALA  81  -1.640 -23.773 -23.773
  629   1H1   BME  16           HE1      MER  16  -9.759  11.682  11.682
  630   2H1   BME  16           HE2      MER  16  -8.671  13.045  13.045
  631   1H2   BME  16           HZ1      MER  16  -7.227  11.598  11.598
  632   2H2   BME  16           HZ2      MER  16  -8.270  10.232  10.232
  633    HO1  BME  16           HH       MER  16 -10.569  12.009  12.009

  Start of MODEL   21
    1    H    ASN   3           HN       ASN   3  -2.283 -10.677 -10.677
    2    HA   ASN   3           HA       ASN   3   0.213 -11.258 -11.258
    3   1HB   ASN   3           HB1      ASN   3  -1.155 -13.027 -13.027
    4   2HB   ASN   3           HB2      ASN   3  -1.229 -13.202 -13.202
    5   1HD2  ASN   3          HD21      ASN   3  -4.633 -12.929 -12.929
    6   2HD2  ASN   3          HD22      ASN   3  -3.138 -13.364 -13.364
    7    H    ALA   4           HN       ALA   4   0.072 -11.027 -11.027
    8    HA   ALA   4           HA       ALA   4  -0.122  -9.513  -9.513
    9   1HB   ALA   4           HB1      ALA   4  -2.134 -10.974 -10.974
   10   2HB   ALA   4           HB2      ALA   4  -3.060  -9.880  -9.880
   11   3HB   ALA   4           HB3      ALA   4  -2.465  -9.341  -9.341
   12    HA   PRO   5           HA       PRO   5  -0.229  -5.632  -5.632
   13   1HB   PRO   5           HB1      PRO   5   2.138  -5.492  -5.492
   14   2HB   PRO   5           HB2      PRO   5   1.960  -4.825  -4.825
   15   1HG   PRO   5           HG1      PRO   5   3.320  -7.104  -7.104
   16   2HG   PRO   5           HG2      PRO   5   2.082  -7.033  -7.033
   17   1HD   PRO   5           HD1      PRO   5   1.837  -8.258  -8.258
   18   2HD   PRO   5           HD2      PRO   5   1.356  -8.954  -8.954
   19    H    LYS   6           HN       LYS   6  -1.712  -4.444  -4.444
   20    HA   LYS   6           HA       LYS   6  -2.305  -4.177  -4.177
   21   1HB   LYS   6           HB1      LYS   6  -3.984  -2.558  -2.558
   22   2HB   LYS   6           HB2      LYS   6  -4.447  -3.628  -3.628
   23   1HG   LYS   6           HG1      LYS   6  -5.105  -5.184  -5.184
   24   2HG   LYS   6           HG2      LYS   6  -3.506  -5.353  -5.353
   25   1HD   LYS   6           HD1      LYS   6  -5.619  -3.353  -3.353
   26   2HD   LYS   6           HD2      LYS   6  -5.165  -4.829  -4.829
   27   1HE   LYS   6           HE1      LYS   6  -3.947  -3.212  -3.212
   28   2HE   LYS   6           HE2      LYS   6  -2.748  -3.793  -3.793
   29   1HZ   LYS   6           HZ1      LYS   6  -4.129  -1.678  -1.678
   30   2HZ   LYS   6           HZ2      LYS   6  -3.688  -1.199  -1.199
   31   3HZ   LYS   6           HZ3      LYS   6  -2.502  -1.756  -1.756
   32    H    ARG   7           HN       ARG   7  -1.590  -2.547  -2.547
   33    HA   ARG   7           HA       ARG   7   0.239  -0.828  -0.828
   34   1HB   ARG   7           HB1      ARG   7  -0.957   0.759   0.759
   35   2HB   ARG   7           HB2      ARG   7  -1.415  -0.883  -0.883
   36   1HG   ARG   7           HG1      ARG   7  -3.461  -0.447  -0.447
   37   2HG   ARG   7           HG2      ARG   7  -3.058   1.250   1.250
   38   1HD   ARG   7           HD1      ARG   7  -3.052   0.689   0.689
   39   2HD   ARG   7           HD2      ARG   7  -4.027  -0.690  -0.690
   40    HE   ARG   7           HE       ARG   7  -4.833   2.112   2.112
   41   1HH1  ARG   7          HH11      ARG   7  -5.907  -1.060  -1.060
   42   2HH1  ARG   7          HH12      ARG   7  -7.260  -0.698  -0.698
   43   1HH2  ARG   7          HH21      ARG   7  -6.265   2.621   2.621
   44   2HH2  ARG   7          HH22      ARG   7  -7.472   1.439   1.439
   45    HA   PRO   8           HA       PRO   8  -0.454   1.323   1.323
   46   1HB   PRO   8           HB1      PRO   8   2.513   1.668   1.668
   47   2HB   PRO   8           HB2      PRO   8   1.681   1.234   1.234
   48   1HG   PRO   8           HG1      PRO   8   2.847  -0.728  -0.728
   49   2HG   PRO   8           HG2      PRO   8   1.187  -0.996  -0.996
   50   1HD   PRO   8           HD1      PRO   8   2.100  -0.085  -0.085
   51   2HD   PRO   8           HD2      PRO   8   1.029  -1.445  -1.445
   52    HA   PRO   9           HA       PRO   9  -0.497   5.748   5.748
   53   1HB   PRO   9           HB1      PRO   9   2.398   5.877   5.877
   54   2HB   PRO   9           HB2      PRO   9   1.126   7.080   7.080
   55   1HG   PRO   9           HG1      PRO   9   1.487   5.340   5.340
   56   2HG   PRO   9           HG2      PRO   9  -0.175   5.522   5.522
   57   1HD   PRO   9           HD1      PRO   9   1.846   3.354   3.354
   58   2HD   PRO   9           HD2      PRO   9   0.116   3.157   3.157
   59    H    SER  10           HN       SER  10   0.141   7.507   7.507
   60    HA   SER  10           HA       SER  10   1.479   6.593   6.593
   61   1HB   SER  10           HB1      SER  10  -0.934   7.096   7.096
   62   2HB   SER  10           HB2      SER  10  -0.636   8.749   8.749
   63    HG   SER  10           HG       SER  10   1.129   8.125   8.125
   64    H    ALA  11           HN       ALA  11   1.291   9.252   9.252
   65    HA   ALA  11           HA       ALA  11   3.522  10.457  10.457
   66   1HB   ALA  11           HB1      ALA  11   2.939  11.278  11.278
   67   2HB   ALA  11           HB2      ALA  11   4.195  11.961  11.961
   68   3HB   ALA  11           HB3      ALA  11   4.335  10.319  10.319
   69    H    PHE  12           HN       PHE  12   0.767  10.812  10.812
   70    HA   PHE  12           HA       PHE  12  -0.187  13.409  13.409
   71   1HB   PHE  12           HB1      PHE  12  -0.785  12.645  12.645
   72   2HB   PHE  12           HB2      PHE  12  -1.183  11.015  11.015
   73    HD1  PHE  12           HD1      PHE  12  -2.265  14.531  14.531
   74    HD2  PHE  12           HD2      PHE  12  -3.438  10.515  10.515
   75    HE1  PHE  12           HE1      PHE  12  -4.622  15.192  15.192
   76    HE2  PHE  12           HE2      PHE  12  -5.783  11.167  11.167
   77    HZ   PHE  12           HZ       PHE  12  -6.390  13.512  13.512
   78    H    PHE  13           HN       PHE  13   0.081  10.458  10.458
   79    HA   PHE  13           HA       PHE  13  -2.492  10.484  10.484
   80   1HB   PHE  13           HB1      PHE  13  -1.024   8.416   8.416
   81   2HB   PHE  13           HB2      PHE  13  -0.093   8.867   8.867
   82    HD1  PHE  13           HD1      PHE  13  -1.550   9.295   9.295
   83    HD2  PHE  13           HD2      PHE  13  -2.933   7.107   7.107
   84    HE1  PHE  13           HE1      PHE  13  -3.291   8.254   8.254
   85    HE2  PHE  13           HE2      PHE  13  -4.671   6.067   6.067
   86    HZ   PHE  13           HZ       PHE  13  -4.853   6.636   6.636
   87    H    LEU  14           HN       LEU  14   0.918  10.964  10.964
   88    HA   LEU  14           HA       LEU  14   0.572  11.718  11.718
   89   1HB   LEU  14           HB1      LEU  14   2.515  13.016  13.016
   90   2HB   LEU  14           HB2      LEU  14   2.700  12.981  12.981
   91    HG   LEU  14           HG       LEU  14   4.250  11.445  11.445
   92   1HD1  LEU  14          HD11      LEU  14   3.025  10.370  10.370
   93   2HD1  LEU  14          HD12      LEU  14   1.879   9.665   9.665
   94   3HD1  LEU  14          HD13      LEU  14   3.562   9.165   9.165
   95   1HD2  LEU  14          HD21      LEU  14   3.735  11.291  11.291
   96   2HD2  LEU  14          HD22      LEU  14   4.002   9.694   9.694
   97   3HD2  LEU  14          HD23      LEU  14   2.380  10.221  10.221
   98    H    PHE  15           HN       PHE  15   0.740  13.711  13.711
   99    HA   PHE  15           HA       PHE  15  -0.017  16.232  16.232
  100   1HB   PHE  15           HB1      PHE  15   1.183  16.113  16.113
  101   2HB   PHE  15           HB2      PHE  15   0.178  14.776  14.776
  102    HD1  PHE  15           HD1      PHE  15  -1.891  15.165  15.165
  103    HD2  PHE  15           HD2      PHE  15   0.595  18.451  18.451
  104    HE1  PHE  15           HE1      PHE  15  -3.114  16.607  16.607
  105    HE2  PHE  15           HE2      PHE  15  -0.657  19.893  19.893
  106    HZ   PHE  15           HZ       PHE  15  -2.507  18.967  18.967
  107    H    CYS  16           HN       MER  16  -2.134  13.890  13.890
  108    HA   CYS  16           HA       MER  16  -4.554  15.309  15.309
  109   1HB   CYS  16           HB1      MER  16  -5.756  13.247  13.247
  110   2HB   CYS  16           HB2      MER  16  -4.376  13.159  13.159
  111    H    SER  17           HN       SER  17  -3.074  13.025  13.025
  112    HA   SER  17           HA       SER  17  -5.116  12.963  12.963
  113   1HB   SER  17           HB1      SER  17  -2.076  12.831  12.831
  114   2HB   SER  17           HB2      SER  17  -3.310  12.253  12.253
  115    HG   SER  17           HG       SER  17  -2.358  11.047  11.047
  116    H    GLU  18           HN       GLU  18  -2.368  15.122  15.122
  117    HA   GLU  18           HA       GLU  18  -2.925  16.720  16.720
  118   1HB   GLU  18           HB1      GLU  18  -0.757  16.538  16.538
  119   2HB   GLU  18           HB2      GLU  18  -1.415  17.319  17.319
  120   1HG   GLU  18           HG1      GLU  18  -1.758  19.405  19.405
  121   2HG   GLU  18           HG2      GLU  18  -1.376  18.641  18.641
  122    H    TYR  19           HN       TYR  19  -4.481  16.649  16.649
  123    HA   TYR  19           HA       TYR  19  -5.532  19.410  19.410
  124   1HB   TYR  19           HB1      TYR  19  -5.282  17.378  17.378
  125   2HB   TYR  19           HB2      TYR  19  -6.722  18.425  18.425
  126    HD1  TYR  19           HD1      TYR  19  -3.084  18.658  18.658
  127    HD2  TYR  19           HD2      TYR  19  -6.486  20.459  20.459
  128    HE1  TYR  19           HE1      TYR  19  -1.673  20.479  20.479
  129    HE2  TYR  19           HE2      TYR  19  -5.085  22.290  22.290
  130    HH   TYR  19           HH       TYR  19  -2.702  22.675  22.675
  131    H    ARG  20           HN       ARG  20  -6.789  16.189  16.189
  132    HA   ARG  20           HA       ARG  20  -9.347  16.079  16.079
  133   1HB   ARG  20           HB1      ARG  20  -7.670  15.070  15.070
  134   2HB   ARG  20           HB2      ARG  20  -9.409  14.850  14.850
  135   1HG   ARG  20           HG1      ARG  20  -9.221  13.848  13.848
  136   2HG   ARG  20           HG2      ARG  20  -7.492  13.824  13.824
  137   1HD   ARG  20           HD1      ARG  20  -8.562  11.635  11.635
  138   2HD   ARG  20           HD2      ARG  20  -7.832  12.375  12.375
  139    HE   ARG  20           HE       ARG  20 -10.095  13.112  13.112
  140   1HH1  ARG  20          HH11      ARG  20 -12.029  13.197  13.197
  141   2HH1  ARG  20          HH12      ARG  20 -12.714  11.617  11.617
  142   1HH2  ARG  20          HH21      ARG  20  -9.911  10.043  10.043
  143   2HH2  ARG  20          HH22      ARG  20 -11.472   9.772   9.772
  144    HA   PRO  21           HA       PRO  21 -11.294  17.732  17.732
  145   1HB   PRO  21           HB1      PRO  21  -9.979  18.798  18.798
  146   2HB   PRO  21           HB2      PRO  21  -9.949  17.048  17.048
  147   1HG   PRO  21           HG1      PRO  21  -7.882  19.089  19.089
  148   2HG   PRO  21           HG2      PRO  21  -7.600  17.703  17.703
  149   1HD   PRO  21           HD1      PRO  21  -7.267  17.364  17.364
  150   2HD   PRO  21           HD2      PRO  21  -8.170  16.132  16.132
  151    H    LYS  22           HN       LYS  22  -8.923  19.682  19.682
  152    HA   LYS  22           HA       LYS  22 -10.113  22.260  22.260
  153   1HB   LYS  22           HB1      LYS  22  -7.700  21.316  21.316
  154   2HB   LYS  22           HB2      LYS  22  -8.249  22.972  22.972
  155   1HG   LYS  22           HG1      LYS  22  -7.961  23.439  23.439
  156   2HG   LYS  22           HG2      LYS  22  -7.810  21.764  21.764
  157   1HD   LYS  22           HD1      LYS  22  -5.757  22.516  22.516
  158   2HD   LYS  22           HD2      LYS  22  -5.749  23.640  23.640
  159   1HE   LYS  22           HE1      LYS  22  -5.594  20.613  20.613
  160   2HE   LYS  22           HE2      LYS  22  -4.227  21.713  21.713
  161   1HZ   LYS  22           HZ1      LYS  22  -6.279  22.616  22.616
  162   2HZ   LYS  22           HZ2      LYS  22  -6.026  20.965  20.965
  163   3HZ   LYS  22           HZ3      LYS  22  -4.730  22.057  22.057
  164    H    ILE  23           HN       ILE  23 -10.009  20.126  20.126
  165    HA   ILE  23           HA       ILE  23 -11.534  22.223  22.223
  166    HB   ILE  23           HB       ILE  23 -11.381  20.486  20.486
  167   1HG1  ILE  23          HG11      ILE  23  -9.074  19.348  19.348
  168   2HG1  ILE  23          HG12      ILE  23 -10.643  18.559  18.559
  169   1HG2  ILE  23          HG21      ILE  23 -10.021  22.548  22.548
  170   2HG2  ILE  23          HG22      ILE  23  -8.868  21.745  21.745
  171   3HG2  ILE  23          HG23      ILE  23  -9.023  21.251  21.251
  172   1HD1  ILE  23          HD11      ILE  23 -10.550  18.418  18.418
  173   2HD1  ILE  23          HD12      ILE  23  -8.956  19.151  19.151
  174   3HD1  ILE  23          HD13      ILE  23  -9.209  17.577  17.577
  175    H    LYS  24           HN       LYS  24 -11.814  19.224  19.224
  176    HA   LYS  24           HA       LYS  24 -14.426  18.479  18.479
  177   1HB   LYS  24           HB1      LYS  24 -12.588  17.025  17.025
  178   2HB   LYS  24           HB2      LYS  24 -12.763  17.765  17.765
  179   1HG   LYS  24           HG1      LYS  24 -15.062  16.902  16.902
  180   2HG   LYS  24           HG2      LYS  24 -15.064  16.289  16.289
  181   1HD   LYS  24           HD1      LYS  24 -14.678  14.454  14.454
  182   2HD   LYS  24           HD2      LYS  24 -13.291  14.669  14.669
  183   1HE   LYS  24           HE1      LYS  24 -12.603  14.331  14.331
  184   2HE   LYS  24           HE2      LYS  24 -12.095  15.907  15.907
  185   1HZ   LYS  24           HZ1      LYS  24 -14.683  16.118  16.118
  186   2HZ   LYS  24           HZ2      LYS  24 -13.705  15.296  15.296
  187   3HZ   LYS  24           HZ3      LYS  24 -13.244  16.830  16.830
  188    H    GLY  25           HN       GLY  25 -13.010  20.462  20.462
  189   1HA   GLY  25           HA1      GLY  25 -15.362  20.759  20.759
  190   2HA   GLY  25           HA2      GLY  25 -13.891  21.735  21.735
  191    H    GLU  26           HN       GLU  26 -13.755  22.638  22.638
  192    HA   GLU  26           HA       GLU  26 -15.575  24.846  24.846
  193   1HB   GLU  26           HB1      GLU  26 -13.621  23.832  23.832
  194   2HB   GLU  26           HB2      GLU  26 -14.442  25.376  25.376
  195   1HG   GLU  26           HG1      GLU  26 -12.759  24.575  24.575
  196   2HG   GLU  26           HG2      GLU  26 -12.078  25.425  25.425
  197    H    HIS  27           HN       HIS  27 -15.233  22.024  22.024
  198    HA   HIS  27           HA       HIS  27 -17.975  22.421  22.421
  199   1HB   HIS  27           HB1      HIS  27 -15.604  21.169  21.169
  200   2HB   HIS  27           HB2      HIS  27 -17.171  21.586  21.586
  201    HD1  HIS  27           HD1      HIS  27 -17.668  24.299  24.299
  202    HD2  HIS  27           HD2      HIS  27 -13.742  23.175  23.175
  203    HE1  HIS  27           HE1      HIS  27 -16.347  26.340  26.340
  204    HA   PRO  28           HA       PRO  28 -18.145  18.218  18.218
  205   1HB   PRO  28           HB1      PRO  28 -20.101  18.614  18.614
  206   2HB   PRO  28           HB2      PRO  28 -18.457  19.153  19.153
  207   1HG   PRO  28           HG1      PRO  28 -20.734  20.827  20.827
  208   2HG   PRO  28           HG2      PRO  28 -19.799  21.187  21.187
  209   1HD   PRO  28           HD1      PRO  28 -19.054  22.228  22.228
  210   2HD   PRO  28           HD2      PRO  28 -17.812  21.750  21.750
  211    H    GLY  29           HN       GLY  29 -18.835  19.172  19.172
  212   1HA   GLY  29           HA1      GLY  29 -21.572  18.210  18.210
  213   2HA   GLY  29           HA2      GLY  29 -20.833  19.555  19.555
  214    H    LEU  30           HN       LEU  30 -18.180  18.056  18.056
  215    HA   LEU  30           HA       LEU  30 -18.239  16.595  16.595
  216   1HB   LEU  30           HB1      LEU  30 -15.997  16.895  16.895
  217   2HB   LEU  30           HB2      LEU  30 -15.777  16.433  16.433
  218    HG   LEU  30           HG       LEU  30 -16.586  19.097  19.097
  219   1HD1  LEU  30          HD11      LEU  30 -14.136  18.233  18.233
  220   2HD1  LEU  30          HD12      LEU  30 -14.476  19.882  19.882
  221   3HD1  LEU  30          HD13      LEU  30 -14.200  18.641  18.641
  222   1HD2  LEU  30          HD21      LEU  30 -16.383  18.365  18.365
  223   2HD2  LEU  30          HD22      LEU  30 -17.864  18.782  18.782
  224   3HD2  LEU  30          HD23      LEU  30 -16.609  19.985  19.985
  225    H    SER  31           HN       SER  31 -17.209  14.509  14.509
  226    HA   SER  31           HA       SER  31 -17.892  12.641  12.641
  227   1HB   SER  31           HB1      SER  31 -17.795  12.062  12.062
  228   2HB   SER  31           HB2      SER  31 -18.335  10.952  10.952
  229    HG   SER  31           HG       SER  31 -20.188  11.902  11.902
  230    H    ILE  32           HN       ILE  32 -16.467  10.566  10.566
  231    HA   ILE  32           HA       ILE  32 -13.735  11.384  11.384
  232    HB   ILE  32           HB       ILE  32 -14.823   9.416   9.416
  233   1HG1  ILE  32          HG11      ILE  32 -13.017   7.737   7.737
  234   2HG1  ILE  32          HG12      ILE  32 -12.479   8.461   8.461
  235   1HG2  ILE  32          HG21      ILE  32 -14.841   8.174   8.174
  236   2HG2  ILE  32          HG22      ILE  32 -15.219   7.305   7.305
  237   3HG2  ILE  32          HG23      ILE  32 -16.248   8.622   8.622
  238   1HD1  ILE  32          HD11      ILE  32 -12.399   9.813   9.813
  239   2HD1  ILE  32          HD12      ILE  32 -11.024   9.136   9.136
  240   3HD1  ILE  32          HD13      ILE  32 -11.843  10.543  10.543
  241    H    GLY  33           HN       GLY  33 -15.516  11.073  11.073
  242   1HA   GLY  33           HA1      GLY  33 -13.271  10.368  10.368
  243   2HA   GLY  33           HA2      GLY  33 -14.977  10.336  10.336
  244    H    ASP  34           HN       ASP  34 -14.819  13.024  13.024
  245    HA   ASP  34           HA       ASP  34 -14.272  14.770  14.770
  246   1HB   ASP  34           HB1      ASP  34 -15.945  15.062  15.062
  247   2HB   ASP  34           HB2      ASP  34 -15.741  16.420  16.420
  248    H    VAL  35           HN       VAL  35 -13.943  14.429  14.429
  249    HA   VAL  35           HA       VAL  35 -12.139  16.589  16.589
  250    HB   VAL  35           HB       VAL  35 -12.581  13.917  13.917
  251   1HG1  VAL  35          HG11      VAL  35 -11.174  16.403  16.403
  252   2HG1  VAL  35          HG12      VAL  35 -11.547  14.971  14.971
  253   3HG1  VAL  35          HG13      VAL  35 -10.385  14.881  14.881
  254   1HG2  VAL  35          HG21      VAL  35 -13.693  16.676  16.676
  255   2HG2  VAL  35          HG22      VAL  35 -14.595  15.300  15.300
  256   3HG2  VAL  35          HG23      VAL  35 -13.923  15.251  15.251
  257    H    ALA  36           HN       ALA  36 -11.834  13.424  13.424
  258    HA   ALA  36           HA       ALA  36  -8.932  13.352  13.352
  259   1HB   ALA  36           HB1      ALA  36 -10.284  11.356  11.356
  260   2HB   ALA  36           HB2      ALA  36 -10.998  11.473  11.473
  261   3HB   ALA  36           HB3      ALA  36  -9.296  11.059  11.059
  262    H    LYS  37           HN       LYS  37 -11.490  13.490  13.490
  263    HA   LYS  37           HA       LYS  37  -9.635  13.554  13.554
  264   1HB   LYS  37           HB1      LYS  37 -11.943  12.860  12.860
  265   2HB   LYS  37           HB2      LYS  37 -12.527  14.451  14.451
  266   1HG   LYS  37           HG1      LYS  37 -11.452  15.460  15.460
  267   2HG   LYS  37           HG2      LYS  37 -10.707  13.925  13.925
  268   1HD   LYS  37           HD1      LYS  37 -13.024  12.982  12.982
  269   2HD   LYS  37           HD2      LYS  37 -13.695  14.557  14.557
  270   1HE   LYS  37           HE1      LYS  37 -11.783  14.000  14.000
  271   2HE   LYS  37           HE2      LYS  37 -13.516  14.251  14.251
  272   1HZ   LYS  37           HZ1      LYS  37 -12.465  16.372  16.372
  273   2HZ   LYS  37           HZ2      LYS  37 -11.491  16.168  16.168
  274   3HZ   LYS  37           HZ3      LYS  37 -13.165  16.403  16.403
  275    H    LYS  38           HN       LYS  38 -10.979  16.059  16.059
  276    HA   LYS  38           HA       LYS  38 -10.178  18.249  18.249
  277   1HB   LYS  38           HB1      LYS  38 -12.163  18.354  18.354
  278   2HB   LYS  38           HB2      LYS  38 -11.139  18.097  18.097
  279   1HG   LYS  38           HG1      LYS  38 -10.576  20.486  20.486
  280   2HG   LYS  38           HG2      LYS  38 -11.954  20.529  20.529
  281   1HD   LYS  38           HD1      LYS  38 -10.388  19.961  19.961
  282   2HD   LYS  38           HD2      LYS  38  -9.035  20.087  20.087
  283   1HE   LYS  38           HE1      LYS  38  -9.325  22.222  22.222
  284   2HE   LYS  38           HE2      LYS  38  -9.672  22.435  22.435
  285   1HZ   LYS  38           HZ1      LYS  38 -12.037  21.683  21.683
  286   2HZ   LYS  38           HZ2      LYS  38 -11.332  22.945  22.945
  287   3HZ   LYS  38           HZ3      LYS  38 -11.668  23.153  23.153
  288    H    LEU  39           HN       LEU  39  -9.114  17.072  17.072
  289    HA   LEU  39           HA       LEU  39  -6.807  18.797  18.797
  290   1HB   LEU  39           HB1      LEU  39  -7.120  18.306  18.306
  291   2HB   LEU  39           HB2      LEU  39  -8.367  17.184  17.184
  292    HG   LEU  39           HG       LEU  39  -6.434  15.550  15.550
  293   1HD1  LEU  39          HD11      LEU  39  -4.729  17.450  17.450
  294   2HD1  LEU  39          HD12      LEU  39  -5.194  17.658  17.658
  295   3HD1  LEU  39          HD13      LEU  39  -4.412  16.163  16.163
  296   1HD2  LEU  39          HD21      LEU  39  -7.999  15.379  15.379
  297   2HD2  LEU  39          HD22      LEU  39  -6.353  14.982  14.982
  298   3HD2  LEU  39          HD23      LEU  39  -6.994  16.558  16.558
  299    H    GLY  40           HN       GLY  40  -7.467  15.595  15.595
  300   1HA   GLY  40           HA1      GLY  40  -4.745  14.693  14.693
  301   2HA   GLY  40           HA2      GLY  40  -6.093  14.096  14.096
  302    H    GLU  41           HN       GLU  41  -6.858  16.569  16.569
  303    HA   GLU  41           HA       GLU  41  -5.016  16.700  16.700
  304   1HB   GLU  41           HB1      GLU  41  -7.136  18.574  18.574
  305   2HB   GLU  41           HB2      GLU  41  -6.328  18.841  18.841
  306   1HG   GLU  41           HG1      GLU  41  -7.792  16.248  16.248
  307   2HG   GLU  41           HG2      GLU  41  -8.621  17.612  17.612
  308    H    MET  42           HN       MET  42  -5.594  18.782  18.782
  309    HA   MET  42           HA       MET  42  -3.752  20.831  20.831
  310   1HB   MET  42           HB1      MET  42  -4.483  19.539  19.539
  311   2HB   MET  42           HB2      MET  42  -3.681  21.097  21.097
  312   1HG   MET  42           HG1      MET  42  -6.377  20.458  20.458
  313   2HG   MET  42           HG2      MET  42  -6.255  21.170  21.170
  314   1HE   MET  42           HE1      MET  42  -5.890  21.189  21.189
  315   2HE   MET  42           HE2      MET  42  -6.909  22.592  22.592
  316   3HE   MET  42           HE3      MET  42  -5.147  22.697  22.697
  317    H    TRP  43           HN       TRP  43  -3.281  17.789  17.789
  318    HA   TRP  43           HA       TRP  43  -0.594  17.932  17.932
  319   1HB   TRP  43           HB1      TRP  43  -1.899  16.076  16.076
  320   2HB   TRP  43           HB2      TRP  43  -2.315  15.626  15.626
  321    HD1  TRP  43           HD1      TRP  43  -0.751  13.998  13.998
  322    HE1  TRP  43           HE1      TRP  43   1.463  13.045  13.045
  323    HE3  TRP  43           HE3      TRP  43   0.174  16.603  16.603
  324    HZ2  TRP  43           HZ2      TRP  43   3.507  13.267  13.267
  325    HZ3  TRP  43           HZ3      TRP  43   2.208  16.244  16.244
  326    HH2  TRP  43           HH2      TRP  43   3.896  14.576  14.576
  327    H    ASN  44           HN       ASN  44  -1.980  16.857  16.857
  328    HA   ASN  44           HA       ASN  44   0.486  16.296  16.296
  329   1HB   ASN  44           HB1      ASN  44  -2.187  17.090  17.090
  330   2HB   ASN  44           HB2      ASN  44  -0.834  16.353  16.353
  331   1HD2  ASN  44          HD21      ASN  44  -3.356  13.913  13.913
  332   2HD2  ASN  44          HD22      ASN  44  -3.722  15.493  15.493
  333    H    ASN  45           HN       ASN  45  -0.781  19.206  19.206
  334    HA   ASN  45           HA       ASN  45   1.153  20.761  20.761
  335   1HB   ASN  45           HB1      ASN  45  -1.535  21.956  21.956
  336   2HB   ASN  45           HB2      ASN  45  -0.450  22.437  22.437
  337   1HD2  ASN  45          HD21      ASN  45  -3.435  19.883  19.883
  338   2HD2  ASN  45          HD22      ASN  45  -3.248  20.786  20.786
  339    H    THR  46           HN       THR  46   1.336  19.774  19.774
  340    HA   THR  46           HA       THR  46   0.797  22.069  22.069
  341    HB   THR  46           HB       THR  46   0.950  19.710  19.710
  342    HG1  THR  46           HG1      THR  46   2.957  20.900  20.900
  343   1HG2  THR  46          HG21      THR  46   3.075  18.919  18.919
  344   2HG2  THR  46          HG22      THR  46   3.999  20.049  20.049
  345   3HG2  THR  46          HG23      THR  46   3.135  18.737  18.737
  346    H    ALA  47           HN       ALA  47   3.669  20.732  20.732
  347    HA   ALA  47           HA       ALA  47   4.956  23.134  23.134
  348   1HB   ALA  47           HB1      ALA  47   5.980  21.961  21.961
  349   2HB   ALA  47           HB2      ALA  47   6.768  23.250  23.250
  350   3HB   ALA  47           HB3      ALA  47   5.216  23.531  23.531
  351    H    ALA  48           HN       ALA  48   5.517  19.993  19.993
  352    HA   ALA  48           HA       ALA  48   6.439  18.032  18.032
  353   1HB   ALA  48           HB1      ALA  48   6.275  18.977  18.977
  354   2HB   ALA  48           HB2      ALA  48   7.804  19.815  19.815
  355   3HB   ALA  48           HB3      ALA  48   7.747  18.068  18.068
  356    H    ASP  49           HN       ASP  49   7.614  20.828  20.828
  357    HA   ASP  49           HA       ASP  49  10.318  19.957  19.957
  358   1HB   ASP  49           HB1      ASP  49  10.355  22.025  22.025
  359   2HB   ASP  49           HB2      ASP  49   8.975  22.666  22.666
  360    H    ASP  50           HN       ASP  50   7.153  20.494  20.494
  361    HA   ASP  50           HA       ASP  50   7.725  20.693  20.693
  362   1HB   ASP  50           HB1      ASP  50   6.260  22.465  22.465
  363   2HB   ASP  50           HB2      ASP  50   5.088  21.190  21.190
  364    H    LYS  51           HN       LYS  51   7.089  18.569  18.569
  365    HA   LYS  51           HA       LYS  51   5.292  16.746  16.746
  366   1HB   LYS  51           HB1      LYS  51   6.835  16.353  16.353
  367   2HB   LYS  51           HB2      LYS  51   5.778  15.153  15.153
  368   1HG   LYS  51           HG1      LYS  51   3.857  16.716  16.716
  369   2HG   LYS  51           HG2      LYS  51   4.960  17.839  17.839
  370   1HD   LYS  51           HD1      LYS  51   5.547  16.104  16.104
  371   2HD   LYS  51           HD2      LYS  51   4.495  14.953  14.953
  372   1HE   LYS  51           HE1      LYS  51   2.541  16.238  16.238
  373   2HE   LYS  51           HE2      LYS  51   3.488  17.571  17.571
  374   1HZ   LYS  51           HZ1      LYS  51   4.228  15.184  15.184
  375   2HZ   LYS  51           HZ2      LYS  51   2.533  15.310  15.310
  376   3HZ   LYS  51           HZ3      LYS  51   3.490  16.561  16.561
  377    H    GLN  52           HN       GLN  52   8.516  16.947  16.947
  378    HA   GLN  52           HA       GLN  52   9.911  14.811  14.811
  379   1HB   GLN  52           HB1      GLN  52  10.611  17.476  17.476
  380   2HB   GLN  52           HB2      GLN  52  11.171  17.206  17.206
  381   1HG   GLN  52           HG1      GLN  52  13.012  16.727  16.727
  382   2HG   GLN  52           HG2      GLN  52  12.461  15.194  15.194
  383   1HE2  GLN  52          HE21      GLN  52  10.767  15.307  15.307
  384   2HE2  GLN  52          HE22      GLN  52  10.135  16.123  16.123
  385    HA   PRO  53           HA       PRO  53  10.373  15.294  15.294
  386   1HB   PRO  53           HB1      PRO  53   8.182  16.612  16.612
  387   2HB   PRO  53           HB2      PRO  53   9.760  17.336  17.336
  388   1HG   PRO  53           HG1      PRO  53   7.325  17.366  17.366
  389   2HG   PRO  53           HG2      PRO  53   8.287  18.744  18.744
  390   1HD   PRO  53           HD1      PRO  53   8.895  17.751  17.751
  391   2HD   PRO  53           HD2      PRO  53  10.244  17.986  17.986
  392    H    TYR  54           HN       TYR  54   7.077  15.331  15.331
  393    HA   TYR  54           HA       TYR  54   6.148  13.150  13.150
  394   1HB   TYR  54           HB1      TYR  54   4.964  14.375  14.375
  395   2HB   TYR  54           HB2      TYR  54   4.118  13.248  13.248
  396    HD1  TYR  54           HD1      TYR  54   4.479  14.126  14.126
  397    HD2  TYR  54           HD2      TYR  54   4.253  16.556  16.556
  398    HE1  TYR  54           HE1      TYR  54   3.748  16.021  16.021
  399    HE2  TYR  54           HE2      TYR  54   3.519  18.451  18.451
  400    HH   TYR  54           HH       TYR  54   3.952  18.867  18.867
  401    H    GLU  55           HN       GLU  55   6.804  13.512  13.512
  402    HA   GLU  55           HA       GLU  55   6.381  10.952  10.952
  403   1HB   GLU  55           HB1      GLU  55   7.684  13.367  13.367
  404   2HB   GLU  55           HB2      GLU  55   8.804  12.082  12.082
  405   1HG   GLU  55           HG1      GLU  55   6.881  10.857  10.857
  406   2HG   GLU  55           HG2      GLU  55   5.886  12.272  12.272
  407    H    LYS  56           HN       LYS  56   9.505  12.096  12.096
  408    HA   LYS  56           HA       LYS  56  11.065   9.886   9.886
  409   1HB   LYS  56           HB1      LYS  56  11.714  12.114  12.114
  410   2HB   LYS  56           HB2      LYS  56  10.897  11.692  11.692
  411   1HG   LYS  56           HG1      LYS  56  12.460   9.775   9.775
  412   2HG   LYS  56           HG2      LYS  56  13.246  10.164  10.164
  413   1HD   LYS  56           HD1      LYS  56  13.494  12.588  12.588
  414   2HD   LYS  56           HD2      LYS  56  13.312  11.603  11.603
  415   1HE   LYS  56           HE1      LYS  56  15.705  11.826  11.826
  416   2HE   LYS  56           HE2      LYS  56  15.209  10.150  10.150
  417   1HZ   LYS  56           HZ1      LYS  56  14.729  11.523  11.523
  418   2HZ   LYS  56           HZ2      LYS  56  16.316  11.867  11.867
  419   3HZ   LYS  56           HZ3      LYS  56  15.820  10.255  10.255
  420    H    LYS  57           HN       LYS  57   8.622  10.348  10.348
  421    HA   LYS  57           HA       LYS  57   9.330   7.884   7.884
  422   1HB   LYS  57           HB1      LYS  57   8.061  10.013  10.013
  423   2HB   LYS  57           HB2      LYS  57   6.628   9.281   9.281
  424   1HG   LYS  57           HG1      LYS  57   7.125   7.170   7.170
  425   2HG   LYS  57           HG2      LYS  57   8.505   7.983   7.983
  426   1HD   LYS  57           HD1      LYS  57   6.919   9.747   9.747
  427   2HD   LYS  57           HD2      LYS  57   5.584   8.771   8.771
  428   1HE   LYS  57           HE1      LYS  57   6.419   6.842   6.842
  429   2HE   LYS  57           HE2      LYS  57   7.678   7.888   7.888
  430   1HZ   LYS  57           HZ1      LYS  57   5.222   9.199   9.199
  431   2HZ   LYS  57           HZ2      LYS  57   5.057   7.628   7.628
  432   3HZ   LYS  57           HZ3      LYS  57   6.271   8.655   8.655
  433    H    ALA  58           HN       ALA  58   6.620   8.926   8.926
  434    HA   ALA  58           HA       ALA  58   5.154   6.601   6.601
  435   1HB   ALA  58           HB1      ALA  58   4.582   8.731   8.731
  436   2HB   ALA  58           HB2      ALA  58   5.903   8.517   8.517
  437   3HB   ALA  58           HB3      ALA  58   4.545   7.410   7.410
  438    H    ALA  59           HN       ALA  59   7.983   7.495   7.495
  439    HA   ALA  59           HA       ALA  59   8.270   5.289   5.289
  440   1HB   ALA  59           HB1      ALA  59   9.690   7.326   7.326
  441   2HB   ALA  59           HB2      ALA  59  10.478   6.871   6.871
  442   3HB   ALA  59           HB3      ALA  59  10.697   5.890   5.890
  443    H    LYS  60           HN       LYS  60  10.029   5.694   5.694
  444    HA   LYS  60           HA       LYS  60  11.180   3.267   3.267
  445   1HB   LYS  60           HB1      LYS  60  11.028   5.421   5.421
  446   2HB   LYS  60           HB2      LYS  60   9.666   4.617   4.617
  447   1HG   LYS  60           HG1      LYS  60  11.562   4.062   4.062
  448   2HG   LYS  60           HG2      LYS  60  11.222   2.617   2.617
  449   1HD   LYS  60           HD1      LYS  60  13.035   3.111   3.111
  450   2HD   LYS  60           HD2      LYS  60  13.275   4.707   4.707
  451   1HE   LYS  60           HE1      LYS  60  15.015   3.201   3.201
  452   2HE   LYS  60           HE2      LYS  60  13.950   3.617   3.617
  453   1HZ   LYS  60           HZ1      LYS  60  12.930   1.353   1.353
  454   2HZ   LYS  60           HZ2      LYS  60  14.581   1.099   1.099
  455   3HZ   LYS  60           HZ3      LYS  60  13.534   1.495   1.495
  456    H    LEU  61           HN       LEU  61   7.867   4.066   4.066
  457    HA   LEU  61           HA       LEU  61   7.122   1.460   1.460
  458   1HB   LEU  61           HB1      LEU  61   5.364   3.662   3.662
  459   2HB   LEU  61           HB2      LEU  61   4.833   2.375   2.375
  460    HG   LEU  61           HG       LEU  61   6.893   4.543   4.543
  461   1HD1  LEU  61          HD11      LEU  61   4.065   4.107   4.107
  462   2HD1  LEU  61          HD12      LEU  61   5.182   5.343   5.343
  463   3HD1  LEU  61          HD13      LEU  61   4.615   5.380   5.380
  464   1HD2  LEU  61          HD21      LEU  61   5.808   2.313   2.313
  465   2HD2  LEU  61          HD22      LEU  61   7.453   2.417   2.417
  466   3HD2  LEU  61          HD23      LEU  61   6.869   3.620   3.620
  467    H    LYS  62           HN       LYS  62   6.372   2.951   2.951
  468    HA   LYS  62           HA       LYS  62   5.057   0.788   0.788
  469   1HB   LYS  62           HB1      LYS  62   7.110   2.709   2.709
  470   2HB   LYS  62           HB2      LYS  62   6.073   1.660   1.660
  471   1HG   LYS  62           HG1      LYS  62   4.987   3.697   3.697
  472   2HG   LYS  62           HG2      LYS  62   5.271   4.099   4.099
  473   1HD   LYS  62           HD1      LYS  62   3.634   1.623   1.623
  474   2HD   LYS  62           HD2      LYS  62   2.896   3.104   3.104
  475   1HE   LYS  62           HE1      LYS  62   2.265   2.617   2.617
  476   2HE   LYS  62           HE2      LYS  62   3.176   4.114   4.114
  477   1HZ   LYS  62           HZ1      LYS  62   4.969   1.988   1.988
  478   2HZ   LYS  62           HZ2      LYS  62   3.724   1.857   1.857
  479   3HZ   LYS  62           HZ3      LYS  62   4.627   3.290   3.290
  480    H    GLU  63           HN       GLU  63   8.428   1.451   1.451
  481    HA   GLU  63           HA       GLU  63   9.568  -0.746  -0.746
  482   1HB   GLU  63           HB1      GLU  63  10.427   1.523   1.523
  483   2HB   GLU  63           HB2      GLU  63  11.106   0.148   0.148
  484   1HG   GLU  63           HG1      GLU  63  12.163  -0.590  -0.590
  485   2HG   GLU  63           HG2      GLU  63  11.424   0.784   0.784
  486    H    LYS  64           HN       LYS  64   8.838  -0.324  -0.324
  487    HA   LYS  64           HA       LYS  64   9.574  -2.827  -2.827
  488   1HB   LYS  64           HB1      LYS  64   7.170  -1.092  -1.092
  489   2HB   LYS  64           HB2      LYS  64   7.550  -2.559  -2.559
  490   1HG   LYS  64           HG1      LYS  64   9.544  -0.286  -0.286
  491   2HG   LYS  64           HG2      LYS  64   8.458  -0.431  -0.431
  492   1HD   LYS  64           HD1      LYS  64   9.415  -2.721  -2.721
  493   2HD   LYS  64           HD2      LYS  64  10.565  -2.493  -2.493
  494   1HE   LYS  64           HE1      LYS  64  10.340  -0.701  -0.701
  495   2HE   LYS  64           HE2      LYS  64  11.573  -1.928  -1.928
  496   1HZ   LYS  64           HZ1      LYS  64  11.501  -0.281  -0.281
  497   2HZ   LYS  64           HZ2      LYS  64  11.559   0.711   0.711
  498   3HZ   LYS  64           HZ3      LYS  64  12.747  -0.477  -0.477
  499    H    TYR  65           HN       TYR  65   6.393  -1.982  -1.982
  500    HA   TYR  65           HA       TYR  65   5.058  -4.404  -4.404
  501   1HB   TYR  65           HB1      TYR  65   3.892  -2.477  -2.477
  502   2HB   TYR  65           HB2      TYR  65   5.067  -2.190  -2.190
  503    HD1  TYR  65           HD1      TYR  65   3.894  -5.650  -5.650
  504    HD2  TYR  65           HD2      TYR  65   3.013  -1.800  -1.800
  505    HE1  TYR  65           HE1      TYR  65   2.396  -6.666  -6.666
  506    HE2  TYR  65           HE2      TYR  65   1.514  -2.823  -2.823
  507    HH   TYR  65           HH       TYR  65   0.151  -5.505  -5.505
  508    H    GLU  66           HN       GLU  66   6.797  -3.325  -3.325
  509    HA   GLU  66           HA       GLU  66   6.689  -5.690  -5.690
  510   1HB   GLU  66           HB1      GLU  66   8.996  -3.776  -3.776
  511   2HB   GLU  66           HB2      GLU  66   8.693  -4.928  -4.928
  512   1HG   GLU  66           HG1      GLU  66   6.230  -3.466  -3.466
  513   2HG   GLU  66           HG2      GLU  66   7.507  -2.269  -2.269
  514    H    LYS  67           HN       LYS  67   8.718  -5.117  -5.117
  515    HA   LYS  67           HA       LYS  67  10.441  -7.437  -7.437
  516   1HB   LYS  67           HB1      LYS  67  10.523  -5.139  -5.139
  517   2HB   LYS  67           HB2      LYS  67  11.340  -6.610  -6.610
  518   1HG   LYS  67           HG1      LYS  67  12.932  -5.256  -5.256
  519   2HG   LYS  67           HG2      LYS  67  12.573  -6.579  -6.579
  520   1HD   LYS  67           HD1      LYS  67  11.053  -5.033  -5.033
  521   2HD   LYS  67           HD2      LYS  67  11.527  -3.723  -3.723
  522   1HE   LYS  67           HE1      LYS  67  13.443  -5.336  -5.336
  523   2HE   LYS  67           HE2      LYS  67  12.878  -3.713  -3.713
  524   1HZ   LYS  67           HZ1      LYS  67  13.874  -3.734  -3.734
  525   2HZ   LYS  67           HZ2      LYS  67  15.020  -4.480  -4.480
  526   3HZ   LYS  67           HZ3      LYS  67  14.477  -2.911  -2.911
  527    H    ASP  68           HN       ASP  68   7.843  -6.567  -6.567
  528    HA   ASP  68           HA       ASP  68   7.956  -8.799  -8.799
  529   1HB   ASP  68           HB1      ASP  68   6.032  -6.506  -6.506
  530   2HB   ASP  68           HB2      ASP  68   5.619  -7.841  -7.841
  531    H    ILE  69           HN       ILE  69   6.650  -7.944  -7.944
  532    HA   ILE  69           HA       ILE  69   4.689 -10.148 -10.148
  533    HB   ILE  69           HB       ILE  69   4.097  -8.072  -8.072
  534   1HG1  ILE  69          HG11      ILE  69   3.407  -9.022  -9.022
  535   2HG1  ILE  69          HG12      ILE  69   4.702 -10.215 -10.215
  536   1HG2  ILE  69          HG21      ILE  69   6.383  -7.450  -7.450
  537   2HG2  ILE  69          HG22      ILE  69   6.433  -8.720  -8.720
  538   3HG2  ILE  69          HG23      ILE  69   5.290  -7.399  -7.399
  539   1HD1  ILE  69          HD11      ILE  69   2.466 -10.070 -10.070
  540   2HD1  ILE  69          HD12      ILE  69   2.524 -11.213 -11.213
  541   3HD1  ILE  69          HD13      ILE  69   3.722 -11.301 -11.301
  542    H    ALA  70           HN       ALA  70   7.660  -9.184  -9.184
  543    HA   ALA  70           HA       ALA  70   8.268 -11.509 -11.509
  544   1HB   ALA  70           HB1      ALA  70  10.210  -9.607  -9.607
  545   2HB   ALA  70           HB2      ALA  70  10.664 -10.717 -10.717
  546   3HB   ALA  70           HB3      ALA  70   9.595  -9.374  -9.374
  547    H    ALA  71           HN       ALA  71   8.392 -10.772 -10.772
  548    HA   ALA  71           HA       ALA  71   9.920 -13.145 -13.145
  549   1HB   ALA  71           HB1      ALA  71   8.542 -11.010 -11.010
  550   2HB   ALA  71           HB2      ALA  71   9.590 -12.265 -12.265
  551   3HB   ALA  71           HB3      ALA  71  10.248 -11.031 -11.031
  552    H    TYR  72           HN       TYR  72   6.661 -11.910 -11.910
  553    HA   TYR  72           HA       TYR  72   5.337 -13.869 -13.869
  554   1HB   TYR  72           HB1      TYR  72   4.279 -11.804 -11.804
  555   2HB   TYR  72           HB2      TYR  72   4.416 -12.212 -12.212
  556    HD1  TYR  72           HD1      TYR  72   3.344 -14.962 -14.962
  557    HD2  TYR  72           HD2      TYR  72   2.024 -11.614 -11.614
  558    HE1  TYR  72           HE1      TYR  72   1.071 -15.866 -15.866
  559    HE2  TYR  72           HE2      TYR  72  -0.248 -12.523 -12.523
  560    HH   TYR  72           HH       TYR  72  -1.136 -15.256 -15.256
  561    H    ARG  73           HN       ARG  73   5.892 -13.641 -13.641
  562    HA   ARG  73           HA       ARG  73   4.738 -16.199 -16.199
  563   1HB   ARG  73           HB1      ARG  73   6.576 -14.353 -14.353
  564   2HB   ARG  73           HB2      ARG  73   5.700 -15.706 -15.706
  565   1HG   ARG  73           HG1      ARG  73   3.545 -14.604 -14.604
  566   2HG   ARG  73           HG2      ARG  73   4.454 -13.227 -13.227
  567   1HD   ARG  73           HD1      ARG  73   5.421 -12.943 -12.943
  568   2HD   ARG  73           HD2      ARG  73   4.353 -14.234 -14.234
  569    HE   ARG  73           HE       ARG  73   3.420 -11.625 -11.625
  570   1HH1  ARG  73          HH11      ARG  73   1.055 -12.548 -12.548
  571   2HH1  ARG  73          HH12      ARG  73   0.359 -12.883 -12.883
  572   1HH2  ARG  73          HH21      ARG  73   3.475 -12.862 -12.862
  573   2HH2  ARG  73          HH22      ARG  73   1.771 -13.065 -13.065
  574    H    ALA  74           HN       ALA  74   7.843 -14.898 -14.898
  575    HA   ALA  74           HA       ALA  74   9.783 -16.593 -16.593
  576   1HB   ALA  74           HB1      ALA  74  10.223 -14.822 -14.822
  577   2HB   ALA  74           HB2      ALA  74   9.516 -15.816 -15.816
  578   3HB   ALA  74           HB3      ALA  74  10.993 -16.318 -16.318
  579    H    LYS  75           HN       LYS  75   7.633 -17.373 -17.373
  580    HA   LYS  75           HA       LYS  75   6.822 -19.842 -19.842
  581   1HB   LYS  75           HB1      LYS  75   8.971 -20.878 -20.878
  582   2HB   LYS  75           HB2      LYS  75   9.812 -20.164 -20.164
  583   1HG   LYS  75           HG1      LYS  75   8.413 -21.617 -21.617
  584   2HG   LYS  75           HG2      LYS  75   7.560 -22.230 -22.230
  585   1HD   LYS  75           HD1      LYS  75   9.519 -23.366 -23.366
  586   2HD   LYS  75           HD2      LYS  75  10.582 -22.470 -22.470
  587   1HE   LYS  75           HE1      LYS  75  10.141 -24.805 -24.805
  588   2HE   LYS  75           HE2      LYS  75   9.612 -23.593 -23.593
  589   1HZ   LYS  75           HZ1      LYS  75   7.505 -24.135 -24.135
  590   2HZ   LYS  75           HZ2      LYS  75   8.117 -25.609 -25.609
  591   3HZ   LYS  75           HZ3      LYS  75   7.593 -24.421 -24.421
  592    H    GLY  76           HN       GLY  76   5.660 -18.455 -18.455
  593   1HA   GLY  76           HA1      GLY  76   6.498 -18.648 -18.648
  594   2HA   GLY  76           HA2      GLY  76   5.666 -17.230 -17.230
  595    H    LYS  77           HN       LYS  77   3.544 -17.558 -17.558
  596    HA   LYS  77           HA       LYS  77   1.313 -18.188 -18.188
  597   1HB   LYS  77           HB1      LYS  77   2.626 -20.962 -20.962
  598   2HB   LYS  77           HB2      LYS  77   0.946 -20.682 -20.682
  599   1HG   LYS  77           HG1      LYS  77   1.738 -19.048 -19.048
  600   2HG   LYS  77           HG2      LYS  77   3.356 -19.647 -19.647
  601   1HD   LYS  77           HD1      LYS  77   2.499 -20.864 -20.864
  602   2HD   LYS  77           HD2      LYS  77   2.545 -21.982 -21.982
  603   1HE   LYS  77           HE1      LYS  77   0.109 -21.688 -21.688
  604   2HE   LYS  77           HE2      LYS  77   0.049 -20.467 -20.467
  605   1HZ   LYS  77           HZ1      LYS  77   1.272 -22.772 -22.772
  606   2HZ   LYS  77           HZ2      LYS  77  -0.176 -23.226 -23.226
  607   3HZ   LYS  77           HZ3      LYS  77  -0.194 -22.051 -22.051
  608    HA   PRO  78           HA       PRO  78   0.659 -19.710 -19.710
  609   1HB   PRO  78           HB1      PRO  78  -1.880 -20.585 -20.585
  610   2HB   PRO  78           HB2      PRO  78  -1.562 -18.882 -18.882
  611   1HG   PRO  78           HG1      PRO  78  -2.068 -21.164 -21.164
  612   2HG   PRO  78           HG2      PRO  78  -2.858 -19.593 -19.593
  613   1HD   PRO  78           HD1      PRO  78  -0.696 -20.087 -20.087
  614   2HD   PRO  78           HD2      PRO  78  -1.021 -18.471 -18.471
  615    H    ASP  79           HN       ASP  79   2.020 -21.315 -21.315
  616    HA   ASP  79           HA       ASP  79   1.596 -24.024 -24.024
  617   1HB   ASP  79           HB1      ASP  79   2.091 -23.449 -23.449
  618   2HB   ASP  79           HB2      ASP  79   1.886 -25.032 -25.032
  619    H    ALA  80           HN       ALA  80   3.291 -22.344 -22.344
  620    HA   ALA  80           HA       ALA  80   6.000 -22.919 -22.919
  621   1HB   ALA  80           HB1      ALA  80   5.420 -20.519 -20.519
  622   2HB   ALA  80           HB2      ALA  80   5.095 -20.776 -20.776
  623   3HB   ALA  80           HB3      ALA  80   6.729 -20.965 -20.965
  624    H    ALA  81           HN       ALA  81   6.582 -24.783 -24.783
  625    HA   ALA  81           HA       ALA  81   6.357 -25.258 -25.258
  626   1HB   ALA  81           HB1      ALA  81   5.204 -26.909 -26.909
  627   2HB   ALA  81           HB2      ALA  81   6.701 -27.220 -27.220
  628   3HB   ALA  81           HB3      ALA  81   6.556 -27.667 -27.667
  629   1H1   BME  16           HE1      MER  16  -8.335   9.917   9.917
  630   2H1   BME  16           HE2      MER  16  -7.291   9.453   9.453
  631   1H2   BME  16           HZ1      MER  16  -6.310   8.639   8.639
  632   2H2   BME  16           HZ2      MER  16  -5.298   9.791   9.791
  633    HO1  BME  16           HH       MER  16  -6.383  11.736  11.736

  Start of MODEL   22
    1    H    ASN   3           HN       ASN   3  -2.689 -10.462 -10.462
    2    HA   ASN   3           HA       ASN   3   0.092  -9.487  -9.487
    3   1HB   ASN   3           HB1      ASN   3   0.645 -11.740 -11.740
    4   2HB   ASN   3           HB2      ASN   3   0.026 -11.831 -11.831
    5   1HD2  ASN   3          HD21      ASN   3  -3.177 -12.903 -12.903
    6   2HD2  ASN   3          HD22      ASN   3  -2.757 -11.294 -11.294
    7    H    ALA   4           HN       ALA   4   0.787 -10.200 -10.200
    8    HA   ALA   4           HA       ALA   4   0.578  -9.858  -9.858
    9   1HB   ALA   4           HB1      ALA   4  -1.445 -11.315 -11.315
   10   2HB   ALA   4           HB2      ALA   4  -2.455  -9.927  -9.927
   11   3HB   ALA   4           HB3      ALA   4  -1.622 -10.009 -10.009
   12    HA   PRO   5           HA       PRO   5   0.251  -5.536  -5.536
   13   1HB   PRO   5           HB1      PRO   5   2.719  -5.273  -5.273
   14   2HB   PRO   5           HB2      PRO   5   2.440  -4.772  -4.772
   15   1HG   PRO   5           HG1      PRO   5   3.946  -6.955  -6.955
   16   2HG   PRO   5           HG2      PRO   5   2.751  -6.973  -6.973
   17   1HD   PRO   5           HD1      PRO   5   2.399  -8.092  -8.092
   18   2HD   PRO   5           HD2      PRO   5   2.121  -8.916  -8.916
   19    H    LYS   6           HN       LYS   6  -1.372  -4.722  -4.722
   20    HA   LYS   6           HA       LYS   6  -2.045  -4.926  -4.926
   21   1HB   LYS   6           HB1      LYS   6  -2.886  -2.867  -2.867
   22   2HB   LYS   6           HB2      LYS   6  -3.719  -3.104  -3.104
   23   1HG   LYS   6           HG1      LYS   6  -4.353  -5.357  -5.357
   24   2HG   LYS   6           HG2      LYS   6  -3.301  -5.393  -5.393
   25   1HD   LYS   6           HD1      LYS   6  -4.678  -3.597  -3.597
   26   2HD   LYS   6           HD2      LYS   6  -5.750  -3.610  -3.610
   27   1HE   LYS   6           HE1      LYS   6  -6.375  -5.937  -5.937
   28   2HE   LYS   6           HE2      LYS   6  -5.191  -6.065  -6.065
   29   1HZ   LYS   6           HZ1      LYS   6  -6.820  -3.846  -3.846
   30   2HZ   LYS   6           HZ2      LYS   6  -7.816  -5.180  -5.180
   31   3HZ   LYS   6           HZ3      LYS   6  -6.660  -5.275  -5.275
   32    H    ARG   7           HN       ARG   7  -2.649  -2.483  -2.483
   33    HA   ARG   7           HA       ARG   7   0.060  -1.583  -1.583
   34   1HB   ARG   7           HB1      ARG   7  -2.074  -0.083  -0.083
   35   2HB   ARG   7           HB2      ARG   7  -0.726  -0.979  -0.979
   36   1HG   ARG   7           HG1      ARG   7  -2.503  -2.197  -2.197
   37   2HG   ARG   7           HG2      ARG   7  -2.159  -3.122  -3.122
   38   1HD   ARG   7           HD1      ARG   7  -3.981  -1.775  -1.775
   39   2HD   ARG   7           HD2      ARG   7  -4.320  -0.994  -0.994
   40    HE   ARG   7           HE       ARG   7  -4.617  -3.941  -3.941
   41   1HH1  ARG   7          HH11      ARG   7  -5.034  -4.189  -4.189
   42   2HH1  ARG   7          HH12      ARG   7  -6.539  -3.460  -3.460
   43   1HH2  ARG   7          HH21      ARG   7  -6.736  -1.565  -1.565
   44   2HH2  ARG   7          HH22      ARG   7  -7.527  -1.939  -1.939
   45    HA   PRO   8           HA       PRO   8  -0.490   1.581   1.581
   46   1HB   PRO   8           HB1      PRO   8   2.001   2.756   2.756
   47   2HB   PRO   8           HB2      PRO   8   1.763   1.160   1.160
   48   1HG   PRO   8           HG1      PRO   8   2.440   1.847   1.847
   49   2HG   PRO   8           HG2      PRO   8   3.338   0.790   0.790
   50   1HD   PRO   8           HD1      PRO   8   1.572  -0.281  -0.281
   51   2HD   PRO   8           HD2      PRO   8   1.592  -0.880  -0.880
   52    HA   PRO   9           HA       PRO   9  -1.168   5.944   5.944
   53   1HB   PRO   9           HB1      PRO   9   1.685   6.033   6.033
   54   2HB   PRO   9           HB2      PRO   9   0.513   7.349   7.349
   55   1HG   PRO   9           HG1      PRO   9   0.604   5.869   5.869
   56   2HG   PRO   9           HG2      PRO   9  -0.997   6.145   6.145
   57   1HD   PRO   9           HD1      PRO   9   0.708   3.661   3.661
   58   2HD   PRO   9           HD2      PRO   9  -1.062   3.788   3.788
   59    H    SER  10           HN       SER  10  -0.092   7.738   7.738
   60    HA   SER  10           HA       SER  10   1.010   6.628   6.628
   61   1HB   SER  10           HB1      SER  10  -0.845   9.008   9.008
   62   2HB   SER  10           HB2      SER  10  -0.225   8.446   8.446
   63    HG   SER  10           HG       SER  10  -1.739   7.017   7.017
   64    H    ALA  11           HN       ALA  11   0.905   9.632   9.632
   65    HA   ALA  11           HA       ALA  11   3.443  10.468  10.468
   66   1HB   ALA  11           HB1      ALA  11   2.573  11.366  11.366
   67   2HB   ALA  11           HB2      ALA  11   4.006  11.928  11.928
   68   3HB   ALA  11           HB3      ALA  11   3.922  10.276  10.276
   69    H    PHE  12           HN       PHE  12   0.691  11.173  11.173
   70    HA   PHE  12           HA       PHE  12  -0.105  13.758  13.758
   71   1HB   PHE  12           HB1      PHE  12  -0.953  12.831  12.831
   72   2HB   PHE  12           HB2      PHE  12  -1.259  11.255  11.255
   73    HD1  PHE  12           HD1      PHE  12  -3.014  13.403  13.403
   74    HD2  PHE  12           HD2      PHE  12  -3.059  11.934  11.934
   75    HE1  PHE  12           HE1      PHE  12  -5.427  13.753  13.753
   76    HE2  PHE  12           HE2      PHE  12  -5.480  12.300  12.300
   77    HZ   PHE  12           HZ       PHE  12  -6.674  13.205  13.205
   78    H    PHE  13           HN       PHE  13  -0.704  10.476  10.476
   79    HA   PHE  13           HA       PHE  13  -2.591  10.893  10.893
   80   1HB   PHE  13           HB1      PHE  13  -1.407   8.707   8.707
   81   2HB   PHE  13           HB2      PHE  13  -0.154   9.198   9.198
   82    HD1  PHE  13           HD1      PHE  13  -3.799   8.585   8.585
   83    HD2  PHE  13           HD2      PHE  13  -0.578   9.018   9.018
   84    HE1  PHE  13           HE1      PHE  13  -5.284   7.914   7.914
   85    HE2  PHE  13           HE2      PHE  13  -2.062   8.333   8.333
   86    HZ   PHE  13           HZ       PHE  13  -4.415   7.785   7.785
   87    H    LEU  14           HN       LEU  14   0.912  11.343  11.343
   88    HA   LEU  14           HA       LEU  14   0.754  12.047  12.047
   89   1HB   LEU  14           HB1      LEU  14   2.619  13.227  13.227
   90   2HB   LEU  14           HB2      LEU  14   2.902  13.298  13.298
   91    HG   LEU  14           HG       LEU  14   4.366  11.612  11.612
   92   1HD1  LEU  14          HD11      LEU  14   3.124  10.604  10.604
   93   2HD1  LEU  14          HD12      LEU  14   1.946   9.918   9.918
   94   3HD1  LEU  14          HD13      LEU  14   3.616   9.389   9.389
   95   1HD2  LEU  14          HD21      LEU  14   3.792  11.443  11.443
   96   2HD2  LEU  14          HD22      LEU  14   3.980   9.842   9.842
   97   3HD2  LEU  14          HD23      LEU  14   2.378  10.457  10.457
   98    H    PHE  15           HN       PHE  15   0.814  14.148  14.148
   99    HA   PHE  15           HA       PHE  15   0.231  16.643  16.643
  100   1HB   PHE  15           HB1      PHE  15   1.008  16.708  16.708
  101   2HB   PHE  15           HB2      PHE  15   0.140  15.218  15.218
  102    HD1  PHE  15           HD1      PHE  15  -0.119  18.905  18.905
  103    HD2  PHE  15           HD2      PHE  15  -1.956  15.261  15.261
  104    HE1  PHE  15           HE1      PHE  15  -1.723  20.172  20.172
  105    HE2  PHE  15           HE2      PHE  15  -3.547  16.534  16.534
  106    HZ   PHE  15           HZ       PHE  15  -3.425  18.976  18.976
  107    H    CYS  16           HN       MER  16  -2.082  14.408  14.408
  108    HA   CYS  16           HA       MER  16  -4.477  15.715  15.715
  109   1HB   CYS  16           HB1      MER  16  -5.615  13.633  13.633
  110   2HB   CYS  16           HB2      MER  16  -4.174  13.453  13.453
  111    H    SER  17           HN       SER  17  -2.963  13.319  13.319
  112    HA   SER  17           HA       SER  17  -4.748  13.326  13.326
  113   1HB   SER  17           HB1      SER  17  -1.694  13.170  13.170
  114   2HB   SER  17           HB2      SER  17  -2.817  12.683  12.683
  115    HG   SER  17           HG       SER  17  -3.033  10.887  10.887
  116    H    GLU  18           HN       GLU  18  -1.897  15.295  15.295
  117    HA   GLU  18           HA       GLU  18  -1.828  16.870  16.870
  118   1HB   GLU  18           HB1      GLU  18  -0.366  16.999  16.999
  119   2HB   GLU  18           HB2      GLU  18  -1.605  17.990  17.990
  120   1HG   GLU  18           HG1      GLU  18  -1.435  19.654  19.654
  121   2HG   GLU  18           HG2      GLU  18  -0.141  18.709  18.709
  122    H    TYR  19           HN       TYR  19  -3.955  17.521  17.521
  123    HA   TYR  19           HA       TYR  19  -5.740  19.012  19.012
  124   1HB   TYR  19           HB1      TYR  19  -5.760  20.965  20.965
  125   2HB   TYR  19           HB2      TYR  19  -4.052  20.537  20.537
  126    HD1  TYR  19           HD1      TYR  19  -3.624  18.428  18.428
  127    HD2  TYR  19           HD2      TYR  19  -5.804  22.081  22.081
  128    HE1  TYR  19           HE1      TYR  19  -3.317  18.594  18.594
  129    HE2  TYR  19           HE2      TYR  19  -5.494  22.251  22.251
  130    HH   TYR  19           HH       TYR  19  -3.697  21.331  21.331
  131    H    ARG  20           HN       ARG  20  -6.445  16.620  16.620
  132    HA   ARG  20           HA       ARG  20  -8.328  16.852  16.852
  133   1HB   ARG  20           HB1      ARG  20  -7.212  14.668  14.668
  134   2HB   ARG  20           HB2      ARG  20  -7.825  14.511  14.511
  135   1HG   ARG  20           HG1      ARG  20 -10.056  15.010  15.010
  136   2HG   ARG  20           HG2      ARG  20  -9.059  13.720  13.720
  137   1HD   ARG  20           HD1      ARG  20 -10.155  13.790  13.790
  138   2HD   ARG  20           HD2      ARG  20 -10.876  12.892  12.892
  139    HE   ARG  20           HE       ARG  20  -8.121  12.359  12.359
  140   1HH1  ARG  20          HH11      ARG  20  -7.641  10.680  10.680
  141   2HH1  ARG  20          HH12      ARG  20  -8.709   9.318   9.318
  142   1HH2  ARG  20          HH21      ARG  20 -11.028  10.977  10.977
  143   2HH2  ARG  20          HH22      ARG  20 -10.672   9.489   9.489
  144    HA   PRO  21           HA       PRO  21 -11.377  16.386  16.386
  145   1HB   PRO  21           HB1      PRO  21  -9.791  17.318  17.318
  146   2HB   PRO  21           HB2      PRO  21 -10.889  15.941  15.941
  147   1HG   PRO  21           HG1      PRO  21  -8.249  15.458  15.458
  148   2HG   PRO  21           HG2      PRO  21  -9.234  14.587  14.587
  149   1HD   PRO  21           HD1      PRO  21  -7.670  17.180  17.180
  150   2HD   PRO  21           HD2      PRO  21  -7.529  15.655  15.655
  151    H    LYS  22           HN       LYS  22  -9.155  18.924  18.924
  152    HA   LYS  22           HA       LYS  22 -10.921  21.032  21.032
  153   1HB   LYS  22           HB1      LYS  22  -8.297  21.273  21.273
  154   2HB   LYS  22           HB2      LYS  22  -9.151  22.580  22.580
  155   1HG   LYS  22           HG1      LYS  22  -8.961  20.715  20.715
  156   2HG   LYS  22           HG2      LYS  22  -7.496  20.384  20.384
  157   1HD   LYS  22           HD1      LYS  22  -8.342  23.106  23.106
  158   2HD   LYS  22           HD2      LYS  22  -7.111  22.071  22.071
  159   1HE   LYS  22           HE1      LYS  22  -6.969  23.340  23.340
  160   2HE   LYS  22           HE2      LYS  22  -6.099  23.883  23.883
  161   1HZ   LYS  22           HZ1      LYS  22  -5.619  21.152  21.152
  162   2HZ   LYS  22           HZ2      LYS  22  -5.378  21.897  21.897
  163   3HZ   LYS  22           HZ3      LYS  22  -4.527  22.446  22.446
  164    H    ILE  23           HN       ILE  23 -10.105  19.662  19.662
  165    HA   ILE  23           HA       ILE  23 -11.429  21.948  21.948
  166    HB   ILE  23           HB       ILE  23 -11.256  20.415  20.415
  167   1HG1  ILE  23          HG11      ILE  23  -9.313  18.794  18.794
  168   2HG1  ILE  23          HG12      ILE  23 -10.928  18.218  18.218
  169   1HG2  ILE  23          HG21      ILE  23  -9.715  22.273  22.273
  170   2HG2  ILE  23          HG22      ILE  23  -8.741  21.244  21.244
  171   3HG2  ILE  23          HG23      ILE  23  -8.797  20.958  20.958
  172   1HD1  ILE  23          HD11      ILE  23 -10.435  18.400  18.400
  173   2HD1  ILE  23          HD12      ILE  23  -8.795  18.899  18.899
  174   3HD1  ILE  23          HD13      ILE  23  -9.343  17.295  17.295
  175    H    LYS  24           HN       LYS  24 -11.960  18.714  18.714
  176    HA   LYS  24           HA       LYS  24 -14.449  18.071  18.071
  177   1HB   LYS  24           HB1      LYS  24 -12.795  16.615  16.615
  178   2HB   LYS  24           HB2      LYS  24 -13.098  17.431  17.431
  179   1HG   LYS  24           HG1      LYS  24 -15.653  16.715  16.715
  180   2HG   LYS  24           HG2      LYS  24 -14.972  15.530  15.530
  181   1HD   LYS  24           HD1      LYS  24 -14.213  15.871  15.871
  182   2HD   LYS  24           HD2      LYS  24 -15.309  14.656  14.656
  183   1HE   LYS  24           HE1      LYS  24 -12.376  14.870  14.870
  184   2HE   LYS  24           HE2      LYS  24 -13.021  13.744  13.744
  185   1HZ   LYS  24           HZ1      LYS  24 -14.544  13.536  13.536
  186   2HZ   LYS  24           HZ2      LYS  24 -12.907  13.472  13.472
  187   3HZ   LYS  24           HZ3      LYS  24 -13.522  12.382  12.382
  188    H    GLY  25           HN       GLY  25 -13.483  19.822  19.822
  189   1HA   GLY  25           HA1      GLY  25 -15.991  20.125  20.125
  190   2HA   GLY  25           HA2      GLY  25 -14.558  21.121  21.121
  191    H    GLU  26           HN       GLU  26 -14.171  22.347  22.347
  192    HA   GLU  26           HA       GLU  26 -16.106  24.439  24.439
  193   1HB   GLU  26           HB1      GLU  26 -13.935  23.867  23.867
  194   2HB   GLU  26           HB2      GLU  26 -14.720  25.419  25.419
  195   1HG   GLU  26           HG1      GLU  26 -13.869  25.307  25.307
  196   2HG   GLU  26           HG2      GLU  26 -13.006  23.869  23.869
  197    H    HIS  27           HN       HIS  27 -15.486  21.763  21.763
  198    HA   HIS  27           HA       HIS  27 -17.932  22.409  22.409
  199   1HB   HIS  27           HB1      HIS  27 -15.388  20.985  20.985
  200   2HB   HIS  27           HB2      HIS  27 -16.762  21.442  21.442
  201    HD1  HIS  27           HD1      HIS  27 -17.203  24.101  24.101
  202    HD2  HIS  27           HD2      HIS  27 -13.530  23.030  23.030
  203    HE1  HIS  27           HE1      HIS  27 -15.816  26.141  26.141
  204    HA   PRO  28           HA       PRO  28 -18.931  18.274  18.274
  205   1HB   PRO  28           HB1      PRO  28 -21.177  18.939  18.939
  206   2HB   PRO  28           HB2      PRO  28 -19.596  19.298  19.298
  207   1HG   PRO  28           HG1      PRO  28 -21.355  21.173  21.173
  208   2HG   PRO  28           HG2      PRO  28 -20.708  21.473  21.473
  209   1HD   PRO  28           HD1      PRO  28 -19.369  22.354  22.354
  210   2HD   PRO  28           HD2      PRO  28 -18.457  21.779  21.779
  211    H    GLY  29           HN       GLY  29 -19.013  19.232  19.232
  212   1HA   GLY  29           HA1      GLY  29 -21.644  18.469  18.469
  213   2HA   GLY  29           HA2      GLY  29 -20.716  19.814  19.814
  214    H    LEU  30           HN       LEU  30 -18.250  18.167  18.167
  215    HA   LEU  30           HA       LEU  30 -17.946  16.762  16.762
  216   1HB   LEU  30           HB1      LEU  30 -15.991  17.027  17.027
  217   2HB   LEU  30           HB2      LEU  30 -15.546  16.610  16.610
  218    HG   LEU  30           HG       LEU  30 -16.543  19.260  19.260
  219   1HD1  LEU  30          HD11      LEU  30 -13.850  18.407  18.407
  220   2HD1  LEU  30          HD12      LEU  30 -14.262  20.047  20.047
  221   3HD1  LEU  30          HD13      LEU  30 -14.195  18.792  18.792
  222   1HD2  LEU  30          HD21      LEU  30 -17.407  18.946  18.946
  223   2HD2  LEU  30          HD22      LEU  30 -16.152  20.170  20.170
  224   3HD2  LEU  30          HD23      LEU  30 -15.782  18.568  18.568
  225    H    SER  31           HN       SER  31 -17.171  14.608  14.608
  226    HA   SER  31           HA       SER  31 -18.013  12.826  12.826
  227   1HB   SER  31           HB1      SER  31 -17.914  12.157  12.157
  228   2HB   SER  31           HB2      SER  31 -18.611  11.172  11.172
  229    HG   SER  31           HG       SER  31 -20.351  12.291  12.291
  230    H    ILE  32           HN       ILE  32 -16.738  10.621  10.621
  231    HA   ILE  32           HA       ILE  32 -13.984  11.258  11.258
  232    HB   ILE  32           HB       ILE  32 -15.547   9.180   9.180
  233   1HG1  ILE  32          HG11      ILE  32 -13.301   9.178   9.178
  234   2HG1  ILE  32          HG12      ILE  32 -13.730   7.593   7.593
  235   1HG2  ILE  32          HG21      ILE  32 -16.166   8.553   8.553
  236   2HG2  ILE  32          HG22      ILE  32 -14.498   8.190   8.190
  237   3HG2  ILE  32          HG23      ILE  32 -15.344   7.207   7.207
  238   1HD1  ILE  32          HD11      ILE  32 -12.335   8.002   8.002
  239   2HD1  ILE  32          HD12      ILE  32 -11.858   9.558   9.558
  240   3HD1  ILE  32          HD13      ILE  32 -11.414   8.081   8.081
  241    H    GLY  33           HN       GLY  33 -15.746  11.241  11.241
  242   1HA   GLY  33           HA1      GLY  33 -13.427  10.682  10.682
  243   2HA   GLY  33           HA2      GLY  33 -15.112  10.702  10.702
  244    H    ASP  34           HN       ASP  34 -14.916  13.285  13.285
  245    HA   ASP  34           HA       ASP  34 -14.219  15.119  15.119
  246   1HB   ASP  34           HB1      ASP  34 -16.035  15.509  15.509
  247   2HB   ASP  34           HB2      ASP  34 -15.762  16.750  16.750
  248    H    VAL  35           HN       VAL  35 -14.144  14.568  14.568
  249    HA   VAL  35           HA       VAL  35 -12.399  16.690  16.690
  250    HB   VAL  35           HB       VAL  35 -12.762  13.858  13.858
  251   1HG1  VAL  35          HG11      VAL  35 -11.462  16.319  16.319
  252   2HG1  VAL  35          HG12      VAL  35 -11.724  14.787  14.787
  253   3HG1  VAL  35          HG13      VAL  35 -10.587  14.894  14.894
  254   1HG2  VAL  35          HG21      VAL  35 -13.940  16.526  16.526
  255   2HG2  VAL  35          HG22      VAL  35 -14.812  15.208  15.208
  256   3HG2  VAL  35          HG23      VAL  35 -14.156  14.994  14.994
  257    H    ALA  36           HN       ALA  36 -12.030  13.564  13.564
  258    HA   ALA  36           HA       ALA  36  -9.150  13.458  13.458
  259   1HB   ALA  36           HB1      ALA  36 -11.270  11.767  11.767
  260   2HB   ALA  36           HB2      ALA  36  -9.581  11.286  11.286
  261   3HB   ALA  36           HB3      ALA  36 -10.541  11.455  11.455
  262    H    LYS  37           HN       LYS  37 -11.618  13.861  13.861
  263    HA   LYS  37           HA       LYS  37  -9.493  14.158  14.158
  264   1HB   LYS  37           HB1      LYS  37 -12.448  14.763  14.763
  265   2HB   LYS  37           HB2      LYS  37 -11.374  15.033  15.033
  266   1HG   LYS  37           HG1      LYS  37 -10.718  12.663  12.663
  267   2HG   LYS  37           HG2      LYS  37 -11.765  12.337  12.337
  268   1HD   LYS  37           HD1      LYS  37 -13.737  13.145  13.145
  269   2HD   LYS  37           HD2      LYS  37 -12.657  13.423  13.423
  270   1HE   LYS  37           HE1      LYS  37 -13.068  10.706  10.706
  271   2HE   LYS  37           HE2      LYS  37 -13.840  11.231  11.231
  272   1HZ   LYS  37           HZ1      LYS  37 -11.103  11.723  11.723
  273   2HZ   LYS  37           HZ2      LYS  37 -11.303  10.129  10.129
  274   3HZ   LYS  37           HZ3      LYS  37 -12.058  10.634  10.634
  275    H    LYS  38           HN       LYS  38 -10.727  16.318  16.318
  276    HA   LYS  38           HA       LYS  38 -10.213  18.721  18.721
  277   1HB   LYS  38           HB1      LYS  38 -12.137  18.474  18.474
  278   2HB   LYS  38           HB2      LYS  38 -10.881  18.562  18.562
  279   1HG   LYS  38           HG1      LYS  38 -11.691  20.769  20.769
  280   2HG   LYS  38           HG2      LYS  38 -10.195  20.779  20.779
  281   1HD   LYS  38           HD1      LYS  38 -11.529  20.341  20.341
  282   2HD   LYS  38           HD2      LYS  38 -12.996  20.414  20.414
  283   1HE   LYS  38           HE1      LYS  38 -12.599  22.581  22.581
  284   2HE   LYS  38           HE2      LYS  38 -12.396  22.751  22.751
  285   1HZ   LYS  38           HZ1      LYS  38  -9.942  21.989  21.989
  286   2HZ   LYS  38           HZ2      LYS  38 -10.546  23.268  23.268
  287   3HZ   LYS  38           HZ3      LYS  38 -10.355  23.459  23.459
  288    H    LEU  39           HN       LEU  39  -9.308  17.240  17.240
  289    HA   LEU  39           HA       LEU  39  -6.968  18.693  18.693
  290   1HB   LEU  39           HB1      LEU  39  -8.193  17.356  17.356
  291   2HB   LEU  39           HB2      LEU  39  -7.971  15.926  15.926
  292    HG   LEU  39           HG       LEU  39  -5.727  15.956  15.956
  293   1HD1  LEU  39          HD11      LEU  39  -6.138  18.139  18.139
  294   2HD1  LEU  39          HD12      LEU  39  -4.627  17.287  17.287
  295   3HD1  LEU  39          HD13      LEU  39  -5.246  18.349  18.349
  296   1HD2  LEU  39          HD21      LEU  39  -7.144  14.608  14.608
  297   2HD2  LEU  39          HD22      LEU  39  -5.705  15.191  15.191
  298   3HD2  LEU  39          HD23      LEU  39  -7.234  15.980  15.980
  299    H    GLY  40           HN       GLY  40  -7.453  15.647  15.647
  300   1HA   GLY  40           HA1      GLY  40  -4.816  14.946  14.946
  301   2HA   GLY  40           HA2      GLY  40  -6.198  14.499  14.499
  302    H    GLU  41           HN       GLU  41  -7.045  16.909  16.909
  303    HA   GLU  41           HA       GLU  41  -5.277  17.394  17.394
  304   1HB   GLU  41           HB1      GLU  41  -7.339  19.084  19.084
  305   2HB   GLU  41           HB2      GLU  41  -6.460  19.733  19.733
  306   1HG   GLU  41           HG1      GLU  41  -8.053  17.126  17.126
  307   2HG   GLU  41           HG2      GLU  41  -8.631  18.651  18.651
  308    H    MET  42           HN       MET  42  -5.684  19.325  19.325
  309    HA   MET  42           HA       MET  42  -3.662  21.231  21.231
  310   1HB   MET  42           HB1      MET  42  -4.392  19.906  19.906
  311   2HB   MET  42           HB2      MET  42  -3.559  21.449  21.449
  312   1HG   MET  42           HG1      MET  42  -5.629  22.084  22.084
  313   2HG   MET  42           HG2      MET  42  -6.355  20.707  20.707
  314   1HE   MET  42           HE1      MET  42  -8.399  21.800  21.800
  315   2HE   MET  42           HE2      MET  42  -7.819  20.679  20.679
  316   3HE   MET  42           HE3      MET  42  -8.496  22.239  22.239
  317    H    TRP  43           HN       TRP  43  -3.393  18.074  18.074
  318    HA   TRP  43           HA       TRP  43  -0.673  18.066  18.066
  319   1HB   TRP  43           HB1      TRP  43  -2.003  16.123  16.123
  320   2HB   TRP  43           HB2      TRP  43  -2.467  15.810  15.810
  321    HD1  TRP  43           HD1      TRP  43  -0.959  14.212  14.212
  322    HE1  TRP  43           HE1      TRP  43   1.278  13.260  13.260
  323    HE3  TRP  43           HE3      TRP  43   0.182  16.691  16.691
  324    HZ2  TRP  43           HZ2      TRP  43   3.436  13.415  13.415
  325    HZ3  TRP  43           HZ3      TRP  43   2.308  16.299  16.299
  326    HH2  TRP  43           HH2      TRP  43   3.946  14.665  14.665
  327    H    ASN  44           HN       ASN  44  -2.186  17.196  17.196
  328    HA   ASN  44           HA       ASN  44   0.213  16.629  16.629
  329   1HB   ASN  44           HB1      ASN  44  -2.491  17.505  17.505
  330   2HB   ASN  44           HB2      ASN  44  -1.189  16.726  16.726
  331   1HD2  ASN  44          HD21      ASN  44  -3.765  14.370  14.370
  332   2HD2  ASN  44          HD22      ASN  44  -4.078  15.974  15.974
  333    H    ASN  45           HN       ASN  45  -0.715  19.465  19.465
  334    HA   ASN  45           HA       ASN  45   1.011  21.081  21.081
  335   1HB   ASN  45           HB1      ASN  45  -1.607  22.169  22.169
  336   2HB   ASN  45           HB2      ASN  45  -0.578  22.904  22.904
  337   1HD2  ASN  45          HD21      ASN  45  -3.533  20.462  20.462
  338   2HD2  ASN  45          HD22      ASN  45  -3.325  21.108  21.108
  339    H    THR  46           HN       THR  46   1.499  19.912  19.912
  340    HA   THR  46           HA       THR  46   1.246  22.128  22.128
  341    HB   THR  46           HB       THR  46   1.355  19.730  19.730
  342    HG1  THR  46           HG1      THR  46   2.117  20.727  20.727
  343   1HG2  THR  46          HG21      THR  46   3.209  18.896  18.896
  344   2HG2  THR  46          HG22      THR  46   4.349  19.896  19.896
  345   3HG2  THR  46          HG23      THR  46   3.523  18.590  18.590
  346    H    ALA  47           HN       ALA  47   3.738  20.767  20.767
  347    HA   ALA  47           HA       ALA  47   5.161  23.042  23.042
  348   1HB   ALA  47           HB1      ALA  47   5.826  23.314  23.314
  349   2HB   ALA  47           HB2      ALA  47   6.481  21.688  21.688
  350   3HB   ALA  47           HB3      ALA  47   7.200  22.954  22.954
  351    H    ALA  48           HN       ALA  48   5.736  19.918  19.918
  352    HA   ALA  48           HA       ALA  48   6.152  17.853  17.853
  353   1HB   ALA  48           HB1      ALA  48   6.250  18.949  18.949
  354   2HB   ALA  48           HB2      ALA  48   7.856  19.556  19.556
  355   3HB   ALA  48           HB3      ALA  48   7.562  17.830  17.830
  356    H    ASP  49           HN       ASP  49   8.176  20.616  20.616
  357    HA   ASP  49           HA       ASP  49  10.537  19.223  19.223
  358   1HB   ASP  49           HB1      ASP  49   9.917  22.215  22.215
  359   2HB   ASP  49           HB2      ASP  49  11.502  21.461  21.461
  360    H    ASP  50           HN       ASP  50   7.610  19.935  19.935
  361    HA   ASP  50           HA       ASP  50   8.459  20.216  20.216
  362   1HB   ASP  50           HB1      ASP  50   6.999  22.060  22.060
  363   2HB   ASP  50           HB2      ASP  50   5.779  20.861  20.861
  364    H    LYS  51           HN       LYS  51   7.296  18.165  18.165
  365    HA   LYS  51           HA       LYS  51   5.677  16.425  16.425
  366   1HB   LYS  51           HB1      LYS  51   6.835  15.929  15.929
  367   2HB   LYS  51           HB2      LYS  51   5.786  14.820  14.820
  368   1HG   LYS  51           HG1      LYS  51   3.999  16.553  16.553
  369   2HG   LYS  51           HG2      LYS  51   5.068  17.613  17.613
  370   1HD   LYS  51           HD1      LYS  51   5.216  15.921  15.921
  371   2HD   LYS  51           HD2      LYS  51   4.168  14.844  14.844
  372   1HE   LYS  51           HE1      LYS  51   2.342  16.398  16.398
  373   2HE   LYS  51           HE2      LYS  51   3.328  17.617  17.617
  374   1HZ   LYS  51           HZ1      LYS  51   3.507  15.202  15.202
  375   2HZ   LYS  51           HZ2      LYS  51   1.868  15.567  15.567
  376   3HZ   LYS  51           HZ3      LYS  51   2.878  16.695  16.695
  377    H    GLN  52           HN       GLN  52   8.724  16.326  16.326
  378    HA   GLN  52           HA       GLN  52  10.056  14.166  14.166
  379   1HB   GLN  52           HB1      GLN  52  10.802  17.020  17.020
  380   2HB   GLN  52           HB2      GLN  52  11.911  16.031  16.031
  381   1HG   GLN  52           HG1      GLN  52  12.747  16.262  16.262
  382   2HG   GLN  52           HG2      GLN  52  12.234  14.601  14.601
  383   1HE2  GLN  52          HE21      GLN  52   9.227  15.301  15.301
  384   2HE2  GLN  52          HE22      GLN  52   9.468  14.667  14.667
  385    HA   PRO  53           HA       PRO  53  10.921  14.493  14.493
  386   1HB   PRO  53           HB1      PRO  53   9.028  16.049  16.049
  387   2HB   PRO  53           HB2      PRO  53  10.655  16.585  16.585
  388   1HG   PRO  53           HG1      PRO  53   8.084  16.952  16.952
  389   2HG   PRO  53           HG2      PRO  53   9.252  18.193  18.193
  390   1HD   PRO  53           HD1      PRO  53   9.466  17.166  17.166
  391   2HD   PRO  53           HD2      PRO  53  10.965  17.257  17.257
  392    H    TYR  54           HN       TYR  54   7.534  15.045  15.045
  393    HA   TYR  54           HA       TYR  54   6.429  12.980  12.980
  394   1HB   TYR  54           HB1      TYR  54   5.354  14.409  14.409
  395   2HB   TYR  54           HB2      TYR  54   4.394  13.272  13.272
  396    HD1  TYR  54           HD1      TYR  54   4.878  13.931  13.931
  397    HD2  TYR  54           HD2      TYR  54   4.690  16.583  16.583
  398    HE1  TYR  54           HE1      TYR  54   4.253  15.765  15.765
  399    HE2  TYR  54           HE2      TYR  54   4.062  18.419  18.419
  400    HH   TYR  54           HH       TYR  54   4.508  18.428  18.428
  401    H    GLU  55           HN       GLU  55   7.015  13.212  13.212
  402    HA   GLU  55           HA       GLU  55   6.224  10.684  10.684
  403   1HB   GLU  55           HB1      GLU  55   7.630  12.994  12.994
  404   2HB   GLU  55           HB2      GLU  55   8.570  11.615  11.615
  405   1HG   GLU  55           HG1      GLU  55   6.446  10.619  10.619
  406   2HG   GLU  55           HG2      GLU  55   5.592  12.063  12.063
  407    H    LYS  56           HN       LYS  56   9.523  11.631  11.631
  408    HA   LYS  56           HA       LYS  56  10.838   9.219   9.219
  409   1HB   LYS  56           HB1      LYS  56  11.909  11.415  11.415
  410   2HB   LYS  56           HB2      LYS  56  11.277  11.472  11.472
  411   1HG   LYS  56           HG1      LYS  56  12.711   9.688   9.688
  412   2HG   LYS  56           HG2      LYS  56  13.120   9.233   9.233
  413   1HD   LYS  56           HD1      LYS  56  14.280  11.412  11.412
  414   2HD   LYS  56           HD2      LYS  56  13.838  11.911  11.911
  415   1HE   LYS  56           HE1      LYS  56  15.532   9.452   9.452
  416   2HE   LYS  56           HE2      LYS  56  16.200  11.018  11.018
  417   1HZ   LYS  56           HZ1      LYS  56  14.232  10.355  10.355
  418   2HZ   LYS  56           HZ2      LYS  56  15.267   9.019   9.019
  419   3HZ   LYS  56           HZ3      LYS  56  15.903  10.539  10.539
  420    H    LYS  57           HN       LYS  57   8.724  10.271  10.271
  421    HA   LYS  57           HA       LYS  57   9.497   8.131   8.131
  422   1HB   LYS  57           HB1      LYS  57   8.333  10.412  10.412
  423   2HB   LYS  57           HB2      LYS  57   6.847   9.644   9.644
  424   1HG   LYS  57           HG1      LYS  57   7.316   7.736   7.736
  425   2HG   LYS  57           HG2      LYS  57   8.716   8.621   8.621
  426   1HD   LYS  57           HD1      LYS  57   7.184  10.534  10.534
  427   2HD   LYS  57           HD2      LYS  57   5.818   9.525   9.525
  428   1HE   LYS  57           HE1      LYS  57   6.588   7.793   7.793
  429   2HE   LYS  57           HE2      LYS  57   7.878   8.886   8.886
  430   1HZ   LYS  57           HZ1      LYS  57   5.461  10.292  10.292
  431   2HZ   LYS  57           HZ2      LYS  57   5.251   8.834   8.834
  432   3HZ   LYS  57           HZ3      LYS  57   6.488   9.907   9.907
  433    H    ALA  58           HN       ALA  58   6.641   8.847   8.847
  434    HA   ALA  58           HA       ALA  58   5.138   6.538   6.538
  435   1HB   ALA  58           HB1      ALA  58   4.491   8.450   8.450
  436   2HB   ALA  58           HB2      ALA  58   5.726   7.989   7.989
  437   3HB   ALA  58           HB3      ALA  58   4.362   6.928   6.928
  438    H    ALA  59           HN       ALA  59   7.783   7.057   7.057
  439    HA   ALA  59           HA       ALA  59   8.017   4.581   4.581
  440   1HB   ALA  59           HB1      ALA  59   9.451   6.547   6.547
  441   2HB   ALA  59           HB2      ALA  59  10.325   6.347   6.347
  442   3HB   ALA  59           HB3      ALA  59  10.437   5.118   5.118
  443    H    LYS  60           HN       LYS  60   9.929   5.526   5.526
  444    HA   LYS  60           HA       LYS  60  11.141   3.242   3.242
  445   1HB   LYS  60           HB1      LYS  60  11.177   5.487   5.487
  446   2HB   LYS  60           HB2      LYS  60   9.644   5.087   5.087
  447   1HG   LYS  60           HG1      LYS  60  10.714   3.034   3.034
  448   2HG   LYS  60           HG2      LYS  60  12.253   3.562   3.562
  449   1HD   LYS  60           HD1      LYS  60  10.528   5.062   5.062
  450   2HD   LYS  60           HD2      LYS  60  12.033   4.235   4.235
  451   1HE   LYS  60           HE1      LYS  60  13.212   5.845   5.845
  452   2HE   LYS  60           HE2      LYS  60  11.691   6.718   6.718
  453   1HZ   LYS  60           HZ1      LYS  60  12.171   6.319   6.319
  454   2HZ   LYS  60           HZ2      LYS  60  13.603   6.911   6.911
  455   3HZ   LYS  60           HZ3      LYS  60  12.154   7.780   7.780
  456    H    LEU  61           HN       LEU  61   7.834   4.108   4.108
  457    HA   LEU  61           HA       LEU  61   7.213   1.687   1.687
  458   1HB   LEU  61           HB1      LEU  61   5.271   3.488   3.488
  459   2HB   LEU  61           HB2      LEU  61   4.904   2.449   2.449
  460    HG   LEU  61           HG       LEU  61   6.713   4.911   4.911
  461   1HD1  LEU  61          HD11      LEU  61   4.123   4.319   4.319
  462   2HD1  LEU  61          HD12      LEU  61   5.095   5.779   5.779
  463   3HD1  LEU  61          HD13      LEU  61   4.348   5.410   5.410
  464   1HD2  LEU  61          HD21      LEU  61   6.247   2.955   2.955
  465   2HD2  LEU  61          HD22      LEU  61   7.767   3.212   3.212
  466   3HD2  LEU  61          HD23      LEU  61   7.085   4.496   4.496
  467    H    LYS  62           HN       LYS  62   6.334   2.595   2.595
  468    HA   LYS  62           HA       LYS  62   5.105   0.229   0.229
  469   1HB   LYS  62           HB1      LYS  62   5.425   2.209   2.209
  470   2HB   LYS  62           HB2      LYS  62   7.147   1.916   1.916
  471   1HG   LYS  62           HG1      LYS  62   5.989  -0.561  -0.561
  472   2HG   LYS  62           HG2      LYS  62   5.013   0.666   0.666
  473   1HD   LYS  62           HD1      LYS  62   8.057   0.503   0.503
  474   2HD   LYS  62           HD2      LYS  62   6.963  -0.030  -0.030
  475   1HE   LYS  62           HE1      LYS  62   7.222   2.846   2.846
  476   2HE   LYS  62           HE2      LYS  62   7.828   2.231   2.231
  477   1HZ   LYS  62           HZ1      LYS  62   5.130   1.549   1.549
  478   2HZ   LYS  62           HZ2      LYS  62   5.284   3.193   3.193
  479   3HZ   LYS  62           HZ3      LYS  62   5.881   2.615   2.615
  480    H    GLU  63           HN       GLU  63   8.462   1.051   1.051
  481    HA   GLU  63           HA       GLU  63   9.657  -1.292  -1.292
  482   1HB   GLU  63           HB1      GLU  63  10.407   1.193   1.193
  483   2HB   GLU  63           HB2      GLU  63  11.523  -0.105  -0.105
  484   1HG   GLU  63           HG1      GLU  63  10.684   0.854   0.854
  485   2HG   GLU  63           HG2      GLU  63  12.076   1.480   1.480
  486    H    LYS  64           HN       LYS  64   9.023  -0.314  -0.314
  487    HA   LYS  64           HA       LYS  64  10.021  -2.610  -2.610
  488   1HB   LYS  64           HB1      LYS  64   9.115  -0.416  -0.416
  489   2HB   LYS  64           HB2      LYS  64   7.503  -1.076  -1.076
  490   1HG   LYS  64           HG1      LYS  64   8.158  -3.053  -3.053
  491   2HG   LYS  64           HG2      LYS  64   9.748  -2.344  -2.344
  492   1HD   LYS  64           HD1      LYS  64   7.726  -0.342  -0.342
  493   2HD   LYS  64           HD2      LYS  64   7.380  -1.819  -1.819
  494   1HE   LYS  64           HE1      LYS  64   8.889  -0.356  -0.356
  495   2HE   LYS  64           HE2      LYS  64   9.725  -1.841  -1.841
  496   1HZ   LYS  64           HZ1      LYS  64  10.100   0.015   0.015
  497   2HZ   LYS  64           HZ2      LYS  64  10.441   0.787   0.787
  498   3HZ   LYS  64           HZ3      LYS  64  11.253  -0.644  -0.644
  499    H    TYR  65           HN       TYR  65   6.773  -1.989  -1.989
  500    HA   TYR  65           HA       TYR  65   5.516  -4.425  -4.425
  501   1HB   TYR  65           HB1      TYR  65   4.109  -2.682  -2.682
  502   2HB   TYR  65           HB2      TYR  65   5.162  -2.236  -2.236
  503    HD1  TYR  65           HD1      TYR  65   3.643  -5.600  -5.600
  504    HD2  TYR  65           HD2      TYR  65   3.686  -2.166  -2.166
  505    HE1  TYR  65           HE1      TYR  65   2.140  -6.712  -6.712
  506    HE2  TYR  65           HE2      TYR  65   2.187  -3.291  -3.291
  507    HH   TYR  65           HH       TYR  65   1.734  -6.032  -6.032
  508    H    GLU  66           HN       GLU  66   6.759  -3.504  -3.504
  509    HA   GLU  66           HA       GLU  66   6.555  -5.830  -5.830
  510   1HB   GLU  66           HB1      GLU  66   8.831  -3.885  -3.885
  511   2HB   GLU  66           HB2      GLU  66   8.467  -5.049  -5.049
  512   1HG   GLU  66           HG1      GLU  66   6.244  -3.179  -3.179
  513   2HG   GLU  66           HG2      GLU  66   7.508  -2.506  -2.506
  514    H    LYS  67           HN       LYS  67   8.927  -5.259  -5.259
  515    HA   LYS  67           HA       LYS  67  10.556  -7.548  -7.548
  516   1HB   LYS  67           HB1      LYS  67  10.812  -5.333  -5.333
  517   2HB   LYS  67           HB2      LYS  67  11.738  -6.786  -6.786
  518   1HG   LYS  67           HG1      LYS  67  12.962  -5.024  -5.024
  519   2HG   LYS  67           HG2      LYS  67  12.929  -6.598  -6.598
  520   1HD   LYS  67           HD1      LYS  67  11.222  -5.822  -5.822
  521   2HD   LYS  67           HD2      LYS  67  11.078  -4.287  -4.287
  522   1HE   LYS  67           HE1      LYS  67  13.634  -5.295  -5.295
  523   2HE   LYS  67           HE2      LYS  67  12.530  -4.153  -4.153
  524   1HZ   LYS  67           HZ1      LYS  67  13.119  -3.258  -3.258
  525   2HZ   LYS  67           HZ2      LYS  67  14.581  -3.643  -3.643
  526   3HZ   LYS  67           HZ3      LYS  67  13.507  -2.538  -2.538
  527    H    ASP  68           HN       ASP  68   8.388  -6.737  -6.737
  528    HA   ASP  68           HA       ASP  68   8.810  -9.208  -9.208
  529   1HB   ASP  68           HB1      ASP  68   6.953  -6.854  -6.854
  530   2HB   ASP  68           HB2      ASP  68   6.885  -8.275  -8.275
  531    H    ILE  69           HN       ILE  69   6.930  -8.000  -8.000
  532    HA   ILE  69           HA       ILE  69   4.810 -10.020 -10.020
  533    HB   ILE  69           HB       ILE  69   4.544  -7.554  -7.554
  534   1HG1  ILE  69          HG11      ILE  69   2.552  -8.506  -8.506
  535   2HG1  ILE  69          HG12      ILE  69   2.853  -8.395  -8.395
  536   1HG2  ILE  69          HG21      ILE  69   6.268  -7.643  -7.643
  537   2HG2  ILE  69          HG22      ILE  69   5.354  -8.823  -8.823
  538   3HG2  ILE  69          HG23      ILE  69   4.721  -7.197  -7.197
  539   1HD1  ILE  69          HD11      ILE  69   3.577 -10.766 -10.766
  540   2HD1  ILE  69          HD12      ILE  69   3.192 -10.872 -10.872
  541   3HD1  ILE  69          HD13      ILE  69   1.921 -10.577 -10.577
  542    H    ALA  70           HN       ALA  70   7.420  -9.108  -9.108
  543    HA   ALA  70           HA       ALA  70   7.280 -11.241 -11.241
  544   1HB   ALA  70           HB1      ALA  70   9.777  -9.747  -9.747
  545   2HB   ALA  70           HB2      ALA  70   9.707 -10.777 -10.777
  546   3HB   ALA  70           HB3      ALA  70   8.781  -9.299  -9.299
  547    H    ALA  71           HN       ALA  71   8.473 -10.892 -10.892
  548    HA   ALA  71           HA       ALA  71   9.902 -13.431 -13.431
  549   1HB   ALA  71           HB1      ALA  71   9.054 -11.529 -11.529
  550   2HB   ALA  71           HB2      ALA  71  10.149 -12.890 -12.890
  551   3HB   ALA  71           HB3      ALA  71  10.613 -11.521 -11.521
  552    H    TYR  72           HN       TYR  72   6.905 -12.035 -12.035
  553    HA   TYR  72           HA       TYR  72   5.750 -14.134 -14.134
  554   1HB   TYR  72           HB1      TYR  72   4.854 -11.864 -11.864
  555   2HB   TYR  72           HB2      TYR  72   4.430 -12.136 -12.136
  556    HD1  TYR  72           HD1      TYR  72   2.696 -13.999 -13.999
  557    HD2  TYR  72           HD2      TYR  72   3.337 -12.369 -12.369
  558    HE1  TYR  72           HE1      TYR  72   0.507 -14.841 -14.841
  559    HE2  TYR  72           HE2      TYR  72   1.154 -13.214 -13.214
  560    HH   TYR  72           HH       TYR  72  -1.106 -13.791 -13.791
  561    H    ARG  73           HN       ARG  73   5.781 -13.531 -13.531
  562    HA   ARG  73           HA       ARG  73   4.323 -16.018 -16.018
  563   1HB   ARG  73           HB1      ARG  73   5.254 -13.766 -13.766
  564   2HB   ARG  73           HB2      ARG  73   4.341 -15.159 -15.159
  565   1HG   ARG  73           HG1      ARG  73   2.608 -14.462 -14.462
  566   2HG   ARG  73           HG2      ARG  73   3.487 -12.947 -12.947
  567   1HD   ARG  73           HD1      ARG  73   1.512 -12.833 -12.833
  568   2HD   ARG  73           HD2      ARG  73   3.009 -12.593 -12.593
  569    HE   ARG  73           HE       ARG  73   2.853 -14.952 -14.952
  570   1HH1  ARG  73          HH11      ARG  73   0.073 -13.089 -13.089
  571   2HH1  ARG  73          HH12      ARG  73  -1.031 -14.404 -14.404
  572   1HH2  ARG  73          HH21      ARG  73   1.479 -16.829 -16.829
  573   2HH2  ARG  73          HH22      ARG  73  -0.221 -16.562 -16.562
  574    H    ALA  74           HN       ALA  74   7.481 -15.053 -15.053
  575    HA   ALA  74           HA       ALA  74   8.442 -17.058 -17.058
  576   1HB   ALA  74           HB1      ALA  74   9.998 -15.185 -15.185
  577   2HB   ALA  74           HB2      ALA  74  10.714 -16.244 -16.244
  578   3HB   ALA  74           HB3      ALA  74   9.676 -14.940 -14.940
  579    H    LYS  75           HN       LYS  75   7.008 -17.392 -17.392
  580    HA   LYS  75           HA       LYS  75   6.984 -18.701 -18.701
  581   1HB   LYS  75           HB1      LYS  75   7.022 -20.176 -20.176
  582   2HB   LYS  75           HB2      LYS  75   8.584 -20.690 -20.690
  583   1HG   LYS  75           HG1      LYS  75   7.511 -21.453 -21.453
  584   2HG   LYS  75           HG2      LYS  75   5.941 -20.963 -20.963
  585   1HD   LYS  75           HD1      LYS  75   6.481 -22.480 -22.480
  586   2HD   LYS  75           HD2      LYS  75   7.803 -23.112 -23.112
  587   1HE   LYS  75           HE1      LYS  75   4.838 -23.231 -23.231
  588   2HE   LYS  75           HE2      LYS  75   5.879 -24.579 -24.579
  589   1HZ   LYS  75           HZ1      LYS  75   7.035 -23.222 -23.222
  590   2HZ   LYS  75           HZ2      LYS  75   5.397 -23.509 -23.509
  591   3HZ   LYS  75           HZ3      LYS  75   6.420 -24.803 -24.803
  592    H    GLY  76           HN       GLY  76   8.872 -16.830 -16.830
  593   1HA   GLY  76           HA1      GLY  76  11.535 -17.591 -17.591
  594   2HA   GLY  76           HA2      GLY  76  10.781 -16.116 -16.116
  595    H    LYS  77           HN       LYS  77   9.210 -16.592 -16.592
  596    HA   LYS  77           HA       LYS  77  10.615 -17.130 -17.130
  597   1HB   LYS  77           HB1      LYS  77   7.690 -17.838 -17.838
  598   2HB   LYS  77           HB2      LYS  77   8.678 -17.086 -17.086
  599   1HG   LYS  77           HG1      LYS  77   8.717 -14.985 -14.985
  600   2HG   LYS  77           HG2      LYS  77   7.980 -15.702 -15.702
  601   1HD   LYS  77           HD1      LYS  77   6.032 -16.377 -16.377
  602   2HD   LYS  77           HD2      LYS  77   6.687 -15.770 -15.770
  603   1HE   LYS  77           HE1      LYS  77   5.940 -14.107 -14.107
  604   2HE   LYS  77           HE2      LYS  77   5.074 -14.145 -14.145
  605   1HZ   LYS  77           HZ1      LYS  77   7.724 -13.533 -13.533
  606   2HZ   LYS  77           HZ2      LYS  77   7.250 -12.548 -12.548
  607   3HZ   LYS  77           HZ3      LYS  77   6.353 -12.541 -12.541
  608    HA   PRO  78           HA       PRO  78   8.622 -21.276 -21.276
  609   1HB   PRO  78           HB1      PRO  78   7.336 -22.195 -22.195
  610   2HB   PRO  78           HB2      PRO  78   6.606 -22.075 -22.075
  611   1HG   PRO  78           HG1      PRO  78   5.907 -20.289 -20.289
  612   2HG   PRO  78           HG2      PRO  78   6.188 -19.721 -19.721
  613   1HD   PRO  78           HD1      PRO  78   8.203 -19.811 -19.811
  614   2HD   PRO  78           HD2      PRO  78   7.729 -18.373 -18.373
  615    H    ASP  79           HN       ASP  79   9.749 -20.872 -20.872
  616    HA   ASP  79           HA       ASP  79  11.840 -22.948 -22.948
  617   1HB   ASP  79           HB1      ASP  79  10.238 -22.600 -22.600
  618   2HB   ASP  79           HB2      ASP  79  11.635 -23.641 -23.641
  619    H    ALA  80           HN       ALA  80  13.300 -21.323 -21.323
  620    HA   ALA  80           HA       ALA  80  14.152 -19.011 -19.011
  621   1HB   ALA  80           HB1      ALA  80  15.549 -20.452 -20.452
  622   2HB   ALA  80           HB2      ALA  80  16.001 -21.447 -21.447
  623   3HB   ALA  80           HB3      ALA  80  16.525 -19.771 -19.771
  624    H    ALA  81           HN       ALA  81  15.066 -21.873 -21.873
  625    HA   ALA  81           HA       ALA  81  16.292 -21.083 -21.083
  626   1HB   ALA  81           HB1      ALA  81  13.957 -23.036 -23.036
  627   2HB   ALA  81           HB2      ALA  81  15.144 -22.970 -22.970
  628   3HB   ALA  81           HB3      ALA  81  15.637 -23.412 -23.412
  629   1H1   BME  16           HE1      MER  16  -7.387  11.948  11.948
  630   2H1   BME  16           HE2      MER  16  -8.549  10.849  10.849
  631   1H2   BME  16           HZ1      MER  16  -6.645   9.315   9.315
  632   2H2   BME  16           HZ2      MER  16  -5.552  10.405  10.405
  633    HO1  BME  16           HH       MER  16  -8.432   9.677   9.677

  Start of MODEL   23
    1    H    ASN   3           HN       ASN   3  -3.846 -10.146 -10.146
    2    HA   ASN   3           HA       ASN   3  -2.525 -12.066 -12.066
    3   1HB   ASN   3           HB1      ASN   3  -4.849 -12.621 -12.621
    4   2HB   ASN   3           HB2      ASN   3  -5.431 -11.140 -11.140
    5   1HD2  ASN   3          HD21      ASN   3  -4.034 -13.289 -13.289
    6   2HD2  ASN   3          HD22      ASN   3  -3.006 -12.469 -12.469
    7    H    ALA   4           HN       ALA   4  -1.139 -10.061 -10.061
    8    HA   ALA   4           HA       ALA   4  -0.273  -8.809  -8.809
    9   1HB   ALA   4           HB1      ALA   4  -2.064  -9.494  -9.494
   10   2HB   ALA   4           HB2      ALA   4  -3.146  -8.278  -8.278
   11   3HB   ALA   4           HB3      ALA   4  -1.662  -7.794  -7.794
   12    HA   PRO   5           HA       PRO   5  -0.860  -5.425  -5.425
   13   1HB   PRO   5           HB1      PRO   5   1.404  -4.560  -4.560
   14   2HB   PRO   5           HB2      PRO   5   1.249  -4.303  -4.303
   15   1HG   PRO   5           HG1      PRO   5   2.760  -6.375  -6.375
   16   2HG   PRO   5           HG2      PRO   5   1.522  -6.687  -6.687
   17   1HD   PRO   5           HD1      PRO   5   1.351  -7.279  -7.279
   18   2HD   PRO   5           HD2      PRO   5   0.926  -8.324  -8.324
   19    H    LYS   6           HN       LYS   6  -0.787  -5.342  -5.342
   20    HA   LYS   6           HA       LYS   6  -1.806  -4.079  -4.079
   21   1HB   LYS   6           HB1      LYS   6  -3.711  -3.513  -3.513
   22   2HB   LYS   6           HB2      LYS   6  -4.005  -2.933  -2.933
   23   1HG   LYS   6           HG1      LYS   6  -4.177  -5.142  -5.142
   24   2HG   LYS   6           HG2      LYS   6  -3.529  -5.876  -5.876
   25   1HD   LYS   6           HD1      LYS   6  -5.944  -6.226  -6.226
   26   2HD   LYS   6           HD2      LYS   6  -5.563  -5.110  -5.110
   27   1HE   LYS   6           HE1      LYS   6  -6.485  -4.172  -4.172
   28   2HE   LYS   6           HE2      LYS   6  -7.593  -4.480  -4.480
   29   1HZ   LYS   6           HZ1      LYS   6  -5.546  -2.849  -2.849
   30   2HZ   LYS   6           HZ2      LYS   6  -6.096  -2.185  -2.185
   31   3HZ   LYS   6           HZ3      LYS   6  -7.188  -2.482  -2.482
   32    H    ARG   7           HN       ARG   7  -0.161  -2.707  -2.707
   33    HA   ARG   7           HA       ARG   7   1.203  -0.738  -0.738
   34   1HB   ARG   7           HB1      ARG   7  -1.155  -0.394  -0.394
   35   2HB   ARG   7           HB2      ARG   7  -0.170   1.017   1.017
   36   1HG   ARG   7           HG1      ARG   7   0.757  -0.007  -0.007
   37   2HG   ARG   7           HG2      ARG   7   1.877  -0.349  -0.349
   38   1HD   ARG   7           HD1      ARG   7   1.630  -2.387  -2.387
   39   2HD   ARG   7           HD2      ARG   7   0.705  -2.645  -2.645
   40    HE   ARG   7           HE       ARG   7  -1.353  -2.117  -2.117
   41   1HH1  ARG   7          HH11      ARG   7  -0.281  -0.890  -0.890
   42   2HH1  ARG   7          HH12      ARG   7  -0.166  -2.183  -2.183
   43   1HH2  ARG   7          HH21      ARG   7  -0.406  -4.662  -4.662
   44   2HH2  ARG   7          HH22      ARG   7  -0.240  -4.369  -4.369
   45    HA   PRO   8           HA       PRO   8  -0.828   1.189   1.189
   46   1HB   PRO   8           HB1      PRO   8   2.168   1.445   1.445
   47   2HB   PRO   8           HB2      PRO   8   0.923   1.087   1.087
   48   1HG   PRO   8           HG1      PRO   8   2.277  -0.952  -0.952
   49   2HG   PRO   8           HG2      PRO   8   0.513  -1.106  -1.106
   50   1HD   PRO   8           HD1      PRO   8   2.340  -0.308  -0.308
   51   2HD   PRO   8           HD2      PRO   8   1.101  -1.583  -1.583
   52    HA   PRO   9           HA       PRO   9  -0.839   5.590   5.590
   53   1HB   PRO   9           HB1      PRO   9   1.875   5.704   5.704
   54   2HB   PRO   9           HB2      PRO   9   0.560   6.882   6.882
   55   1HG   PRO   9           HG1      PRO   9   0.627   5.028   5.028
   56   2HG   PRO   9           HG2      PRO   9  -0.934   5.260   5.260
   57   1HD   PRO   9           HD1      PRO   9   1.145   3.107   3.107
   58   2HD   PRO   9           HD2      PRO   9  -0.630   2.927   2.927
   59    H    SER  10           HN       SER  10  -0.158   7.479   7.479
   60    HA   SER  10           HA       SER  10   1.537   6.907   6.907
   61   1HB   SER  10           HB1      SER  10  -0.713   8.902   8.902
   62   2HB   SER  10           HB2      SER  10   0.182   8.639   8.639
   63    HG   SER  10           HG       SER  10  -0.543   6.278   6.278
   64    H    ALA  11           HN       ALA  11   1.229   9.129   9.129
   65    HA   ALA  11           HA       ALA  11   3.384  10.279  10.279
   66   1HB   ALA  11           HB1      ALA  11   2.935  11.520  11.520
   67   2HB   ALA  11           HB2      ALA  11   4.130  12.065  12.065
   68   3HB   ALA  11           HB3      ALA  11   4.320  10.505  10.505
   69    H    PHE  12           HN       PHE  12   0.819  11.147  11.147
   70    HA   PHE  12           HA       PHE  12  -0.126  13.589  13.589
   71   1HB   PHE  12           HB1      PHE  12  -0.900  12.738  12.738
   72   2HB   PHE  12           HB2      PHE  12  -1.231  11.133  11.133
   73    HD1  PHE  12           HD1      PHE  12  -2.876  13.523  13.523
   74    HD2  PHE  12           HD2      PHE  12  -3.083  11.593  11.593
   75    HE1  PHE  12           HE1      PHE  12  -5.288  13.907  13.907
   76    HE2  PHE  12           HE2      PHE  12  -5.498  11.989  11.989
   77    HZ   PHE  12           HZ       PHE  12  -6.609  13.144  13.144
   78    H    PHE  13           HN       PHE  13  -0.710  10.215  10.215
   79    HA   PHE  13           HA       PHE  13  -2.596  10.327  10.327
   80   1HB   PHE  13           HB1      PHE  13  -1.154   8.302   8.302
   81   2HB   PHE  13           HB2      PHE  13  -0.062   8.785   8.785
   82    HD1  PHE  13           HD1      PHE  13  -3.616   7.975   7.975
   83    HD2  PHE  13           HD2      PHE  13  -0.674   8.305   8.305
   84    HE1  PHE  13           HE1      PHE  13  -5.205   7.038   7.038
   85    HE2  PHE  13           HE2      PHE  13  -2.266   7.367   7.367
   86    HZ   PHE  13           HZ       PHE  13  -4.530   6.732   6.732
   87    H    LEU  14           HN       LEU  14   0.806  11.174  11.174
   88    HA   LEU  14           HA       LEU  14   0.409  11.598  11.598
   89   1HB   LEU  14           HB1      LEU  14   2.466  12.921  12.921
   90   2HB   LEU  14           HB2      LEU  14   2.532  12.849  12.849
   91    HG   LEU  14           HG       LEU  14   4.054  11.246  11.246
   92   1HD1  LEU  14          HD11      LEU  14   2.573  10.210  10.210
   93   2HD1  LEU  14          HD12      LEU  14   1.523   9.605   9.605
   94   3HD1  LEU  14          HD13      LEU  14   3.165   9.002   9.002
   95   1HD2  LEU  14          HD21      LEU  14   3.679  11.233  11.233
   96   2HD2  LEU  14          HD22      LEU  14   3.846   9.595   9.595
   97   3HD2  LEU  14          HD23      LEU  14   2.261  10.209  10.209
   98    H    PHE  15           HN       PHE  15   0.807  13.899  13.899
   99    HA   PHE  15           HA       PHE  15   0.091  16.271  16.271
  100   1HB   PHE  15           HB1      PHE  15   1.043  16.832  16.832
  101   2HB   PHE  15           HB2      PHE  15   0.624  15.253  15.253
  102    HD1  PHE  15           HD1      PHE  15  -1.848  15.030  15.030
  103    HD2  PHE  15           HD2      PHE  15   0.184  18.747  18.747
  104    HE1  PHE  15           HE1      PHE  15  -3.377  16.074  16.074
  105    HE2  PHE  15           HE2      PHE  15  -1.361  19.792  19.792
  106    HZ   PHE  15           HZ       PHE  15  -3.132  18.451  18.451
  107    H    CYS  16           HN       MER  16  -2.008  13.959  13.959
  108    HA   CYS  16           HA       MER  16  -4.384  15.455  15.455
  109   1HB   CYS  16           HB1      MER  16  -5.605  13.411  13.411
  110   2HB   CYS  16           HB2      MER  16  -4.110  13.311  13.311
  111    H    SER  17           HN       SER  17  -3.081  12.927  12.927
  112    HA   SER  17           HA       SER  17  -5.108  12.802  12.802
  113   1HB   SER  17           HB1      SER  17  -2.088  12.867  12.867
  114   2HB   SER  17           HB2      SER  17  -3.310  12.283  12.283
  115    HG   SER  17           HG       SER  17  -3.364  10.509  10.509
  116    H    GLU  18           HN       GLU  18  -2.519  15.094  15.094
  117    HA   GLU  18           HA       GLU  18  -3.104  16.654  16.654
  118   1HB   GLU  18           HB1      GLU  18  -1.034  16.706  16.706
  119   2HB   GLU  18           HB2      GLU  18  -1.891  17.479  17.479
  120   1HG   GLU  18           HG1      GLU  18  -2.254  18.884  18.884
  121   2HG   GLU  18           HG2      GLU  18  -0.569  18.791  18.791
  122    H    TYR  19           HN       TYR  19  -4.370  16.841  16.841
  123    HA   TYR  19           HA       TYR  19  -5.952  19.268  19.268
  124   1HB   TYR  19           HB1      TYR  19  -5.554  17.349  17.349
  125   2HB   TYR  19           HB2      TYR  19  -6.922  18.489  18.489
  126    HD1  TYR  19           HD1      TYR  19  -3.282  18.477  18.477
  127    HD2  TYR  19           HD2      TYR  19  -6.522  20.555  20.555
  128    HE1  TYR  19           HE1      TYR  19  -1.740  20.231  20.231
  129    HE2  TYR  19           HE2      TYR  19  -4.987  22.310  22.310
  130    HH   TYR  19           HH       TYR  19  -2.638  22.627  22.627
  131    H    ARG  20           HN       ARG  20  -6.630  15.917  15.917
  132    HA   ARG  20           HA       ARG  20  -9.200  15.437  15.437
  133   1HB   ARG  20           HB1      ARG  20  -7.880  13.728  13.728
  134   2HB   ARG  20           HB2      ARG  20  -7.519  14.585  14.585
  135   1HG   ARG  20           HG1      ARG  20  -9.771  14.201  14.201
  136   2HG   ARG  20           HG2      ARG  20 -10.332  13.627  13.627
  137   1HD   ARG  20           HD1      ARG  20  -9.828  11.746  11.746
  138   2HD   ARG  20           HD2      ARG  20  -8.832  11.654  11.654
  139    HE   ARG  20           HE       ARG  20  -7.044  12.846  12.846
  140   1HH1  ARG  20          HH11      ARG  20  -8.351  13.141  13.141
  141   2HH1  ARG  20          HH12      ARG  20  -7.984  11.675  11.675
  142   1HH2  ARG  20          HH21      ARG  20  -7.068   9.979   9.979
  143   2HH2  ARG  20          HH22      ARG  20  -7.237   9.833   9.833
  144    HA   PRO  21           HA       PRO  21 -11.251  17.199  17.199
  145   1HB   PRO  21           HB1      PRO  21  -9.923  18.420  18.420
  146   2HB   PRO  21           HB2      PRO  21  -9.874  16.652  16.652
  147   1HG   PRO  21           HG1      PRO  21  -7.834  18.670  18.670
  148   2HG   PRO  21           HG2      PRO  21  -7.525  17.317  17.317
  149   1HD   PRO  21           HD1      PRO  21  -7.225  16.965  16.965
  150   2HD   PRO  21           HD2      PRO  21  -7.985  15.688  15.688
  151    H    LYS  22           HN       LYS  22  -8.581  19.163  19.163
  152    HA   LYS  22           HA       LYS  22  -9.617  21.754  21.754
  153   1HB   LYS  22           HB1      LYS  22  -7.277  21.000  21.000
  154   2HB   LYS  22           HB2      LYS  22  -7.685  20.813  20.813
  155   1HG   LYS  22           HG1      LYS  22  -7.200  22.993  22.993
  156   2HG   LYS  22           HG2      LYS  22  -8.602  23.425  23.425
  157   1HD   LYS  22           HD1      LYS  22  -6.969  24.555  24.555
  158   2HD   LYS  22           HD2      LYS  22  -6.946  23.045  23.045
  159   1HE   LYS  22           HE1      LYS  22  -5.027  23.887  23.887
  160   2HE   LYS  22           HE2      LYS  22  -4.642  23.718  23.718
  161   1HZ   LYS  22           HZ1      LYS  22  -5.672  21.273  21.273
  162   2HZ   LYS  22           HZ2      LYS  22  -4.531  21.788  21.788
  163   3HZ   LYS  22           HZ3      LYS  22  -4.100  21.642  21.642
  164    H    ILE  23           HN       ILE  23  -9.987  19.598  19.598
  165    HA   ILE  23           HA       ILE  23 -11.336  21.741  21.741
  166    HB   ILE  23           HB       ILE  23 -11.259  18.802  18.802
  167   1HG1  ILE  23          HG11      ILE  23  -9.149  20.862  20.862
  168   2HG1  ILE  23          HG12      ILE  23  -8.878  19.717  19.717
  169   1HG2  ILE  23          HG21      ILE  23 -12.733  20.398  20.398
  170   2HG2  ILE  23          HG22      ILE  23 -11.345  21.426  21.426
  171   3HG2  ILE  23          HG23      ILE  23 -11.432  19.832  19.832
  172   1HD1  ILE  23          HD11      ILE  23  -9.575  18.938  18.938
  173   2HD1  ILE  23          HD12      ILE  23  -7.984  18.848  18.848
  174   3HD1  ILE  23          HD13      ILE  23  -9.284  17.837  17.837
  175    H    LYS  24           HN       LYS  24 -11.904  18.711  18.711
  176    HA   LYS  24           HA       LYS  24 -14.664  18.391  18.391
  177   1HB   LYS  24           HB1      LYS  24 -12.918  16.825  16.825
  178   2HB   LYS  24           HB2      LYS  24 -12.903  17.557  17.557
  179   1HG   LYS  24           HG1      LYS  24 -14.750  16.324  16.324
  180   2HG   LYS  24           HG2      LYS  24 -15.684  16.877  16.877
  181   1HD   LYS  24           HD1      LYS  24 -15.537  14.458  14.458
  182   2HD   LYS  24           HD2      LYS  24 -14.567  15.121  15.121
  183   1HE   LYS  24           HE1      LYS  24 -13.290  13.325  13.325
  184   2HE   LYS  24           HE2      LYS  24 -12.515  14.835  14.835
  185   1HZ   LYS  24           HZ1      LYS  24 -14.498  14.307  14.307
  186   2HZ   LYS  24           HZ2      LYS  24 -13.578  12.894  12.894
  187   3HZ   LYS  24           HZ3      LYS  24 -12.810  14.352  14.352
  188    H    GLY  25           HN       GLY  25 -12.901  20.444  20.444
  189   1HA   GLY  25           HA1      GLY  25 -14.957  21.006  21.006
  190   2HA   GLY  25           HA2      GLY  25 -13.426  21.868  21.868
  191    H    GLU  26           HN       GLU  26 -13.473  22.672  22.672
  192    HA   GLU  26           HA       GLU  26 -15.194  24.949  24.949
  193   1HB   GLU  26           HB1      GLU  26 -13.576  23.713  23.713
  194   2HB   GLU  26           HB2      GLU  26 -14.216  25.340  25.340
  195   1HG   GLU  26           HG1      GLU  26 -12.280  24.343  24.343
  196   2HG   GLU  26           HG2      GLU  26 -11.737  25.099  25.099
  197    H    HIS  27           HN       HIS  27 -15.163  22.043  22.043
  198    HA   HIS  27           HA       HIS  27 -17.971  22.418  22.418
  199   1HB   HIS  27           HB1      HIS  27 -15.872  20.982  20.982
  200   2HB   HIS  27           HB2      HIS  27 -17.430  21.638  21.638
  201    HD1  HIS  27           HD1      HIS  27 -17.493  24.372  24.372
  202    HD2  HIS  27           HD2      HIS  27 -13.769  22.716  22.716
  203    HE1  HIS  27           HE1      HIS  27 -15.972  26.210  26.210
  204    HA   PRO  28           HA       PRO  28 -18.144  18.231  18.231
  205   1HB   PRO  28           HB1      PRO  28 -19.973  18.682  18.682
  206   2HB   PRO  28           HB2      PRO  28 -18.293  19.133  19.133
  207   1HG   PRO  28           HG1      PRO  28 -20.553  20.934  20.934
  208   2HG   PRO  28           HG2      PRO  28 -19.466  21.216  21.216
  209   1HD   PRO  28           HD1      PRO  28 -18.932  22.263  22.263
  210   2HD   PRO  28           HD2      PRO  28 -17.615  21.789  21.789
  211    H    GLY  29           HN       GLY  29 -18.840  19.149  19.149
  212   1HA   GLY  29           HA1      GLY  29 -21.710  18.567  18.567
  213   2HA   GLY  29           HA2      GLY  29 -20.851  19.776  19.776
  214    H    LEU  30           HN       LEU  30 -18.402  18.104  18.104
  215    HA   LEU  30           HA       LEU  30 -19.225  16.395  16.395
  216   1HB   LEU  30           HB1      LEU  30 -16.387  16.309  16.309
  217   2HB   LEU  30           HB2      LEU  30 -17.290  17.069  17.069
  218    HG   LEU  30           HG       LEU  30 -16.587  18.452  18.452
  219   1HD1  LEU  30          HD11      LEU  30 -14.531  17.776  17.776
  220   2HD1  LEU  30          HD12      LEU  30 -15.176  18.572  18.572
  221   3HD1  LEU  30          HD13      LEU  30 -14.745  19.512  19.512
  222   1HD2  LEU  30          HD21      LEU  30 -17.442  19.500  19.500
  223   2HD2  LEU  30          HD22      LEU  30 -18.480  19.482  19.482
  224   3HD2  LEU  30          HD23      LEU  30 -17.045  20.492  20.492
  225    H    SER  31           HN       SER  31 -17.573  14.493  14.493
  226    HA   SER  31           HA       SER  31 -17.827  12.791  12.791
  227   1HB   SER  31           HB1      SER  31 -19.095  12.084  12.084
  228   2HB   SER  31           HB2      SER  31 -17.513  11.859  11.859
  229    HG   SER  31           HG       SER  31 -17.519  10.751  10.751
  230    H    ILE  32           HN       ILE  32 -16.116  10.904  10.904
  231    HA   ILE  32           HA       ILE  32 -13.518  12.152  12.152
  232    HB   ILE  32           HB       ILE  32 -14.383  10.345  10.345
  233   1HG1  ILE  32          HG11      ILE  32 -12.323   8.926   8.926
  234   2HG1  ILE  32          HG12      ILE  32 -11.830   9.495   9.495
  235   1HG2  ILE  32          HG21      ILE  32 -15.597   8.986   8.986
  236   2HG2  ILE  32          HG22      ILE  32 -14.101   8.549   8.549
  237   3HG2  ILE  32          HG23      ILE  32 -14.425   7.973   7.973
  238   1HD1  ILE  32          HD11      ILE  32 -12.087  11.244  11.244
  239   2HD1  ILE  32          HD12      ILE  32 -10.592  10.697  10.697
  240   3HD1  ILE  32          HD13      ILE  32 -11.613  11.836  11.836
  241    H    GLY  33           HN       GLY  33 -15.260  11.425  11.425
  242   1HA   GLY  33           HA1      GLY  33 -13.121  10.453  10.453
  243   2HA   GLY  33           HA2      GLY  33 -14.856  10.353  10.353
  244    H    ASP  34           HN       ASP  34 -14.747  13.212  13.212
  245    HA   ASP  34           HA       ASP  34 -14.311  14.721  14.721
  246   1HB   ASP  34           HB1      ASP  34 -15.988  15.125  15.125
  247   2HB   ASP  34           HB2      ASP  34 -15.913  16.377  16.377
  248    H    VAL  35           HN       VAL  35 -13.954  14.704  14.704
  249    HA   VAL  35           HA       VAL  35 -12.293  17.022  17.022
  250    HB   VAL  35           HB       VAL  35 -12.684  14.506  14.506
  251   1HG1  VAL  35          HG11      VAL  35 -11.296  17.087  17.087
  252   2HG1  VAL  35          HG12      VAL  35 -11.676  15.773  15.773
  253   3HG1  VAL  35          HG13      VAL  35 -10.521  15.526  15.526
  254   1HG2  VAL  35          HG21      VAL  35 -14.734  15.913  15.913
  255   2HG2  VAL  35          HG22      VAL  35 -14.080  15.907  15.907
  256   3HG2  VAL  35          HG23      VAL  35 -13.829  17.300  17.300
  257    H    ALA  36           HN       ALA  36 -11.848  13.814  13.814
  258    HA   ALA  36           HA       ALA  36  -8.937  13.838  13.838
  259   1HB   ALA  36           HB1      ALA  36 -10.192  11.861  11.861
  260   2HB   ALA  36           HB2      ALA  36 -10.880  11.725  11.725
  261   3HB   ALA  36           HB3      ALA  36  -9.161  11.458  11.458
  262    H    LYS  37           HN       LYS  37 -11.501  13.568  13.568
  263    HA   LYS  37           HA       LYS  37  -9.562  13.418  13.418
  264   1HB   LYS  37           HB1      LYS  37 -11.828  12.603  12.603
  265   2HB   LYS  37           HB2      LYS  37 -12.488  14.211  14.211
  266   1HG   LYS  37           HG1      LYS  37 -12.528  13.585  13.585
  267   2HG   LYS  37           HG2      LYS  37 -11.458  14.956  14.956
  268   1HD   LYS  37           HD1      LYS  37  -9.465  13.521  13.521
  269   2HD   LYS  37           HD2      LYS  37 -10.445  12.068  12.068
  270   1HE   LYS  37           HE1      LYS  37 -10.490  14.154  14.154
  271   2HE   LYS  37           HE2      LYS  37  -9.574  12.654  12.654
  272   1HZ   LYS  37           HZ1      LYS  37 -12.189  12.025  12.025
  273   2HZ   LYS  37           HZ2      LYS  37 -12.268  13.058  13.058
  274   3HZ   LYS  37           HZ3      LYS  37 -11.361  11.623  11.623
  275    H    LYS  38           HN       LYS  38 -10.833  16.096  16.096
  276    HA   LYS  38           HA       LYS  38 -10.117  18.100  18.100
  277   1HB   LYS  38           HB1      LYS  38 -12.061  18.343  18.343
  278   2HB   LYS  38           HB2      LYS  38 -10.926  18.361  18.361
  279   1HG   LYS  38           HG1      LYS  38  -9.930  20.433  20.433
  280   2HG   LYS  38           HG2      LYS  38 -10.818  20.384  20.384
  281   1HD   LYS  38           HD1      LYS  38 -12.970  20.482  20.482
  282   2HD   LYS  38           HD2      LYS  38 -12.046  20.618  20.618
  283   1HE   LYS  38           HE1      LYS  38 -11.055  22.736  22.736
  284   2HE   LYS  38           HE2      LYS  38 -11.856  22.575  22.575
  285   1HZ   LYS  38           HZ1      LYS  38 -13.775  22.314  22.314
  286   2HZ   LYS  38           HZ2      LYS  38 -12.853  23.701  23.701
  287   3HZ   LYS  38           HZ3      LYS  38 -13.626  23.528  23.528
  288    H    LEU  39           HN       LEU  39  -9.261  17.235  17.235
  289    HA   LEU  39           HA       LEU  39  -6.889  18.648  18.648
  290   1HB   LEU  39           HB1      LEU  39  -8.004  17.548  17.548
  291   2HB   LEU  39           HB2      LEU  39  -7.990  16.023  16.023
  292    HG   LEU  39           HG       LEU  39  -5.725  15.876  15.876
  293   1HD1  LEU  39          HD11      LEU  39  -5.891  18.257  18.257
  294   2HD1  LEU  39          HD12      LEU  39  -4.465  17.253  17.253
  295   3HD1  LEU  39          HD13      LEU  39  -5.009  18.243  18.243
  296   1HD2  LEU  39          HD21      LEU  39  -7.180  14.750  14.750
  297   2HD2  LEU  39          HD22      LEU  39  -5.723  15.284  15.284
  298   3HD2  LEU  39          HD23      LEU  39  -7.192  16.202  16.202
  299    H    GLY  40           HN       GLY  40  -7.364  15.510  15.510
  300   1HA   GLY  40           HA1      GLY  40  -4.693  14.786  14.786
  301   2HA   GLY  40           HA2      GLY  40  -6.041  14.240  14.240
  302    H    GLU  41           HN       GLU  41  -6.905  16.625  16.625
  303    HA   GLU  41           HA       GLU  41  -5.067  16.994  16.994
  304   1HB   GLU  41           HB1      GLU  41  -7.152  18.860  18.860
  305   2HB   GLU  41           HB2      GLU  41  -6.375  19.064  19.064
  306   1HG   GLU  41           HG1      GLU  41  -7.262  16.954  16.954
  307   2HG   GLU  41           HG2      GLU  41  -7.871  16.505  16.505
  308    H    MET  42           HN       MET  42  -5.744  18.979  18.979
  309    HA   MET  42           HA       MET  42  -3.910  21.065  21.065
  310   1HB   MET  42           HB1      MET  42  -4.430  19.571  19.571
  311   2HB   MET  42           HB2      MET  42  -3.853  21.208  21.208
  312   1HG   MET  42           HG1      MET  42  -6.539  20.345  20.345
  313   2HG   MET  42           HG2      MET  42  -6.368  20.891  20.891
  314   1HE   MET  42           HE1      MET  42  -6.362  21.709  21.709
  315   2HE   MET  42           HE2      MET  42  -7.962  21.808  21.808
  316   3HE   MET  42           HE3      MET  42  -7.212  23.241  23.241
  317    H    TRP  43           HN       TRP  43  -3.378  17.951  17.951
  318    HA   TRP  43           HA       TRP  43  -0.710  18.044  18.044
  319   1HB   TRP  43           HB1      TRP  43  -2.046  16.072  16.072
  320   2HB   TRP  43           HB2      TRP  43  -2.343  15.740  15.740
  321    HD1  TRP  43           HD1      TRP  43  -0.742  14.134  14.134
  322    HE1  TRP  43           HE1      TRP  43   1.479  13.231  13.231
  323    HE3  TRP  43           HE3      TRP  43   0.089  16.733  16.733
  324    HZ2  TRP  43           HZ2      TRP  43   3.499  13.480  13.480
  325    HZ3  TRP  43           HZ3      TRP  43   2.135  16.411  16.411
  326    HH2  TRP  43           HH2      TRP  43   3.852  14.788  14.788
  327    H    ASN  44           HN       ASN  44  -2.004  17.073  17.073
  328    HA   ASN  44           HA       ASN  44   0.484  16.600  16.600
  329   1HB   ASN  44           HB1      ASN  44  -2.167  17.430  17.430
  330   2HB   ASN  44           HB2      ASN  44  -0.803  16.701  16.701
  331   1HD2  ASN  44          HD21      ASN  44  -3.385  14.245  14.245
  332   2HD2  ASN  44          HD22      ASN  44  -3.720  15.838  15.838
  333    H    ASN  45           HN       ASN  45  -0.814  19.447  19.447
  334    HA   ASN  45           HA       ASN  45   1.089  21.111  21.111
  335   1HB   ASN  45           HB1      ASN  45  -1.624  22.179  22.179
  336   2HB   ASN  45           HB2      ASN  45  -0.557  22.814  22.814
  337   1HD2  ASN  45          HD21      ASN  45  -3.423  20.201  20.201
  338   2HD2  ASN  45          HD22      ASN  45  -3.275  20.991  20.991
  339    H    THR  46           HN       THR  46   1.386  19.978  19.978
  340    HA   THR  46           HA       THR  46   0.870  22.167  22.167
  341    HB   THR  46           HB       THR  46   1.025  19.740  19.740
  342    HG1  THR  46           HG1      THR  46   1.558  20.735  20.735
  343   1HG2  THR  46          HG21      THR  46   3.128  19.058  19.058
  344   2HG2  THR  46          HG22      THR  46   4.063  20.134  20.134
  345   3HG2  THR  46          HG23      THR  46   3.245  18.759  18.759
  346    H    ALA  47           HN       ALA  47   3.549  20.908  20.908
  347    HA   ALA  47           HA       ALA  47   4.947  23.225  23.225
  348   1HB   ALA  47           HB1      ALA  47   6.110  21.930  21.930
  349   2HB   ALA  47           HB2      ALA  47   6.874  23.213  23.213
  350   3HB   ALA  47           HB3      ALA  47   5.404  23.535  23.535
  351    H    ALA  48           HN       ALA  48   5.518  20.118  20.118
  352    HA   ALA  48           HA       ALA  48   6.109  18.067  18.067
  353   1HB   ALA  48           HB1      ALA  48   6.311  19.141  19.141
  354   2HB   ALA  48           HB2      ALA  48   7.872  19.803  19.803
  355   3HB   ALA  48           HB3      ALA  48   7.634  18.067  18.067
  356    H    ASP  49           HN       ASP  49   7.933  20.909  20.909
  357    HA   ASP  49           HA       ASP  49  10.295  19.585  19.585
  358   1HB   ASP  49           HB1      ASP  49   9.509  22.539  22.539
  359   2HB   ASP  49           HB2      ASP  49  11.105  21.923  21.923
  360    H    ASP  50           HN       ASP  50   7.255  20.382  20.382
  361    HA   ASP  50           HA       ASP  50   7.930  20.649  20.649
  362   1HB   ASP  50           HB1      ASP  50   6.522  22.477  22.477
  363   2HB   ASP  50           HB2      ASP  50   5.289  21.258  21.258
  364    H    LYS  51           HN       LYS  51   7.154  18.503  18.503
  365    HA   LYS  51           HA       LYS  51   5.328  16.768  16.768
  366   1HB   LYS  51           HB1      LYS  51   6.765  16.303  16.303
  367   2HB   LYS  51           HB2      LYS  51   5.709  15.136  15.136
  368   1HG   LYS  51           HG1      LYS  51   3.830  16.765  16.765
  369   2HG   LYS  51           HG2      LYS  51   4.929  17.846  17.846
  370   1HD   LYS  51           HD1      LYS  51   5.344  16.098  16.098
  371   2HD   LYS  51           HD2      LYS  51   4.305  14.981  14.981
  372   1HE   LYS  51           HE1      LYS  51   2.378  16.386  16.386
  373   2HE   LYS  51           HE2      LYS  51   3.345  17.639  17.639
  374   1HZ   LYS  51           HZ1      LYS  51   3.827  15.175  15.175
  375   2HZ   LYS  51           HZ2      LYS  51   2.148  15.421  15.421
  376   3HZ   LYS  51           HZ3      LYS  51   3.136  16.585  16.585
  377    H    GLN  52           HN       GLN  52   8.511  16.839  16.839
  378    HA   GLN  52           HA       GLN  52   9.888  14.710  14.710
  379   1HB   GLN  52           HB1      GLN  52  10.608  17.350  17.350
  380   2HB   GLN  52           HB2      GLN  52  11.230  17.113  17.113
  381   1HG   GLN  52           HG1      GLN  52  12.996  16.563  16.563
  382   2HG   GLN  52           HG2      GLN  52  12.458  15.057  15.057
  383   1HE2  GLN  52          HE21      GLN  52  10.586  15.102  15.102
  384   2HE2  GLN  52          HE22      GLN  52  10.036  15.970  15.970
  385    HA   PRO  53           HA       PRO  53  10.384  15.329  15.329
  386   1HB   PRO  53           HB1      PRO  53   8.113  16.643  16.643
  387   2HB   PRO  53           HB2      PRO  53   9.713  17.358  17.358
  388   1HG   PRO  53           HG1      PRO  53   7.387  17.404  17.404
  389   2HG   PRO  53           HG2      PRO  53   8.349  18.773  18.773
  390   1HD   PRO  53           HD1      PRO  53   9.030  17.736  17.736
  391   2HD   PRO  53           HD2      PRO  53  10.347  17.948  17.948
  392    H    TYR  54           HN       TYR  54   7.051  15.374  15.374
  393    HA   TYR  54           HA       TYR  54   6.117  13.190  13.190
  394   1HB   TYR  54           HB1      TYR  54   5.017  14.441  14.441
  395   2HB   TYR  54           HB2      TYR  54   4.146  13.233  13.233
  396    HD1  TYR  54           HD1      TYR  54   4.333  13.983  13.983
  397    HD2  TYR  54           HD2      TYR  54   4.177  16.588  16.588
  398    HE1  TYR  54           HE1      TYR  54   3.495  15.786  15.786
  399    HE2  TYR  54           HE2      TYR  54   3.337  18.387  18.387
  400    HH   TYR  54           HH       TYR  54   3.218  19.055  19.055
  401    H    GLU  55           HN       GLU  55   6.847  13.512  13.512
  402    HA   GLU  55           HA       GLU  55   6.475  10.944  10.944
  403   1HB   GLU  55           HB1      GLU  55   7.764  13.376  13.376
  404   2HB   GLU  55           HB2      GLU  55   8.880  12.098  12.098
  405   1HG   GLU  55           HG1      GLU  55   6.942  10.904  10.904
  406   2HG   GLU  55           HG2      GLU  55   5.946  12.309  12.309
  407    H    LYS  56           HN       LYS  56   9.582  12.101  12.101
  408    HA   LYS  56           HA       LYS  56  11.135   9.856   9.856
  409   1HB   LYS  56           HB1      LYS  56  11.574  12.252  12.252
  410   2HB   LYS  56           HB2      LYS  56  11.171  11.454  11.454
  411   1HG   LYS  56           HG1      LYS  56  13.308  10.455  10.455
  412   2HG   LYS  56           HG2      LYS  56  13.653  11.558  11.558
  413   1HD   LYS  56           HD1      LYS  56  13.650   9.955   9.955
  414   2HD   LYS  56           HD2      LYS  56  12.212   9.166   9.166
  415   1HE   LYS  56           HE1      LYS  56  15.013   8.888   8.888
  416   2HE   LYS  56           HE2      LYS  56  14.193   7.674   7.674
  417   1HZ   LYS  56           HZ1      LYS  56  12.506   8.412   8.412
  418   2HZ   LYS  56           HZ2      LYS  56  14.041   8.067   8.067
  419   3HZ   LYS  56           HZ3      LYS  56  13.232   6.909   6.909
  420    H    LYS  57           HN       LYS  57   8.678  10.459  10.459
  421    HA   LYS  57           HA       LYS  57   9.223   8.014   8.014
  422   1HB   LYS  57           HB1      LYS  57   6.756   9.833   9.833
  423   2HB   LYS  57           HB2      LYS  57   6.957   8.463   8.463
  424   1HG   LYS  57           HG1      LYS  57   9.109   9.479   9.479
  425   2HG   LYS  57           HG2      LYS  57   8.773  10.907  10.907
  426   1HD   LYS  57           HD1      LYS  57   6.649  11.276  11.276
  427   2HD   LYS  57           HD2      LYS  57   6.937   9.817   9.817
  428   1HE   LYS  57           HE1      LYS  57   8.784  12.236  12.236
  429   2HE   LYS  57           HE2      LYS  57   7.643  11.843  11.843
  430   1HZ   LYS  57           HZ1      LYS  57   9.214   9.583   9.583
  431   2HZ   LYS  57           HZ2      LYS  57  10.233  10.918  10.918
  432   3HZ   LYS  57           HZ3      LYS  57   9.096  10.463  10.463
  433    H    ALA  58           HN       ALA  58   6.719   9.019   9.019
  434    HA   ALA  58           HA       ALA  58   5.203   6.699   6.699
  435   1HB   ALA  58           HB1      ALA  58   4.774   8.772   8.772
  436   2HB   ALA  58           HB2      ALA  58   6.155   8.426   8.426
  437   3HB   ALA  58           HB3      ALA  58   4.757   7.365   7.365
  438    H    ALA  59           HN       ALA  59   8.179   7.446   7.446
  439    HA   ALA  59           HA       ALA  59   8.554   5.077   5.077
  440   1HB   ALA  59           HB1      ALA  59  10.067   7.053   7.053
  441   2HB   ALA  59           HB2      ALA  59  10.709   6.708   6.708
  442   3HB   ALA  59           HB3      ALA  59  11.000   5.591   5.591
  443    H    LYS  60           HN       LYS  60  10.055   5.716   5.716
  444    HA   LYS  60           HA       LYS  60  11.149   3.378   3.378
  445   1HB   LYS  60           HB1      LYS  60  10.989   5.553   5.553
  446   2HB   LYS  60           HB2      LYS  60   9.419   5.069   5.069
  447   1HG   LYS  60           HG1      LYS  60  10.494   3.031   3.031
  448   2HG   LYS  60           HG2      LYS  60  12.052   3.608   3.608
  449   1HD   LYS  60           HD1      LYS  60  10.210   5.024   5.024
  450   2HD   LYS  60           HD2      LYS  60  11.686   4.175   4.175
  451   1HE   LYS  60           HE1      LYS  60  12.309   6.483   6.483
  452   2HE   LYS  60           HE2      LYS  60  12.921   5.849   5.849
  453   1HZ   LYS  60           HZ1      LYS  60  10.295   6.713   6.713
  454   2HZ   LYS  60           HZ2      LYS  60  11.147   7.950   7.950
  455   3HZ   LYS  60           HZ3      LYS  60  11.728   7.324   7.324
  456    H    LEU  61           HN       LEU  61   7.678   4.036   4.036
  457    HA   LEU  61           HA       LEU  61   7.218   1.314   1.314
  458   1HB   LEU  61           HB1      LEU  61   4.803   2.076   2.076
  459   2HB   LEU  61           HB2      LEU  61   5.945   3.039   3.039
  460    HG   LEU  61           HG       LEU  61   5.966   4.627   4.627
  461   1HD1  LEU  61          HD11      LEU  61   3.309   3.200   3.200
  462   2HD1  LEU  61          HD12      LEU  61   3.836   4.662   4.662
  463   3HD1  LEU  61          HD13      LEU  61   4.634   3.150   3.150
  464   1HD2  LEU  61          HD21      LEU  61   5.079   5.190   5.190
  465   2HD2  LEU  61          HD22      LEU  61   4.057   5.848   5.848
  466   3HD2  LEU  61          HD23      LEU  61   3.556   4.410   4.410
  467    H    LYS  62           HN       LYS  62   6.690   3.026   3.026
  468    HA   LYS  62           HA       LYS  62   5.113   1.204   1.204
  469   1HB   LYS  62           HB1      LYS  62   6.185   3.573   3.573
  470   2HB   LYS  62           HB2      LYS  62   7.546   2.633   2.633
  471   1HG   LYS  62           HG1      LYS  62   4.681   2.358   2.358
  472   2HG   LYS  62           HG2      LYS  62   5.938   3.275   3.275
  473   1HD   LYS  62           HD1      LYS  62   7.280   1.145   1.145
  474   2HD   LYS  62           HD2      LYS  62   5.931   0.261   0.261
  475   1HE   LYS  62           HE1      LYS  62   5.780   0.181   0.181
  476   2HE   LYS  62           HE2      LYS  62   4.429   1.080   1.080
  477   1HZ   LYS  62           HZ1      LYS  62   6.541   2.863   2.863
  478   2HZ   LYS  62           HZ2      LYS  62   6.333   1.940   1.940
  479   3HZ   LYS  62           HZ3      LYS  62   5.024   2.808   2.808
  480    H    GLU  63           HN       GLU  63   8.500   1.457   1.457
  481    HA   GLU  63           HA       GLU  63   9.547  -0.837  -0.837
  482   1HB   GLU  63           HB1      GLU  63  10.906   1.107   1.107
  483   2HB   GLU  63           HB2      GLU  63  10.497   0.774   0.774
  484   1HG   GLU  63           HG1      GLU  63  11.700  -1.468  -1.468
  485   2HG   GLU  63           HG2      GLU  63  12.220  -0.988  -0.988
  486    H    LYS  64           HN       LYS  64   8.281  -0.275  -0.275
  487    HA   LYS  64           HA       LYS  64   8.957  -2.710  -2.710
  488   1HB   LYS  64           HB1      LYS  64   7.752  -0.702  -0.702
  489   2HB   LYS  64           HB2      LYS  64   6.256  -1.360  -1.360
  490   1HG   LYS  64           HG1      LYS  64   6.725  -3.525  -3.525
  491   2HG   LYS  64           HG2      LYS  64   8.174  -2.811  -2.811
  492   1HD   LYS  64           HD1      LYS  64   6.502  -2.594  -2.594
  493   2HD   LYS  64           HD2      LYS  64   6.737  -0.996  -0.996
  494   1HE   LYS  64           HE1      LYS  64   4.330  -1.462  -1.462
  495   2HE   LYS  64           HE2      LYS  64   4.694  -1.287  -1.287
  496   1HZ   LYS  64           HZ1      LYS  64   5.039  -3.979  -3.979
  497   2HZ   LYS  64           HZ2      LYS  64   3.534  -3.452  -3.452
  498   3HZ   LYS  64           HZ3      LYS  64   3.912  -3.303  -3.303
  499    H    TYR  65           HN       TYR  65   6.111  -1.835  -1.835
  500    HA   TYR  65           HA       TYR  65   4.764  -4.301  -4.301
  501   1HB   TYR  65           HB1      TYR  65   3.497  -2.531  -2.531
  502   2HB   TYR  65           HB2      TYR  65   4.884  -1.786  -1.786
  503    HD1  TYR  65           HD1      TYR  65   3.221  -5.135  -5.135
  504    HD2  TYR  65           HD2      TYR  65   4.276  -1.413  -1.413
  505    HE1  TYR  65           HE1      TYR  65   2.365  -5.900  -5.900
  506    HE2  TYR  65           HE2      TYR  65   3.424  -2.189  -2.189
  507    HH   TYR  65           HH       TYR  65   3.043  -5.055  -5.055
  508    H    GLU  66           HN       GLU  66   7.133  -3.085  -3.085
  509    HA   GLU  66           HA       GLU  66   7.127  -5.182  -5.182
  510   1HB   GLU  66           HB1      GLU  66   9.526  -3.639  -3.639
  511   2HB   GLU  66           HB2      GLU  66   9.423  -4.591  -4.591
  512   1HG   GLU  66           HG1      GLU  66   7.158  -2.728  -2.728
  513   2HG   GLU  66           HG2      GLU  66   8.642  -1.834  -1.834
  514    H    LYS  67           HN       LYS  67   8.679  -5.209  -5.209
  515    HA   LYS  67           HA       LYS  67  10.018  -7.788  -7.788
  516   1HB   LYS  67           HB1      LYS  67  11.346  -7.517  -7.517
  517   2HB   LYS  67           HB2      LYS  67  11.328  -6.023  -6.023
  518   1HG   LYS  67           HG1      LYS  67   9.165  -5.821  -5.821
  519   2HG   LYS  67           HG2      LYS  67  10.467  -6.534  -6.534
  520   1HD   LYS  67           HD1      LYS  67  10.952  -4.078  -4.078
  521   2HD   LYS  67           HD2      LYS  67  10.320  -3.968  -3.968
  522   1HE   LYS  67           HE1      LYS  67  12.755  -3.711  -3.711
  523   2HE   LYS  67           HE2      LYS  67  12.254  -5.172  -5.172
  524   1HZ   LYS  67           HZ1      LYS  67  12.785  -5.813  -5.813
  525   2HZ   LYS  67           HZ2      LYS  67  14.079  -4.904  -4.904
  526   3HZ   LYS  67           HZ3      LYS  67  13.594  -6.318  -6.318
  527    H    ASP  68           HN       ASP  68   7.401  -6.527  -6.527
  528    HA   ASP  68           HA       ASP  68   6.860  -8.786  -8.786
  529   1HB   ASP  68           HB1      ASP  68   6.454  -6.416  -6.416
  530   2HB   ASP  68           HB2      ASP  68   5.241  -6.283  -6.283
  531    H    ILE  69           HN       ILE  69   6.279  -7.648  -7.648
  532    HA   ILE  69           HA       ILE  69   3.902  -9.364  -9.364
  533    HB   ILE  69           HB       ILE  69   4.267  -6.976  -6.976
  534   1HG1  ILE  69          HG11      ILE  69   2.469  -7.952  -7.952
  535   2HG1  ILE  69          HG12      ILE  69   3.431  -7.614  -7.614
  536   1HG2  ILE  69          HG21      ILE  69   6.539  -7.208  -7.208
  537   2HG2  ILE  69          HG22      ILE  69   6.132  -8.379  -8.379
  538   3HG2  ILE  69          HG23      ILE  69   5.553  -6.719  -6.719
  539   1HD1  ILE  69          HD11      ILE  69   4.185 -10.020 -10.020
  540   2HD1  ILE  69          HD12      ILE  69   3.127 -10.285 -10.285
  541   3HD1  ILE  69          HD13      ILE  69   2.441  -9.852  -9.852
  542    H    ALA  70           HN       ALA  70   7.308  -8.894  -8.894
  543    HA   ALA  70           HA       ALA  70   7.733 -11.206 -11.206
  544   1HB   ALA  70           HB1      ALA  70   9.474  -9.404  -9.404
  545   2HB   ALA  70           HB2      ALA  70   9.670  -9.906  -9.906
  546   3HB   ALA  70           HB3      ALA  70  10.128 -10.991 -10.991
  547    H    ALA  71           HN       ALA  71   7.372 -10.575 -10.575
  548    HA   ALA  71           HA       ALA  71   8.183 -13.185 -13.185
  549   1HB   ALA  71           HB1      ALA  71   6.628 -10.952 -10.952
  550   2HB   ALA  71           HB2      ALA  71   7.293 -12.367 -12.367
  551   3HB   ALA  71           HB3      ALA  71   8.369 -11.188 -11.188
  552    H    TYR  72           HN       TYR  72   5.177 -11.453 -11.453
  553    HA   TYR  72           HA       TYR  72   3.262 -13.286 -13.286
  554   1HB   TYR  72           HB1      TYR  72   2.453 -11.218 -11.218
  555   2HB   TYR  72           HB2      TYR  72   3.293 -11.386 -11.386
  556    HD1  TYR  72           HD1      TYR  72   0.674 -13.013 -13.013
  557    HD2  TYR  72           HD2      TYR  72   2.021 -12.180 -12.180
  558    HE1  TYR  72           HE1      TYR  72  -1.373 -14.003 -14.003
  559    HE2  TYR  72           HE2      TYR  72  -0.040 -13.169 -13.169
  560    HH   TYR  72           HH       TYR  72  -2.716 -13.974 -13.974
  561    H    ARG  73           HN       ARG  73   4.770 -13.038 -13.038
  562    HA   ARG  73           HA       ARG  73   3.633 -15.263 -15.263
  563   1HB   ARG  73           HB1      ARG  73   6.337 -13.902 -13.902
  564   2HB   ARG  73           HB2      ARG  73   5.694 -15.090 -15.090
  565   1HG   ARG  73           HG1      ARG  73   3.822 -13.644 -13.644
  566   2HG   ARG  73           HG2      ARG  73   4.248 -12.490 -12.490
  567   1HD   ARG  73           HD1      ARG  73   6.376 -11.978 -11.978
  568   2HD   ARG  73           HD2      ARG  73   6.086 -13.248 -13.248
  569    HE   ARG  73           HE       ARG  73   4.327 -10.831 -10.831
  570   1HH1  ARG  73          HH11      ARG  73   3.502 -13.115 -13.115
  571   2HH1  ARG  73          HH12      ARG  73   4.101 -12.647 -12.647
  572   1HH2  ARG  73          HH21      ARG  73   6.239 -10.216 -10.216
  573   2HH2  ARG  73          HH22      ARG  73   5.705 -10.948 -10.948
  574    H    ALA  74           HN       ALA  74   6.280 -14.785 -14.785
  575    HA   ALA  74           HA       ALA  74   7.149 -17.602 -17.602
  576   1HB   ALA  74           HB1      ALA  74   8.800 -15.813 -15.813
  577   2HB   ALA  74           HB2      ALA  74   8.311 -15.140 -15.140
  578   3HB   ALA  74           HB3      ALA  74   9.108 -16.708 -16.708
  579    H    LYS  75           HN       LYS  75   4.632 -17.000 -17.000
  580    HA   LYS  75           HA       LYS  75   3.318 -17.560 -17.560
  581   1HB   LYS  75           HB1      LYS  75   4.618 -19.696 -19.696
  582   2HB   LYS  75           HB2      LYS  75   5.840 -19.041 -19.041
  583   1HG   LYS  75           HG1      LYS  75   4.296 -18.993 -18.993
  584   2HG   LYS  75           HG2      LYS  75   2.925 -19.288 -19.288
  585   1HD   LYS  75           HD1      LYS  75   3.536 -21.326 -21.326
  586   2HD   LYS  75           HD2      LYS  75   3.718 -21.570 -21.570
  587   1HE   LYS  75           HE1      LYS  75   6.067 -20.837 -20.837
  588   2HE   LYS  75           HE2      LYS  75   5.607 -22.496 -22.496
  589   1HZ   LYS  75           HZ1      LYS  75   5.749 -21.145 -21.145
  590   2HZ   LYS  75           HZ2      LYS  75   7.157 -20.778 -20.778
  591   3HZ   LYS  75           HZ3      LYS  75   6.737 -22.396 -22.396
  592    H    GLY  76           HN       GLY  76   3.606 -15.281 -15.281
  593   1HA   GLY  76           HA1      GLY  76   5.002 -14.388 -14.388
  594   2HA   GLY  76           HA2      GLY  76   4.471 -13.340 -13.340
  595    H    LYS  77           HN       LYS  77   2.996 -15.850 -15.850
  596    HA   LYS  77           HA       LYS  77   0.627 -14.157 -14.157
  597   1HB   LYS  77           HB1      LYS  77   0.824 -17.191 -17.191
  598   2HB   LYS  77           HB2      LYS  77  -0.599 -16.262 -16.262
  599   1HG   LYS  77           HG1      LYS  77  -0.970 -16.999 -16.999
  600   2HG   LYS  77           HG2      LYS  77  -0.472 -15.330 -15.330
  601   1HD   LYS  77           HD1      LYS  77   1.710 -15.917 -15.917
  602   2HD   LYS  77           HD2      LYS  77   1.566 -17.571 -17.571
  603   1HE   LYS  77           HE1      LYS  77  -0.064 -16.301 -16.301
  604   2HE   LYS  77           HE2      LYS  77   1.289 -17.398 -17.398
  605   1HZ   LYS  77           HZ1      LYS  77  -0.534 -18.585 -18.585
  606   2HZ   LYS  77           HZ2      LYS  77  -1.389 -18.023 -18.023
  607   3HZ   LYS  77           HZ3      LYS  77  -0.087 -19.092 -19.092
  608    HA   PRO  78           HA       PRO  78   1.449 -16.444 -16.444
  609   1HB   PRO  78           HB1      PRO  78   4.481 -16.576 -16.576
  610   2HB   PRO  78           HB2      PRO  78   3.340 -17.716 -17.716
  611   1HG   PRO  78           HG1      PRO  78   4.359 -18.386 -18.386
  612   2HG   PRO  78           HG2      PRO  78   2.611 -18.543 -18.543
  613   1HD   PRO  78           HD1      PRO  78   4.125 -16.187 -16.187
  614   2HD   PRO  78           HD2      PRO  78   2.800 -17.138 -17.138
  615    H    ASP  79           HN       ASP  79   2.464 -13.586 -13.586
  616    HA   ASP  79           HA       ASP  79   2.859 -11.493 -11.493
  617   1HB   ASP  79           HB1      ASP  79   1.563 -12.666 -12.666
  618   2HB   ASP  79           HB2      ASP  79   1.637 -10.975 -10.975
  619    H    ALA  80           HN       ALA  80   5.068 -11.569 -11.569
  620    HA   ALA  80           HA       ALA  80   6.563 -12.442 -12.442
  621   1HB   ALA  80           HB1      ALA  80   7.536 -11.356 -11.356
  622   2HB   ALA  80           HB2      ALA  80   8.568 -12.003 -12.003
  623   3HB   ALA  80           HB3      ALA  80   7.443 -13.054 -13.054
  624    H    ALA  81           HN       ALA  81   6.194  -9.593  -9.593
  625    HA   ALA  81           HA       ALA  81   6.899  -7.843  -7.843
  626   1HB   ALA  81           HB1      ALA  81   7.383  -7.348  -7.348
  627   2HB   ALA  81           HB2      ALA  81   7.767  -6.225  -6.225
  628   3HB   ALA  81           HB3      ALA  81   8.610  -7.762  -7.762
  629   1H1   BME  16           HE1      MER  16  -8.302   9.727   9.727
  630   2H1   BME  16           HE2      MER  16  -8.868   9.204   9.204
  631   1H2   BME  16           HZ1      MER  16  -7.361  11.186  11.186
  632   2H2   BME  16           HZ2      MER  16  -6.685   9.768   9.768
  633    HO1  BME  16           HH       MER  16  -7.840   7.420   7.420

  Start of MODEL   24
    1    H    ASN   3           HN       ASN   3   1.109  -9.180  -9.180
    2    HA   ASN   3           HA       ASN   3   1.516 -11.509 -11.509
    3   1HB   ASN   3           HB1      ASN   3   0.491 -12.103 -12.103
    4   2HB   ASN   3           HB2      ASN   3  -0.810 -10.964 -10.964
    5   1HD2  ASN   3          HD21      ASN   3  -1.101 -14.671 -14.671
    6   2HD2  ASN   3          HD22      ASN   3   0.043 -14.187 -14.187
    7    H    ALA   4           HN       ALA   4   1.667 -10.083 -10.083
    8    HA   ALA   4           HA       ALA   4   0.857  -9.040  -9.040
    9   1HB   ALA   4           HB1      ALA   4  -1.141 -10.543 -10.543
   10   2HB   ALA   4           HB2      ALA   4  -1.944  -9.404  -9.404
   11   3HB   ALA   4           HB3      ALA   4  -1.560  -8.934  -8.934
   12    HA   PRO   5           HA       PRO   5   0.886  -5.337  -5.337
   13   1HB   PRO   5           HB1      PRO   5   3.034  -4.525  -4.525
   14   2HB   PRO   5           HB2      PRO   5   3.057  -4.506  -4.506
   15   1HG   PRO   5           HG1      PRO   5   4.444  -6.433  -6.433
   16   2HG   PRO   5           HG2      PRO   5   3.477  -6.851  -6.851
   17   1HD   PRO   5           HD1      PRO   5   2.651  -7.147  -7.147
   18   2HD   PRO   5           HD2      PRO   5   2.623  -8.365  -8.365
   19    H    LYS   6           HN       LYS   6  -0.131  -5.915  -5.915
   20    HA   LYS   6           HA       LYS   6  -1.461  -4.888  -4.888
   21   1HB   LYS   6           HB1      LYS   6  -1.990  -3.254  -3.254
   22   2HB   LYS   6           HB2      LYS   6  -2.763  -2.771  -2.771
   23   1HG   LYS   6           HG1      LYS   6  -3.441  -5.378  -5.378
   24   2HG   LYS   6           HG2      LYS   6  -3.063  -5.326  -5.326
   25   1HD   LYS   6           HD1      LYS   6  -5.294  -4.756  -4.756
   26   2HD   LYS   6           HD2      LYS   6  -4.668  -3.145  -3.145
   27   1HE   LYS   6           HE1      LYS   6  -5.784  -4.977  -4.977
   28   2HE   LYS   6           HE2      LYS   6  -6.620  -3.607  -3.607
   29   1HZ   LYS   6           HZ1      LYS   6  -4.148  -2.710  -2.710
   30   2HZ   LYS   6           HZ2      LYS   6  -4.874  -3.636  -3.636
   31   3HZ   LYS   6           HZ3      LYS   6  -5.698  -2.318  -2.318
   32    H    ARG   7           HN       ARG   7  -2.043  -2.285  -2.285
   33    HA   ARG   7           HA       ARG   7   0.555  -1.374  -1.374
   34   1HB   ARG   7           HB1      ARG   7  -2.305  -0.703  -0.703
   35   2HB   ARG   7           HB2      ARG   7  -0.940   0.068   0.068
   36   1HG   ARG   7           HG1      ARG   7  -0.348  -1.820  -1.820
   37   2HG   ARG   7           HG2      ARG   7  -0.863  -2.933  -2.933
   38   1HD   ARG   7           HD1      ARG   7  -2.252  -2.976  -2.976
   39   2HD   ARG   7           HD2      ARG   7  -3.180  -2.757  -2.757
   40    HE   ARG   7           HE       ARG   7  -2.407  -0.436  -0.436
   41   1HH1  ARG   7          HH11      ARG   7  -3.988  -0.465  -0.465
   42   2HH1  ARG   7          HH12      ARG   7  -5.583  -0.163  -0.163
   43   1HH2  ARG   7          HH21      ARG   7  -4.716  -0.855  -0.855
   44   2HH2  ARG   7          HH22      ARG   7  -6.007  -0.390  -0.390
   45    HA   PRO   8           HA       PRO   8   0.231   1.394   1.394
   46   1HB   PRO   8           HB1      PRO   8   2.791   2.475   2.475
   47   2HB   PRO   8           HB2      PRO   8   2.474   0.843   0.843
   48   1HG   PRO   8           HG1      PRO   8   3.133   1.723   1.723
   49   2HG   PRO   8           HG2      PRO   8   3.991   0.535   0.535
   50   1HD   PRO   8           HD1      PRO   8   2.166  -0.306  -0.306
   51   2HD   PRO   8           HD2      PRO   8   2.157  -1.031  -1.031
   52    HA   PRO   9           HA       PRO   9  -0.541   5.776   5.776
   53   1HB   PRO   9           HB1      PRO   9   2.346   6.113   6.113
   54   2HB   PRO   9           HB2      PRO   9   1.035   7.292   7.292
   55   1HG   PRO   9           HG1      PRO   9   1.437   5.754   5.754
   56   2HG   PRO   9           HG2      PRO   9  -0.225   5.849   5.849
   57   1HD   PRO   9           HD1      PRO   9   1.805   3.634   3.634
   58   2HD   PRO   9           HD2      PRO   9   0.055   3.478   3.478
   59    H    SER  10           HN       SER  10   0.110   7.544   7.544
   60    HA   SER  10           HA       SER  10   1.332   6.509   6.509
   61   1HB   SER  10           HB1      SER  10  -0.161   8.194   8.194
   62   2HB   SER  10           HB2      SER  10  -1.061   6.997   6.997
   63    HG   SER  10           HG       SER  10  -0.894   9.644   9.644
   64    H    ALA  11           HN       ALA  11   1.059   9.389   9.389
   65    HA   ALA  11           HA       ALA  11   3.359  10.608  10.608
   66   1HB   ALA  11           HB1      ALA  11   2.576  11.270  11.270
   67   2HB   ALA  11           HB2      ALA  11   3.873  12.026  12.026
   68   3HB   ALA  11           HB3      ALA  11   4.028  10.369  10.369
   69    H    PHE  12           HN       PHE  12   0.516  10.820  10.820
   70    HA   PHE  12           HA       PHE  12  -0.457  13.431  13.431
   71   1HB   PHE  12           HB1      PHE  12  -0.952  12.872  12.872
   72   2HB   PHE  12           HB2      PHE  12  -1.189  11.151  11.151
   73    HD1  PHE  12           HD1      PHE  12  -2.785  14.518  14.518
   74    HD2  PHE  12           HD2      PHE  12  -3.257  10.309  10.309
   75    HE1  PHE  12           HE1      PHE  12  -5.229  14.791  14.791
   76    HE2  PHE  12           HE2      PHE  12  -5.674  10.583  10.583
   77    HZ   PHE  12           HZ       PHE  12  -6.677  12.817  12.817
   78    H    PHE  13           HN       PHE  13  -0.104  10.667  10.667
   79    HA   PHE  13           HA       PHE  13  -2.775  10.569  10.569
   80   1HB   PHE  13           HB1      PHE  13  -1.310   8.537   8.537
   81   2HB   PHE  13           HB2      PHE  13  -0.443   8.821   8.821
   82    HD1  PHE  13           HD1      PHE  13  -2.057   9.098   9.098
   83    HD2  PHE  13           HD2      PHE  13  -3.150   7.154   7.154
   84    HE1  PHE  13           HE1      PHE  13  -3.853   7.903   7.903
   85    HE2  PHE  13           HE2      PHE  13  -4.944   5.963   5.963
   86    HZ   PHE  13           HZ       PHE  13  -5.299   6.335   6.335
   87    H    LEU  14           HN       LEU  14   0.691  10.954  10.954
   88    HA   LEU  14           HA       LEU  14   0.485  11.627  11.627
   89   1HB   LEU  14           HB1      LEU  14   2.431  12.873  12.873
   90   2HB   LEU  14           HB2      LEU  14   2.650  12.828  12.828
   91    HG   LEU  14           HG       LEU  14   4.136  11.252  11.252
   92   1HD1  LEU  14          HD11      LEU  14   2.926  10.177  10.177
   93   2HD1  LEU  14          HD12      LEU  14   1.741   9.515   9.515
   94   3HD1  LEU  14          HD13      LEU  14   3.412   8.984   8.984
   95   1HD2  LEU  14          HD21      LEU  14   3.571  11.151  11.151
   96   2HD2  LEU  14          HD22      LEU  14   3.802   9.531   9.531
   97   3HD2  LEU  14          HD23      LEU  14   2.182  10.118  10.118
   98    H    PHE  15           HN       PHE  15   0.584  13.654  13.654
   99    HA   PHE  15           HA       PHE  15  -0.023  16.173  16.173
  100   1HB   PHE  15           HB1      PHE  15   0.949  16.372  16.372
  101   2HB   PHE  15           HB2      PHE  15   0.233  14.846  14.846
  102    HD1  PHE  15           HD1      PHE  15  -2.187  14.919  14.919
  103    HD2  PHE  15           HD2      PHE  15   0.207  18.397  18.397
  104    HE1  PHE  15           HE1      PHE  15  -3.600  16.173  16.173
  105    HE2  PHE  15           HE2      PHE  15  -1.221  19.642  19.642
  106    HZ   PHE  15           HZ       PHE  15  -3.122  18.522  18.522
  107    H    CYS  16           HN       MER  16  -2.157  13.830  13.830
  108    HA   CYS  16           HA       MER  16  -4.541  15.286  15.286
  109   1HB   CYS  16           HB1      MER  16  -4.552  13.181  13.181
  110   2HB   CYS  16           HB2      MER  16  -4.150  12.271  12.271
  111    H    SER  17           HN       SER  17  -3.204  12.955  12.955
  112    HA   SER  17           HA       SER  17  -5.317  13.240  13.240
  113   1HB   SER  17           HB1      SER  17  -3.664  12.391  12.391
  114   2HB   SER  17           HB2      SER  17  -3.648  11.514  11.514
  115    HG   SER  17           HG       SER  17  -1.690  12.929  12.929
  116    H    GLU  18           HN       GLU  18  -2.210  14.895  14.895
  117    HA   GLU  18           HA       GLU  18  -2.115  16.537  16.537
  118   1HB   GLU  18           HB1      GLU  18  -0.507  16.608  16.608
  119   2HB   GLU  18           HB2      GLU  18  -1.688  17.411  17.411
  120   1HG   GLU  18           HG1      GLU  18  -1.774  19.345  19.345
  121   2HG   GLU  18           HG2      GLU  18  -0.558  18.582  18.582
  122    H    TYR  19           HN       TYR  19  -4.173  17.107  17.107
  123    HA   TYR  19           HA       TYR  19  -5.867  18.846  18.846
  124   1HB   TYR  19           HB1      TYR  19  -5.948  20.590  20.590
  125   2HB   TYR  19           HB2      TYR  19  -4.237  20.217  20.217
  126    HD1  TYR  19           HD1      TYR  19  -4.984  17.529  17.529
  127    HD2  TYR  19           HD2      TYR  19  -4.779  21.776  21.776
  128    HE1  TYR  19           HE1      TYR  19  -4.616  17.422  17.422
  129    HE2  TYR  19           HE2      TYR  19  -4.419  21.667  21.667
  130    HH   TYR  19           HH       TYR  19  -5.070  19.908  19.908
  131    H    ARG  20           HN       ARG  20  -6.687  16.274  16.274
  132    HA   ARG  20           HA       ARG  20  -8.618  16.635  16.635
  133   1HB   ARG  20           HB1      ARG  20  -7.720  14.427  14.427
  134   2HB   ARG  20           HB2      ARG  20  -8.034  14.287  14.287
  135   1HG   ARG  20           HG1      ARG  20 -10.430  14.121  14.121
  136   2HG   ARG  20           HG2      ARG  20 -10.249  14.643  14.643
  137   1HD   ARG  20           HD1      ARG  20 -10.585  12.165  12.165
  138   2HD   ARG  20           HD2      ARG  20  -9.077  12.565  12.565
  139    HE   ARG  20           HE       ARG  20  -7.972  12.190  12.190
  140   1HH1  ARG  20          HH11      ARG  20  -9.051  11.406  11.406
  141   2HH1  ARG  20          HH12      ARG  20  -9.741   9.825   9.825
  142   1HH2  ARG  20          HH21      ARG  20  -9.686   9.925   9.925
  143   2HH2  ARG  20          HH22      ARG  20 -10.111   8.960   8.960
  144    HA   PRO  21           HA       PRO  21 -11.691  16.664  16.664
  145   1HB   PRO  21           HB1      PRO  21  -9.994  17.342  17.342
  146   2HB   PRO  21           HB2      PRO  21 -11.278  16.139  16.139
  147   1HG   PRO  21           HG1      PRO  21  -8.720  15.297  15.297
  148   2HG   PRO  21           HG2      PRO  21  -9.824  14.547  14.547
  149   1HD   PRO  21           HD1      PRO  21  -7.906  16.886  16.886
  150   2HD   PRO  21           HD2      PRO  21  -7.991  15.343  15.343
  151    H    LYS  22           HN       LYS  22  -9.131  18.772  18.772
  152    HA   LYS  22           HA       LYS  22 -10.365  21.183  21.183
  153   1HB   LYS  22           HB1      LYS  22  -7.820  20.650  20.650
  154   2HB   LYS  22           HB2      LYS  22  -7.996  21.086  21.086
  155   1HG   LYS  22           HG1      LYS  22  -8.864  23.320  23.320
  156   2HG   LYS  22           HG2      LYS  22  -8.788  22.862  22.862
  157   1HD   LYS  22           HD1      LYS  22  -6.258  22.485  22.485
  158   2HD   LYS  22           HD2      LYS  22  -6.458  23.269  23.269
  159   1HE   LYS  22           HE1      LYS  22  -5.771  24.957  24.957
  160   2HE   LYS  22           HE2      LYS  22  -7.437  25.275  25.275
  161   1HZ   LYS  22           HZ1      LYS  22  -7.478  23.476  23.476
  162   2HZ   LYS  22           HZ2      LYS  22  -6.425  24.736  24.736
  163   3HZ   LYS  22           HZ3      LYS  22  -8.024  25.084  25.084
  164    H    ILE  23           HN       ILE  23 -10.071  19.625  19.625
  165    HA   ILE  23           HA       ILE  23 -11.159  21.959  21.959
  166    HB   ILE  23           HB       ILE  23 -11.063  19.041  19.041
  167   1HG1  ILE  23          HG11      ILE  23  -9.042  21.218  21.218
  168   2HG1  ILE  23          HG12      ILE  23  -8.783  20.117  20.117
  169   1HG2  ILE  23          HG21      ILE  23 -11.315  21.677  21.677
  170   2HG2  ILE  23          HG22      ILE  23 -11.250  20.084  20.084
  171   3HG2  ILE  23          HG23      ILE  23 -12.619  20.535  20.535
  172   1HD1  ILE  23          HD11      ILE  23  -9.050  18.196  18.196
  173   2HD1  ILE  23          HD12      ILE  23  -9.297  19.297  19.297
  174   3HD1  ILE  23          HD13      ILE  23  -7.742  19.249  19.249
  175    H    LYS  24           HN       LYS  24 -12.060  18.816  18.816
  176    HA   LYS  24           HA       LYS  24 -14.711  18.520  18.520
  177   1HB   LYS  24           HB1      LYS  24 -13.087  16.948  16.948
  178   2HB   LYS  24           HB2      LYS  24 -13.218  17.827  17.827
  179   1HG   LYS  24           HG1      LYS  24 -15.786  17.345  17.345
  180   2HG   LYS  24           HG2      LYS  24 -15.438  16.220  16.220
  181   1HD   LYS  24           HD1      LYS  24 -14.297  16.081  16.081
  182   2HD   LYS  24           HD2      LYS  24 -15.597  15.089  15.089
  183   1HE   LYS  24           HE1      LYS  24 -14.024  14.123  14.123
  184   2HE   LYS  24           HE2      LYS  24 -12.721  15.076  15.076
  185   1HZ   LYS  24           HZ1      LYS  24 -13.994  13.738  13.738
  186   2HZ   LYS  24           HZ2      LYS  24 -13.711  12.608  12.608
  187   3HZ   LYS  24           HZ3      LYS  24 -12.421  13.507  13.507
  188    H    GLY  25           HN       GLY  25 -13.281  20.097  20.097
  189   1HA   GLY  25           HA1      GLY  25 -15.515  20.823  20.823
  190   2HA   GLY  25           HA2      GLY  25 -13.965  21.665  21.665
  191    H    GLU  26           HN       GLU  26 -13.745  22.712  22.712
  192    HA   GLU  26           HA       GLU  26 -15.397  25.032  25.032
  193   1HB   GLU  26           HB1      GLU  26 -13.449  24.019  24.019
  194   2HB   GLU  26           HB2      GLU  26 -14.006  25.672  25.672
  195   1HG   GLU  26           HG1      GLU  26 -12.623  24.278  24.278
  196   2HG   GLU  26           HG2      GLU  26 -11.681  25.015  25.015
  197    H    HIS  27           HN       HIS  27 -15.188  22.303  22.303
  198    HA   HIS  27           HA       HIS  27 -17.744  23.026  23.026
  199   1HB   HIS  27           HB1      HIS  27 -15.390  21.511  21.511
  200   2HB   HIS  27           HB2      HIS  27 -16.813  22.110  22.110
  201    HD1  HIS  27           HD1      HIS  27 -17.031  24.883  24.883
  202    HD2  HIS  27           HD2      HIS  27 -13.291  23.260  23.260
  203    HE1  HIS  27           HE1      HIS  27 -15.439  26.750  26.750
  204    HA   PRO  28           HA       PRO  28 -18.530  18.880  18.880
  205   1HB   PRO  28           HB1      PRO  28 -20.627  19.533  19.533
  206   2HB   PRO  28           HB2      PRO  28 -18.980  19.888  19.888
  207   1HG   PRO  28           HG1      PRO  28 -20.919  21.770  21.770
  208   2HG   PRO  28           HG2      PRO  28 -20.088  22.065  22.065
  209   1HD   PRO  28           HD1      PRO  28 -19.020  22.956  22.956
  210   2HD   PRO  28           HD2      PRO  28 -17.953  22.384  22.384
  211    H    GLY  29           HN       GLY  29 -18.884  19.811  19.811
  212   1HA   GLY  29           HA1      GLY  29 -21.611  19.043  19.043
  213   2HA   GLY  29           HA2      GLY  29 -20.744  20.367  20.367
  214    H    LEU  30           HN       LEU  30 -18.194  18.755  18.755
  215    HA   LEU  30           HA       LEU  30 -18.167  17.280  17.280
  216   1HB   LEU  30           HB1      LEU  30 -16.002  17.557  17.557
  217   2HB   LEU  30           HB2      LEU  30 -15.729  17.040  17.040
  218    HG   LEU  30           HG       LEU  30 -16.458  19.758  19.758
  219   1HD1  LEU  30          HD11      LEU  30 -14.036  18.724  18.724
  220   2HD1  LEU  30          HD12      LEU  30 -14.292  20.405  20.405
  221   3HD1  LEU  30          HD13      LEU  30 -14.104  19.195  19.195
  222   1HD2  LEU  30          HD21      LEU  30 -16.248  18.927  18.927
  223   2HD2  LEU  30          HD22      LEU  30 -17.722  19.436  19.436
  224   3HD2  LEU  30          HD23      LEU  30 -16.412  20.577  20.577
  225    H    SER  31           HN       SER  31 -17.331  15.134  15.134
  226    HA   SER  31           HA       SER  31 -18.075  13.396  13.396
  227   1HB   SER  31           HB1      SER  31 -18.069  12.722  12.722
  228   2HB   SER  31           HB2      SER  31 -18.630  11.676  11.676
  229    HG   SER  31           HG       SER  31 -20.434  12.714  12.714
  230    H    ILE  32           HN       ILE  32 -16.830  11.264  11.264
  231    HA   ILE  32           HA       ILE  32 -14.077  11.804  11.804
  232    HB   ILE  32           HB       ILE  32 -15.350   9.875   9.875
  233   1HG1  ILE  32          HG11      ILE  32 -12.763   9.620   9.620
  234   2HG1  ILE  32          HG12      ILE  32 -13.680   8.266   8.266
  235   1HG2  ILE  32          HG21      ILE  32 -15.604   8.869   8.869
  236   2HG2  ILE  32          HG22      ILE  32 -16.046   7.938   7.938
  237   3HG2  ILE  32          HG23      ILE  32 -16.904   9.417   9.417
  238   1HD1  ILE  32          HD11      ILE  32 -13.030   8.705   8.705
  239   2HD1  ILE  32          HD12      ILE  32 -12.248   7.569   7.569
  240   3HD1  ILE  32          HD13      ILE  32 -13.935   7.362   7.362
  241    H    GLY  33           HN       GLY  33 -15.777  11.544  11.544
  242   1HA   GLY  33           HA1      GLY  33 -13.332  10.958  10.958
  243   2HA   GLY  33           HA2      GLY  33 -14.977  10.852  10.852
  244    H    ASP  34           HN       ASP  34 -14.820  13.600  13.600
  245    HA   ASP  34           HA       ASP  34 -14.246  15.300  15.300
  246   1HB   ASP  34           HB1      ASP  34 -15.984  15.643  15.643
  247   2HB   ASP  34           HB2      ASP  34 -15.760  16.979  16.979
  248    H    VAL  35           HN       VAL  35 -13.999  14.948  14.948
  249    HA   VAL  35           HA       VAL  35 -12.155  17.097  17.097
  250    HB   VAL  35           HB       VAL  35 -12.622  14.408  14.408
  251   1HG1  VAL  35          HG11      VAL  35 -11.281  16.989  16.989
  252   2HG1  VAL  35          HG12      VAL  35 -11.571  15.562  15.562
  253   3HG1  VAL  35          HG13      VAL  35 -10.430  15.496  15.496
  254   1HG2  VAL  35          HG21      VAL  35 -13.757  17.173  17.173
  255   2HG2  VAL  35          HG22      VAL  35 -14.647  15.802  15.802
  256   3HG2  VAL  35          HG23      VAL  35 -14.001  15.741  15.741
  257    H    ALA  36           HN       ALA  36 -11.989  13.756  13.756
  258    HA   ALA  36           HA       ALA  36  -9.144  13.491  13.491
  259   1HB   ALA  36           HB1      ALA  36 -11.342  11.900  11.900
  260   2HB   ALA  36           HB2      ALA  36  -9.672  11.352  11.352
  261   3HB   ALA  36           HB3      ALA  36 -10.634  11.582  11.582
  262    H    LYS  37           HN       LYS  37 -11.612  13.979  13.979
  263    HA   LYS  37           HA       LYS  37  -9.476  14.179  14.179
  264   1HB   LYS  37           HB1      LYS  37 -12.439  14.846  14.846
  265   2HB   LYS  37           HB2      LYS  37 -11.365  15.106  15.106
  266   1HG   LYS  37           HG1      LYS  37 -10.706  12.715  12.715
  267   2HG   LYS  37           HG2      LYS  37 -11.812  12.412  12.412
  268   1HD   LYS  37           HD1      LYS  37 -13.718  13.213  13.213
  269   2HD   LYS  37           HD2      LYS  37 -12.569  13.434  13.434
  270   1HE   LYS  37           HE1      LYS  37 -13.120  10.776  10.776
  271   2HE   LYS  37           HE2      LYS  37 -13.738  11.246  11.246
  272   1HZ   LYS  37           HZ1      LYS  37 -10.972  11.665  11.665
  273   2HZ   LYS  37           HZ2      LYS  37 -11.284  10.098  10.098
  274   3HZ   LYS  37           HZ3      LYS  37 -11.873  10.582  10.582
  275    H    LYS  38           HN       LYS  38 -10.640  16.303  16.303
  276    HA   LYS  38           HA       LYS  38 -10.173  18.728  18.728
  277   1HB   LYS  38           HB1      LYS  38 -11.823  18.839  18.839
  278   2HB   LYS  38           HB2      LYS  38 -10.629  18.249  18.249
  279   1HG   LYS  38           HG1      LYS  38  -9.517  20.267  20.267
  280   2HG   LYS  38           HG2      LYS  38  -9.826  20.700  20.700
  281   1HD   LYS  38           HD1      LYS  38 -11.967  20.755  20.755
  282   2HD   LYS  38           HD2      LYS  38 -11.003  22.148  22.148
  283   1HE   LYS  38           HE1      LYS  38 -11.816  21.877  21.877
  284   2HE   LYS  38           HE2      LYS  38 -12.885  20.591  20.591
  285   1HZ   LYS  38           HZ1      LYS  38 -13.240  22.800  22.800
  286   2HZ   LYS  38           HZ2      LYS  38 -13.335  23.319  23.319
  287   3HZ   LYS  38           HZ3      LYS  38 -14.347  22.072  22.072
  288    H    LEU  39           HN       LEU  39  -8.657  17.201  17.201
  289    HA   LEU  39           HA       LEU  39  -6.274  18.734  18.734
  290   1HB   LEU  39           HB1      LEU  39  -5.208  17.343  17.343
  291   2HB   LEU  39           HB2      LEU  39  -6.653  18.173  18.173
  292    HG   LEU  39           HG       LEU  39  -7.386  15.555  15.555
  293   1HD1  LEU  39          HD11      LEU  39  -4.940  14.980  14.980
  294   2HD1  LEU  39          HD12      LEU  39  -5.456  15.702  15.702
  295   3HD1  LEU  39          HD13      LEU  39  -6.234  14.232  14.232
  296   1HD2  LEU  39          HD21      LEU  39  -8.505  17.134  17.134
  297   2HD2  LEU  39          HD22      LEU  39  -8.257  15.508  15.508
  298   3HD2  LEU  39          HD23      LEU  39  -7.163  16.811  16.811
  299    H    GLY  40           HN       GLY  40  -7.591  15.808  15.808
  300   1HA   GLY  40           HA1      GLY  40  -5.231  14.340  14.340
  301   2HA   GLY  40           HA2      GLY  40  -6.700  14.333  14.333
  302    H    GLU  41           HN       GLU  41  -6.967  16.942  16.942
  303    HA   GLU  41           HA       GLU  41  -5.035  17.231  17.231
  304   1HB   GLU  41           HB1      GLU  41  -7.451  18.598  18.598
  305   2HB   GLU  41           HB2      GLU  41  -6.454  19.480  19.480
  306   1HG   GLU  41           HG1      GLU  41  -8.234  18.202  18.202
  307   2HG   GLU  41           HG2      GLU  41  -6.646  17.642  17.642
  308    H    MET  42           HN       MET  42  -5.847  19.133  19.133
  309    HA   MET  42           HA       MET  42  -4.013  21.198  21.198
  310   1HB   MET  42           HB1      MET  42  -4.525  19.470  19.470
  311   2HB   MET  42           HB2      MET  42  -3.754  21.046  21.046
  312   1HG   MET  42           HG1      MET  42  -6.514  20.617  20.617
  313   2HG   MET  42           HG2      MET  42  -6.337  21.006  21.006
  314   1HE   MET  42           HE1      MET  42  -8.174  22.338  22.338
  315   2HE   MET  42           HE2      MET  42  -7.489  23.731  23.731
  316   3HE   MET  42           HE3      MET  42  -6.919  22.126  22.126
  317    H    TRP  43           HN       TRP  43  -3.418  18.021  18.021
  318    HA   TRP  43           HA       TRP  43  -0.713  18.028  18.028
  319   1HB   TRP  43           HB1      TRP  43  -2.095  16.273  16.273
  320   2HB   TRP  43           HB2      TRP  43  -2.610  15.879  15.879
  321    HD1  TRP  43           HD1      TRP  43  -1.120  14.198  14.198
  322    HE1  TRP  43           HE1      TRP  43   1.081  13.147  13.147
  323    HE3  TRP  43           HE3      TRP  43  -0.017  16.654  16.654
  324    HZ2  TRP  43           HZ2      TRP  43   3.158  13.246  13.246
  325    HZ3  TRP  43           HZ3      TRP  43   2.035  16.181  16.181
  326    HH2  TRP  43           HH2      TRP  43   3.638  14.475  14.475
  327    H    ASN  44           HN       ASN  44  -2.262  16.978  16.978
  328    HA   ASN  44           HA       ASN  44   0.046  16.316  16.316
  329   1HB   ASN  44           HB1      ASN  44  -2.473  17.684  17.684
  330   2HB   ASN  44           HB2      ASN  44  -1.217  16.922  16.922
  331   1HD2  ASN  44          HD21      ASN  44  -4.075  14.538  14.538
  332   2HD2  ASN  44          HD22      ASN  44  -4.198  16.185  16.185
  333    H    ASN  45           HN       ASN  45  -1.356  19.416  19.416
  334    HA   ASN  45           HA       ASN  45   1.084  20.786  20.786
  335   1HB   ASN  45           HB1      ASN  45  -0.443  22.739  22.739
  336   2HB   ASN  45           HB2      ASN  45  -0.961  21.327  21.327
  337   1HD2  ASN  45          HD21      ASN  45  -4.090  21.213  21.213
  338   2HD2  ASN  45          HD22      ASN  45  -3.129  20.637  20.637
  339    H    THR  46           HN       THR  46   1.168  19.835  19.835
  340    HA   THR  46           HA       THR  46   0.350  21.909  21.909
  341    HB   THR  46           HB       THR  46   0.699  19.504  19.504
  342    HG1  THR  46           HG1      THR  46   1.677  21.788  21.788
  343   1HG2  THR  46          HG21      THR  46   2.908  18.975  18.975
  344   2HG2  THR  46          HG22      THR  46   3.715  20.088  20.088
  345   3HG2  THR  46          HG23      THR  46   2.949  18.653  18.653
  346    H    ALA  47           HN       ALA  47   3.294  20.892  20.892
  347    HA   ALA  47           HA       ALA  47   4.465  23.425  23.425
  348   1HB   ALA  47           HB1      ALA  47   4.848  23.391  23.391
  349   2HB   ALA  47           HB2      ALA  47   5.692  21.864  21.864
  350   3HB   ALA  47           HB3      ALA  47   6.354  23.329  23.329
  351    H    ALA  48           HN       ALA  48   5.101  20.202  20.202
  352    HA   ALA  48           HA       ALA  48   5.736  18.291  18.291
  353   1HB   ALA  48           HB1      ALA  48   5.774  19.560  19.560
  354   2HB   ALA  48           HB2      ALA  48   7.341  20.235  20.235
  355   3HB   ALA  48           HB3      ALA  48   7.158  18.509  18.509
  356    H    ASP  49           HN       ASP  49   7.508  21.111  21.111
  357    HA   ASP  49           HA       ASP  49   9.951  19.750  19.750
  358   1HB   ASP  49           HB1      ASP  49  10.066  21.902  21.902
  359   2HB   ASP  49           HB2      ASP  49   9.070  22.675  22.675
  360    H    ASP  50           HN       ASP  50   6.989  20.163  20.163
  361    HA   ASP  50           HA       ASP  50   7.779  20.376  20.376
  362   1HB   ASP  50           HB1      ASP  50   6.208  22.205  22.205
  363   2HB   ASP  50           HB2      ASP  50   5.083  20.973  20.973
  364    H    LYS  51           HN       LYS  51   6.804  18.369  18.369
  365    HA   LYS  51           HA       LYS  51   5.160  16.519  16.519
  366   1HB   LYS  51           HB1      LYS  51   6.524  16.120  16.120
  367   2HB   LYS  51           HB2      LYS  51   5.456  14.966  14.966
  368   1HG   LYS  51           HG1      LYS  51   3.593  16.599  16.599
  369   2HG   LYS  51           HG2      LYS  51   4.687  17.728  17.728
  370   1HD   LYS  51           HD1      LYS  51   5.105  16.099  16.099
  371   2HD   LYS  51           HD2      LYS  51   4.084  14.917  14.917
  372   1HE   LYS  51           HE1      LYS  51   2.140  16.318  16.318
  373   2HE   LYS  51           HE2      LYS  51   3.096  17.618  17.618
  374   1HZ   LYS  51           HZ1      LYS  51   3.599  15.267  15.267
  375   2HZ   LYS  51           HZ2      LYS  51   1.915  15.430  15.430
  376   3HZ   LYS  51           HZ3      LYS  51   2.829  16.683  16.683
  377    H    GLN  52           HN       GLN  52   8.270  16.604  16.604
  378    HA   GLN  52           HA       GLN  52   9.677  14.497  14.497
  379   1HB   GLN  52           HB1      GLN  52  10.343  17.186  17.186
  380   2HB   GLN  52           HB2      GLN  52  11.092  16.837  16.837
  381   1HG   GLN  52           HG1      GLN  52  12.710  16.396  16.396
  382   2HG   GLN  52           HG2      GLN  52  12.246  14.864  14.864
  383   1HE2  GLN  52          HE21      GLN  52  10.070  14.991  14.991
  384   2HE2  GLN  52          HE22      GLN  52   9.622  15.810  15.810
  385    HA   PRO  53           HA       PRO  53  10.398  14.867  14.867
  386   1HB   PRO  53           HB1      PRO  53   8.324  16.244  16.244
  387   2HB   PRO  53           HB2      PRO  53   9.915  16.919  16.919
  388   1HG   PRO  53           HG1      PRO  53   7.393  17.066  17.066
  389   2HG   PRO  53           HG2      PRO  53   8.419  18.406  18.406
  390   1HD   PRO  53           HD1      PRO  53   8.865  17.443  17.443
  391   2HD   PRO  53           HD2      PRO  53  10.283  17.626  17.626
  392    H    TYR  54           HN       TYR  54   6.990  15.129  15.129
  393    HA   TYR  54           HA       TYR  54   6.087  12.919  12.919
  394   1HB   TYR  54           HB1      TYR  54   4.832  14.231  14.231
  395   2HB   TYR  54           HB2      TYR  54   3.996  13.120  13.120
  396    HD1  TYR  54           HD1      TYR  54   4.479  13.903  13.903
  397    HD2  TYR  54           HD2      TYR  54   4.330  16.449  16.449
  398    HE1  TYR  54           HE1      TYR  54   3.955  15.811  15.811
  399    HE2  TYR  54           HE2      TYR  54   3.811  18.353  18.353
  400    HH   TYR  54           HH       TYR  54   4.319  18.457  18.457
  401    H    GLU  55           HN       GLU  55   6.699  13.343  13.343
  402    HA   GLU  55           HA       GLU  55   6.158  10.806  10.806
  403   1HB   GLU  55           HB1      GLU  55   7.434  13.227  13.227
  404   2HB   GLU  55           HB2      GLU  55   8.531  11.946  11.946
  405   1HG   GLU  55           HG1      GLU  55   6.601  10.779  10.779
  406   2HG   GLU  55           HG2      GLU  55   5.564  12.116  12.116
  407    H    LYS  56           HN       LYS  56   9.410  11.853  11.853
  408    HA   LYS  56           HA       LYS  56  10.825   9.528   9.528
  409   1HB   LYS  56           HB1      LYS  56  11.811  11.694  11.694
  410   2HB   LYS  56           HB2      LYS  56  11.037  11.470  11.470
  411   1HG   LYS  56           HG1      LYS  56  12.326   9.274   9.274
  412   2HG   LYS  56           HG2      LYS  56  13.158   9.664   9.664
  413   1HD   LYS  56           HD1      LYS  56  14.409  11.369  11.369
  414   2HD   LYS  56           HD2      LYS  56  13.209  11.747  11.747
  415   1HE   LYS  56           HE1      LYS  56  13.747   9.646   9.646
  416   2HE   LYS  56           HE2      LYS  56  14.900   9.182   9.182
  417   1HZ   LYS  56           HZ1      LYS  56  15.501  11.770  11.770
  418   2HZ   LYS  56           HZ2      LYS  56  15.333  10.710  10.710
  419   3HZ   LYS  56           HZ3      LYS  56  16.436  10.356  10.356
  420    H    LYS  57           HN       LYS  57   8.649  10.324  10.324
  421    HA   LYS  57           HA       LYS  57   9.308   7.967   7.967
  422   1HB   LYS  57           HB1      LYS  57   6.948   9.928   9.928
  423   2HB   LYS  57           HB2      LYS  57   7.075   8.592   8.592
  424   1HG   LYS  57           HG1      LYS  57   9.332  10.614  10.614
  425   2HG   LYS  57           HG2      LYS  57   8.045  10.846  10.846
  426   1HD   LYS  57           HD1      LYS  57   8.635   8.818   8.818
  427   2HD   LYS  57           HD2      LYS  57   9.761   8.309   8.309
  428   1HE   LYS  57           HE1      LYS  57  11.214  10.247  10.247
  429   2HE   LYS  57           HE2      LYS  57  10.086  10.799  10.799
  430   1HZ   LYS  57           HZ1      LYS  57  10.650   8.119   8.119
  431   2HZ   LYS  57           HZ2      LYS  57  12.129   8.903   8.903
  432   3HZ   LYS  57           HZ3      LYS  57  11.080   9.473   9.473
  433    H    ALA  58           HN       ALA  58   6.507   8.816   8.816
  434    HA   ALA  58           HA       ALA  58   5.103   6.425   6.425
  435   1HB   ALA  58           HB1      ALA  58   4.405   8.422   8.422
  436   2HB   ALA  58           HB2      ALA  58   5.712   8.098   8.098
  437   3HB   ALA  58           HB3      ALA  58   4.386   6.960   6.960
  438    H    ALA  59           HN       ALA  59   7.810   7.223   7.223
  439    HA   ALA  59           HA       ALA  59   8.166   4.811   4.811
  440   1HB   ALA  59           HB1      ALA  59   9.445   6.897   6.897
  441   2HB   ALA  59           HB2      ALA  59  10.342   6.711   6.711
  442   3HB   ALA  59           HB3      ALA  59  10.531   5.533   5.533
  443    H    LYS  60           HN       LYS  60  10.033   5.775   5.775
  444    HA   LYS  60           HA       LYS  60  11.394   3.523   3.523
  445   1HB   LYS  60           HB1      LYS  60  11.487   5.655   5.655
  446   2HB   LYS  60           HB2      LYS  60   9.894   5.369   5.369
  447   1HG   LYS  60           HG1      LYS  60  10.727   3.346   3.346
  448   2HG   LYS  60           HG2      LYS  60  12.319   3.596   3.596
  449   1HD   LYS  60           HD1      LYS  60  12.493   5.794   5.794
  450   2HD   LYS  60           HD2      LYS  60  10.879   5.600   5.600
  451   1HE   LYS  60           HE1      LYS  60  13.219   3.730   3.730
  452   2HE   LYS  60           HE2      LYS  60  12.642   4.989   4.989
  453   1HZ   LYS  60           HZ1      LYS  60  10.451   3.440   3.440
  454   2HZ   LYS  60           HZ2      LYS  60  11.692   2.384   2.384
  455   3HZ   LYS  60           HZ3      LYS  60  11.152   3.599   3.599
  456    H    LEU  61           HN       LEU  61   8.059   4.158   4.158
  457    HA   LEU  61           HA       LEU  61   7.656   1.637   1.637
  458   1HB   LEU  61           HB1      LEU  61   5.587   3.435   3.435
  459   2HB   LEU  61           HB2      LEU  61   5.288   2.277   2.277
  460    HG   LEU  61           HG       LEU  61   7.061   4.764   4.764
  461   1HD1  LEU  61          HD11      LEU  61   4.433   4.076   4.076
  462   2HD1  LEU  61          HD12      LEU  61   5.391   5.527   5.527
  463   3HD1  LEU  61          HD13      LEU  61   4.706   5.249   5.249
  464   1HD2  LEU  61          HD21      LEU  61   6.527   2.649   2.649
  465   2HD2  LEU  61          HD22      LEU  61   8.073   2.967   2.967
  466   3HD2  LEU  61          HD23      LEU  61   7.360   4.178   4.178
  467    H    LYS  62           HN       LYS  62   6.590   2.683   2.683
  468    HA   LYS  62           HA       LYS  62   5.465   0.383   0.383
  469   1HB   LYS  62           HB1      LYS  62   5.907   2.644   2.644
  470   2HB   LYS  62           HB2      LYS  62   7.531   2.100   2.100
  471   1HG   LYS  62           HG1      LYS  62   6.680   1.438   1.438
  472   2HG   LYS  62           HG2      LYS  62   6.317  -0.013  -0.013
  473   1HD   LYS  62           HD1      LYS  62   4.367   0.709   0.709
  474   2HD   LYS  62           HD2      LYS  62   4.002   0.782   0.782
  475   1HE   LYS  62           HE1      LYS  62   4.095   3.155   3.155
  476   2HE   LYS  62           HE2      LYS  62   5.056   3.260   3.260
  477   1HZ   LYS  62           HZ1      LYS  62   2.641   1.971   1.971
  478   2HZ   LYS  62           HZ2      LYS  62   2.291   3.385   3.385
  479   3HZ   LYS  62           HZ3      LYS  62   3.208   3.470   3.470
  480    H    GLU  63           HN       GLU  63   8.789   1.262   1.262
  481    HA   GLU  63           HA       GLU  63  10.072  -0.934  -0.934
  482   1HB   GLU  63           HB1      GLU  63  10.739   1.496   1.496
  483   2HB   GLU  63           HB2      GLU  63  11.624   0.244   0.244
  484   1HG   GLU  63           HG1      GLU  63  12.462  -0.442  -0.442
  485   2HG   GLU  63           HG2      GLU  63  11.697   1.023   1.023
  486    H    LYS  64           HN       LYS  64   9.547  -0.305  -0.305
  487    HA   LYS  64           HA       LYS  64  10.536  -2.756  -2.756
  488   1HB   LYS  64           HB1      LYS  64   9.705  -0.713  -0.713
  489   2HB   LYS  64           HB2      LYS  64   8.089  -1.362  -1.362
  490   1HG   LYS  64           HG1      LYS  64   8.903  -3.550  -3.550
  491   2HG   LYS  64           HG2      LYS  64  10.444  -2.779  -2.779
  492   1HD   LYS  64           HD1      LYS  64   9.307  -2.597  -2.597
  493   2HD   LYS  64           HD2      LYS  64   9.164  -1.007  -1.007
  494   1HE   LYS  64           HE1      LYS  64   6.993  -3.118  -3.118
  495   2HE   LYS  64           HE2      LYS  64   7.007  -1.982  -1.982
  496   1HZ   LYS  64           HZ1      LYS  64   7.376  -0.521  -0.521
  497   2HZ   LYS  64           HZ2      LYS  64   6.082  -1.588  -1.588
  498   3HZ   LYS  64           HZ3      LYS  64   6.047  -0.515  -0.515
  499    H    TYR  65           HN       TYR  65   7.254  -1.937  -1.937
  500    HA   TYR  65           HA       TYR  65   5.918  -4.354  -4.354
  501   1HB   TYR  65           HB1      TYR  65   4.581  -2.493  -2.493
  502   2HB   TYR  65           HB2      TYR  65   5.604  -1.999  -1.999
  503    HD1  TYR  65           HD1      TYR  65   3.621  -5.113  -5.113
  504    HD2  TYR  65           HD2      TYR  65   4.385  -1.916  -1.916
  505    HE1  TYR  65           HE1      TYR  65   1.992  -6.039  -6.039
  506    HE2  TYR  65           HE2      TYR  65   2.757  -2.851  -2.851
  507    HH   TYR  65           HH       TYR  65   1.798  -5.668  -5.668
  508    H    GLU  66           HN       GLU  66   7.298  -3.309  -3.309
  509    HA   GLU  66           HA       GLU  66   6.862  -5.548  -5.548
  510   1HB   GLU  66           HB1      GLU  66   9.338  -3.862  -3.862
  511   2HB   GLU  66           HB2      GLU  66   8.872  -4.953  -4.953
  512   1HG   GLU  66           HG1      GLU  66   6.624  -3.171  -3.171
  513   2HG   GLU  66           HG2      GLU  66   8.067  -2.215  -2.215
  514    H    LYS  67           HN       LYS  67   9.276  -5.196  -5.196
  515    HA   LYS  67           HA       LYS  67  10.699  -7.625  -7.625
  516   1HB   LYS  67           HB1      LYS  67  11.128  -6.331  -6.331
  517   2HB   LYS  67           HB2      LYS  67  12.275  -7.211  -7.211
  518   1HG   LYS  67           HG1      LYS  67  11.353  -4.371  -4.371
  519   2HG   LYS  67           HG2      LYS  67  12.976  -4.992  -4.992
  520   1HD   LYS  67           HD1      LYS  67  12.300  -6.055  -6.055
  521   2HD   LYS  67           HD2      LYS  67  11.203  -4.690  -4.690
  522   1HE   LYS  67           HE1      LYS  67  14.191  -4.461  -4.461
  523   2HE   LYS  67           HE2      LYS  67  13.351  -4.005  -4.005
  524   1HZ   LYS  67           HZ1      LYS  67  12.109  -2.800  -2.800
  525   2HZ   LYS  67           HZ2      LYS  67  13.775  -2.472  -2.472
  526   3HZ   LYS  67           HZ3      LYS  67  12.858  -2.076  -2.076
  527    H    ASP  68           HN       ASP  68   8.453  -6.705  -6.705
  528    HA   ASP  68           HA       ASP  68   8.566  -9.251  -9.251
  529   1HB   ASP  68           HB1      ASP  68   6.970  -6.729  -6.729
  530   2HB   ASP  68           HB2      ASP  68   6.712  -8.168  -8.168
  531    H    ILE  69           HN       ILE  69   6.989  -7.893  -7.893
  532    HA   ILE  69           HA       ILE  69   4.588  -9.609  -9.609
  533    HB   ILE  69           HB       ILE  69   4.649  -7.108  -7.108
  534   1HG1  ILE  69          HG11      ILE  69   2.568  -7.969  -7.969
  535   2HG1  ILE  69          HG12      ILE  69   2.861  -7.566  -7.566
  536   1HG2  ILE  69          HG21      ILE  69   6.380  -7.374  -7.374
  537   2HG2  ILE  69          HG22      ILE  69   5.349  -8.419  -8.419
  538   3HG2  ILE  69          HG23      ILE  69   4.911  -6.731  -6.731
  539   1HD1  ILE  69          HD11      ILE  69   3.449  -9.945  -9.945
  540   2HD1  ILE  69          HD12      ILE  69   3.074 -10.297 -10.297
  541   3HD1  ILE  69          HD13      ILE  69   1.803  -9.758  -9.758
  542    H    ALA  70           HN       ALA  70   7.334  -8.984  -8.984
  543    HA   ALA  70           HA       ALA  70   7.003 -11.107 -11.107
  544   1HB   ALA  70           HB1      ALA  70   9.590  -9.780  -9.780
  545   2HB   ALA  70           HB2      ALA  70   9.435 -10.779 -10.779
  546   3HB   ALA  70           HB3      ALA  70   8.607  -9.237  -9.237
  547    H    ALA  71           HN       ALA  71   8.187 -10.828 -10.828
  548    HA   ALA  71           HA       ALA  71   9.388 -13.506 -13.506
  549   1HB   ALA  71           HB1      ALA  71   8.901 -11.503 -11.503
  550   2HB   ALA  71           HB2      ALA  71   9.827 -12.991 -12.991
  551   3HB   ALA  71           HB3      ALA  71  10.407 -11.700 -11.700
  552    H    TYR  72           HN       TYR  72   6.521 -11.837 -11.837
  553    HA   TYR  72           HA       TYR  72   5.325 -13.874 -13.874
  554   1HB   TYR  72           HB1      TYR  72   4.563 -11.625 -11.625
  555   2HB   TYR  72           HB2      TYR  72   4.206 -11.588 -11.588
  556    HD1  TYR  72           HD1      TYR  72   3.272 -13.686 -13.686
  557    HD2  TYR  72           HD2      TYR  72   2.004 -11.723 -11.723
  558    HE1  TYR  72           HE1      TYR  72   0.971 -14.415 -14.415
  559    HE2  TYR  72           HE2      TYR  72  -0.297 -12.449 -12.449
  560    HH   TYR  72           HH       TYR  72  -1.167 -14.831 -14.831
  561    H    ARG  73           HN       ARG  73   5.071 -13.171 -13.171
  562    HA   ARG  73           HA       ARG  73   3.260 -15.432 -15.432
  563   1HB   ARG  73           HB1      ARG  73   4.439 -13.400 -13.400
  564   2HB   ARG  73           HB2      ARG  73   3.251 -14.605 -14.605
  565   1HG   ARG  73           HG1      ARG  73   1.802 -13.492 -13.492
  566   2HG   ARG  73           HG2      ARG  73   2.926 -12.158 -12.158
  567   1HD   ARG  73           HD1      ARG  73   1.131 -13.370 -13.370
  568   2HD   ARG  73           HD2      ARG  73   1.041 -11.743 -11.743
  569    HE   ARG  73           HE       ARG  73   3.553 -12.519 -12.519
  570   1HH1  ARG  73          HH11      ARG  73   2.488  -9.695  -9.695
  571   2HH1  ARG  73          HH12      ARG  73   2.084  -9.117  -9.117
  572   1HH2  ARG  73          HH21      ARG  73   2.219 -12.314 -12.314
  573   2HH2  ARG  73          HH22      ARG  73   1.925 -10.642 -10.642
  574    H    ALA  74           HN       ALA  74   6.582 -14.775 -14.775
  575    HA   ALA  74           HA       ALA  74   7.025 -17.010 -17.010
  576   1HB   ALA  74           HB1      ALA  74   8.377 -15.008 -15.008
  577   2HB   ALA  74           HB2      ALA  74   9.010 -15.204 -15.204
  578   3HB   ALA  74           HB3      ALA  74   9.399 -16.380 -16.380
  579    H    LYS  75           HN       LYS  75   6.788 -16.577 -16.577
  580    HA   LYS  75           HA       LYS  75   6.951 -19.140 -19.140
  581   1HB   LYS  75           HB1      LYS  75   9.718 -18.218 -18.218
  582   2HB   LYS  75           HB2      LYS  75   9.608 -18.767 -18.767
  583   1HG   LYS  75           HG1      LYS  75   8.703 -20.904 -20.904
  584   2HG   LYS  75           HG2      LYS  75   8.523 -20.461 -20.461
  585   1HD   LYS  75           HD1      LYS  75  11.295 -20.196 -20.196
  586   2HD   LYS  75           HD2      LYS  75  10.682 -21.833 -21.833
  587   1HE   LYS  75           HE1      LYS  75  11.868 -21.330 -21.330
  588   2HE   LYS  75           HE2      LYS  75  10.157 -21.464 -21.464
  589   1HZ   LYS  75           HZ1      LYS  75  10.688 -18.811 -18.811
  590   2HZ   LYS  75           HZ2      LYS  75  11.860 -19.307 -19.307
  591   3HZ   LYS  75           HZ3      LYS  75  10.211 -19.450 -19.450
  592    H    GLY  76           HN       GLY  76   5.481 -17.946 -17.946
  593   1HA   GLY  76           HA1      GLY  76   6.565 -16.276 -16.276
  594   2HA   GLY  76           HA2      GLY  76   4.878 -16.313 -16.313
  595    H    LYS  77           HN       LYS  77   3.972 -18.553 -18.553
  596    HA   LYS  77           HA       LYS  77   3.167 -19.630 -19.630
  597   1HB   LYS  77           HB1      LYS  77   4.186 -21.582 -21.582
  598   2HB   LYS  77           HB2      LYS  77   2.946 -21.831 -21.831
  599   1HG   LYS  77           HG1      LYS  77   1.628 -21.284 -21.284
  600   2HG   LYS  77           HG2      LYS  77   1.842 -19.680 -19.680
  601   1HD   LYS  77           HD1      LYS  77   3.921 -19.469 -19.469
  602   2HD   LYS  77           HD2      LYS  77   3.332 -20.930 -20.930
  603   1HE   LYS  77           HE1      LYS  77   1.755 -18.333 -18.333
  604   2HE   LYS  77           HE2      LYS  77   2.535 -18.952 -18.952
  605   1HZ   LYS  77           HZ1      LYS  77   0.918 -20.980 -20.980
  606   2HZ   LYS  77           HZ2      LYS  77  -0.001 -19.552 -19.552
  607   3HZ   LYS  77           HZ3      LYS  77   0.730 -20.105 -20.105
  608    HA   PRO  78           HA       PRO  78   6.650 -22.768 -22.768
  609   1HB   PRO  78           HB1      PRO  78   9.078 -21.342 -21.342
  610   2HB   PRO  78           HB2      PRO  78   8.723 -23.075 -23.075
  611   1HG   PRO  78           HG1      PRO  78   8.289 -21.835 -21.835
  612   2HG   PRO  78           HG2      PRO  78   7.002 -22.878 -22.878
  613   1HD   PRO  78           HD1      PRO  78   7.308 -19.878 -19.878
  614   2HD   PRO  78           HD2      PRO  78   5.927 -20.690 -20.690
  615    H    ASP  79           HN       ASP  79   7.305 -19.401 -19.401
  616    HA   ASP  79           HA       ASP  79   8.117 -19.722 -19.722
  617   1HB   ASP  79           HB1      ASP  79   9.905 -18.941 -18.941
  618   2HB   ASP  79           HB2      ASP  79   9.028 -17.423 -17.423
  619    H    ALA  80           HN       ALA  80   5.550 -19.578 -19.578
  620    HA   ALA  80           HA       ALA  80   4.534 -17.068 -17.068
  621   1HB   ALA  80           HB1      ALA  80   4.465 -16.824 -16.824
  622   2HB   ALA  80           HB2      ALA  80   3.564 -18.323 -18.323
  623   3HB   ALA  80           HB3      ALA  80   2.835 -16.926 -16.926
  624    H    ALA  81           HN       ALA  81   4.188 -18.335 -18.335
  625    HA   ALA  81           HA       ALA  81   2.029 -20.400 -20.400
  626   1HB   ALA  81           HB1      ALA  81   4.128 -19.973 -19.973
  627   2HB   ALA  81           HB2      ALA  81   2.896 -21.227 -21.227
  628   3HB   ALA  81           HB3      ALA  81   4.148 -21.234 -21.234
  629   1H1   BME  16           HE1      MER  16  -8.066   8.717   8.717
  630   2H1   BME  16           HE2      MER  16  -9.006   9.349   9.349
  631   1H2   BME  16           HZ1      MER  16  -6.925  10.130  10.130
  632   2H2   BME  16           HZ2      MER  16  -5.964   9.562   9.562
  633    HO1  BME  16           HH       MER  16  -7.529   7.110   7.110

  Start of MODEL   25
    1    H    ASN   3           HN       ASN   3  -3.527  -8.702  -8.702
    2    HA   ASN   3           HA       ASN   3  -1.024 -10.281 -10.281
    3   1HB   ASN   3           HB1      ASN   3  -3.873 -11.276 -11.276
    4   2HB   ASN   3           HB2      ASN   3  -2.436 -12.287 -12.287
    5   1HD2  ASN   3          HD21      ASN   3  -2.594 -12.612 -12.612
    6   2HD2  ASN   3          HD22      ASN   3  -2.082 -13.232 -13.232
    7    H    ALA   4           HN       ALA   4  -0.209  -9.073  -9.073
    8    HA   ALA   4           HA       ALA   4   0.628  -9.527  -9.527
    9   1HB   ALA   4           HB1      ALA   4  -1.302 -10.894 -10.894
   10   2HB   ALA   4           HB2      ALA   4  -2.305  -9.441  -9.441
   11   3HB   ALA   4           HB3      ALA   4  -0.924  -9.614  -9.614
   12    HA   PRO   5           HA       PRO   5   0.396  -5.097  -5.097
   13   1HB   PRO   5           HB1      PRO   5   2.599  -4.432  -4.432
   14   2HB   PRO   5           HB2      PRO   5   2.721  -5.067  -5.067
   15   1HG   PRO   5           HG1      PRO   5   2.798  -6.656  -6.656
   16   2HG   PRO   5           HG2      PRO   5   3.998  -6.686  -6.686
   17   1HD   PRO   5           HD1      PRO   5   2.117  -8.561  -8.561
   18   2HD   PRO   5           HD2      PRO   5   2.390  -7.851  -7.851
   19    H    LYS   6           HN       LYS   6  -1.311  -4.350  -4.350
   20    HA   LYS   6           HA       LYS   6  -2.021  -4.689  -4.689
   21   1HB   LYS   6           HB1      LYS   6  -3.598  -4.251  -4.251
   22   2HB   LYS   6           HB2      LYS   6  -3.172  -2.565  -2.565
   23   1HG   LYS   6           HG1      LYS   6  -4.004  -2.895  -2.895
   24   2HG   LYS   6           HG2      LYS   6  -4.717  -4.369  -4.369
   25   1HD   LYS   6           HD1      LYS   6  -6.051  -3.082  -3.082
   26   2HD   LYS   6           HD2      LYS   6  -5.249  -1.597  -1.597
   27   1HE   LYS   6           HE1      LYS   6  -6.118  -1.970  -1.970
   28   2HE   LYS   6           HE2      LYS   6  -7.036  -3.336  -3.336
   29   1HZ   LYS   6           HZ1      LYS   6  -7.559  -1.174  -1.174
   30   2HZ   LYS   6           HZ2      LYS   6  -7.686  -0.618  -0.618
   31   3HZ   LYS   6           HZ3      LYS   6  -8.614  -1.944  -1.944
   32    H    ARG   7           HN       ARG   7  -2.512  -2.487  -2.487
   33    HA   ARG   7           HA       ARG   7  -0.040  -1.315  -1.315
   34   1HB   ARG   7           HB1      ARG   7  -2.860  -0.387  -0.387
   35   2HB   ARG   7           HB2      ARG   7  -1.433   0.377   0.377
   36   1HG   ARG   7           HG1      ARG   7  -2.164  -1.214  -1.214
   37   2HG   ARG   7           HG2      ARG   7  -0.730  -1.891  -1.891
   38   1HD   ARG   7           HD1      ARG   7  -2.067  -3.460  -3.460
   39   2HD   ARG   7           HD2      ARG   7  -3.569  -2.686  -2.686
   40    HE   ARG   7           HE       ARG   7  -1.691  -4.129  -4.129
   41   1HH1  ARG   7          HH11      ARG   7  -3.242  -3.182  -3.182
   42   2HH1  ARG   7          HH12      ARG   7  -4.760  -4.017  -4.017
   43   1HH2  ARG   7          HH21      ARG   7  -4.278  -5.217  -5.217
   44   2HH2  ARG   7          HH22      ARG   7  -5.363  -5.204  -5.204
   45    HA   PRO   8           HA       PRO   8  -0.008   1.611   1.611
   46   1HB   PRO   8           HB1      PRO   8   2.588   2.399   2.399
   47   2HB   PRO   8           HB2      PRO   8   2.278   1.943   1.943
   48   1HG   PRO   8           HG1      PRO   8   3.486   0.171   0.171
   49   2HG   PRO   8           HG2      PRO   8   2.184  -0.389  -0.389
   50   1HD   PRO   8           HD1      PRO   8   1.957   0.364   0.364
   51   2HD   PRO   8           HD2      PRO   8   1.466  -1.129  -1.129
   52    HA   PRO   9           HA       PRO   9  -0.856   5.868   5.868
   53   1HB   PRO   9           HB1      PRO   9   2.084   6.359   6.359
   54   2HB   PRO   9           HB2      PRO   9   0.736   7.478   7.478
   55   1HG   PRO   9           HG1      PRO   9   1.414   6.106   6.106
   56   2HG   PRO   9           HG2      PRO   9  -0.299   6.042   6.042
   57   1HD   PRO   9           HD1      PRO   9   1.877   3.995   3.995
   58   2HD   PRO   9           HD2      PRO   9   0.228   3.702   3.702
   59    H    SER  10           HN       SER  10  -0.134   7.611   7.611
   60    HA   SER  10           HA       SER  10   0.836   6.426   6.426
   61   1HB   SER  10           HB1      SER  10  -1.218   8.630   8.630
   62   2HB   SER  10           HB2      SER  10  -0.714   8.029   8.029
   63    HG   SER  10           HG       SER  10  -1.280   5.973   5.973
   64    H    ALA  11           HN       ALA  11   1.070   9.090   9.090
   65    HA   ALA  11           HA       ALA  11   3.311  10.255  10.255
   66   1HB   ALA  11           HB1      ALA  11   2.502  10.995  10.995
   67   2HB   ALA  11           HB2      ALA  11   3.889  11.623  11.623
   68   3HB   ALA  11           HB3      ALA  11   3.871   9.949   9.949
   69    H    PHE  12           HN       PHE  12   0.519  10.835  10.835
   70    HA   PHE  12           HA       PHE  12  -0.188  13.477  13.477
   71   1HB   PHE  12           HB1      PHE  12  -1.143  12.442  12.442
   72   2HB   PHE  12           HB2      PHE  12  -1.512  10.954  10.954
   73    HD1  PHE  12           HD1      PHE  12  -2.824  13.594  13.594
   74    HD2  PHE  12           HD2      PHE  12  -3.479  11.406  11.406
   75    HE1  PHE  12           HE1      PHE  12  -5.192  14.164  14.164
   76    HE2  PHE  12           HE2      PHE  12  -5.864  11.988  11.988
   77    HZ   PHE  12           HZ       PHE  12  -6.725  13.373  13.373
   78    H    PHE  13           HN       PHE  13  -1.010  10.292  10.292
   79    HA   PHE  13           HA       PHE  13  -2.731  10.751  10.751
   80   1HB   PHE  13           HB1      PHE  13  -1.041   8.664   8.664
   81   2HB   PHE  13           HB2      PHE  13  -0.504   9.086   9.086
   82    HD1  PHE  13           HD1      PHE  13  -3.598   8.483   8.483
   83    HD2  PHE  13           HD2      PHE  13  -1.785   8.279   8.279
   84    HE1  PHE  13           HE1      PHE  13  -5.611   7.397   7.397
   85    HE2  PHE  13           HE2      PHE  13  -3.803   7.192   7.192
   86    HZ   PHE  13           HZ       PHE  13  -5.717   6.748   6.748
   87    H    LEU  14           HN       LEU  14   0.749  11.319  11.319
   88    HA   LEU  14           HA       LEU  14   0.650  12.045  12.045
   89   1HB   LEU  14           HB1      LEU  14   2.529  13.114  13.114
   90   2HB   LEU  14           HB2      LEU  14   2.803  13.232  13.232
   91    HG   LEU  14           HG       LEU  14   4.208  11.506  11.506
   92   1HD1  LEU  14          HD11      LEU  14   2.884  10.579  10.579
   93   2HD1  LEU  14          HD12      LEU  14   1.730   9.890   9.890
   94   3HD1  LEU  14          HD13      LEU  14   3.389   9.320   9.320
   95   1HD2  LEU  14          HD21      LEU  14   3.715  11.297  11.297
   96   2HD2  LEU  14          HD22      LEU  14   3.851   9.709   9.709
   97   3HD2  LEU  14          HD23      LEU  14   2.267  10.350  10.350
   98    H    PHE  15           HN       PHE  15   0.795  14.213  14.213
   99    HA   PHE  15           HA       PHE  15   0.230  16.614  16.614
  100   1HB   PHE  15           HB1      PHE  15   1.043  17.291  17.291
  101   2HB   PHE  15           HB2      PHE  15   0.804  15.655  15.655
  102    HD1  PHE  15           HD1      PHE  15  -1.797  15.247  15.247
  103    HD2  PHE  15           HD2      PHE  15   0.234  18.994  18.994
  104    HE1  PHE  15           HE1      PHE  15  -3.339  16.143  16.143
  105    HE2  PHE  15           HE2      PHE  15  -1.320  19.888  19.888
  106    HZ   PHE  15           HZ       PHE  15  -3.107  18.459  18.459
  107    H    CYS  16           HN       MER  16  -1.913  14.341  14.341
  108    HA   CYS  16           HA       MER  16  -4.367  15.695  15.695
  109   1HB   CYS  16           HB1      MER  16  -5.243  13.645  13.645
  110   2HB   CYS  16           HB2      MER  16  -3.592  13.225  13.225
  111    H    SER  17           HN       SER  17  -2.972  13.391  13.391
  112    HA   SER  17           HA       SER  17  -4.820  13.559  13.559
  113   1HB   SER  17           HB1      SER  17  -1.775  13.342  13.342
  114   2HB   SER  17           HB2      SER  17  -2.929  13.014  13.014
  115    HG   SER  17           HG       SER  17  -2.281  11.502  11.502
  116    H    GLU  18           HN       GLU  18  -1.935  15.468  15.468
  117    HA   GLU  18           HA       GLU  18  -1.839  17.173  17.173
  118   1HB   GLU  18           HB1      GLU  18  -0.396  17.094  17.094
  119   2HB   GLU  18           HB2      GLU  18  -1.578  18.108  18.108
  120   1HG   GLU  18           HG1      GLU  18  -1.283  19.881  19.881
  121   2HG   GLU  18           HG2      GLU  18  -0.115  18.889  18.889
  122    H    TYR  19           HN       TYR  19  -3.951  17.697  17.697
  123    HA   TYR  19           HA       TYR  19  -5.712  19.320  19.320
  124   1HB   TYR  19           HB1      TYR  19  -5.886  21.080  21.080
  125   2HB   TYR  19           HB2      TYR  19  -4.161  20.800  20.800
  126    HD1  TYR  19           HD1      TYR  19  -3.026  19.030  19.030
  127    HD2  TYR  19           HD2      TYR  19  -6.490  21.366  21.366
  128    HE1  TYR  19           HE1      TYR  19  -2.642  18.808  18.808
  129    HE2  TYR  19           HE2      TYR  19  -6.112  21.150  21.150
  130    HH   TYR  19           HH       TYR  19  -3.540  20.553  20.553
  131    H    ARG  20           HN       ARG  20  -6.284  16.889  16.889
  132    HA   ARG  20           HA       ARG  20  -8.106  16.411  16.411
  133   1HB   ARG  20           HB1      ARG  20  -6.909  14.486  14.486
  134   2HB   ARG  20           HB2      ARG  20  -6.922  14.813  14.813
  135   1HG   ARG  20           HG1      ARG  20  -9.297  14.067  14.067
  136   2HG   ARG  20           HG2      ARG  20  -9.329  13.862  13.862
  137   1HD   ARG  20           HD1      ARG  20  -7.687  12.083  12.083
  138   2HD   ARG  20           HD2      ARG  20  -7.301  12.422  12.422
  139    HE   ARG  20           HE       ARG  20 -10.017  11.446  11.446
  140   1HH1  ARG  20          HH11      ARG  20  -8.189  12.015  12.015
  141   2HH1  ARG  20          HH12      ARG  20  -8.300  10.415  10.415
  142   1HH2  ARG  20          HH21      ARG  20  -9.708   9.082   9.082
  143   2HH2  ARG  20          HH22      ARG  20  -9.177   8.719   8.719
  144    HA   PRO  21           HA       PRO  21 -11.403  16.411  16.411
  145   1HB   PRO  21           HB1      PRO  21 -10.713  17.454  17.454
  146   2HB   PRO  21           HB2      PRO  21 -10.540  15.739  15.739
  147   1HG   PRO  21           HG1      PRO  21  -8.401  17.921  17.921
  148   2HG   PRO  21           HG2      PRO  21  -8.282  16.393  16.393
  149   1HD   PRO  21           HD1      PRO  21  -7.312  16.505  16.505
  150   2HD   PRO  21           HD2      PRO  21  -8.309  15.092  15.092
  151    H    LYS  22           HN       LYS  22  -8.975  18.848  18.848
  152    HA   LYS  22           HA       LYS  22 -10.429  21.188  21.188
  153   1HB   LYS  22           HB1      LYS  22  -7.869  20.611  20.611
  154   2HB   LYS  22           HB2      LYS  22  -8.438  22.249  22.249
  155   1HG   LYS  22           HG1      LYS  22  -8.043  20.301  20.301
  156   2HG   LYS  22           HG2      LYS  22  -6.758  21.336  21.336
  157   1HD   LYS  22           HD1      LYS  22  -8.058  23.354  23.354
  158   2HD   LYS  22           HD2      LYS  22  -9.474  22.420  22.420
  159   1HE   LYS  22           HE1      LYS  22  -6.820  22.253  22.253
  160   2HE   LYS  22           HE2      LYS  22  -8.184  23.234  23.234
  161   1HZ   LYS  22           HZ1      LYS  22  -9.115  20.650  20.650
  162   2HZ   LYS  22           HZ2      LYS  22  -7.734  20.529  20.529
  163   3HZ   LYS  22           HZ3      LYS  22  -9.047  21.487  21.487
  164    H    ILE  23           HN       ILE  23 -10.139  19.491  19.491
  165    HA   ILE  23           HA       ILE  23 -11.453  21.831  21.831
  166    HB   ILE  23           HB       ILE  23 -11.170  20.420  20.420
  167   1HG1  ILE  23          HG11      ILE  23  -9.285  18.736  18.736
  168   2HG1  ILE  23          HG12      ILE  23 -10.880  18.164  18.164
  169   1HG2  ILE  23          HG21      ILE  23  -9.624  22.260  22.260
  170   2HG2  ILE  23          HG22      ILE  23  -8.681  21.131  21.131
  171   3HG2  ILE  23          HG23      ILE  23  -8.733  20.979  20.979
  172   1HD1  ILE  23          HD11      ILE  23 -10.291  18.437  18.437
  173   2HD1  ILE  23          HD12      ILE  23  -8.663  18.911  18.911
  174   3HD1  ILE  23          HD13      ILE  23  -9.247  17.300  17.300
  175    H    LYS  24           HN       LYS  24 -11.868  18.548  18.548
  176    HA   LYS  24           HA       LYS  24 -14.438  18.088  18.088
  177   1HB   LYS  24           HB1      LYS  24 -12.630  16.503  16.503
  178   2HB   LYS  24           HB2      LYS  24 -12.911  16.877  16.877
  179   1HG   LYS  24           HG1      LYS  24 -15.410  16.032  16.032
  180   2HG   LYS  24           HG2      LYS  24 -14.200  14.773  14.773
  181   1HD   LYS  24           HD1      LYS  24 -15.056  16.361  16.361
  182   2HD   LYS  24           HD2      LYS  24 -15.851  14.876  14.876
  183   1HE   LYS  24           HE1      LYS  24 -13.705  13.653  13.653
  184   2HE   LYS  24           HE2      LYS  24 -12.860  15.130  15.130
  185   1HZ   LYS  24           HZ1      LYS  24 -15.050  14.852  14.852
  186   2HZ   LYS  24           HZ2      LYS  24 -14.201  13.381  13.381
  187   3HZ   LYS  24           HZ3      LYS  24 -13.394  14.819  14.819
  188    H    GLY  25           HN       GLY  25 -13.324  19.877  19.877
  189   1HA   GLY  25           HA1      GLY  25 -15.823  19.822  19.822
  190   2HA   GLY  25           HA2      GLY  25 -14.299  20.584  20.584
  191    H    GLU  26           HN       GLU  26 -13.778  21.972  21.972
  192    HA   GLU  26           HA       GLU  26 -15.413  24.313  24.313
  193   1HB   GLU  26           HB1      GLU  26 -13.235  23.601  23.601
  194   2HB   GLU  26           HB2      GLU  26 -13.993  25.182  25.182
  195   1HG   GLU  26           HG1      GLU  26 -12.670  23.910  23.910
  196   2HG   GLU  26           HG2      GLU  26 -11.826  24.993  24.993
  197    H    HIS  27           HN       HIS  27 -15.146  21.838  21.838
  198    HA   HIS  27           HA       HIS  27 -17.603  22.860  22.860
  199   1HB   HIS  27           HB1      HIS  27 -15.351  21.359  21.359
  200   2HB   HIS  27           HB2      HIS  27 -16.664  22.293  22.293
  201    HD1  HIS  27           HD1      HIS  27 -16.489  24.956  24.956
  202    HD2  HIS  27           HD2      HIS  27 -13.065  22.819  22.819
  203    HE1  HIS  27           HE1      HIS  27 -14.665  26.606  26.606
  204    HA   PRO  28           HA       PRO  28 -18.624  18.553  18.553
  205   1HB   PRO  28           HB1      PRO  28 -20.614  18.991  18.991
  206   2HB   PRO  28           HB2      PRO  28 -18.934  19.173  19.173
  207   1HG   PRO  28           HG1      PRO  28 -20.843  21.375  21.375
  208   2HG   PRO  28           HG2      PRO  28 -19.892  21.331  21.331
  209   1HD   PRO  28           HD1      PRO  28 -18.958  22.603  22.603
  210   2HD   PRO  28           HD2      PRO  28 -17.851  21.860  21.860
  211    H    GLY  29           HN       GLY  29 -18.899  19.908  19.908
  212   1HA   GLY  29           HA1      GLY  29 -21.732  19.750  19.750
  213   2HA   GLY  29           HA2      GLY  29 -20.623  20.960  20.960
  214    H    LEU  30           HN       LEU  30 -18.373  19.004  19.004
  215    HA   LEU  30           HA       LEU  30 -18.953  17.774  17.774
  216   1HB   LEU  30           HB1      LEU  30 -16.336  17.032  17.032
  217   2HB   LEU  30           HB2      LEU  30 -16.770  18.055  18.055
  218    HG   LEU  30           HG       LEU  30 -16.454  19.112  19.112
  219   1HD1  LEU  30          HD11      LEU  30 -14.337  18.114  18.114
  220   2HD1  LEU  30          HD12      LEU  30 -14.487  19.082  19.082
  221   3HD1  LEU  30          HD13      LEU  30 -14.220  19.856  19.856
  222   1HD2  LEU  30          HD21      LEU  30 -16.531  20.457  20.457
  223   2HD2  LEU  30          HD22      LEU  30 -17.828  20.532  20.532
  224   3HD2  LEU  30          HD23      LEU  30 -16.274  21.274  21.274
  225    H    SER  31           HN       SER  31 -17.719  15.573  15.573
  226    HA   SER  31           HA       SER  31 -18.775  13.663  13.663
  227   1HB   SER  31           HB1      SER  31 -18.230  13.139  13.139
  228   2HB   SER  31           HB2      SER  31 -19.012  12.043  12.043
  229    HG   SER  31           HG       SER  31 -20.045  14.167  14.167
  230    H    ILE  32           HN       ILE  32 -17.516  11.569  11.569
  231    HA   ILE  32           HA       ILE  32 -14.838  12.091  12.091
  232    HB   ILE  32           HB       ILE  32 -16.488   9.624   9.624
  233   1HG1  ILE  32          HG11      ILE  32 -15.966   8.980   8.980
  234   2HG1  ILE  32          HG12      ILE  32 -14.914  10.372  10.372
  235   1HG2  ILE  32          HG21      ILE  32 -13.499   9.493   9.493
  236   2HG2  ILE  32          HG22      ILE  32 -14.578   8.097   8.097
  237   3HG2  ILE  32          HG23      ILE  32 -14.349   9.073   9.073
  238   1HD1  ILE  32          HD11      ILE  32 -17.911  10.501  10.501
  239   2HD1  ILE  32          HD12      ILE  32 -17.156  10.808  10.808
  240   3HD1  ILE  32          HD13      ILE  32 -16.854  11.890  11.890
  241    H    GLY  33           HN       GLY  33 -16.187  11.485  11.485
  242   1HA   GLY  33           HA1      GLY  33 -13.620  11.003  11.003
  243   2HA   GLY  33           HA2      GLY  33 -15.197  11.108  11.108
  244    H    ASP  34           HN       ASP  34 -15.045  13.785  13.785
  245    HA   ASP  34           HA       ASP  34 -13.962  15.473  15.473
  246   1HB   ASP  34           HB1      ASP  34 -16.025  15.934  15.934
  247   2HB   ASP  34           HB2      ASP  34 -15.519  17.239  17.239
  248    H    VAL  35           HN       VAL  35 -14.210  14.902  14.902
  249    HA   VAL  35           HA       VAL  35 -12.359  16.929  16.929
  250    HB   VAL  35           HB       VAL  35 -13.265  14.272  14.272
  251   1HG1  VAL  35          HG11      VAL  35 -11.733  16.562  16.562
  252   2HG1  VAL  35          HG12      VAL  35 -12.369  15.155  15.155
  253   3HG1  VAL  35          HG13      VAL  35 -11.082  14.972  14.972
  254   1HG2  VAL  35          HG21      VAL  35 -15.080  15.984  15.984
  255   2HG2  VAL  35          HG22      VAL  35 -14.691  15.665  15.665
  256   3HG2  VAL  35          HG23      VAL  35 -14.107  17.126  17.126
  257    H    ALA  36           HN       ALA  36 -12.163  13.737  13.737
  258    HA   ALA  36           HA       ALA  36  -9.306  13.507  13.507
  259   1HB   ALA  36           HB1      ALA  36 -10.798  11.557  11.557
  260   2HB   ALA  36           HB2      ALA  36 -11.295  11.686  11.686
  261   3HB   ALA  36           HB3      ALA  36  -9.648  11.210  11.210
  262    H    LYS  37           HN       LYS  37 -11.562  13.825  13.825
  263    HA   LYS  37           HA       LYS  37  -9.262  13.827  13.827
  264   1HB   LYS  37           HB1      LYS  37 -11.510  12.861  12.861
  265   2HB   LYS  37           HB2      LYS  37 -12.140  14.513  14.513
  266   1HG   LYS  37           HG1      LYS  37 -10.740  15.110  15.110
  267   2HG   LYS  37           HG2      LYS  37  -9.660  13.743  13.743
  268   1HD   LYS  37           HD1      LYS  37 -11.509  12.215  12.215
  269   2HD   LYS  37           HD2      LYS  37 -12.510  13.625  13.625
  270   1HE   LYS  37           HE1      LYS  37 -11.366  12.832  12.832
  271   2HE   LYS  37           HE2      LYS  37 -10.822  14.449  14.449
  272   1HZ   LYS  37           HZ1      LYS  37  -9.198  12.560  12.560
  273   2HZ   LYS  37           HZ2      LYS  37  -9.297  12.154  12.154
  274   3HZ   LYS  37           HZ3      LYS  37  -8.765  13.699  13.699
  275    H    LYS  38           HN       LYS  38 -10.649  16.207  16.207
  276    HA   LYS  38           HA       LYS  38  -9.993  18.424  18.424
  277   1HB   LYS  38           HB1      LYS  38 -12.044  18.610  18.610
  278   2HB   LYS  38           HB2      LYS  38 -10.893  18.597  18.597
  279   1HG   LYS  38           HG1      LYS  38 -10.888  20.842  20.842
  280   2HG   LYS  38           HG2      LYS  38  -9.872  20.630  20.630
  281   1HD   LYS  38           HD1      LYS  38 -12.912  20.737  20.737
  282   2HD   LYS  38           HD2      LYS  38 -11.885  22.118  22.118
  283   1HE   LYS  38           HE1      LYS  38 -12.468  21.294  21.294
  284   2HE   LYS  38           HE2      LYS  38 -10.813  20.768  20.768
  285   1HZ   LYS  38           HZ1      LYS  38 -12.580  18.795  18.795
  286   2HZ   LYS  38           HZ2      LYS  38 -13.035  19.234  19.234
  287   3HZ   LYS  38           HZ3      LYS  38 -11.455  18.694  18.694
  288    H    LEU  39           HN       LEU  39  -9.232  17.244  17.244
  289    HA   LEU  39           HA       LEU  39  -6.830  18.842  18.842
  290   1HB   LEU  39           HB1      LEU  39  -7.325  18.254  18.254
  291   2HB   LEU  39           HB2      LEU  39  -8.460  17.066  17.066
  292    HG   LEU  39           HG       LEU  39  -6.187  15.691  15.691
  293   1HD1  LEU  39          HD11      LEU  39  -4.843  17.645  17.645
  294   2HD1  LEU  39          HD12      LEU  39  -5.590  17.594  17.594
  295   3HD1  LEU  39          HD13      LEU  39  -4.563  16.274  16.274
  296   1HD2  LEU  39          HD21      LEU  39  -7.491  16.184  16.184
  297   2HD2  LEU  39          HD22      LEU  39  -8.067  14.995  14.995
  298   3HD2  LEU  39          HD23      LEU  39  -6.528  14.794  14.794
  299    H    GLY  40           HN       GLY  40  -7.604  15.701  15.701
  300   1HA   GLY  40           HA1      GLY  40  -4.921  14.743  14.743
  301   2HA   GLY  40           HA2      GLY  40  -6.319  14.175  14.175
  302    H    GLU  41           HN       GLU  41  -7.046  16.682  16.682
  303    HA   GLU  41           HA       GLU  41  -5.354  16.744  16.744
  304   1HB   GLU  41           HB1      GLU  41  -7.364  18.610  18.610
  305   2HB   GLU  41           HB2      GLU  41  -6.467  19.115  19.115
  306   1HG   GLU  41           HG1      GLU  41  -7.303  17.267  17.267
  307   2HG   GLU  41           HG2      GLU  41  -8.062  16.510  16.510
  308    H    MET  42           HN       MET  42  -5.717  18.959  18.959
  309    HA   MET  42           HA       MET  42  -3.655  20.761  20.761
  310   1HB   MET  42           HB1      MET  42  -4.488  19.694  19.694
  311   2HB   MET  42           HB2      MET  42  -3.478  21.120  21.120
  312   1HG   MET  42           HG1      MET  42  -5.493  21.852  21.852
  313   2HG   MET  42           HG2      MET  42  -6.384  20.688  20.688
  314   1HE   MET  42           HE1      MET  42  -7.229  20.860  20.860
  315   2HE   MET  42           HE2      MET  42  -7.820  22.442  22.442
  316   3HE   MET  42           HE3      MET  42  -8.238  21.800  21.800
  317    H    TRP  43           HN       TRP  43  -3.435  17.752  17.752
  318    HA   TRP  43           HA       TRP  43  -0.728  17.700  17.700
  319   1HB   TRP  43           HB1      TRP  43  -2.120  15.862  15.862
  320   2HB   TRP  43           HB2      TRP  43  -2.573  15.455  15.455
  321    HD1  TRP  43           HD1      TRP  43  -1.122  13.697  13.697
  322    HE1  TRP  43           HE1      TRP  43   1.097  12.723  12.723
  323    HE3  TRP  43           HE3      TRP  43   0.099  16.504  16.504
  324    HZ2  TRP  43           HZ2      TRP  43   3.252  13.005  13.005
  325    HZ3  TRP  43           HZ3      TRP  43   2.222  16.172  16.172
  326    HH2  TRP  43           HH2      TRP  43   3.811  14.422  14.422
  327    H    ASN  44           HN       ASN  44  -2.237  16.614  16.614
  328    HA   ASN  44           HA       ASN  44   0.136  15.879  15.879
  329   1HB   ASN  44           HB1      ASN  44  -2.419  17.023  17.023
  330   2HB   ASN  44           HB2      ASN  44  -1.147  16.162  16.162
  331   1HD2  ASN  44          HD21      ASN  44  -3.962  13.973  13.973
  332   2HD2  ASN  44          HD22      ASN  44  -4.133  15.600  15.600
  333    H    ASN  45           HN       ASN  45  -1.369  18.964  18.964
  334    HA   ASN  45           HA       ASN  45   0.953  20.320  20.320
  335   1HB   ASN  45           HB1      ASN  45  -1.627  21.819  21.819
  336   2HB   ASN  45           HB2      ASN  45  -0.489  21.981  21.981
  337   1HD2  ASN  45          HD21      ASN  45  -3.709  19.619  19.619
  338   2HD2  ASN  45          HD22      ASN  45  -3.441  20.676  20.676
  339    H    THR  46           HN       THR  46   1.265  19.434  19.434
  340    HA   THR  46           HA       THR  46   0.726  21.658  21.658
  341    HB   THR  46           HB       THR  46   1.009  19.256  19.256
  342    HG1  THR  46           HG1      THR  46   3.023  20.499  20.499
  343   1HG2  THR  46          HG21      THR  46   4.027  19.752  19.752
  344   2HG2  THR  46          HG22      THR  46   3.274  18.385  18.385
  345   3HG2  THR  46          HG23      THR  46   3.121  18.588  18.588
  346    H    ALA  47           HN       ALA  47   3.447  20.424  20.424
  347    HA   ALA  47           HA       ALA  47   4.740  22.800  22.800
  348   1HB   ALA  47           HB1      ALA  47   5.232  23.097  23.097
  349   2HB   ALA  47           HB2      ALA  47   5.992  21.516  21.516
  350   3HB   ALA  47           HB3      ALA  47   6.698  22.837  22.837
  351    H    ALA  48           HN       ALA  48   5.326  19.652  19.652
  352    HA   ALA  48           HA       ALA  48   5.995  17.635  17.635
  353   1HB   ALA  48           HB1      ALA  48   5.762  18.567  18.567
  354   2HB   ALA  48           HB2      ALA  48   7.343  19.323  19.323
  355   3HB   ALA  48           HB3      ALA  48   7.195  17.586  17.586
  356    H    ASP  49           HN       ASP  49   7.632  20.475  20.475
  357    HA   ASP  49           HA       ASP  49  10.251  19.252  19.252
  358   1HB   ASP  49           HB1      ASP  49   9.930  21.373  21.373
  359   2HB   ASP  49           HB2      ASP  49   9.383  22.185  22.185
  360    H    ASP  50           HN       ASP  50   7.330  19.961  19.961
  361    HA   ASP  50           HA       ASP  50   8.314  20.296  20.296
  362   1HB   ASP  50           HB1      ASP  50   6.700  22.053  22.053
  363   2HB   ASP  50           HB2      ASP  50   5.488  20.793  20.793
  364    H    LYS  51           HN       LYS  51   7.195  18.122  18.122
  365    HA   LYS  51           HA       LYS  51   5.578  16.440  16.440
  366   1HB   LYS  51           HB1      LYS  51   6.820  15.912  15.912
  367   2HB   LYS  51           HB2      LYS  51   5.925  14.695  14.695
  368   1HG   LYS  51           HG1      LYS  51   3.955  16.296  16.296
  369   2HG   LYS  51           HG2      LYS  51   4.890  17.310  17.310
  370   1HD   LYS  51           HD1      LYS  51   5.116  15.407  15.407
  371   2HD   LYS  51           HD2      LYS  51   4.226  14.372  14.372
  372   1HE   LYS  51           HE1      LYS  51   2.260  15.869  15.869
  373   2HE   LYS  51           HE2      LYS  51   3.130  16.841  16.841
  374   1HZ   LYS  51           HZ1      LYS  51   3.312  14.171  14.171
  375   2HZ   LYS  51           HZ2      LYS  51   1.684  14.486  14.486
  376   3HZ   LYS  51           HZ3      LYS  51   2.497  15.439  15.439
  377    H    GLN  52           HN       GLN  52   8.690  16.412  16.412
  378    HA   GLN  52           HA       GLN  52  10.072  14.305  14.305
  379   1HB   GLN  52           HB1      GLN  52  10.727  17.109  17.109
  380   2HB   GLN  52           HB2      GLN  52  11.672  16.491  16.491
  381   1HG   GLN  52           HG1      GLN  52  12.942  16.303  16.303
  382   2HG   GLN  52           HG2      GLN  52  12.599  14.705  14.705
  383   1HE2  GLN  52          HE21      GLN  52   9.881  14.998  14.998
  384   2HE2  GLN  52          HE22      GLN  52   9.654  15.584  15.584
  385    HA   PRO  53           HA       PRO  53  10.742  14.908  14.908
  386   1HB   PRO  53           HB1      PRO  53   8.726  16.423  16.423
  387   2HB   PRO  53           HB2      PRO  53  10.337  17.014  17.014
  388   1HG   PRO  53           HG1      PRO  53   7.819  17.144  17.144
  389   2HG   PRO  53           HG2      PRO  53   8.882  18.485  18.485
  390   1HD   PRO  53           HD1      PRO  53   9.307  17.373  17.373
  391   2HD   PRO  53           HD2      PRO  53  10.729  17.573  17.573
  392    H    TYR  54           HN       TYR  54   7.360  15.196  15.196
  393    HA   TYR  54           HA       TYR  54   6.376  13.141  13.141
  394   1HB   TYR  54           HB1      TYR  54   5.162  14.371  14.371
  395   2HB   TYR  54           HB2      TYR  54   4.296  13.285  13.285
  396    HD1  TYR  54           HD1      TYR  54   4.894  14.191  14.191
  397    HD2  TYR  54           HD2      TYR  54   4.407  16.545  16.545
  398    HE1  TYR  54           HE1      TYR  54   4.274  16.123  16.123
  399    HE2  TYR  54           HE2      TYR  54   3.796  18.476  18.476
  400    HH   TYR  54           HH       TYR  54   4.432  18.830  18.830
  401    H    GLU  55           HN       GLU  55   7.020  13.304  13.304
  402    HA   GLU  55           HA       GLU  55   6.317  10.696  10.696
  403   1HB   GLU  55           HB1      GLU  55   7.493  13.001  13.001
  404   2HB   GLU  55           HB2      GLU  55   8.647  11.724  11.724
  405   1HG   GLU  55           HG1      GLU  55   6.730  10.316  10.316
  406   2HG   GLU  55           HG2      GLU  55   5.657  11.672  11.672
  407    H    LYS  56           HN       LYS  56   9.566  11.838  11.838
  408    HA   LYS  56           HA       LYS  56  11.046   9.586   9.586
  409   1HB   LYS  56           HB1      LYS  56  11.959  11.699  11.699
  410   2HB   LYS  56           HB2      LYS  56  10.991  11.607  11.607
  411   1HG   LYS  56           HG1      LYS  56  12.244   9.605   9.605
  412   2HG   LYS  56           HG2      LYS  56  13.206   9.621   9.621
  413   1HD   LYS  56           HD1      LYS  56  13.181  12.194  12.194
  414   2HD   LYS  56           HD2      LYS  56  13.919  10.859  10.859
  415   1HE   LYS  56           HE1      LYS  56  15.625  12.080  12.080
  416   2HE   LYS  56           HE2      LYS  56  15.438  10.465  10.465
  417   1HZ   LYS  56           HZ1      LYS  56  13.632  12.155  12.155
  418   2HZ   LYS  56           HZ2      LYS  56  15.150  12.908  12.908
  419   3HZ   LYS  56           HZ3      LYS  56  14.978  11.344  11.344
  420    H    LYS  57           HN       LYS  57   8.777  10.276  10.276
  421    HA   LYS  57           HA       LYS  57   9.321   7.837   7.837
  422   1HB   LYS  57           HB1      LYS  57   7.112   9.952   9.952
  423   2HB   LYS  57           HB2      LYS  57   7.058   8.545   8.545
  424   1HG   LYS  57           HG1      LYS  57   9.506  10.360  10.360
  425   2HG   LYS  57           HG2      LYS  57   8.190  10.658  10.658
  426   1HD   LYS  57           HD1      LYS  57   8.691   8.859   8.859
  427   2HD   LYS  57           HD2      LYS  57   9.222   7.837   7.837
  428   1HE   LYS  57           HE1      LYS  57  11.101   8.443   8.443
  429   2HE   LYS  57           HE2      LYS  57  11.362   9.085   9.085
  430   1HZ   LYS  57           HZ1      LYS  57   9.947  10.987  10.987
  431   2HZ   LYS  57           HZ2      LYS  57  11.273  10.465  10.465
  432   3HZ   LYS  57           HZ3      LYS  57  11.518  11.084  11.084
  433    H    ALA  58           HN       ALA  58   6.553   8.927   8.927
  434    HA   ALA  58           HA       ALA  58   5.010   6.645   6.645
  435   1HB   ALA  58           HB1      ALA  58   4.476   8.715   8.715
  436   2HB   ALA  58           HB2      ALA  58   5.728   8.416   8.416
  437   3HB   ALA  58           HB3      ALA  58   4.333   7.350   7.350
  438    H    ALA  59           HN       ALA  59   7.829   7.306   7.306
  439    HA   ALA  59           HA       ALA  59   7.880   4.936   4.936
  440   1HB   ALA  59           HB1      ALA  59   9.291   6.946   6.946
  441   2HB   ALA  59           HB2      ALA  59  10.229   6.651   6.651
  442   3HB   ALA  59           HB3      ALA  59  10.290   5.505   5.505
  443    H    LYS  60           HN       LYS  60   9.869   5.724   5.724
  444    HA   LYS  60           HA       LYS  60  11.111   3.389   3.389
  445   1HB   LYS  60           HB1      LYS  60  10.761   5.815   5.815
  446   2HB   LYS  60           HB2      LYS  60   9.859   4.776   4.776
  447   1HG   LYS  60           HG1      LYS  60  12.096   4.736   4.736
  448   2HG   LYS  60           HG2      LYS  60  11.967   3.232   3.232
  449   1HD   LYS  60           HD1      LYS  60  13.057   4.291   4.291
  450   2HD   LYS  60           HD2      LYS  60  13.157   5.816   5.816
  451   1HE   LYS  60           HE1      LYS  60  14.593   4.695   4.695
  452   2HE   LYS  60           HE2      LYS  60  14.566   3.227   3.227
  453   1HZ   LYS  60           HZ1      LYS  60  15.239   5.406   5.406
  454   2HZ   LYS  60           HZ2      LYS  60  16.238   5.425   5.425
  455   3HZ   LYS  60           HZ3      LYS  60  16.172   4.041   4.041
  456    H    LEU  61           HN       LEU  61   7.838   4.270   4.270
  457    HA   LEU  61           HA       LEU  61   7.227   1.800   1.800
  458   1HB   LEU  61           HB1      LEU  61   5.383   3.854   3.854
  459   2HB   LEU  61           HB2      LEU  61   4.897   2.652   2.652
  460    HG   LEU  61           HG       LEU  61   7.014   4.820   4.820
  461   1HD1  LEU  61          HD11      LEU  61   4.164   4.601   4.601
  462   2HD1  LEU  61          HD12      LEU  61   5.331   5.839   5.839
  463   3HD1  LEU  61          HD13      LEU  61   4.778   5.737   5.737
  464   1HD2  LEU  61          HD21      LEU  61   5.848   2.785   2.785
  465   2HD2  LEU  61          HD22      LEU  61   7.498   2.807   2.807
  466   3HD2  LEU  61          HD23      LEU  61   6.940   4.097   4.097
  467    H    LYS  62           HN       LYS  62   6.117   2.906   2.906
  468    HA   LYS  62           HA       LYS  62   4.840   0.605   0.605
  469   1HB   LYS  62           HB1      LYS  62   6.710   2.508   2.508
  470   2HB   LYS  62           HB2      LYS  62   5.866   1.231   1.231
  471   1HG   LYS  62           HG1      LYS  62   4.344   3.191   3.191
  472   2HG   LYS  62           HG2      LYS  62   4.773   3.637   3.637
  473   1HD   LYS  62           HD1      LYS  62   3.280   1.046   1.046
  474   2HD   LYS  62           HD2      LYS  62   2.445   2.558   2.558
  475   1HE   LYS  62           HE1      LYS  62   3.464   2.732   2.732
  476   2HE   LYS  62           HE2      LYS  62   4.430   1.291   1.291
  477   1HZ   LYS  62           HZ1      LYS  62   1.754   0.672   0.672
  478   2HZ   LYS  62           HZ2      LYS  62   1.840   1.472   1.472
  479   3HZ   LYS  62           HZ3      LYS  62   2.772   0.077   0.077
  480    H    GLU  63           HN       GLU  63   8.212   1.332   1.332
  481    HA   GLU  63           HA       GLU  63   9.289  -1.001  -1.001
  482   1HB   GLU  63           HB1      GLU  63  10.223   1.317   1.317
  483   2HB   GLU  63           HB2      GLU  63  11.356   0.008   0.008
  484   1HG   GLU  63           HG1      GLU  63  11.183   0.292   0.292
  485   2HG   GLU  63           HG2      GLU  63   9.976   1.550   1.550
  486    H    LYS  64           HN       LYS  64   9.028  -0.100  -0.100
  487    HA   LYS  64           HA       LYS  64   9.956  -2.463  -2.463
  488   1HB   LYS  64           HB1      LYS  64   7.850  -0.434  -0.434
  489   2HB   LYS  64           HB2      LYS  64   8.208  -1.791  -1.791
  490   1HG   LYS  64           HG1      LYS  64  10.428  -0.017  -0.017
  491   2HG   LYS  64           HG2      LYS  64   9.539   0.479   0.479
  492   1HD   LYS  64           HD1      LYS  64  10.914  -2.250  -2.250
  493   2HD   LYS  64           HD2      LYS  64  11.733  -0.827  -0.827
  494   1HE   LYS  64           HE1      LYS  64   9.141  -1.915  -1.915
  495   2HE   LYS  64           HE2      LYS  64  10.746  -2.252  -2.252
  496   1HZ   LYS  64           HZ1      LYS  64  10.535   0.503   0.503
  497   2HZ   LYS  64           HZ2      LYS  64   9.138  -0.012  -0.012
  498   3HZ   LYS  64           HZ3      LYS  64  10.670  -0.372  -0.372
  499    H    TYR  65           HN       TYR  65   6.713  -1.666  -1.666
  500    HA   TYR  65           HA       TYR  65   5.382  -4.032  -4.032
  501   1HB   TYR  65           HB1      TYR  65   3.976  -2.265  -2.265
  502   2HB   TYR  65           HB2      TYR  65   5.012  -1.754  -1.754
  503    HD1  TYR  65           HD1      TYR  65   3.342  -5.055  -5.055
  504    HD2  TYR  65           HD2      TYR  65   3.617  -1.613  -1.613
  505    HE1  TYR  65           HE1      TYR  65   1.818  -6.090  -6.090
  506    HE2  TYR  65           HE2      TYR  65   2.095  -2.649  -2.649
  507    HH   TYR  65           HH       TYR  65   1.394  -5.845  -5.845
  508    H    GLU  66           HN       GLU  66   6.364  -3.205  -3.205
  509    HA   GLU  66           HA       GLU  66   5.951  -5.612  -5.612
  510   1HB   GLU  66           HB1      GLU  66   8.199  -3.671  -3.671
  511   2HB   GLU  66           HB2      GLU  66   7.709  -4.894  -4.894
  512   1HG   GLU  66           HG1      GLU  66   5.580  -3.002  -3.002
  513   2HG   GLU  66           HG2      GLU  66   6.694  -2.346  -2.346
  514    H    LYS  67           HN       LYS  67   8.659  -4.907  -4.907
  515    HA   LYS  67           HA       LYS  67  10.087  -7.316  -7.316
  516   1HB   LYS  67           HB1      LYS  67  10.732  -5.014  -5.014
  517   2HB   LYS  67           HB2      LYS  67  11.634  -6.493  -6.493
  518   1HG   LYS  67           HG1      LYS  67  12.929  -5.204  -5.204
  519   2HG   LYS  67           HG2      LYS  67  12.198  -6.457  -6.457
  520   1HD   LYS  67           HD1      LYS  67  10.503  -4.808  -4.808
  521   2HD   LYS  67           HD2      LYS  67  11.241  -3.578  -3.578
  522   1HE   LYS  67           HE1      LYS  67  13.389  -3.826  -3.826
  523   2HE   LYS  67           HE2      LYS  67  12.657  -5.036  -5.036
  524   1HZ   LYS  67           HZ1      LYS  67  11.002  -2.794  -2.794
  525   2HZ   LYS  67           HZ2      LYS  67  12.590  -2.255  -2.255
  526   3HZ   LYS  67           HZ3      LYS  67  11.921  -3.423  -3.423
  527    H    ASP  68           HN       ASP  68   8.267  -6.277  -6.277
  528    HA   ASP  68           HA       ASP  68   8.889  -8.550  -8.550
  529   1HB   ASP  68           HB1      ASP  68   8.423  -6.220  -6.220
  530   2HB   ASP  68           HB2      ASP  68   6.732  -6.444  -6.444
  531    H    ILE  69           HN       ILE  69   6.662  -7.622  -7.622
  532    HA   ILE  69           HA       ILE  69   4.688  -9.637  -9.637
  533    HB   ILE  69           HB       ILE  69   3.912  -7.513  -7.513
  534   1HG1  ILE  69          HG11      ILE  69   2.421  -8.449  -8.449
  535   2HG1  ILE  69          HG12      ILE  69   3.531  -9.751  -9.751
  536   1HG2  ILE  69          HG21      ILE  69   5.882  -7.259  -7.259
  537   2HG2  ILE  69          HG22      ILE  69   5.311  -8.567  -8.567
  538   3HG2  ILE  69          HG23      ILE  69   4.352  -7.098  -7.098
  539   1HD1  ILE  69          HD11      ILE  69   2.189  -9.438  -9.438
  540   2HD1  ILE  69          HD12      ILE  69   1.692 -10.561 -10.561
  541   3HD1  ILE  69          HD13      ILE  69   3.243 -10.757 -10.757
  542    H    ALA  70           HN       ALA  70   7.067  -8.995  -8.995
  543    HA   ALA  70           HA       ALA  70   6.885 -11.365 -11.365
  544   1HB   ALA  70           HB1      ALA  70   9.399  -9.718  -9.718
  545   2HB   ALA  70           HB2      ALA  70   9.265 -10.875 -10.875
  546   3HB   ALA  70           HB3      ALA  70   8.297  -9.412  -9.412
  547    H    ALA  71           HN       ALA  71   8.278 -10.679 -10.679
  548    HA   ALA  71           HA       ALA  71   9.605 -13.283 -13.283
  549   1HB   ALA  71           HB1      ALA  71   9.251 -11.005 -11.005
  550   2HB   ALA  71           HB2      ALA  71  10.264 -12.417 -12.417
  551   3HB   ALA  71           HB3      ALA  71  10.665 -11.265 -11.265
  552    H    TYR  72           HN       TYR  72   6.801 -11.570 -11.570
  553    HA   TYR  72           HA       TYR  72   5.782 -13.211 -13.211
  554   1HB   TYR  72           HB1      TYR  72   4.980 -10.959 -10.959
  555   2HB   TYR  72           HB2      TYR  72   3.947 -12.035 -12.035
  556    HD1  TYR  72           HD1      TYR  72   2.419 -13.693 -13.693
  557    HD2  TYR  72           HD2      TYR  72   4.320 -10.257 -10.257
  558    HE1  TYR  72           HE1      TYR  72   0.836 -13.698 -13.698
  559    HE2  TYR  72           HE2      TYR  72   2.743 -10.257 -10.257
  560    HH   TYR  72           HH       TYR  72   1.140 -12.555 -12.555
  561    H    ARG  73           HN       ARG  73   5.255 -13.288 -13.288
  562    HA   ARG  73           HA       ARG  73   3.669 -15.705 -15.705
  563   1HB   ARG  73           HB1      ARG  73   4.799 -13.919 -13.919
  564   2HB   ARG  73           HB2      ARG  73   3.771 -15.293 -15.293
  565   1HG   ARG  73           HG1      ARG  73   2.886 -13.054 -13.054
  566   2HG   ARG  73           HG2      ARG  73   2.654 -12.958 -12.958
  567   1HD   ARG  73           HD1      ARG  73   1.330 -15.045 -15.045
  568   2HD   ARG  73           HD2      ARG  73   1.584 -15.208 -15.208
  569    HE   ARG  73           HE       ARG  73   0.194 -12.833 -12.833
  570   1HH1  ARG  73          HH11      ARG  73   0.998 -14.021 -14.021
  571   2HH1  ARG  73          HH12      ARG  73  -0.612 -14.163 -14.163
  572   1HH2  ARG  73          HH21      ARG  73  -2.074 -13.591 -13.591
  573   2HH2  ARG  73          HH22      ARG  73  -2.411 -13.912 -13.912
  574    H    ALA  74           HN       ALA  74   6.823 -14.739 -14.739
  575    HA   ALA  74           HA       ALA  74   8.023 -16.702 -16.702
  576   1HB   ALA  74           HB1      ALA  74   9.093 -15.763 -15.763
  577   2HB   ALA  74           HB2      ALA  74  10.050 -16.533 -16.533
  578   3HB   ALA  74           HB3      ALA  74   9.340 -14.964 -14.964
  579    H    LYS  75           HN       LYS  75   7.300 -17.044 -17.044
  580    HA   LYS  75           HA       LYS  75   6.326 -18.984 -18.984
  581   1HB   LYS  75           HB1      LYS  75   6.734 -20.585 -20.585
  582   2HB   LYS  75           HB2      LYS  75   8.418 -20.671 -20.671
  583   1HG   LYS  75           HG1      LYS  75   7.557 -21.455 -21.455
  584   2HG   LYS  75           HG2      LYS  75   5.955 -21.482 -21.482
  585   1HD   LYS  75           HD1      LYS  75   6.788 -23.741 -23.741
  586   2HD   LYS  75           HD2      LYS  75   6.745 -23.258 -23.258
  587   1HE   LYS  75           HE1      LYS  75   9.274 -22.977 -22.977
  588   2HE   LYS  75           HE2      LYS  75   8.891 -24.461 -24.461
  589   1HZ   LYS  75           HZ1      LYS  75   8.551 -22.403 -22.403
  590   2HZ   LYS  75           HZ2      LYS  75  10.020 -22.105 -22.105
  591   3HZ   LYS  75           HZ3      LYS  75   9.759 -23.592 -23.592
  592    H    GLY  76           HN       GLY  76   7.614 -17.200 -17.200
  593   1HA   GLY  76           HA1      GLY  76  10.259 -18.070 -18.070
  594   2HA   GLY  76           HA2      GLY  76   9.637 -16.431 -16.431
  595    H    LYS  77           HN       LYS  77   7.233 -16.771 -16.771
  596    HA   LYS  77           HA       LYS  77   6.673 -16.309 -16.309
  597   1HB   LYS  77           HB1      LYS  77   5.723 -19.088 -19.088
  598   2HB   LYS  77           HB2      LYS  77   4.875 -17.869 -17.869
  599   1HG   LYS  77           HG1      LYS  77   4.716 -16.439 -16.439
  600   2HG   LYS  77           HG2      LYS  77   5.526 -17.698 -17.698
  601   1HD   LYS  77           HD1      LYS  77   3.695 -19.308 -19.308
  602   2HD   LYS  77           HD2      LYS  77   2.834 -17.918 -17.918
  603   1HE   LYS  77           HE1      LYS  77   2.832 -16.885 -16.885
  604   2HE   LYS  77           HE2      LYS  77   3.675 -18.301 -18.301
  605   1HZ   LYS  77           HZ1      LYS  77   1.438 -19.166 -19.166
  606   2HZ   LYS  77           HZ2      LYS  77   0.944 -17.953 -17.953
  607   3HZ   LYS  77           HZ3      LYS  77   1.766 -19.323 -19.323
  608    HA   PRO  78           HA       PRO  78   9.301 -18.153 -18.153
  609   1HB   PRO  78           HB1      PRO  78   7.377 -17.314 -17.314
  610   2HB   PRO  78           HB2      PRO  78   9.035 -16.764 -16.764
  611   1HG   PRO  78           HG1      PRO  78   7.018 -15.092 -15.092
  612   2HG   PRO  78           HG2      PRO  78   8.383 -15.233 -15.233
  613   1HD   PRO  78           HD1      PRO  78   5.720 -16.746 -16.746
  614   2HD   PRO  78           HD2      PRO  78   6.438 -15.699 -15.699
  615    H    ASP  79           HN       ASP  79   6.668 -19.653 -19.653
  616    HA   ASP  79           HA       ASP  79   7.048 -21.919 -21.919
  617   1HB   ASP  79           HB1      ASP  79   4.544 -22.299 -22.299
  618   2HB   ASP  79           HB2      ASP  79   4.928 -20.732 -20.732
  619    H    ALA  80           HN       ALA  80   7.699 -21.064 -21.064
  620    HA   ALA  80           HA       ALA  80   7.094 -23.693 -23.693
  621   1HB   ALA  80           HB1      ALA  80   7.186 -20.948 -20.948
  622   2HB   ALA  80           HB2      ALA  80   6.936 -22.467 -22.467
  623   3HB   ALA  80           HB3      ALA  80   5.737 -21.891 -21.891
  624    H    ALA  81           HN       ALA  81   9.201 -20.856 -20.856
  625    HA   ALA  81           HA       ALA  81  11.516 -22.689 -22.689
  626   1HB   ALA  81           HB1      ALA  81  10.814 -21.652 -21.652
  627   2HB   ALA  81           HB2      ALA  81  10.953 -20.052 -20.052
  628   3HB   ALA  81           HB3      ALA  81  12.386 -21.045 -21.045
  629   1H1   BME  16           HE1      MER  16  -9.117  10.459  10.459
  630   2H1   BME  16           HE2      MER  16  -7.958   9.214   9.214
  631   1H2   BME  16           HZ1      MER  16  -6.162  10.421  10.421
  632   2H2   BME  16           HZ2      MER  16  -7.268  11.682  11.682
  633    HO1  BME  16           HH       MER  16  -8.046   8.448   8.448

  Start of MODEL   26
    1    H    ASN   3           HN       ASN   3  -2.642 -11.461 -11.461
    2    HA   ASN   3           HA       ASN   3  -1.018 -13.113 -13.113
    3   1HB   ASN   3           HB1      ASN   3  -3.959 -13.021 -13.021
    4   2HB   ASN   3           HB2      ASN   3  -3.493 -13.340 -13.340
    5   1HD2  ASN   3          HD21      ASN   3  -2.830 -16.686 -16.686
    6   2HD2  ASN   3          HD22      ASN   3  -3.337 -15.488 -15.488
    7    H    ALA   4           HN       ALA   4   0.041 -11.788 -11.788
    8    HA   ALA   4           HA       ALA   4   0.446 -10.380 -10.380
    9   1HB   ALA   4           HB1      ALA   4  -1.625 -11.241 -11.241
   10   2HB   ALA   4           HB2      ALA   4  -2.590 -10.042 -10.042
   11   3HB   ALA   4           HB3      ALA   4  -1.400  -9.534  -9.534
   12    HA   PRO   5           HA       PRO   5   0.379  -6.479  -6.479
   13   1HB   PRO   5           HB1      PRO   5   2.989  -6.400  -6.400
   14   2HB   PRO   5           HB2      PRO   5   2.637  -6.004  -6.004
   15   1HG   PRO   5           HG1      PRO   5   3.886  -8.325  -8.325
   16   2HG   PRO   5           HG2      PRO   5   2.568  -8.322  -8.322
   17   1HD   PRO   5           HD1      PRO   5   2.417  -9.074  -9.074
   18   2HD   PRO   5           HD2      PRO   5   1.859 -10.002 -10.002
   19    H    LYS   6           HN       LYS   6  -1.167  -5.454  -5.454
   20    HA   LYS   6           HA       LYS   6  -1.265  -5.207  -5.207
   21   1HB   LYS   6           HB1      LYS   6  -2.675  -3.859  -3.859
   22   2HB   LYS   6           HB2      LYS   6  -2.858  -3.137  -3.137
   23   1HG   LYS   6           HG1      LYS   6  -4.726  -4.616  -4.616
   24   2HG   LYS   6           HG2      LYS   6  -3.746  -5.271  -5.271
   25   1HD   LYS   6           HD1      LYS   6  -2.741  -6.903  -6.903
   26   2HD   LYS   6           HD2      LYS   6  -3.551  -6.209  -6.209
   27   1HE   LYS   6           HE1      LYS   6  -5.759  -6.770  -6.770
   28   2HE   LYS   6           HE2      LYS   6  -4.921  -7.500  -7.500
   29   1HZ   LYS   6           HZ1      LYS   6  -3.905  -8.564  -8.564
   30   2HZ   LYS   6           HZ2      LYS   6  -5.600  -8.662  -8.662
   31   3HZ   LYS   6           HZ3      LYS   6  -4.723  -9.355  -9.355
   32    H    ARG   7           HN       ARG   7  -1.545  -2.609  -2.609
   33    HA   ARG   7           HA       ARG   7   1.231  -1.736  -1.736
   34   1HB   ARG   7           HB1      ARG   7  -1.003  -0.490  -0.490
   35   2HB   ARG   7           HB2      ARG   7   0.678  -0.019  -0.019
   36   1HG   ARG   7           HG1      ARG   7   0.453  -1.433  -1.433
   37   2HG   ARG   7           HG2      ARG   7   1.166  -2.484  -2.484
   38   1HD   ARG   7           HD1      ARG   7  -0.969  -3.565  -3.565
   39   2HD   ARG   7           HD2      ARG   7  -1.837  -2.372  -2.372
   40    HE   ARG   7           HE       ARG   7   0.125  -4.348  -4.348
   41   1HH1  ARG   7          HH11      ARG   7  -0.284  -2.386  -2.386
   42   2HH1  ARG   7          HH12      ARG   7  -1.738  -2.845  -2.845
   43   1HH2  ARG   7          HH21      ARG   7  -2.778  -4.952  -4.952
   44   2HH2  ARG   7          HH22      ARG   7  -3.184  -4.333  -4.333
   45    HA   PRO   8           HA       PRO   8   0.046   1.183   1.183
   46   1HB   PRO   8           HB1      PRO   8   2.445   2.587   2.587
   47   2HB   PRO   8           HB2      PRO   8   2.264   0.961   0.961
   48   1HG   PRO   8           HG1      PRO   8   3.298   1.808   1.808
   49   2HG   PRO   8           HG2      PRO   8   4.052   0.719   0.719
   50   1HD   PRO   8           HD1      PRO   8   2.621  -0.265  -0.265
   51   2HD   PRO   8           HD2      PRO   8   2.511  -1.049  -1.049
   52    HA   PRO   9           HA       PRO   9  -1.111   5.394   5.394
   53   1HB   PRO   9           HB1      PRO   9   1.613   5.939   5.939
   54   2HB   PRO   9           HB2      PRO   9   0.249   7.061   7.061
   55   1HG   PRO   9           HG1      PRO   9   0.393   5.606   5.606
   56   2HG   PRO   9           HG2      PRO   9  -1.163   5.603   5.603
   57   1HD   PRO   9           HD1      PRO   9   0.966   3.467   3.467
   58   2HD   PRO   9           HD2      PRO   9  -0.798   3.272   3.272
   59    H    SER  10           HN       SER  10  -0.276   7.419   7.419
   60    HA   SER  10           HA       SER  10   0.924   6.588   6.588
   61   1HB   SER  10           HB1      SER  10  -0.886   8.952   8.952
   62   2HB   SER  10           HB2      SER  10  -0.323   8.459   8.459
   63    HG   SER  10           HG       SER  10  -1.315   6.344   6.344
   64    H    ALA  11           HN       ALA  11   0.769   9.406   9.406
   65    HA   ALA  11           HA       ALA  11   3.274  10.171  10.171
   66   1HB   ALA  11           HB1      ALA  11   2.592  11.299  11.299
   67   2HB   ALA  11           HB2      ALA  11   3.945  11.803  11.803
   68   3HB   ALA  11           HB3      ALA  11   3.928  10.198  10.198
   69    H    PHE  12           HN       PHE  12   0.542  11.187  11.187
   70    HA   PHE  12           HA       PHE  12   0.066  13.722  13.722
   71   1HB   PHE  12           HB1      PHE  12  -1.092  13.760  13.760
   72   2HB   PHE  12           HB2      PHE  12  -1.034  11.984  11.984
   73    HD1  PHE  12           HD1      PHE  12  -3.109  13.789  13.789
   74    HD2  PHE  12           HD2      PHE  12  -2.921  11.727  11.727
   75    HE1  PHE  12           HE1      PHE  12  -5.555  13.656  13.656
   76    HE2  PHE  12           HE2      PHE  12  -5.361  11.615  11.615
   77    HZ   PHE  12           HZ       PHE  12  -6.691  12.564  12.564
   78    H    PHE  13           HN       PHE  13  -0.820  10.397  10.397
   79    HA   PHE  13           HA       PHE  13  -2.930  10.638  10.638
   80   1HB   PHE  13           HB1      PHE  13  -1.568   8.541   8.541
   81   2HB   PHE  13           HB2      PHE  13  -0.663   8.821   8.821
   82    HD1  PHE  13           HD1      PHE  13  -4.068   8.310   8.310
   83    HD2  PHE  13           HD2      PHE  13  -1.674   8.291   8.291
   84    HE1  PHE  13           HE1      PHE  13  -5.947   7.369   7.369
   85    HE2  PHE  13           HE2      PHE  13  -3.551   7.343   7.343
   86    HZ   PHE  13           HZ       PHE  13  -5.690   6.879   6.879
   87    H    LEU  14           HN       LEU  14   0.523  10.973  10.973
   88    HA   LEU  14           HA       LEU  14   0.211  11.404  11.404
   89   1HB   LEU  14           HB1      LEU  14   2.248  12.744  12.744
   90   2HB   LEU  14           HB2      LEU  14   2.400  12.640  12.640
   91    HG   LEU  14           HG       LEU  14   3.894  11.035  11.035
   92   1HD1  LEU  14          HD11      LEU  14   2.577   9.973   9.973
   93   2HD1  LEU  14          HD12      LEU  14   1.433   9.357   9.357
   94   3HD1  LEU  14          HD13      LEU  14   3.098   8.802   8.802
   95   1HD2  LEU  14          HD21      LEU  14   3.411  11.012  11.012
   96   2HD2  LEU  14          HD22      LEU  14   3.553   9.371   9.371
   97   3HD2  LEU  14          HD23      LEU  14   1.970  10.034  10.034
   98    H    PHE  15           HN       PHE  15   0.529  13.764  13.764
   99    HA   PHE  15           HA       PHE  15  -0.062  16.146  16.146
  100   1HB   PHE  15           HB1      PHE  15   0.853  16.368  16.368
  101   2HB   PHE  15           HB2      PHE  15  -0.141  15.048  15.048
  102    HD1  PHE  15           HD1      PHE  15  -0.727  18.536  18.536
  103    HD2  PHE  15           HD2      PHE  15  -1.544  15.593  15.593
  104    HE1  PHE  15           HE1      PHE  15  -2.141  20.138  20.138
  105    HE2  PHE  15           HE2      PHE  15  -2.947  17.195  17.195
  106    HZ   PHE  15           HZ       PHE  15  -3.244  19.461  19.461
  107    H    CYS  16           HN       MER  16  -2.326  14.132  14.132
  108    HA   CYS  16           HA       MER  16  -4.741  15.442  15.442
  109   1HB   CYS  16           HB1      MER  16  -5.806  13.376  13.376
  110   2HB   CYS  16           HB2      MER  16  -4.194  13.090  13.090
  111    H    SER  17           HN       SER  17  -3.330  13.046  13.046
  112    HA   SER  17           HA       SER  17  -5.271  13.202  13.202
  113   1HB   SER  17           HB1      SER  17  -3.410  11.545  11.545
  114   2HB   SER  17           HB2      SER  17  -2.297  12.699  12.699
  115    HG   SER  17           HG       SER  17  -3.171  12.214  12.214
  116    H    GLU  18           HN       GLU  18  -2.182  14.812  14.812
  117    HA   GLU  18           HA       GLU  18  -1.851  16.306  16.306
  118   1HB   GLU  18           HB1      GLU  18  -0.493  16.432  16.432
  119   2HB   GLU  18           HB2      GLU  18  -1.685  17.566  17.566
  120   1HG   GLU  18           HG1      GLU  18   0.074  18.932  18.932
  121   2HG   GLU  18           HG2      GLU  18  -1.210  19.077  19.077
  122    H    TYR  19           HN       TYR  19  -4.124  17.132  17.132
  123    HA   TYR  19           HA       TYR  19  -5.563  18.872  18.872
  124   1HB   TYR  19           HB1      TYR  19  -5.758  20.673  20.673
  125   2HB   TYR  19           HB2      TYR  19  -4.038  20.207  20.207
  126    HD1  TYR  19           HD1      TYR  19  -4.601  17.656  17.656
  127    HD2  TYR  19           HD2      TYR  19  -5.495  21.808  21.808
  128    HE1  TYR  19           HE1      TYR  19  -4.645  17.551  17.551
  129    HE2  TYR  19           HE2      TYR  19  -5.544  21.698  21.698
  130    HH   TYR  19           HH       TYR  19  -5.908  20.054  20.054
  131    H    ARG  20           HN       ARG  20  -6.216  16.216  16.216
  132    HA   ARG  20           HA       ARG  20  -8.356  16.498  16.498
  133   1HB   ARG  20           HB1      ARG  20  -7.474  14.276  14.276
  134   2HB   ARG  20           HB2      ARG  20  -8.246  14.468  14.468
  135   1HG   ARG  20           HG1      ARG  20 -10.351  14.909  14.909
  136   2HG   ARG  20           HG2      ARG  20  -9.365  13.676  13.676
  137   1HD   ARG  20           HD1      ARG  20 -10.443  13.524  13.524
  138   2HD   ARG  20           HD2      ARG  20 -11.087  12.655  12.655
  139    HE   ARG  20           HE       ARG  20  -8.238  12.252  12.252
  140   1HH1  ARG  20          HH11      ARG  20  -8.641  10.355  10.355
  141   2HH1  ARG  20          HH12      ARG  20  -9.446   9.020   9.020
  142   1HH2  ARG  20          HH21      ARG  20 -10.495  10.944  10.944
  143   2HH2  ARG  20          HH22      ARG  20 -10.527   9.360   9.360
  144    HA   PRO  21           HA       PRO  21 -11.462  16.918  16.918
  145   1HB   PRO  21           HB1      PRO  21  -9.967  17.599  17.599
  146   2HB   PRO  21           HB2      PRO  21 -11.132  16.297  16.297
  147   1HG   PRO  21           HG1      PRO  21  -8.513  15.672  15.672
  148   2HG   PRO  21           HG2      PRO  21  -9.475  14.858  14.858
  149   1HD   PRO  21           HD1      PRO  21  -7.774  17.378  17.378
  150   2HD   PRO  21           HD2      PRO  21  -7.592  15.840  15.840
  151    H    LYS  22           HN       LYS  22  -9.081  19.030  19.030
  152    HA   LYS  22           HA       LYS  22 -10.299  21.441  21.441
  153   1HB   LYS  22           HB1      LYS  22  -7.673  20.661  20.661
  154   2HB   LYS  22           HB2      LYS  22  -7.950  21.671  21.671
  155   1HG   LYS  22           HG1      LYS  22  -7.884  23.591  23.591
  156   2HG   LYS  22           HG2      LYS  22  -8.990  22.986  22.986
  157   1HD   LYS  22           HD1      LYS  22  -6.848  23.444  23.444
  158   2HD   LYS  22           HD2      LYS  22  -7.116  21.715  21.715
  159   1HE   LYS  22           HE1      LYS  22  -5.621  21.500  21.500
  160   2HE   LYS  22           HE2      LYS  22  -5.341  23.238  23.238
  161   1HZ   LYS  22           HZ1      LYS  22  -4.895  22.088  22.088
  162   2HZ   LYS  22           HZ2      LYS  22  -3.966  21.299  21.299
  163   3HZ   LYS  22           HZ3      LYS  22  -3.834  22.981  22.981
  164    H    ILE  23           HN       ILE  23  -9.807  19.866  19.866
  165    HA   ILE  23           HA       ILE  23 -11.012  22.159  22.159
  166    HB   ILE  23           HB       ILE  23 -11.025  20.477  20.477
  167   1HG1  ILE  23          HG11      ILE  23  -9.117  18.864  18.864
  168   2HG1  ILE  23          HG12      ILE  23 -10.772  18.368  18.368
  169   1HG2  ILE  23          HG21      ILE  23  -9.376  22.279  22.279
  170   2HG2  ILE  23          HG22      ILE  23  -8.401  21.279  21.279
  171   3HG2  ILE  23          HG23      ILE  23  -8.560  20.866  20.866
  172   1HD1  ILE  23          HD11      ILE  23 -10.296  18.345  18.345
  173   2HD1  ILE  23          HD12      ILE  23  -8.625  18.784  18.784
  174   3HD1  ILE  23          HD13      ILE  23  -9.256  17.258  17.258
  175    H    LYS  24           HN       LYS  24 -11.663  18.992  18.992
  176    HA   LYS  24           HA       LYS  24 -14.274  18.515  18.515
  177   1HB   LYS  24           HB1      LYS  24 -12.629  16.959  16.959
  178   2HB   LYS  24           HB2      LYS  24 -12.836  17.766  17.766
  179   1HG   LYS  24           HG1      LYS  24 -15.336  17.178  17.178
  180   2HG   LYS  24           HG2      LYS  24 -15.015  16.209  16.209
  181   1HD   LYS  24           HD1      LYS  24 -13.815  15.803  15.803
  182   2HD   LYS  24           HD2      LYS  24 -15.068  14.818  14.818
  183   1HE   LYS  24           HE1      LYS  24 -12.197  15.096  15.096
  184   2HE   LYS  24           HE2      LYS  24 -12.891  13.692  13.692
  185   1HZ   LYS  24           HZ1      LYS  24 -14.520  14.346  14.346
  186   2HZ   LYS  24           HZ2      LYS  24 -12.909  14.336  14.336
  187   3HZ   LYS  24           HZ3      LYS  24 -13.559  12.964  12.964
  188    H    GLY  25           HN       GLY  25 -12.904  20.157  20.157
  189   1HA   GLY  25           HA1      GLY  25 -15.205  20.708  20.708
  190   2HA   GLY  25           HA2      GLY  25 -13.708  21.638  21.638
  191    H    GLU  26           HN       GLU  26 -13.582  22.615  22.615
  192    HA   GLU  26           HA       GLU  26 -15.341  24.865  24.865
  193   1HB   GLU  26           HB1      GLU  26 -13.376  23.889  23.889
  194   2HB   GLU  26           HB2      GLU  26 -14.057  25.503  25.503
  195   1HG   GLU  26           HG1      GLU  26 -12.540  24.383  24.383
  196   2HG   GLU  26           HG2      GLU  26 -11.678  25.099  25.099
  197    H    HIS  27           HN       HIS  27 -15.019  22.123  22.123
  198    HA   HIS  27           HA       HIS  27 -17.656  22.686  22.686
  199   1HB   HIS  27           HB1      HIS  27 -15.277  21.234  21.234
  200   2HB   HIS  27           HB2      HIS  27 -16.734  21.790  21.790
  201    HD1  HIS  27           HD1      HIS  27 -17.016  24.542  24.542
  202    HD2  HIS  27           HD2      HIS  27 -13.221  23.066  23.066
  203    HE1  HIS  27           HE1      HIS  27 -15.489  26.459  26.459
  204    HA   PRO  28           HA       PRO  28 -18.235  18.531  18.531
  205   1HB   PRO  28           HB1      PRO  28 -20.271  19.122  19.122
  206   2HB   PRO  28           HB2      PRO  28 -18.611  19.528  19.528
  207   1HG   PRO  28           HG1      PRO  28 -20.694  21.346  21.346
  208   2HG   PRO  28           HG2      PRO  28 -19.762  21.666  21.666
  209   1HD   PRO  28           HD1      PRO  28 -18.901  22.577  22.577
  210   2HD   PRO  28           HD2      PRO  28 -17.741  22.087  22.087
  211    H    GLY  29           HN       GLY  29 -18.723  19.405  19.405
  212   1HA   GLY  29           HA1      GLY  29 -21.485  18.590  18.590
  213   2HA   GLY  29           HA2      GLY  29 -20.660  19.888  19.888
  214    H    LEU  30           HN       LEU  30 -18.063  18.397  18.397
  215    HA   LEU  30           HA       LEU  30 -18.070  16.972  16.972
  216   1HB   LEU  30           HB1      LEU  30 -15.981  17.056  17.056
  217   2HB   LEU  30           HB2      LEU  30 -15.658  16.609  16.609
  218    HG   LEU  30           HG       LEU  30 -16.416  19.309  19.309
  219   1HD1  LEU  30          HD11      LEU  30 -13.901  18.341  18.341
  220   2HD1  LEU  30          HD12      LEU  30 -14.195  19.995  19.995
  221   3HD1  LEU  30          HD13      LEU  30 -14.067  18.721  18.721
  222   1HD2  LEU  30          HD21      LEU  30 -16.018  18.619  18.619
  223   2HD2  LEU  30          HD22      LEU  30 -17.535  19.099  19.099
  224   3HD2  LEU  30          HD23      LEU  30 -16.202  20.231  20.231
  225    H    SER  31           HN       SER  31 -17.193  14.852  14.852
  226    HA   SER  31           HA       SER  31 -18.194  12.851  12.851
  227   1HB   SER  31           HB1      SER  31 -19.302  12.842  12.842
  228   2HB   SER  31           HB2      SER  31 -17.700  12.561  12.561
  229    HG   SER  31           HG       SER  31 -17.888  10.577  10.577
  230    H    ILE  32           HN       ILE  32 -16.808  10.732  10.732
  231    HA   ILE  32           HA       ILE  32 -14.066  11.432  11.432
  232    HB   ILE  32           HB       ILE  32 -15.671   9.427   9.427
  233   1HG1  ILE  32          HG11      ILE  32 -13.479   9.507   9.507
  234   2HG1  ILE  32          HG12      ILE  32 -13.870   7.878   7.878
  235   1HG2  ILE  32          HG21      ILE  32 -16.188   8.611   8.611
  236   2HG2  ILE  32          HG22      ILE  32 -14.504   8.218   8.218
  237   3HG2  ILE  32          HG23      ILE  32 -15.404   7.340   7.340
  238   1HD1  ILE  32          HD11      ILE  32 -12.385   8.149   8.149
  239   2HD1  ILE  32          HD12      ILE  32 -11.970   9.767   9.767
  240   3HD1  ILE  32          HD13      ILE  32 -11.526   8.372   8.372
  241    H    GLY  33           HN       GLY  33 -15.755  11.358  11.358
  242   1HA   GLY  33           HA1      GLY  33 -13.508  10.627  10.627
  243   2HA   GLY  33           HA2      GLY  33 -15.209  10.703  10.703
  244    H    ASP  34           HN       ASP  34 -15.077  13.291  13.291
  245    HA   ASP  34           HA       ASP  34 -14.312  15.091  15.091
  246   1HB   ASP  34           HB1      ASP  34 -15.999  15.568  15.568
  247   2HB   ASP  34           HB2      ASP  34 -15.759  16.801  16.801
  248    H    VAL  35           HN       VAL  35 -14.067  14.578  14.578
  249    HA   VAL  35           HA       VAL  35 -12.239  16.680  16.680
  250    HB   VAL  35           HB       VAL  35 -12.730  13.909  13.909
  251   1HG1  VAL  35          HG11      VAL  35 -11.191  16.262  16.262
  252   2HG1  VAL  35          HG12      VAL  35 -11.559  14.774  14.774
  253   3HG1  VAL  35          HG13      VAL  35 -10.463  14.749  14.749
  254   1HG2  VAL  35          HG21      VAL  35 -13.667  16.664  16.664
  255   2HG2  VAL  35          HG22      VAL  35 -14.658  15.403  15.403
  256   3HG2  VAL  35          HG23      VAL  35 -13.965  15.171  15.171
  257    H    ALA  36           HN       ALA  36 -11.988  13.532  13.532
  258    HA   ALA  36           HA       ALA  36  -9.110  13.344  13.344
  259   1HB   ALA  36           HB1      ALA  36 -11.299  11.729  11.729
  260   2HB   ALA  36           HB2      ALA  36  -9.618  11.202  11.202
  261   3HB   ALA  36           HB3      ALA  36 -10.569  11.380  11.380
  262    H    LYS  37           HN       LYS  37 -11.639  13.971  13.971
  263    HA   LYS  37           HA       LYS  37  -9.884  14.114  14.114
  264   1HB   LYS  37           HB1      LYS  37 -12.073  13.834  13.834
  265   2HB   LYS  37           HB2      LYS  37 -12.680  14.731  14.731
  266   1HG   LYS  37           HG1      LYS  37 -13.323  15.808  15.808
  267   2HG   LYS  37           HG2      LYS  37 -12.303  16.842  16.842
  268   1HD   LYS  37           HD1      LYS  37 -10.530  16.768  16.768
  269   2HD   LYS  37           HD2      LYS  37 -10.946  15.178  15.178
  270   1HE   LYS  37           HE1      LYS  37 -11.323  17.104  17.104
  271   2HE   LYS  37           HE2      LYS  37 -12.760  16.133  16.133
  272   1HZ   LYS  37           HZ1      LYS  37 -12.694  18.177  18.177
  273   2HZ   LYS  37           HZ2      LYS  37 -12.394  18.877  18.877
  274   3HZ   LYS  37           HZ3      LYS  37 -13.795  17.949  17.949
  275    H    LYS  38           HN       LYS  38 -11.128  16.527  16.527
  276    HA   LYS  38           HA       LYS  38 -10.096  18.832  18.832
  277   1HB   LYS  38           HB1      LYS  38 -11.978  18.653  18.653
  278   2HB   LYS  38           HB2      LYS  38 -10.728  18.326  18.326
  279   1HG   LYS  38           HG1      LYS  38 -10.796  20.536  20.536
  280   2HG   LYS  38           HG2      LYS  38  -9.706  20.628  20.628
  281   1HD   LYS  38           HD1      LYS  38 -12.724  21.033  21.033
  282   2HD   LYS  38           HD2      LYS  38 -11.506  22.278  22.278
  283   1HE   LYS  38           HE1      LYS  38 -12.185  21.884  21.884
  284   2HE   LYS  38           HE2      LYS  38 -10.670  21.009  21.009
  285   1HZ   LYS  38           HZ1      LYS  38 -12.793  19.333  19.333
  286   2HZ   LYS  38           HZ2      LYS  38 -13.166  20.030  20.030
  287   3HZ   LYS  38           HZ3      LYS  38 -11.725  19.154  19.154
  288    H    LEU  39           HN       LEU  39  -9.050  17.191  17.191
  289    HA   LEU  39           HA       LEU  39  -6.552  18.635  18.635
  290   1HB   LEU  39           HB1      LEU  39  -6.685  18.084  18.084
  291   2HB   LEU  39           HB2      LEU  39  -8.240  17.412  17.412
  292    HG   LEU  39           HG       LEU  39  -6.973  15.257  15.257
  293   1HD1  LEU  39          HD11      LEU  39  -4.903  16.970  16.970
  294   2HD1  LEU  39          HD12      LEU  39  -4.758  15.239  15.239
  295   3HD1  LEU  39          HD13      LEU  39  -4.651  16.131  16.131
  296   1HD2  LEU  39          HD21      LEU  39  -8.406  15.759  15.759
  297   2HD2  LEU  39          HD22      LEU  39  -7.028  14.808  14.808
  298   3HD2  LEU  39          HD23      LEU  39  -7.027  16.533  16.533
  299    H    GLY  40           HN       GLY  40  -7.578  15.674  15.674
  300   1HA   GLY  40           HA1      GLY  40  -4.906  14.526  14.526
  301   2HA   GLY  40           HA2      GLY  40  -6.287  13.982  13.982
  302    H    GLU  41           HN       GLU  41  -6.698  16.929  16.929
  303    HA   GLU  41           HA       GLU  41  -4.977  16.958  16.958
  304   1HB   GLU  41           HB1      GLU  41  -7.350  17.385  17.385
  305   2HB   GLU  41           HB2      GLU  41  -7.266  18.687  18.687
  306   1HG   GLU  41           HG1      GLU  41  -7.327  19.605  19.605
  307   2HG   GLU  41           HG2      GLU  41  -5.769  19.941  19.941
  308    H    MET  42           HN       MET  42  -5.793  18.909  18.909
  309    HA   MET  42           HA       MET  42  -4.031  21.064  21.064
  310   1HB   MET  42           HB1      MET  42  -4.738  19.450  19.450
  311   2HB   MET  42           HB2      MET  42  -3.829  20.952  20.952
  312   1HG   MET  42           HG1      MET  42  -6.616  20.684  20.684
  313   2HG   MET  42           HG2      MET  42  -6.298  21.284  21.284
  314   1HE   MET  42           HE1      MET  42  -5.750  21.867  21.867
  315   2HE   MET  42           HE2      MET  42  -7.415  22.192  22.192
  316   3HE   MET  42           HE3      MET  42  -6.396  23.493  23.493
  317    H    TRP  43           HN       TRP  43  -3.491  17.838  17.838
  318    HA   TRP  43           HA       TRP  43  -0.836  17.894  17.894
  319   1HB   TRP  43           HB1      TRP  43  -2.219  15.891  15.891
  320   2HB   TRP  43           HB2      TRP  43  -2.417  15.818  15.818
  321    HD1  TRP  43           HD1      TRP  43  -0.946  14.158  14.158
  322    HE1  TRP  43           HE1      TRP  43   1.313  13.228  13.228
  323    HE3  TRP  43           HE3      TRP  43   0.069  16.667  16.667
  324    HZ2  TRP  43           HZ2      TRP  43   3.397  13.414  13.414
  325    HZ3  TRP  43           HZ3      TRP  43   2.088  16.288  16.288
  326    HH2  TRP  43           HH2      TRP  43   3.798  14.658  14.658
  327    H    ASN  44           HN       ASN  44  -2.119  17.230  17.230
  328    HA   ASN  44           HA       ASN  44   0.414  17.083  17.083
  329   1HB   ASN  44           HB1      ASN  44  -2.309  17.761  17.761
  330   2HB   ASN  44           HB2      ASN  44  -0.884  17.241  17.241
  331   1HD2  ASN  44          HD21      ASN  44  -3.198  14.381  14.381
  332   2HD2  ASN  44          HD22      ASN  44  -3.708  15.950  15.950
  333    H    ASN  45           HN       ASN  45  -1.171  19.690  19.690
  334    HA   ASN  45           HA       ASN  45   0.554  21.648  21.648
  335   1HB   ASN  45           HB1      ASN  45  -2.221  22.391  22.391
  336   2HB   ASN  45           HB2      ASN  45  -1.246  23.193  23.193
  337   1HD2  ASN  45          HD21      ASN  45  -3.925  20.445  20.445
  338   2HD2  ASN  45          HD22      ASN  45  -3.801  21.135  21.135
  339    H    THR  46           HN       THR  46   1.037  20.309  20.309
  340    HA   THR  46           HA       THR  46   0.381  22.289  22.289
  341    HB   THR  46           HB       THR  46   0.598  19.870  19.870
  342    HG1  THR  46           HG1      THR  46   1.275  20.702  20.702
  343   1HG2  THR  46          HG21      THR  46   2.577  19.197  19.197
  344   2HG2  THR  46          HG22      THR  46   3.622  20.174  20.174
  345   3HG2  THR  46          HG23      THR  46   2.797  18.793  18.793
  346    H    ALA  47           HN       ALA  47   3.179  21.285  21.285
  347    HA   ALA  47           HA       ALA  47   4.417  23.768  23.768
  348   1HB   ALA  47           HB1      ALA  47   4.818  23.770  23.770
  349   2HB   ALA  47           HB2      ALA  47   5.677  22.255  22.255
  350   3HB   ALA  47           HB3      ALA  47   6.301  23.721  23.721
  351    H    ALA  48           HN       ALA  48   5.108  20.571  20.571
  352    HA   ALA  48           HA       ALA  48   5.768  18.685  18.685
  353   1HB   ALA  48           HB1      ALA  48   6.138  20.081  20.081
  354   2HB   ALA  48           HB2      ALA  48   7.635  20.679  20.679
  355   3HB   ALA  48           HB3      ALA  48   7.441  18.970  18.970
  356    H    ASP  49           HN       ASP  49   7.564  21.487  21.487
  357    HA   ASP  49           HA       ASP  49   9.825  20.092  20.092
  358   1HB   ASP  49           HB1      ASP  49  10.112  22.248  22.248
  359   2HB   ASP  49           HB2      ASP  49   8.967  23.024  23.024
  360    H    ASP  50           HN       ASP  50   6.774  20.384  20.384
  361    HA   ASP  50           HA       ASP  50   7.194  20.581  20.581
  362   1HB   ASP  50           HB1      ASP  50   5.679  22.352  22.352
  363   2HB   ASP  50           HB2      ASP  50   4.695  21.118  21.118
  364    H    LYS  51           HN       LYS  51   6.429  18.694  18.694
  365    HA   LYS  51           HA       LYS  51   4.856  16.644  16.644
  366   1HB   LYS  51           HB1      LYS  51   6.420  16.523  16.523
  367   2HB   LYS  51           HB2      LYS  51   5.378  15.248  15.248
  368   1HG   LYS  51           HG1      LYS  51   3.431  16.812  16.812
  369   2HG   LYS  51           HG2      LYS  51   4.518  18.040  18.040
  370   1HD   LYS  51           HD1      LYS  51   5.129  16.534  16.534
  371   2HD   LYS  51           HD2      LYS  51   4.081  15.287  15.287
  372   1HE   LYS  51           HE1      LYS  51   2.121  16.577  16.577
  373   2HE   LYS  51           HE2      LYS  51   3.037  18.011  18.011
  374   1HZ   LYS  51           HZ1      LYS  51   3.818  15.846  15.846
  375   2HZ   LYS  51           HZ2      LYS  51   2.120  15.933  15.933
  376   3HZ   LYS  51           HZ3      LYS  51   3.040  17.283  17.283
  377    H    GLN  52           HN       GLN  52   8.090  16.976  16.976
  378    HA   GLN  52           HA       GLN  52   9.546  14.882  14.882
  379   1HB   GLN  52           HB1      GLN  52  10.158  17.586  17.586
  380   2HB   GLN  52           HB2      GLN  52  10.736  17.189  17.189
  381   1HG   GLN  52           HG1      GLN  52  12.577  16.876  16.876
  382   2HG   GLN  52           HG2      GLN  52  12.063  15.293  15.293
  383   1HE2  GLN  52          HE21      GLN  52  10.382  15.644  15.644
  384   2HE2  GLN  52          HE22      GLN  52   9.743  16.392  16.392
  385    HA   PRO  53           HA       PRO  53  10.033  15.011  15.011
  386   1HB   PRO  53           HB1      PRO  53   7.860  16.207  16.207
  387   2HB   PRO  53           HB2      PRO  53   9.413  16.989  16.989
  388   1HG   PRO  53           HG1      PRO  53   6.917  17.060  17.060
  389   2HG   PRO  53           HG2      PRO  53   7.852  18.435  18.435
  390   1HD   PRO  53           HD1      PRO  53   8.402  17.622  17.622
  391   2HD   PRO  53           HD2      PRO  53   9.782  17.830  17.830
  392    H    TYR  54           HN       TYR  54   6.777  15.044  15.044
  393    HA   TYR  54           HA       TYR  54   5.878  12.724  12.724
  394   1HB   TYR  54           HB1      TYR  54   4.603  14.216  14.216
  395   2HB   TYR  54           HB2      TYR  54   3.792  13.015  13.015
  396    HD1  TYR  54           HD1      TYR  54   4.299  13.674  13.674
  397    HD2  TYR  54           HD2      TYR  54   3.935  16.381  16.381
  398    HE1  TYR  54           HE1      TYR  54   3.645  15.456  15.456
  399    HE2  TYR  54           HE2      TYR  54   3.295  18.165  18.165
  400    HH   TYR  54           HH       TYR  54   3.775  18.069  18.069
  401    H    GLU  55           HN       GLU  55   6.508  13.434  13.434
  402    HA   GLU  55           HA       GLU  55   5.961  10.951  10.951
  403   1HB   GLU  55           HB1      GLU  55   7.050  13.450  13.450
  404   2HB   GLU  55           HB2      GLU  55   8.297  12.299  12.299
  405   1HG   GLU  55           HG1      GLU  55   6.588  10.954  10.954
  406   2HG   GLU  55           HG2      GLU  55   5.373  12.140  12.140
  407    H    LYS  56           HN       LYS  56   9.129  12.047  12.047
  408    HA   LYS  56           HA       LYS  56  10.593   9.723   9.723
  409   1HB   LYS  56           HB1      LYS  56  11.300  12.127  12.127
  410   2HB   LYS  56           HB2      LYS  56  11.137  11.396  11.396
  411   1HG   LYS  56           HG1      LYS  56  12.724   9.574   9.574
  412   2HG   LYS  56           HG2      LYS  56  12.897  10.396  10.396
  413   1HD   LYS  56           HD1      LYS  56  13.658  12.471  12.471
  414   2HD   LYS  56           HD2      LYS  56  13.763  11.393  11.393
  415   1HE   LYS  56           HE1      LYS  56  15.287  11.099  11.099
  416   2HE   LYS  56           HE2      LYS  56  15.968  11.548  11.548
  417   1HZ   LYS  56           HZ1      LYS  56  14.579   9.151   9.151
  418   2HZ   LYS  56           HZ2      LYS  56  15.559   8.998   8.998
  419   3HZ   LYS  56           HZ3      LYS  56  16.248   9.430   9.430
  420    H    LYS  57           HN       LYS  57   8.391  10.468  10.468
  421    HA   LYS  57           HA       LYS  57   9.134   8.275   8.275
  422   1HB   LYS  57           HB1      LYS  57   7.275  10.476  10.476
  423   2HB   LYS  57           HB2      LYS  57   6.297   9.029   9.029
  424   1HG   LYS  57           HG1      LYS  57   6.967   9.582   9.582
  425   2HG   LYS  57           HG2      LYS  57   7.964   8.214   8.214
  426   1HD   LYS  57           HD1      LYS  57   9.619  10.214  10.214
  427   2HD   LYS  57           HD2      LYS  57   8.703  11.129  11.129
  428   1HE   LYS  57           HE1      LYS  57  10.661  10.222  10.222
  429   2HE   LYS  57           HE2      LYS  57   9.255   9.351   9.351
  430   1HZ   LYS  57           HZ1      LYS  57  10.181   8.061   8.061
  431   2HZ   LYS  57           HZ2      LYS  57  11.506   8.326   8.326
  432   3HZ   LYS  57           HZ3      LYS  57  10.150   7.480   7.480
  433    H    ALA  58           HN       ALA  58   6.417   8.797   8.797
  434    HA   ALA  58           HA       ALA  58   5.109   6.372   6.372
  435   1HB   ALA  58           HB1      ALA  58   5.879   7.937   7.937
  436   2HB   ALA  58           HB2      ALA  58   4.608   6.726   6.726
  437   3HB   ALA  58           HB3      ALA  58   4.457   8.227   8.227
  438    H    ALA  59           HN       ALA  59   7.932   7.132   7.132
  439    HA   ALA  59           HA       ALA  59   8.493   4.704   4.704
  440   1HB   ALA  59           HB1      ALA  59   9.799   6.812   6.812
  441   2HB   ALA  59           HB2      ALA  59  10.565   6.593   6.593
  442   3HB   ALA  59           HB3      ALA  59  10.852   5.438   5.438
  443    H    LYS  60           HN       LYS  60   9.948   5.705   5.705
  444    HA   LYS  60           HA       LYS  60  11.215   3.359   3.359
  445   1HB   LYS  60           HB1      LYS  60  11.234   5.620   5.620
  446   2HB   LYS  60           HB2      LYS  60   9.707   5.187   5.187
  447   1HG   LYS  60           HG1      LYS  60  11.611   2.981   2.981
  448   2HG   LYS  60           HG2      LYS  60  12.344   4.470   4.470
  449   1HD   LYS  60           HD1      LYS  60  10.378   4.913   4.913
  450   2HD   LYS  60           HD2      LYS  60   9.629   3.422   3.422
  451   1HE   LYS  60           HE1      LYS  60  12.311   3.586   3.586
  452   2HE   LYS  60           HE2      LYS  60  10.790   3.115   3.115
  453   1HZ   LYS  60           HZ1      LYS  60  11.145   1.575   1.575
  454   2HZ   LYS  60           HZ2      LYS  60  12.589   1.525   1.525
  455   3HZ   LYS  60           HZ3      LYS  60  11.124   1.069   1.069
  456    H    LEU  61           HN       LEU  61   7.856   4.217   4.217
  457    HA   LEU  61           HA       LEU  61   7.164   1.842   1.842
  458   1HB   LEU  61           HB1      LEU  61   5.334   3.482   3.482
  459   2HB   LEU  61           HB2      LEU  61   4.821   2.454   2.454
  460    HG   LEU  61           HG       LEU  61   6.531   4.974   4.974
  461   1HD1  LEU  61          HD11      LEU  61   4.172   5.393   5.393
  462   2HD1  LEU  61          HD12      LEU  61   3.741   4.340   4.340
  463   3HD1  LEU  61          HD13      LEU  61   4.620   5.841   5.841
  464   1HD2  LEU  61          HD21      LEU  61   5.661   3.058   3.058
  465   2HD2  LEU  61          HD22      LEU  61   7.308   3.321   3.321
  466   3HD2  LEU  61          HD23      LEU  61   6.445   4.615   4.615
  467    H    LYS  62           HN       LYS  62   6.605   2.562   2.562
  468    HA   LYS  62           HA       LYS  62   5.717   0.078   0.078
  469   1HB   LYS  62           HB1      LYS  62   7.723   1.991   1.991
  470   2HB   LYS  62           HB2      LYS  62   7.085   0.591   0.591
  471   1HG   LYS  62           HG1      LYS  62   5.191   2.612   2.612
  472   2HG   LYS  62           HG2      LYS  62   5.901   2.926   2.926
  473   1HD   LYS  62           HD1      LYS  62   4.425   0.325   0.325
  474   2HD   LYS  62           HD2      LYS  62   3.597   1.737   1.737
  475   1HE   LYS  62           HE1      LYS  62   5.920   0.308   0.308
  476   2HE   LYS  62           HE2      LYS  62   4.229   0.193   0.193
  477   1HZ   LYS  62           HZ1      LYS  62   4.892   2.896   2.896
  478   2HZ   LYS  62           HZ2      LYS  62   6.092   2.125   2.125
  479   3HZ   LYS  62           HZ3      LYS  62   4.460   1.993   1.993
  480    H    GLU  63           HN       GLU  63   9.048   1.105   1.105
  481    HA   GLU  63           HA       GLU  63  10.489  -1.184  -1.184
  482   1HB   GLU  63           HB1      GLU  63  11.184   1.317   1.317
  483   2HB   GLU  63           HB2      GLU  63  11.309   0.496   0.496
  484   1HG   GLU  63           HG1      GLU  63  12.995  -1.074  -1.074
  485   2HG   GLU  63           HG2      GLU  63  12.878  -0.251  -0.251
  486    H    LYS  64           HN       LYS  64   9.166  -0.256  -0.256
  487    HA   LYS  64           HA       LYS  64   9.968  -2.464  -2.464
  488   1HB   LYS  64           HB1      LYS  64   8.662  -0.300  -0.300
  489   2HB   LYS  64           HB2      LYS  64   7.207  -1.178  -1.178
  490   1HG   LYS  64           HG1      LYS  64   7.821  -2.982  -2.982
  491   2HG   LYS  64           HG2      LYS  64   9.221  -2.033  -2.033
  492   1HD   LYS  64           HD1      LYS  64   7.542  -0.099  -0.099
  493   2HD   LYS  64           HD2      LYS  64   6.274  -1.300  -1.300
  494   1HE   LYS  64           HE1      LYS  64   6.837  -1.083  -1.083
  495   2HE   LYS  64           HE2      LYS  64   7.379  -2.664  -2.664
  496   1HZ   LYS  64           HZ1      LYS  64   9.417  -0.799  -0.799
  497   2HZ   LYS  64           HZ2      LYS  64   8.888  -0.622  -0.622
  498   3HZ   LYS  64           HZ3      LYS  64   9.424  -2.136  -2.136
  499    H    TYR  65           HN       TYR  65   6.959  -2.026  -2.026
  500    HA   TYR  65           HA       TYR  65   5.704  -4.505  -4.505
  501   1HB   TYR  65           HB1      TYR  65   4.382  -2.836  -2.836
  502   2HB   TYR  65           HB2      TYR  65   5.678  -2.278  -2.278
  503    HD1  TYR  65           HD1      TYR  65   4.442  -5.818  -5.818
  504    HD2  TYR  65           HD2      TYR  65   4.338  -2.033  -2.033
  505    HE1  TYR  65           HE1      TYR  65   3.333  -6.828  -6.828
  506    HE2  TYR  65           HE2      TYR  65   3.233  -3.046  -3.046
  507    HH   TYR  65           HH       TYR  65   1.738  -5.142  -5.142
  508    H    GLU  66           HN       GLU  66   7.778  -3.494  -3.494
  509    HA   GLU  66           HA       GLU  66   7.885  -5.734  -5.734
  510   1HB   GLU  66           HB1      GLU  66  10.176  -3.940  -3.940
  511   2HB   GLU  66           HB2      GLU  66  10.151  -5.013  -5.013
  512   1HG   GLU  66           HG1      GLU  66   7.861  -3.064  -3.064
  513   2HG   GLU  66           HG2      GLU  66   9.385  -2.416  -2.416
  514    H    LYS  67           HN       LYS  67   9.448  -5.271  -5.271
  515    HA   LYS  67           HA       LYS  67  11.106  -7.659  -7.659
  516   1HB   LYS  67           HB1      LYS  67  10.595  -6.325  -6.325
  517   2HB   LYS  67           HB2      LYS  67  12.041  -7.146  -7.146
  518   1HG   LYS  67           HG1      LYS  67  11.118  -4.346  -4.346
  519   2HG   LYS  67           HG2      LYS  67  12.647  -4.872  -4.872
  520   1HD   LYS  67           HD1      LYS  67  12.966  -6.038  -6.038
  521   2HD   LYS  67           HD2      LYS  67  11.693  -4.936  -4.936
  522   1HE   LYS  67           HE1      LYS  67  12.950  -2.999  -2.999
  523   2HE   LYS  67           HE2      LYS  67  14.254  -4.022  -4.022
  524   1HZ   LYS  67           HZ1      LYS  67  13.741  -4.704  -4.704
  525   2HZ   LYS  67           HZ2      LYS  67  13.880  -3.012  -3.012
  526   3HZ   LYS  67           HZ3      LYS  67  15.134  -4.002  -4.002
  527    H    ASP  68           HN       ASP  68   8.094  -6.873  -6.873
  528    HA   ASP  68           HA       ASP  68   7.792  -9.310  -9.310
  529   1HB   ASP  68           HB1      ASP  68   5.852  -7.106  -7.106
  530   2HB   ASP  68           HB2      ASP  68   5.560  -8.395  -8.395
  531    H    ILE  69           HN       ILE  69   7.133  -8.096  -8.096
  532    HA   ILE  69           HA       ILE  69   5.141 -10.213 -10.213
  533    HB   ILE  69           HB       ILE  69   4.800  -8.000  -8.000
  534   1HG1  ILE  69          HG11      ILE  69   4.435  -8.566  -8.566
  535   2HG1  ILE  69          HG12      ILE  69   5.691  -9.801  -9.801
  536   1HG2  ILE  69          HG21      ILE  69   7.142  -7.367  -7.367
  537   2HG2  ILE  69          HG22      ILE  69   7.391  -8.457  -8.457
  538   3HG2  ILE  69          HG23      ILE  69   6.304  -7.085  -7.085
  539   1HD1  ILE  69          HD11      ILE  69   3.139  -9.912  -9.912
  540   2HD1  ILE  69          HD12      ILE  69   3.443 -10.822 -10.822
  541   3HD1  ILE  69          HD13      ILE  69   4.401 -11.136 -11.136
  542    H    ALA  70           HN       ALA  70   8.344  -9.273  -9.273
  543    HA   ALA  70           HA       ALA  70   9.095 -11.375 -11.375
  544   1HB   ALA  70           HB1      ALA  70  10.859  -9.987  -9.987
  545   2HB   ALA  70           HB2      ALA  70  11.468 -10.922 -10.922
  546   3HB   ALA  70           HB3      ALA  70  10.632  -9.412  -9.412
  547    H    ALA  71           HN       ALA  71   8.758 -11.099 -11.099
  548    HA   ALA  71           HA       ALA  71   9.827 -13.714 -13.714
  549   1HB   ALA  71           HB1      ALA  71   8.179 -11.737 -11.737
  550   2HB   ALA  71           HB2      ALA  71   9.008 -13.144 -13.144
  551   3HB   ALA  71           HB3      ALA  71   9.930 -11.821 -11.821
  552    H    TYR  72           HN       TYR  72   6.660 -12.195 -12.195
  553    HA   TYR  72           HA       TYR  72   4.934 -14.276 -14.276
  554   1HB   TYR  72           HB1      TYR  72   4.154 -12.047 -12.047
  555   2HB   TYR  72           HB2      TYR  72   4.643 -12.176 -12.176
  556    HD1  TYR  72           HD1      TYR  72   2.335 -13.752 -13.752
  557    HD2  TYR  72           HD2      TYR  72   3.106 -12.867 -12.867
  558    HE1  TYR  72           HE1      TYR  72   0.117 -14.600 -14.600
  559    HE2  TYR  72           HE2      TYR  72   0.889 -13.710 -13.710
  560    HH   TYR  72           HH       TYR  72  -1.545 -14.062 -14.062
  561    H    ARG  73           HN       ARG  73   6.233 -13.551 -13.551
  562    HA   ARG  73           HA       ARG  73   5.082 -15.714 -15.714
  563   1HB   ARG  73           HB1      ARG  73   7.489 -13.931 -13.931
  564   2HB   ARG  73           HB2      ARG  73   6.793 -15.029 -15.029
  565   1HG   ARG  73           HG1      ARG  73   4.734 -13.800 -13.800
  566   2HG   ARG  73           HG2      ARG  73   5.133 -12.854 -12.854
  567   1HD   ARG  73           HD1      ARG  73   5.491 -11.574 -11.574
  568   2HD   ARG  73           HD2      ARG  73   6.986 -11.745 -11.745
  569    HE   ARG  73           HE       ARG  73   6.280 -13.487 -13.487
  570   1HH1  ARG  73          HH11      ARG  73   8.538 -14.534 -14.534
  571   2HH1  ARG  73          HH12      ARG  73   9.904 -13.723 -13.723
  572   1HH2  ARG  73          HH21      ARG  73   7.944 -11.190 -11.190
  573   2HH2  ARG  73          HH22      ARG  73   9.560 -11.782 -11.782
  574    H    ALA  74           HN       ALA  74   7.910 -15.154 -15.154
  575    HA   ALA  74           HA       ALA  74   9.250 -17.623 -17.623
  576   1HB   ALA  74           HB1      ALA  74   9.946 -15.546 -15.546
  577   2HB   ALA  74           HB2      ALA  74  11.012 -16.847 -16.847
  578   3HB   ALA  74           HB3      ALA  74  10.538 -15.608 -15.608
  579    H    LYS  75           HN       LYS  75   6.646 -17.804 -17.804
  580    HA   LYS  75           HA       LYS  75   7.483 -19.706 -19.706
  581   1HB   LYS  75           HB1      LYS  75   6.749 -17.532 -17.532
  582   2HB   LYS  75           HB2      LYS  75   5.171 -17.716 -17.716
  583   1HG   LYS  75           HG1      LYS  75   4.844 -19.891 -19.891
  584   2HG   LYS  75           HG2      LYS  75   6.463 -19.803 -19.803
  585   1HD   LYS  75           HD1      LYS  75   5.758 -17.729 -17.729
  586   2HD   LYS  75           HD2      LYS  75   4.130 -17.948 -17.948
  587   1HE   LYS  75           HE1      LYS  75   4.339 -18.989 -18.989
  588   2HE   LYS  75           HE2      LYS  75   4.042 -20.228 -20.228
  589   1HZ   LYS  75           HZ1      LYS  75   6.809 -19.793 -19.793
  590   2HZ   LYS  75           HZ2      LYS  75   6.177 -20.043 -20.043
  591   3HZ   LYS  75           HZ3      LYS  75   5.921 -21.198 -21.198
  592    H    GLY  76           HN       GLY  76   4.552 -18.467 -18.467
  593   1HA   GLY  76           HA1      GLY  76   3.267 -19.776 -19.776
  594   2HA   GLY  76           HA2      GLY  76   3.742 -21.234 -21.234
  595    H    LYS  77           HN       LYS  77   2.770 -18.133 -18.133
  596    HA   LYS  77           HA       LYS  77   1.032 -17.353 -17.353
  597   1HB   LYS  77           HB1      LYS  77  -0.462 -19.934 -19.934
  598   2HB   LYS  77           HB2      LYS  77  -1.166 -18.507 -18.507
  599   1HG   LYS  77           HG1      LYS  77  -0.707 -17.150 -17.150
  600   2HG   LYS  77           HG2      LYS  77   0.296 -18.386 -18.386
  601   1HD   LYS  77           HD1      LYS  77  -1.665 -19.876 -19.876
  602   2HD   LYS  77           HD2      LYS  77  -2.702 -18.725 -18.725
  603   1HE   LYS  77           HE1      LYS  77  -1.176 -18.123 -18.123
  604   2HE   LYS  77           HE2      LYS  77  -2.866 -18.596 -18.596
  605   1HZ   LYS  77           HZ1      LYS  77  -2.502 -16.507 -16.507
  606   2HZ   LYS  77           HZ2      LYS  77  -1.755 -16.060 -16.060
  607   3HZ   LYS  77           HZ3      LYS  77  -3.394 -16.507 -16.507
  608    HA   PRO  78           HA       PRO  78   1.733 -19.781 -19.781
  609   1HB   PRO  78           HB1      PRO  78  -0.093 -17.953 -17.953
  610   2HB   PRO  78           HB2      PRO  78   1.650 -18.137 -18.137
  611   1HG   PRO  78           HG1      PRO  78   0.609 -15.889 -15.889
  612   2HG   PRO  78           HG2      PRO  78   2.117 -16.580 -16.580
  613   1HD   PRO  78           HD1      PRO  78  -0.717 -17.062 -17.062
  614   2HD   PRO  78           HD2      PRO  78   0.716 -16.474 -16.474
  615    H    ASP  79           HN       ASP  79  -0.549 -20.391 -20.391
  616    HA   ASP  79           HA       ASP  79  -2.042 -22.039 -22.039
  617   1HB   ASP  79           HB1      ASP  79  -3.196 -19.703 -19.703
  618   2HB   ASP  79           HB2      ASP  79  -3.656 -20.667 -20.667
  619    H    ALA  80           HN       ALA  80  -0.019 -22.779 -22.779
  620    HA   ALA  80           HA       ALA  80  -1.504 -24.352 -24.352
  621   1HB   ALA  80           HB1      ALA  80   0.465 -22.998 -22.998
  622   2HB   ALA  80           HB2      ALA  80   1.494 -23.906 -23.906
  623   3HB   ALA  80           HB3      ALA  80   0.738 -24.712 -24.712
  624    H    ALA  81           HN       ALA  81  -2.197 -25.272 -25.272
  625    HA   ALA  81           HA       ALA  81  -0.520 -27.672 -27.672
  626   1HB   ALA  81           HB1      ALA  81  -2.411 -26.117 -26.117
  627   2HB   ALA  81           HB2      ALA  81  -1.531 -27.563 -27.563
  628   3HB   ALA  81           HB3      ALA  81  -0.657 -26.090 -26.090
  629   1H1   BME  16           HE1      MER  16  -5.962  10.457  10.457
  630   2H1   BME  16           HE2      MER  16  -7.358  11.537  11.537
  631   1H2   BME  16           HZ1      MER  16  -8.452  10.499  10.499
  632   2H2   BME  16           HZ2      MER  16  -7.163   9.333   9.333
  633    HO1  BME  16           HH       MER  16  -7.083   8.984   8.984

  Start of MODEL   27
    1    H    ASN   3           HN       ASN   3   2.420  -8.755  -8.755
    2    HA   ASN   3           HA       ASN   3   4.163  -9.030  -9.030
    3   1HB   ASN   3           HB1      ASN   3   2.750 -11.099 -11.099
    4   2HB   ASN   3           HB2      ASN   3   3.800 -11.485 -11.485
    5   1HD2  ASN   3          HD21      ASN   3   6.282  -9.621  -9.621
    6   2HD2  ASN   3          HD22      ASN   3   5.236  -8.806  -8.806
    7    H    ALA   4           HN       ALA   4   3.258 -10.232 -10.232
    8    HA   ALA   4           HA       ALA   4   1.750 -10.795 -10.795
    9   1HB   ALA   4           HB1      ALA   4   0.231 -11.725 -11.725
   10   2HB   ALA   4           HB2      ALA   4  -0.457 -10.128 -10.128
   11   3HB   ALA   4           HB3      ALA   4  -0.683 -10.911 -10.911
   12    HA   PRO   5           HA       PRO   5   1.949  -6.752  -6.752
   13   1HB   PRO   5           HB1      PRO   5   0.482  -7.064  -7.064
   14   2HB   PRO   5           HB2      PRO   5   2.131  -7.647  -7.647
   15   1HG   PRO   5           HG1      PRO   5  -0.441  -9.221  -9.221
   16   2HG   PRO   5           HG2      PRO   5   0.945  -9.680  -9.680
   17   1HD   PRO   5           HD1      PRO   5   0.892 -10.617 -10.617
   18   2HD   PRO   5           HD2      PRO   5   2.406  -9.853  -9.853
   19    H    LYS   6           HN       LYS   6   0.920  -5.546  -5.546
   20    HA   LYS   6           HA       LYS   6  -1.918  -4.890  -4.890
   21   1HB   LYS   6           HB1      LYS   6  -1.166  -6.204  -6.204
   22   2HB   LYS   6           HB2      LYS   6  -0.798  -4.609  -4.609
   23   1HG   LYS   6           HG1      LYS   6  -3.485  -5.605  -5.605
   24   2HG   LYS   6           HG2      LYS   6  -3.070  -5.331  -5.331
   25   1HD   LYS   6           HD1      LYS   6  -2.692  -2.822  -2.822
   26   2HD   LYS   6           HD2      LYS   6  -3.560  -3.281  -3.281
   27   1HE   LYS   6           HE1      LYS   6  -4.579  -3.497  -3.497
   28   2HE   LYS   6           HE2      LYS   6  -5.133  -2.359  -2.359
   29   1HZ   LYS   6           HZ1      LYS   6  -5.328  -4.943  -4.943
   30   2HZ   LYS   6           HZ2      LYS   6  -6.036  -4.941  -4.941
   31   3HZ   LYS   6           HZ3      LYS   6  -6.573  -3.845  -3.845
   32    H    ARG   7           HN       ARG   7  -0.890  -3.295  -3.295
   33    HA   ARG   7           HA       ARG   7   0.429  -1.126  -1.126
   34   1HB   ARG   7           HB1      ARG   7  -1.472   0.217   0.217
   35   2HB   ARG   7           HB2      ARG   7  -1.181  -1.354  -1.354
   36   1HG   ARG   7           HG1      ARG   7  -3.145  -1.352  -1.352
   37   2HG   ARG   7           HG2      ARG   7  -3.654  -0.489  -0.489
   38   1HD   ARG   7           HD1      ARG   7  -3.544  -2.450  -2.450
   39   2HD   ARG   7           HD2      ARG   7  -2.544  -3.321  -3.321
   40    HE   ARG   7           HE       ARG   7  -4.491  -3.439  -3.439
   41   1HH1  ARG   7          HH11      ARG   7  -4.972  -3.986  -3.986
   42   2HH1  ARG   7          HH12      ARG   7  -6.685  -3.734  -3.734
   43   1HH2  ARG   7          HH21      ARG   7  -6.676  -2.460  -2.460
   44   2HH2  ARG   7          HH22      ARG   7  -7.674  -2.851  -2.851
   45    HA   PRO   8           HA       PRO   8  -0.437   1.105   1.105
   46   1HB   PRO   8           HB1      PRO   8   2.000   2.426   2.426
   47   2HB   PRO   8           HB2      PRO   8   1.801   0.761   0.761
   48   1HG   PRO   8           HG1      PRO   8   2.655   1.751   1.751
   49   2HG   PRO   8           HG2      PRO   8   3.505   0.613   0.613
   50   1HD   PRO   8           HD1      PRO   8   1.933  -0.290  -0.290
   51   2HD   PRO   8           HD2      PRO   8   1.857  -1.123  -1.123
   52    HA   PRO   9           HA       PRO   9  -1.348   5.534   5.534
   53   1HB   PRO   9           HB1      PRO   9   1.462   5.785   5.785
   54   2HB   PRO   9           HB2      PRO   9   0.167   6.995   6.995
   55   1HG   PRO   9           HG1      PRO   9   0.382   5.360   5.360
   56   2HG   PRO   9           HG2      PRO   9  -1.229   5.599   5.599
   57   1HD   PRO   9           HD1      PRO   9   0.588   3.210   3.210
   58   2HD   PRO   9           HD2      PRO   9  -1.185   3.260   3.260
   59    H    SER  10           HN       SER  10  -0.355   7.499   7.499
   60    HA   SER  10           HA       SER  10   0.765   6.634   6.634
   61   1HB   SER  10           HB1      SER  10  -1.017   9.007   9.007
   62   2HB   SER  10           HB2      SER  10  -0.425   8.585   8.585
   63    HG   SER  10           HG       SER  10  -1.420   6.404   6.404
   64    H    ALA  11           HN       ALA  11   0.728   9.478   9.478
   65    HA   ALA  11           HA       ALA  11   3.245  10.193  10.193
   66   1HB   ALA  11           HB1      ALA  11   2.669  11.248  11.248
   67   2HB   ALA  11           HB2      ALA  11   4.033  11.685  11.685
   68   3HB   ALA  11           HB3      ALA  11   3.933  10.073  10.073
   69    H    PHE  12           HN       PHE  12   0.378  11.176  11.176
   70    HA   PHE  12           HA       PHE  12   0.298  13.787  13.787
   71   1HB   PHE  12           HB1      PHE  12  -0.991  14.308  14.308
   72   2HB   PHE  12           HB2      PHE  12  -0.711  12.658  12.658
   73    HD1  PHE  12           HD1      PHE  12  -3.105  14.239  14.239
   74    HD2  PHE  12           HD2      PHE  12  -2.500  11.773  11.773
   75    HE1  PHE  12           HE1      PHE  12  -5.518  13.924  13.924
   76    HE2  PHE  12           HE2      PHE  12  -4.925  11.479  11.479
   77    HZ   PHE  12           HZ       PHE  12  -6.444  12.546  12.546
   78    H    PHE  13           HN       PHE  13  -0.433  10.610  10.610
   79    HA   PHE  13           HA       PHE  13  -2.850  10.957  10.957
   80   1HB   PHE  13           HB1      PHE  13  -1.510   8.769   8.769
   81   2HB   PHE  13           HB2      PHE  13  -0.692   9.110   9.110
   82    HD1  PHE  13           HD1      PHE  13  -2.341   9.731   9.731
   83    HD2  PHE  13           HD2      PHE  13  -3.535   7.615   7.615
   84    HE1  PHE  13           HE1      PHE  13  -4.326   8.897   8.897
   85    HE2  PHE  13           HE2      PHE  13  -5.516   6.779   6.779
   86    HZ   PHE  13           HZ       PHE  13  -5.917   7.419   7.419
   87    H    LEU  14           HN       LEU  14   0.604  11.297  11.297
   88    HA   LEU  14           HA       LEU  14   0.384  12.008  12.008
   89   1HB   LEU  14           HB1      LEU  14   2.367  13.155  13.155
   90   2HB   LEU  14           HB2      LEU  14   2.580  13.173  13.173
   91    HG   LEU  14           HG       LEU  14   3.996  11.467  11.467
   92   1HD1  LEU  14          HD11      LEU  14   2.601  10.520  10.520
   93   2HD1  LEU  14          HD12      LEU  14   1.465   9.902   9.902
   94   3HD1  LEU  14          HD13      LEU  14   3.103   9.277   9.277
   95   1HD2  LEU  14          HD21      LEU  14   3.574  11.378  11.378
   96   2HD2  LEU  14          HD22      LEU  14   3.662   9.754   9.754
   97   3HD2  LEU  14          HD23      LEU  14   2.104  10.437  10.437
   98    H    PHE  15           HN       PHE  15   0.605  14.088  14.088
   99    HA   PHE  15           HA       PHE  15   0.092  16.617  16.617
  100   1HB   PHE  15           HB1      PHE  15   0.835  16.356  16.356
  101   2HB   PHE  15           HB2      PHE  15  -0.489  15.227  15.227
  102    HD1  PHE  15           HD1      PHE  15  -0.374  18.836  18.836
  103    HD2  PHE  15           HD2      PHE  15  -1.796  15.973  15.973
  104    HE1  PHE  15           HE1      PHE  15  -1.617  20.590  20.590
  105    HE2  PHE  15           HE2      PHE  15  -3.027  17.729  17.729
  106    HZ   PHE  15           HZ       PHE  15  -2.935  20.039  20.039
  107    H    CYS  16           HN       MER  16  -2.324  14.552  14.552
  108    HA   CYS  16           HA       MER  16  -4.664  15.910  15.910
  109   1HB   CYS  16           HB1      MER  16  -5.816  13.901  13.901
  110   2HB   CYS  16           HB2      MER  16  -4.321  13.602  13.602
  111    H    SER  17           HN       SER  17  -3.175  13.520  13.520
  112    HA   SER  17           HA       SER  17  -4.909  13.593  13.593
  113   1HB   SER  17           HB1      SER  17  -2.871  12.168  12.168
  114   2HB   SER  17           HB2      SER  17  -1.873  13.486  13.486
  115    HG   SER  17           HG       SER  17  -3.337  11.793  11.793
  116    H    GLU  18           HN       GLU  18  -2.023  15.499  15.499
  117    HA   GLU  18           HA       GLU  18  -1.867  17.113  17.113
  118   1HB   GLU  18           HB1      GLU  18  -0.434  17.129  17.129
  119   2HB   GLU  18           HB2      GLU  18  -1.649  18.162  18.162
  120   1HG   GLU  18           HG1      GLU  18  -1.328  19.917  19.917
  121   2HG   GLU  18           HG2      GLU  18  -0.231  18.914  18.914
  122    H    TYR  19           HN       TYR  19  -4.060  17.658  17.658
  123    HA   TYR  19           HA       TYR  19  -5.672  19.436  19.436
  124   1HB   TYR  19           HB1      TYR  19  -6.028  21.023  21.023
  125   2HB   TYR  19           HB2      TYR  19  -4.274  20.747  20.747
  126    HD1  TYR  19           HD1      TYR  19  -4.027  18.236  18.236
  127    HD2  TYR  19           HD2      TYR  19  -6.239  21.830  21.830
  128    HE1  TYR  19           HE1      TYR  19  -3.945  17.963  17.963
  129    HE2  TYR  19           HE2      TYR  19  -6.164  21.555  21.555
  130    HH   TYR  19           HH       TYR  19  -4.905  20.493  20.493
  131    H    ARG  20           HN       ARG  20  -6.017  16.643  16.643
  132    HA   ARG  20           HA       ARG  20  -8.121  16.359  16.359
  133   1HB   ARG  20           HB1      ARG  20  -6.937  14.449  14.449
  134   2HB   ARG  20           HB2      ARG  20  -7.322  14.736  14.736
  135   1HG   ARG  20           HG1      ARG  20  -9.631  14.090  14.090
  136   2HG   ARG  20           HG2      ARG  20  -9.432  14.121  14.121
  137   1HD   ARG  20           HD1      ARG  20  -7.864  12.249  12.249
  138   2HD   ARG  20           HD2      ARG  20  -7.853  12.269  12.269
  139    HE   ARG  20           HE       ARG  20 -10.338  11.648  11.648
  140   1HH1  ARG  20          HH11      ARG  20 -11.019  11.677  11.677
  141   2HH1  ARG  20          HH12      ARG  20 -10.595  10.115  10.115
  142   1HH2  ARG  20          HH21      ARG  20  -8.467   9.407   9.407
  143   2HH2  ARG  20          HH22      ARG  20  -9.110   8.793   8.793
  144    HA   PRO  21           HA       PRO  21 -11.418  16.952  16.952
  145   1HB   PRO  21           HB1      PRO  21 -10.968  17.229  17.229
  146   2HB   PRO  21           HB2      PRO  21 -10.495  15.715  15.715
  147   1HG   PRO  21           HG1      PRO  21  -8.712  18.126  18.126
  148   2HG   PRO  21           HG2      PRO  21  -8.407  16.424  16.424
  149   1HD   PRO  21           HD1      PRO  21  -7.482  17.768  17.768
  150   2HD   PRO  21           HD2      PRO  21  -7.667  16.006  16.006
  151    H    LYS  22           HN       LYS  22  -9.192  19.093  19.093
  152    HA   LYS  22           HA       LYS  22 -10.347  21.483  21.483
  153   1HB   LYS  22           HB1      LYS  22  -7.773  21.070  21.070
  154   2HB   LYS  22           HB2      LYS  22  -8.043  21.345  21.345
  155   1HG   LYS  22           HG1      LYS  22  -7.354  23.460  23.460
  156   2HG   LYS  22           HG2      LYS  22  -9.045  23.583  23.583
  157   1HD   LYS  22           HD1      LYS  22  -8.787  24.665  24.665
  158   2HD   LYS  22           HD2      LYS  22  -9.610  23.165  23.165
  159   1HE   LYS  22           HE1      LYS  22  -6.588  23.518  23.518
  160   2HE   LYS  22           HE2      LYS  22  -7.728  23.732  23.732
  161   1HZ   LYS  22           HZ1      LYS  22  -8.284  21.279  21.279
  162   2HZ   LYS  22           HZ2      LYS  22  -6.601  21.366  21.366
  163   3HZ   LYS  22           HZ3      LYS  22  -7.656  21.593  21.593
  164    H    ILE  23           HN       ILE  23  -9.893  19.995  19.995
  165    HA   ILE  23           HA       ILE  23 -11.379  22.184  22.184
  166    HB   ILE  23           HB       ILE  23 -11.189  20.635  20.635
  167   1HG1  ILE  23          HG11      ILE  23  -9.104  19.150  19.150
  168   2HG1  ILE  23          HG12      ILE  23 -10.699  18.495  18.495
  169   1HG2  ILE  23          HG21      ILE  23  -9.742  22.592  22.592
  170   2HG2  ILE  23          HG22      ILE  23  -8.660  21.638  21.638
  171   3HG2  ILE  23          HG23      ILE  23  -8.788  21.311  21.311
  172   1HD1  ILE  23          HD11      ILE  23 -10.261  18.619  18.619
  173   2HD1  ILE  23          HD12      ILE  23  -8.644  19.216  19.216
  174   3HD1  ILE  23          HD13      ILE  23  -9.101  17.607  17.607
  175    H    LYS  24           HN       LYS  24 -11.690  19.004  19.004
  176    HA   LYS  24           HA       LYS  24 -14.311  18.414  18.414
  177   1HB   LYS  24           HB1      LYS  24 -12.459  16.864  16.864
  178   2HB   LYS  24           HB2      LYS  24 -12.630  17.319  17.319
  179   1HG   LYS  24           HG1      LYS  24 -14.801  16.304  16.304
  180   2HG   LYS  24           HG2      LYS  24 -15.050  16.212  16.212
  181   1HD   LYS  24           HD1      LYS  24 -14.569  13.984  13.984
  182   2HD   LYS  24           HD2      LYS  24 -13.269  14.486  14.486
  183   1HE   LYS  24           HE1      LYS  24 -11.888  15.084  15.084
  184   2HE   LYS  24           HE2      LYS  24 -13.197  14.607  14.607
  185   1HZ   LYS  24           HZ1      LYS  24 -12.701  12.549  12.549
  186   2HZ   LYS  24           HZ2      LYS  24 -11.231  12.998  12.998
  187   3HZ   LYS  24           HZ3      LYS  24 -12.538  12.520  12.520
  188    H    GLY  25           HN       GLY  25 -12.895  19.933  19.933
  189   1HA   GLY  25           HA1      GLY  25 -15.210  19.936  19.936
  190   2HA   GLY  25           HA2      GLY  25 -13.813  21.016  21.016
  191    H    GLU  26           HN       GLU  26 -13.928  22.039  22.039
  192    HA   GLU  26           HA       GLU  26 -15.860  24.157  24.157
  193   1HB   GLU  26           HB1      GLU  26 -13.875  23.504  23.504
  194   2HB   GLU  26           HB2      GLU  26 -14.788  24.996  24.996
  195   1HG   GLU  26           HG1      GLU  26 -13.007  24.033  24.033
  196   2HG   GLU  26           HG2      GLU  26 -12.412  25.077  25.077
  197    H    HIS  27           HN       HIS  27 -15.314  21.649  21.649
  198    HA   HIS  27           HA       HIS  27 -18.097  21.921  21.921
  199   1HB   HIS  27           HB1      HIS  27 -15.752  20.969  20.969
  200   2HB   HIS  27           HB2      HIS  27 -17.286  21.659  21.659
  201    HD1  HIS  27           HD1      HIS  27 -17.497  24.306  24.306
  202    HD2  HIS  27           HD2      HIS  27 -13.706  22.779  22.779
  203    HE1  HIS  27           HE1      HIS  27 -15.964  26.240  26.240
  204    HA   PRO  28           HA       PRO  28 -17.824  17.562  17.562
  205   1HB   PRO  28           HB1      PRO  28 -19.751  17.517  17.517
  206   2HB   PRO  28           HB2      PRO  28 -18.156  18.158  18.158
  207   1HG   PRO  28           HG1      PRO  28 -20.624  19.740  19.740
  208   2HG   PRO  28           HG2      PRO  28 -19.659  20.002  20.002
  209   1HD   PRO  28           HD1      PRO  28 -19.158  21.412  21.412
  210   2HD   PRO  28           HD2      PRO  28 -17.841  20.981  20.981
  211    H    GLY  29           HN       GLY  29 -18.782  18.944  18.944
  212   1HA   GLY  29           HA1      GLY  29 -21.323  17.547  17.547
  213   2HA   GLY  29           HA2      GLY  29 -21.145  19.234  19.234
  214    H    LEU  30           HN       LEU  30 -18.362  17.166  17.166
  215    HA   LEU  30           HA       LEU  30 -18.651  17.270  17.270
  216   1HB   LEU  30           HB1      LEU  30 -16.027  16.441  16.441
  217   2HB   LEU  30           HB2      LEU  30 -16.398  17.367  17.367
  218    HG   LEU  30           HG       LEU  30 -16.620  18.586  18.586
  219   1HD1  LEU  30          HD11      LEU  30 -14.280  17.939  17.939
  220   2HD1  LEU  30          HD12      LEU  30 -14.488  18.760  18.760
  221   3HD1  LEU  30          HD13      LEU  30 -14.473  19.677  19.677
  222   1HD2  LEU  30          HD21      LEU  30 -16.691  19.696  19.696
  223   2HD2  LEU  30          HD22      LEU  30 -18.086  19.586  19.586
  224   3HD2  LEU  30          HD23      LEU  30 -16.756  20.660  20.660
  225    H    SER  31           HN       SER  31 -16.976  15.215  15.215
  226    HA   SER  31           HA       SER  31 -17.967  12.911  12.911
  227   1HB   SER  31           HB1      SER  31 -17.784  12.693  12.693
  228   2HB   SER  31           HB2      SER  31 -17.826  11.279  11.279
  229    HG   SER  31           HG       SER  31 -19.868  11.590  11.590
  230    H    ILE  32           HN       ILE  32 -16.527  10.952  10.952
  231    HA   ILE  32           HA       ILE  32 -13.814  11.785  11.785
  232    HB   ILE  32           HB       ILE  32 -15.032   9.930   9.930
  233   1HG1  ILE  32          HG11      ILE  32 -13.139   8.298   8.298
  234   2HG1  ILE  32          HG12      ILE  32 -12.444   9.009   9.009
  235   1HG2  ILE  32          HG21      ILE  32 -14.658   8.436   8.436
  236   2HG2  ILE  32          HG22      ILE  32 -15.212   7.704   7.704
  237   3HG2  ILE  32          HG23      ILE  32 -16.187   8.937   8.937
  238   1HD1  ILE  32          HD11      ILE  32 -12.812  10.467  10.467
  239   2HD1  ILE  32          HD12      ILE  32 -11.301   9.840   9.840
  240   3HD1  ILE  32          HD13      ILE  32 -12.101  11.174  11.174
  241    H    GLY  33           HN       GLY  33 -15.504  11.225  11.225
  242   1HA   GLY  33           HA1      GLY  33 -13.230  10.331  10.331
  243   2HA   GLY  33           HA2      GLY  33 -14.930  10.287  10.287
  244    H    ASP  34           HN       ASP  34 -14.775  13.154  13.154
  245    HA   ASP  34           HA       ASP  34 -14.070  14.601  14.601
  246   1HB   ASP  34           HB1      ASP  34 -16.095  14.935  14.935
  247   2HB   ASP  34           HB2      ASP  34 -15.670  16.313  16.313
  248    H    VAL  35           HN       VAL  35 -13.847  14.495  14.495
  249    HA   VAL  35           HA       VAL  35 -12.167  16.785  16.785
  250    HB   VAL  35           HB       VAL  35 -12.564  14.151  14.151
  251   1HG1  VAL  35          HG11      VAL  35 -10.327  15.079  15.079
  252   2HG1  VAL  35          HG12      VAL  35 -11.071  16.625  16.625
  253   3HG1  VAL  35          HG13      VAL  35 -11.415  15.210  15.210
  254   1HG2  VAL  35          HG21      VAL  35 -14.534  15.688  15.688
  255   2HG2  VAL  35          HG22      VAL  35 -13.826  15.509  15.509
  256   3HG2  VAL  35          HG23      VAL  35 -13.510  16.957  16.957
  257    H    ALA  36           HN       ALA  36 -11.797  13.467  13.467
  258    HA   ALA  36           HA       ALA  36  -8.940  13.349  13.349
  259   1HB   ALA  36           HB1      ALA  36 -10.336  11.394  11.394
  260   2HB   ALA  36           HB2      ALA  36 -11.059  11.495  11.495
  261   3HB   ALA  36           HB3      ALA  36  -9.363  11.060  11.060
  262    H    LYS  37           HN       LYS  37 -11.396  13.387  13.387
  263    HA   LYS  37           HA       LYS  37  -9.256  13.391  13.391
  264   1HB   LYS  37           HB1      LYS  37 -10.867  13.467  13.467
  265   2HB   LYS  37           HB2      LYS  37 -11.816  12.808  12.808
  266   1HG   LYS  37           HG1      LYS  37 -12.689  15.135  15.135
  267   2HG   LYS  37           HG2      LYS  37 -11.764  15.741  15.741
  268   1HD   LYS  37           HD1      LYS  37 -14.073  13.780  13.780
  269   2HD   LYS  37           HD2      LYS  37 -14.061  15.449  15.449
  270   1HE   LYS  37           HE1      LYS  37 -13.715  14.253  14.253
  271   2HE   LYS  37           HE2      LYS  37 -12.092  14.743  14.743
  272   1HZ   LYS  37           HZ1      LYS  37 -12.647  12.301  12.301
  273   2HZ   LYS  37           HZ2      LYS  37 -13.067  12.171  12.171
  274   3HZ   LYS  37           HZ3      LYS  37 -11.498  12.637  12.637
  275    H    LYS  38           HN       LYS  38 -10.815  15.942  15.942
  276    HA   LYS  38           HA       LYS  38  -9.932  18.050  18.050
  277   1HB   LYS  38           HB1      LYS  38 -11.933  18.213  18.213
  278   2HB   LYS  38           HB2      LYS  38 -10.849  18.186  18.186
  279   1HG   LYS  38           HG1      LYS  38 -11.287  20.493  20.493
  280   2HG   LYS  38           HG2      LYS  38  -9.684  20.252  20.252
  281   1HD   LYS  38           HD1      LYS  38 -10.811  21.523  21.523
  282   2HD   LYS  38           HD2      LYS  38 -10.821  19.897  19.897
  283   1HE   LYS  38           HE1      LYS  38 -13.067  20.843  20.843
  284   2HE   LYS  38           HE2      LYS  38 -13.159  19.594  19.594
  285   1HZ   LYS  38           HZ1      LYS  38 -12.426  21.998  21.998
  286   2HZ   LYS  38           HZ2      LYS  38 -13.783  22.292  22.292
  287   3HZ   LYS  38           HZ3      LYS  38 -13.840  21.086  21.086
  288    H    LEU  39           HN       LEU  39  -8.952  17.020  17.020
  289    HA   LEU  39           HA       LEU  39  -6.615  18.704  18.704
  290   1HB   LEU  39           HB1      LEU  39  -6.612  18.179  18.179
  291   2HB   LEU  39           HB2      LEU  39  -8.167  17.494  17.494
  292    HG   LEU  39           HG       LEU  39  -6.719  15.374  15.374
  293   1HD1  LEU  39          HD11      LEU  39  -5.039  17.111  17.111
  294   2HD1  LEU  39          HD12      LEU  39  -4.679  15.440  15.440
  295   3HD1  LEU  39          HD13      LEU  39  -4.536  16.560  16.560
  296   1HD2  LEU  39          HD21      LEU  39  -8.433  15.702  15.702
  297   2HD2  LEU  39          HD22      LEU  39  -7.068  14.768  14.768
  298   3HD2  LEU  39          HD23      LEU  39  -7.169  16.464  16.464
  299    H    GLY  40           HN       GLY  40  -7.262  15.401  15.401
  300   1HA   GLY  40           HA1      GLY  40  -4.544  14.576  14.576
  301   2HA   GLY  40           HA2      GLY  40  -5.852  13.936  13.936
  302    H    GLU  41           HN       GLU  41  -6.625  16.511  16.511
  303    HA   GLU  41           HA       GLU  41  -4.728  16.692  16.692
  304   1HB   GLU  41           HB1      GLU  41  -7.021  18.437  18.437
  305   2HB   GLU  41           HB2      GLU  41  -6.067  18.837  18.837
  306   1HG   GLU  41           HG1      GLU  41  -7.578  16.215  16.215
  307   2HG   GLU  41           HG2      GLU  41  -8.119  17.543  17.543
  308    H    MET  42           HN       MET  42  -5.585  18.808  18.808
  309    HA   MET  42           HA       MET  42  -3.854  20.944  20.944
  310   1HB   MET  42           HB1      MET  42  -4.499  19.459  19.459
  311   2HB   MET  42           HB2      MET  42  -3.768  21.055  21.055
  312   1HG   MET  42           HG1      MET  42  -6.434  20.391  20.391
  313   2HG   MET  42           HG2      MET  42  -6.346  21.008  21.008
  314   1HE   MET  42           HE1      MET  42  -5.649  21.496  21.496
  315   2HE   MET  42           HE2      MET  42  -7.334  21.991  21.991
  316   3HE   MET  42           HE3      MET  42  -6.117  23.158  23.158
  317    H    TRP  43           HN       TRP  43  -3.177  17.906  17.906
  318    HA   TRP  43           HA       TRP  43  -0.506  18.155  18.155
  319   1HB   TRP  43           HB1      TRP  43  -1.824  16.253  16.253
  320   2HB   TRP  43           HB2      TRP  43  -2.123  15.864  15.864
  321    HD1  TRP  43           HD1      TRP  43  -0.524  14.201  14.201
  322    HE1  TRP  43           HE1      TRP  43   1.651  13.242  13.242
  323    HE3  TRP  43           HE3      TRP  43   0.247  16.977  16.977
  324    HZ2  TRP  43           HZ2      TRP  43   3.597  13.535  13.535
  325    HZ3  TRP  43           HZ3      TRP  43   2.194  16.670  16.670
  326    HH2  TRP  43           HH2      TRP  43   3.884  14.948  14.948
  327    H    ASN  44           HN       ASN  44  -1.813  16.973  16.973
  328    HA   ASN  44           HA       ASN  44   0.656  16.566  16.566
  329   1HB   ASN  44           HB1      ASN  44  -2.016  17.371  17.371
  330   2HB   ASN  44           HB2      ASN  44  -0.640  16.669  16.669
  331   1HD2  ASN  44          HD21      ASN  44  -3.194  14.118  14.118
  332   2HD2  ASN  44          HD22      ASN  44  -3.548  15.685  15.685
  333    H    ASN  45           HN       ASN  45  -0.978  19.402  19.402
  334    HA   ASN  45           HA       ASN  45   0.985  21.105  21.105
  335   1HB   ASN  45           HB1      ASN  45  -1.766  22.117  22.117
  336   2HB   ASN  45           HB2      ASN  45  -0.704  22.679  22.679
  337   1HD2  ASN  45          HD21      ASN  45  -3.503  19.932  19.932
  338   2HD2  ASN  45          HD22      ASN  45  -3.391  20.859  20.859
  339    H    THR  46           HN       THR  46   1.360  20.156  20.156
  340    HA   THR  46           HA       THR  46   0.748  22.523  22.523
  341    HB   THR  46           HB       THR  46   0.865  20.168  20.168
  342    HG1  THR  46           HG1      THR  46   2.828  21.449  21.449
  343   1HG2  THR  46          HG21      THR  46   3.042  19.345  19.345
  344   2HG2  THR  46          HG22      THR  46   3.927  20.517  20.517
  345   3HG2  THR  46          HG23      THR  46   3.037  19.240  19.240
  346    H    ALA  47           HN       ALA  47   3.569  20.918  20.918
  347    HA   ALA  47           HA       ALA  47   4.900  23.324  23.324
  348   1HB   ALA  47           HB1      ALA  47   5.372  23.447  23.447
  349   2HB   ALA  47           HB2      ALA  47   6.109  21.853  21.853
  350   3HB   ALA  47           HB3      ALA  47   6.801  23.221  23.221
  351    H    ALA  48           HN       ALA  48   5.546  20.164  20.164
  352    HA   ALA  48           HA       ALA  48   6.042  18.154  18.154
  353   1HB   ALA  48           HB1      ALA  48   6.048  19.311  19.311
  354   2HB   ALA  48           HB2      ALA  48   7.641  19.971  19.971
  355   3HB   ALA  48           HB3      ALA  48   7.413  18.238  18.238
  356    H    ASP  49           HN       ASP  49   8.035  20.961  20.961
  357    HA   ASP  49           HA       ASP  49  10.349  19.373  19.373
  358   1HB   ASP  49           HB1      ASP  49  11.557  21.349  21.349
  359   2HB   ASP  49           HB2      ASP  49  10.177  21.806  21.806
  360    H    ASP  50           HN       ASP  50   7.466  20.313  20.313
  361    HA   ASP  50           HA       ASP  50   8.355  20.422  20.422
  362   1HB   ASP  50           HB1      ASP  50   7.000  22.443  22.443
  363   2HB   ASP  50           HB2      ASP  50   5.683  21.320  21.320
  364    H    LYS  51           HN       LYS  51   7.409  18.413  18.413
  365    HA   LYS  51           HA       LYS  51   5.465  16.827  16.827
  366   1HB   LYS  51           HB1      LYS  51   6.483  16.572  16.572
  367   2HB   LYS  51           HB2      LYS  51   5.491  15.346  15.346
  368   1HG   LYS  51           HG1      LYS  51   3.948  17.446  17.446
  369   2HG   LYS  51           HG2      LYS  51   4.776  18.165  18.165
  370   1HD   LYS  51           HD1      LYS  51   3.596  15.416  15.416
  371   2HD   LYS  51           HD2      LYS  51   2.495  16.769  16.769
  372   1HE   LYS  51           HE1      LYS  51   4.763  16.317  16.317
  373   2HE   LYS  51           HE2      LYS  51   3.048  16.047  16.047
  374   1HZ   LYS  51           HZ1      LYS  51   3.339  18.648  18.648
  375   2HZ   LYS  51           HZ2      LYS  51   4.472  18.439  18.439
  376   3HZ   LYS  51           HZ3      LYS  51   2.827  18.143  18.143
  377    H    GLN  52           HN       GLN  52   8.518  16.648  16.648
  378    HA   GLN  52           HA       GLN  52   9.603  14.286  14.286
  379   1HB   GLN  52           HB1      GLN  52  10.688  16.772  16.772
  380   2HB   GLN  52           HB2      GLN  52  11.374  16.492  16.492
  381   1HG   GLN  52           HG1      GLN  52  12.940  15.645  15.645
  382   2HG   GLN  52           HG2      GLN  52  12.252  14.268  14.268
  383   1HE2  GLN  52          HE21      GLN  52  10.124  14.402  14.402
  384   2HE2  GLN  52          HE22      GLN  52   9.815  15.396  15.396
  385    HA   PRO  53           HA       PRO  53  10.511  14.873  14.873
  386   1HB   PRO  53           HB1      PRO  53   8.470  16.453  16.453
  387   2HB   PRO  53           HB2      PRO  53  10.132  16.979  16.979
  388   1HG   PRO  53           HG1      PRO  53   7.717  17.239  17.239
  389   2HG   PRO  53           HG2      PRO  53   8.827  18.517  18.517
  390   1HD   PRO  53           HD1      PRO  53   9.326  17.405  17.405
  391   2HD   PRO  53           HD2      PRO  53  10.692  17.469  17.469
  392    H    TYR  54           HN       TYR  54   7.090  15.306  15.306
  393    HA   TYR  54           HA       TYR  54   6.092  13.240  13.240
  394   1HB   TYR  54           HB1      TYR  54   4.966  14.583  14.583
  395   2HB   TYR  54           HB2      TYR  54   4.054  13.413  13.413
  396    HD1  TYR  54           HD1      TYR  54   4.518  14.153  14.153
  397    HD2  TYR  54           HD2      TYR  54   4.150  16.696  16.696
  398    HE1  TYR  54           HE1      TYR  54   3.773  15.982  15.982
  399    HE2  TYR  54           HE2      TYR  54   3.402  18.522  18.522
  400    HH   TYR  54           HH       TYR  54   3.867  18.975  18.975
  401    H    GLU  55           HN       GLU  55   6.689  13.457  13.457
  402    HA   GLU  55           HA       GLU  55   5.966  10.923  10.923
  403   1HB   GLU  55           HB1      GLU  55   7.325  13.199  13.199
  404   2HB   GLU  55           HB2      GLU  55   8.469  11.907  11.907
  405   1HG   GLU  55           HG1      GLU  55   6.664  10.611  10.611
  406   2HG   GLU  55           HG2      GLU  55   5.556  11.941  11.941
  407    H    LYS  56           HN       LYS  56   9.192  11.816  11.816
  408    HA   LYS  56           HA       LYS  56  10.550   9.453   9.453
  409   1HB   LYS  56           HB1      LYS  56  11.336  11.738  11.738
  410   2HB   LYS  56           HB2      LYS  56  10.695  11.236  11.236
  411   1HG   LYS  56           HG1      LYS  56  12.199   9.283   9.283
  412   2HG   LYS  56           HG2      LYS  56  12.754   9.652   9.652
  413   1HD   LYS  56           HD1      LYS  56  13.608  11.875  11.875
  414   2HD   LYS  56           HD2      LYS  56  13.155  11.393  11.393
  415   1HE   LYS  56           HE1      LYS  56  15.543  10.922  10.922
  416   2HE   LYS  56           HE2      LYS  56  14.684   9.399   9.399
  417   1HZ   LYS  56           HZ1      LYS  56  14.637  10.168  10.168
  418   2HZ   LYS  56           HZ2      LYS  56  16.237  10.292  10.292
  419   3HZ   LYS  56           HZ3      LYS  56  15.397   8.822   8.822
  420    H    LYS  57           HN       LYS  57   8.199  10.331  10.331
  421    HA   LYS  57           HA       LYS  57   8.575   8.032   8.032
  422   1HB   LYS  57           HB1      LYS  57   6.365  10.083  10.083
  423   2HB   LYS  57           HB2      LYS  57   5.972   8.626   8.626
  424   1HG   LYS  57           HG1      LYS  57   8.391  10.282  10.282
  425   2HG   LYS  57           HG2      LYS  57   6.783  10.684  10.684
  426   1HD   LYS  57           HD1      LYS  57   6.557   8.309   8.309
  427   2HD   LYS  57           HD2      LYS  57   8.218   8.014   8.014
  428   1HE   LYS  57           HE1      LYS  57   9.030   9.722   9.722
  429   2HE   LYS  57           HE2      LYS  57   7.382  10.208  10.208
  430   1HZ   LYS  57           HZ1      LYS  57   7.570   7.459   7.459
  431   2HZ   LYS  57           HZ2      LYS  57   8.907   8.172   8.172
  432   3HZ   LYS  57           HZ3      LYS  57   7.332   8.675   8.675
  433    H    ALA  58           HN       ALA  58   6.048   8.806   8.806
  434    HA   ALA  58           HA       ALA  58   4.707   6.389   6.389
  435   1HB   ALA  58           HB1      ALA  58   5.462   8.172   8.172
  436   2HB   ALA  58           HB2      ALA  58   4.221   6.934   6.934
  437   3HB   ALA  58           HB3      ALA  58   4.043   8.328   8.328
  438    H    ALA  59           HN       ALA  59   7.497   7.304   7.304
  439    HA   ALA  59           HA       ALA  59   8.010   4.989   4.989
  440   1HB   ALA  59           HB1      ALA  59   9.308   7.113   7.113
  441   2HB   ALA  59           HB2      ALA  59  10.103   6.813   6.813
  442   3HB   ALA  59           HB3      ALA  59  10.378   5.735   5.735
  443    H    LYS  60           HN       LYS  60   9.582   5.772   5.772
  444    HA   LYS  60           HA       LYS  60  10.886   3.458   3.458
  445   1HB   LYS  60           HB1      LYS  60  10.664   5.662   5.662
  446   2HB   LYS  60           HB2      LYS  60   9.239   4.969   4.969
  447   1HG   LYS  60           HG1      LYS  60  10.629   3.032   3.032
  448   2HG   LYS  60           HG2      LYS  60  12.035   3.758   3.758
  449   1HD   LYS  60           HD1      LYS  60  11.564   5.846   5.846
  450   2HD   LYS  60           HD2      LYS  60  10.401   4.867   4.867
  451   1HE   LYS  60           HE1      LYS  60  12.564   4.808   4.808
  452   2HE   LYS  60           HE2      LYS  60  12.255   3.214   3.214
  453   1HZ   LYS  60           HZ1      LYS  60  13.532   4.758   4.758
  454   2HZ   LYS  60           HZ2      LYS  60  14.407   4.923   4.923
  455   3HZ   LYS  60           HZ3      LYS  60  14.115   3.378   3.378
  456    H    LEU  61           HN       LEU  61   7.455   4.059   4.059
  457    HA   LEU  61           HA       LEU  61   6.958   1.447   1.447
  458   1HB   LEU  61           HB1      LEU  61   4.934   3.264   3.264
  459   2HB   LEU  61           HB2      LEU  61   4.604   2.063   2.063
  460    HG   LEU  61           HG       LEU  61   6.305   4.574   4.574
  461   1HD1  LEU  61          HD11      LEU  61   3.561   3.882   3.882
  462   2HD1  LEU  61          HD12      LEU  61   4.497   5.319   5.319
  463   3HD1  LEU  61          HD13      LEU  61   3.955   5.069   5.069
  464   1HD2  LEU  61          HD21      LEU  61   5.594   2.443   2.443
  465   2HD2  LEU  61          HD22      LEU  61   7.189   2.742   2.742
  466   3HD2  LEU  61          HD23      LEU  61   6.424   3.959   3.959
  467    H    LYS  62           HN       LYS  62   6.132   2.751   2.751
  468    HA   LYS  62           HA       LYS  62   5.079   0.530   0.530
  469   1HB   LYS  62           HB1      LYS  62   5.722   2.966   2.966
  470   2HB   LYS  62           HB2      LYS  62   7.237   2.221   2.221
  471   1HG   LYS  62           HG1      LYS  62   5.872   2.080   2.080
  472   2HG   LYS  62           HG2      LYS  62   5.878   0.458   0.458
  473   1HD   LYS  62           HD1      LYS  62   3.675   0.846   0.846
  474   2HD   LYS  62           HD2      LYS  62   3.686   2.518   2.518
  475   1HE   LYS  62           HE1      LYS  62   3.645   0.077   0.077
  476   2HE   LYS  62           HE2      LYS  62   2.273   1.110   1.110
  477   1HZ   LYS  62           HZ1      LYS  62   4.342   2.763   2.763
  478   2HZ   LYS  62           HZ2      LYS  62   4.243   1.478   1.478
  479   3HZ   LYS  62           HZ3      LYS  62   2.874   2.430   2.430
  480    H    GLU  63           HN       GLU  63   8.424   1.377   1.377
  481    HA   GLU  63           HA       GLU  63   9.708  -0.842  -0.842
  482   1HB   GLU  63           HB1      GLU  63  10.840   1.305   1.305
  483   2HB   GLU  63           HB2      GLU  63  10.553   1.141   1.141
  484   1HG   GLU  63           HG1      GLU  63  12.075  -0.868  -0.868
  485   2HG   GLU  63           HG2      GLU  63  12.413  -0.596  -0.596
  486    H    LYS  64           HN       LYS  64   8.827  -0.178  -0.178
  487    HA   LYS  64           HA       LYS  64   9.892  -2.480  -2.480
  488   1HB   LYS  64           HB1      LYS  64   8.953  -0.599  -0.599
  489   2HB   LYS  64           HB2      LYS  64   7.329  -0.956  -0.956
  490   1HG   LYS  64           HG1      LYS  64   7.298  -3.084  -3.084
  491   2HG   LYS  64           HG2      LYS  64   8.961  -2.893  -2.893
  492   1HD   LYS  64           HD1      LYS  64   6.764  -0.916  -0.916
  493   2HD   LYS  64           HD2      LYS  64   7.116  -2.289  -2.289
  494   1HE   LYS  64           HE1      LYS  64   8.342  -0.493  -0.493
  495   2HE   LYS  64           HE2      LYS  64   9.564  -1.334  -1.334
  496   1HZ   LYS  64           HZ1      LYS  64   8.317   0.575   0.575
  497   2HZ   LYS  64           HZ2      LYS  64   8.785   1.319   1.319
  498   3HZ   LYS  64           HZ3      LYS  64   9.935   0.493   0.493
  499    H    TYR  65           HN       TYR  65   6.680  -1.996  -1.996
  500    HA   TYR  65           HA       TYR  65   5.557  -4.536  -4.536
  501   1HB   TYR  65           HB1      TYR  65   4.062  -2.980  -2.980
  502   2HB   TYR  65           HB2      TYR  65   5.272  -2.250  -2.250
  503    HD1  TYR  65           HD1      TYR  65   5.000  -5.773  -5.773
  504    HD2  TYR  65           HD2      TYR  65   3.053  -2.017  -2.017
  505    HE1  TYR  65           HE1      TYR  65   3.860  -6.582  -6.582
  506    HE2  TYR  65           HE2      TYR  65   1.910  -2.841  -2.841
  507    HH   TYR  65           HH       TYR  65   2.743  -5.070  -5.070
  508    H    GLU  66           HN       GLU  66   7.140  -3.358  -3.358
  509    HA   GLU  66           HA       GLU  66   7.431  -5.647  -5.647
  510   1HB   GLU  66           HB1      GLU  66   9.485  -3.497  -3.497
  511   2HB   GLU  66           HB2      GLU  66   9.477  -4.621  -4.621
  512   1HG   GLU  66           HG1      GLU  66   6.962  -3.012  -3.012
  513   2HG   GLU  66           HG2      GLU  66   8.292  -2.184  -2.184
  514    H    LYS  67           HN       LYS  67   9.282  -4.897  -4.897
  515    HA   LYS  67           HA       LYS  67  11.206  -7.048  -7.048
  516   1HB   LYS  67           HB1      LYS  67  10.929  -4.796  -4.796
  517   2HB   LYS  67           HB2      LYS  67  11.812  -6.200  -6.200
  518   1HG   LYS  67           HG1      LYS  67  13.325  -4.582  -4.582
  519   2HG   LYS  67           HG2      LYS  67  13.297  -6.087  -6.087
  520   1HD   LYS  67           HD1      LYS  67  11.762  -5.024  -5.024
  521   2HD   LYS  67           HD2      LYS  67  11.848  -3.520  -3.520
  522   1HE   LYS  67           HE1      LYS  67  14.271  -3.398  -3.398
  523   2HE   LYS  67           HE2      LYS  67  14.248  -4.951  -4.951
  524   1HZ   LYS  67           HZ1      LYS  67  12.330  -3.258  -3.258
  525   2HZ   LYS  67           HZ2      LYS  67  13.812  -2.434  -2.434
  526   3HZ   LYS  67           HZ3      LYS  67  13.720  -3.941  -3.941
  527    H    ASP  68           HN       ASP  68   8.466  -6.484  -6.484
  528    HA   ASP  68           HA       ASP  68   8.648  -8.742  -8.742
  529   1HB   ASP  68           HB1      ASP  68   6.427  -6.852  -6.852
  530   2HB   ASP  68           HB2      ASP  68   6.125  -8.243  -8.243
  531    H    ILE  69           HN       ILE  69   7.396  -7.969  -7.969
  532    HA   ILE  69           HA       ILE  69   5.990 -10.542 -10.542
  533    HB   ILE  69           HB       ILE  69   4.986  -8.603  -8.603
  534   1HG1  ILE  69          HG11      ILE  69   4.612  -9.475  -9.475
  535   2HG1  ILE  69          HG12      ILE  69   6.157 -10.319 -10.319
  536   1HG2  ILE  69          HG21      ILE  69   7.041  -7.376  -7.376
  537   2HG2  ILE  69          HG22      ILE  69   7.486  -8.513  -8.513
  538   3HG2  ILE  69          HG23      ILE  69   6.058  -7.509  -7.509
  539   1HD1  ILE  69          HD11      ILE  69   3.887 -10.950 -10.950
  540   2HD1  ILE  69          HD12      ILE  69   4.287 -11.888 -11.888
  541   3HD1  ILE  69          HD13      ILE  69   5.408 -11.805 -11.805
  542    H    ALA  70           HN       ALA  70   8.753  -8.934  -8.934
  543    HA   ALA  70           HA       ALA  70   9.826 -10.932 -10.932
  544   1HB   ALA  70           HB1      ALA  70  11.377  -9.002  -9.002
  545   2HB   ALA  70           HB2      ALA  70  12.075  -9.891  -9.891
  546   3HB   ALA  70           HB3      ALA  70  10.881  -8.655  -8.655
  547    H    ALA  71           HN       ALA  71   9.790 -10.588 -10.588
  548    HA   ALA  71           HA       ALA  71  11.606 -12.827 -12.827
  549   1HB   ALA  71           HB1      ALA  71   9.913 -11.180 -11.180
  550   2HB   ALA  71           HB2      ALA  71  11.121 -12.370 -12.370
  551   3HB   ALA  71           HB3      ALA  71  11.611 -10.907 -10.907
  552    H    TYR  72           HN       TYR  72   8.206 -11.992 -11.992
  553    HA   TYR  72           HA       TYR  72   7.141 -14.320 -14.320
  554   1HB   TYR  72           HB1      TYR  72   5.855 -12.318 -12.318
  555   2HB   TYR  72           HB2      TYR  72   6.011 -12.596 -12.596
  556    HD1  TYR  72           HD1      TYR  72   4.822 -14.515 -14.515
  557    HD2  TYR  72           HD2      TYR  72   4.223 -13.477 -13.477
  558    HE1  TYR  72           HE1      TYR  72   2.773 -15.855 -15.855
  559    HE2  TYR  72           HE2      TYR  72   2.174 -14.813 -14.813
  560    HH   TYR  72           HH       TYR  72   1.329 -16.932 -16.932
  561    H    ARG  73           HN       ARG  73   8.020 -13.666 -13.666
  562    HA   ARG  73           HA       ARG  73   7.236 -16.367 -16.367
  563   1HB   ARG  73           HB1      ARG  73   8.551 -14.096 -14.096
  564   2HB   ARG  73           HB2      ARG  73   7.982 -15.588 -15.588
  565   1HG   ARG  73           HG1      ARG  73   5.663 -14.978 -14.978
  566   2HG   ARG  73           HG2      ARG  73   6.344 -13.394 -13.394
  567   1HD   ARG  73           HD1      ARG  73   5.997 -14.733 -14.733
  568   2HD   ARG  73           HD2      ARG  73   5.249 -13.245 -13.245
  569    HE   ARG  73           HE       ARG  73   7.528 -12.198 -12.198
  570   1HH1  ARG  73          HH11      ARG  73   9.438 -14.225 -14.225
  571   2HH1  ARG  73          HH12      ARG  73   9.643 -14.481 -14.481
  572   1HH2  ARG  73          HH21      ARG  73   6.630 -12.881 -12.881
  573   2HH2  ARG  73          HH22      ARG  73   8.009 -13.701 -13.701
  574    H    ALA  74           HN       ALA  74   9.997 -14.582 -14.582
  575    HA   ALA  74           HA       ALA  74  12.045 -16.158 -16.158
  576   1HB   ALA  74           HB1      ALA  74  12.551 -14.122 -14.122
  577   2HB   ALA  74           HB2      ALA  74  12.067 -14.969 -14.969
  578   3HB   ALA  74           HB3      ALA  74  13.475 -15.493 -15.493
  579    H    LYS  75           HN       LYS  75  10.284 -16.583 -16.583
  580    HA   LYS  75           HA       LYS  75  10.659 -19.501 -19.501
  581   1HB   LYS  75           HB1      LYS  75  12.674 -18.809 -18.809
  582   2HB   LYS  75           HB2      LYS  75  11.770 -17.771 -17.771
  583   1HG   LYS  75           HG1      LYS  75  10.698 -19.726 -19.726
  584   2HG   LYS  75           HG2      LYS  75  11.472 -20.799 -20.799
  585   1HD   LYS  75           HD1      LYS  75  13.558 -20.619 -20.619
  586   2HD   LYS  75           HD2      LYS  75  13.300 -18.984 -18.984
  587   1HE   LYS  75           HE1      LYS  75  13.344 -20.623 -20.623
  588   2HE   LYS  75           HE2      LYS  75  11.771 -19.854 -19.854
  589   1HZ   LYS  75           HZ1      LYS  75  11.765 -22.135 -22.135
  590   2HZ   LYS  75           HZ2      LYS  75  12.377 -22.565 -22.565
  591   3HZ   LYS  75           HZ3      LYS  75  10.858 -21.820 -21.820
  592    H    GLY  76           HN       GLY  76   8.966 -16.802 -16.802
  593   1HA   GLY  76           HA1      GLY  76   7.284 -18.473 -18.473
  594   2HA   GLY  76           HA2      GLY  76   7.090 -16.754 -16.754
  595    H    LYS  77           HN       LYS  77   6.873 -19.724 -19.724
  596    HA   LYS  77           HA       LYS  77   4.483 -18.779 -18.779
  597   1HB   LYS  77           HB1      LYS  77   6.249 -21.191 -21.191
  598   2HB   LYS  77           HB2      LYS  77   5.097 -20.432 -20.432
  599   1HG   LYS  77           HG1      LYS  77   6.499 -18.340 -18.340
  600   2HG   LYS  77           HG2      LYS  77   7.667 -19.175 -19.175
  601   1HD   LYS  77           HD1      LYS  77   8.527 -19.418 -19.418
  602   2HD   LYS  77           HD2      LYS  77   7.801 -20.962 -20.962
  603   1HE   LYS  77           HE1      LYS  77   5.751 -20.317 -20.317
  604   2HE   LYS  77           HE2      LYS  77   6.440 -18.731 -18.731
  605   1HZ   LYS  77           HZ1      LYS  77   8.283 -20.698 -20.698
  606   2HZ   LYS  77           HZ2      LYS  77   6.773 -21.076 -21.076
  607   3HZ   LYS  77           HZ3      LYS  77   7.478 -19.558 -19.558
  608    HA   PRO  78           HA       PRO  78   1.971 -21.747 -21.747
  609   1HB   PRO  78           HB1      PRO  78   0.726 -22.782 -22.782
  610   2HB   PRO  78           HB2      PRO  78   0.018 -21.757 -21.757
  611   1HG   PRO  78           HG1      PRO  78   0.622 -20.721 -20.721
  612   2HG   PRO  78           HG2      PRO  78   0.886 -19.756 -19.756
  613   1HD   PRO  78           HD1      PRO  78   2.934 -21.488 -21.488
  614   2HD   PRO  78           HD2      PRO  78   3.058 -19.761 -19.761
  615    H    ASP  79           HN       ASP  79   4.551 -22.883 -22.883
  616    HA   ASP  79           HA       ASP  79   3.836 -25.734 -25.734
  617   1HB   ASP  79           HB1      ASP  79   4.541 -25.308 -25.308
  618   2HB   ASP  79           HB2      ASP  79   6.020 -24.549 -24.549
  619    H    ALA  80           HN       ALA  80   5.416 -23.180 -23.180
  620    HA   ALA  80           HA       ALA  80   7.210 -24.757 -24.757
  621   1HB   ALA  80           HB1      ALA  80   7.654 -21.958 -21.958
  622   2HB   ALA  80           HB2      ALA  80   8.731 -22.773 -22.773
  623   3HB   ALA  80           HB3      ALA  80   8.508 -23.410 -23.410
  624    H    ALA  81           HN       ALA  81   5.732 -24.926 -24.926
  625    HA   ALA  81           HA       ALA  81   4.209 -22.689 -22.689
  626   1HB   ALA  81           HB1      ALA  81   4.816 -25.409 -25.409
  627   2HB   ALA  81           HB2      ALA  81   3.607 -24.278 -24.278
  628   3HB   ALA  81           HB3      ALA  81   3.418 -25.026 -25.026
  629   1H1   BME  16           HE1      MER  16  -9.561  11.031  11.031
  630   2H1   BME  16           HE2      MER  16  -8.597   9.626   9.626
  631   1H2   BME  16           HZ1      MER  16  -7.575  12.313  12.313
  632   2H2   BME  16           HZ2      MER  16  -7.527  10.821  10.821
  633    HO1  BME  16           HH       MER  16  -8.344  10.580  10.580

  Start of MODEL   28
    1    H    ASN   3           HN       ASN   3   0.146 -11.998 -11.998
    2    HA   ASN   3           HA       ASN   3   0.422 -12.783 -12.783
    3   1HB   ASN   3           HB1      ASN   3  -2.601 -13.037 -13.037
    4   2HB   ASN   3           HB2      ASN   3  -1.584 -13.977 -13.977
    5   1HD2  ASN   3          HD21      ASN   3  -2.028 -15.219 -15.219
    6   2HD2  ASN   3          HD22      ASN   3  -3.013 -14.038 -14.038
    7    H    ALA   4           HN       ALA   4   1.143 -11.099 -11.099
    8    HA   ALA   4           HA       ALA   4   1.187 -10.027 -10.027
    9   1HB   ALA   4           HB1      ALA   4  -0.894 -11.192 -11.192
   10   2HB   ALA   4           HB2      ALA   4  -1.888  -9.987  -9.987
   11   3HB   ALA   4           HB3      ALA   4  -0.843  -9.514  -9.514
   12    HA   PRO   5           HA       PRO   5   0.806  -6.507  -6.507
   13   1HB   PRO   5           HB1      PRO   5   3.309  -5.732  -5.732
   14   2HB   PRO   5           HB2      PRO   5   2.994  -5.764  -5.764
   15   1HG   PRO   5           HG1      PRO   5   4.493  -7.732  -7.732
   16   2HG   PRO   5           HG2      PRO   5   3.227  -8.152  -8.152
   17   1HD   PRO   5           HD1      PRO   5   3.031  -8.234  -8.234
   18   2HD   PRO   5           HD2      PRO   5   2.660  -9.533  -9.533
   19    H    LYS   6           HN       LYS   6  -0.997  -5.672  -5.672
   20    HA   LYS   6           HA       LYS   6  -1.338  -4.705  -4.705
   21   1HB   LYS   6           HB1      LYS   6  -2.584  -3.756  -3.756
   22   2HB   LYS   6           HB2      LYS   6  -3.153  -3.252  -3.252
   23   1HG   LYS   6           HG1      LYS   6  -3.699  -5.565  -5.565
   24   2HG   LYS   6           HG2      LYS   6  -2.968  -6.177  -6.177
   25   1HD   LYS   6           HD1      LYS   6  -5.410  -6.181  -6.181
   26   2HD   LYS   6           HD2      LYS   6  -4.722  -5.053  -5.053
   27   1HE   LYS   6           HE1      LYS   6  -5.818  -4.180  -4.180
   28   2HE   LYS   6           HE2      LYS   6  -6.800  -4.235  -4.235
   29   1HZ   LYS   6           HZ1      LYS   6  -4.444  -2.874  -2.874
   30   2HZ   LYS   6           HZ2      LYS   6  -5.061  -2.227  -2.227
   31   3HZ   LYS   6           HZ3      LYS   6  -6.032  -2.276  -2.276
   32    H    ARG   7           HN       ARG   7  -1.501  -2.557  -2.557
   33    HA   ARG   7           HA       ARG   7   0.900  -1.238  -1.238
   34   1HB   ARG   7           HB1      ARG   7  -1.733  -0.057  -0.057
   35   2HB   ARG   7           HB2      ARG   7  -0.144   0.577   0.577
   36   1HG   ARG   7           HG1      ARG   7   0.424  -1.735  -1.735
   37   2HG   ARG   7           HG2      ARG   7  -1.261  -2.167  -2.167
   38   1HD   ARG   7           HD1      ARG   7  -0.998  -1.429  -1.429
   39   2HD   ARG   7           HD2      ARG   7  -1.871  -0.154  -0.154
   40    HE   ARG   7           HE       ARG   7   0.289   1.078   1.078
   41   1HH1  ARG   7          HH11      ARG   7   2.378  -0.714  -0.714
   42   2HH1  ARG   7          HH12      ARG   7   2.683  -0.619  -0.619
   43   1HH2  ARG   7          HH21      ARG   7  -0.427   0.866   0.866
   44   2HH2  ARG   7          HH22      ARG   7   1.049   0.302   0.302
   45    HA   PRO   8           HA       PRO   8  -0.029   1.034   1.034
   46   1HB   PRO   8           HB1      PRO   8   2.564   1.660   1.660
   47   2HB   PRO   8           HB2      PRO   8   2.002  -0.013  -0.013
   48   1HG   PRO   8           HG1      PRO   8   3.444   1.496   1.496
   49   2HG   PRO   8           HG2      PRO   8   3.905  -0.035  -0.035
   50   1HD   PRO   8           HD1      PRO   8   2.453   0.049   0.049
   51   2HD   PRO   8           HD2      PRO   8   2.231  -1.254  -1.254
   52    HA   PRO   9           HA       PRO   9  -0.364   5.495   5.495
   53   1HB   PRO   9           HB1      PRO   9   2.487   5.596   5.596
   54   2HB   PRO   9           HB2      PRO   9   1.244   6.842   6.842
   55   1HG   PRO   9           HG1      PRO   9   1.448   5.046   5.046
   56   2HG   PRO   9           HG2      PRO   9  -0.166   5.417   5.417
   57   1HD   PRO   9           HD1      PRO   9   1.502   2.963   2.963
   58   2HD   PRO   9           HD2      PRO   9  -0.266   3.105   3.105
   59    H    SER  10           HN       SER  10  -0.183   7.000   7.000
   60    HA   SER  10           HA       SER  10   1.678   6.387   6.387
   61   1HB   SER  10           HB1      SER  10  -0.747   6.006   6.006
   62   2HB   SER  10           HB2      SER  10  -1.069   7.710   7.710
   63    HG   SER  10           HG       SER  10  -0.419   8.116   8.116
   64    H    ALA  11           HN       ALA  11   1.936   8.384   8.384
   65    HA   ALA  11           HA       ALA  11   3.404  10.243  10.243
   66   1HB   ALA  11           HB1      ALA  11   3.991  10.157  10.157
   67   2HB   ALA  11           HB2      ALA  11   2.497  11.041  11.041
   68   3HB   ALA  11           HB3      ALA  11   3.780  11.781  11.781
   69    H    PHE  12           HN       PHE  12   0.669  10.535  10.535
   70    HA   PHE  12           HA       PHE  12  -0.563  12.911  12.911
   71   1HB   PHE  12           HB1      PHE  12  -1.089  11.588  11.588
   72   2HB   PHE  12           HB2      PHE  12  -1.663  10.254  10.254
   73    HD1  PHE  12           HD1      PHE  12  -3.613  11.812  11.812
   74    HD2  PHE  12           HD2      PHE  12  -2.826  11.989  11.989
   75    HE1  PHE  12           HE1      PHE  12  -5.908  12.581  12.581
   76    HE2  PHE  12           HE2      PHE  12  -5.115  12.744  12.744
   77    HZ   PHE  12           HZ       PHE  12  -6.667  13.040  13.040
   78    H    PHE  13           HN       PHE  13  -0.634   9.649   9.649
   79    HA   PHE  13           HA       PHE  13  -2.685   9.900   9.900
   80   1HB   PHE  13           HB1      PHE  13  -1.480   7.786   7.786
   81   2HB   PHE  13           HB2      PHE  13  -0.033   8.453   8.453
   82    HD1  PHE  13           HD1      PHE  13  -3.464   7.188   7.188
   83    HD2  PHE  13           HD2      PHE  13  -0.002   8.767   8.767
   84    HE1  PHE  13           HE1      PHE  13  -4.370   6.538   6.538
   85    HE2  PHE  13           HE2      PHE  13  -0.909   8.112   8.112
   86    HZ   PHE  13           HZ       PHE  13  -3.094   6.993   6.993
   87    H    LEU  14           HN       LEU  14   0.752  10.580  10.580
   88    HA   LEU  14           HA       LEU  14   0.553  11.475  11.475
   89   1HB   LEU  14           HB1      LEU  14   2.356  12.680  12.680
   90   2HB   LEU  14           HB2      LEU  14   2.576  12.868  12.868
   91    HG   LEU  14           HG       LEU  14   4.171  11.314  11.314
   92   1HD1  LEU  14          HD11      LEU  14   2.974  10.413  10.413
   93   2HD1  LEU  14          HD12      LEU  14   1.880   9.528   9.528
   94   3HD1  LEU  14          HD13      LEU  14   3.588   9.121   9.121
   95   1HD2  LEU  14          HD21      LEU  14   3.648  10.947  10.947
   96   2HD2  LEU  14          HD22      LEU  14   3.944   9.404   9.404
   97   3HD2  LEU  14          HD23      LEU  14   2.303   9.884   9.884
   98    H    PHE  15           HN       PHE  15   0.409  13.598  13.598
   99    HA   PHE  15           HA       PHE  15  -0.287  15.880  15.880
  100   1HB   PHE  15           HB1      PHE  15   0.476  16.916  16.916
  101   2HB   PHE  15           HB2      PHE  15   0.682  15.309  15.309
  102    HD1  PHE  15           HD1      PHE  15  -1.258  14.358  14.358
  103    HD2  PHE  15           HD2      PHE  15  -0.925  18.473  18.473
  104    HE1  PHE  15           HE1      PHE  15  -2.821  14.931  14.931
  105    HE2  PHE  15           HE2      PHE  15  -2.494  19.053  19.053
  106    HZ   PHE  15           HZ       PHE  15  -3.430  17.279  17.279
  107    H    CYS  16           HN       MER  16  -2.279  13.705  13.705
  108    HA   CYS  16           HA       MER  16  -4.727  15.067  15.067
  109   1HB   CYS  16           HB1      MER  16  -4.632  13.220  13.220
  110   2HB   CYS  16           HB2      MER  16  -4.089  12.130  12.130
  111    H    SER  17           HN       SER  17  -3.133  12.754  12.754
  112    HA   SER  17           HA       SER  17  -5.166  12.528  12.528
  113   1HB   SER  17           HB1      SER  17  -2.109  12.518  12.518
  114   2HB   SER  17           HB2      SER  17  -3.292  11.829  11.829
  115    HG   SER  17           HG       SER  17  -3.283  10.146  10.146
  116    H    GLU  18           HN       GLU  18  -2.585  14.823  14.823
  117    HA   GLU  18           HA       GLU  18  -3.219  16.475  16.475
  118   1HB   GLU  18           HB1      GLU  18  -0.944  16.163  16.163
  119   2HB   GLU  18           HB2      GLU  18  -1.468  16.992  16.992
  120   1HG   GLU  18           HG1      GLU  18  -1.868  19.058  19.058
  121   2HG   GLU  18           HG2      GLU  18  -1.448  18.262  18.262
  122    H    TYR  19           HN       TYR  19  -4.779  16.114  16.114
  123    HA   TYR  19           HA       TYR  19  -5.603  18.957  18.957
  124   1HB   TYR  19           HB1      TYR  19  -5.351  16.676  16.676
  125   2HB   TYR  19           HB2      TYR  19  -6.829  17.646  17.646
  126    HD1  TYR  19           HD1      TYR  19  -3.246  18.278  18.278
  127    HD2  TYR  19           HD2      TYR  19  -6.606  19.363  19.363
  128    HE1  TYR  19           HE1      TYR  19  -1.900  19.990  19.990
  129    HE2  TYR  19           HE2      TYR  19  -5.266  21.076  21.076
  130    HH   TYR  19           HH       TYR  19  -3.174  21.853  21.853
  131    H    ARG  20           HN       ARG  20  -6.956  15.769  15.769
  132    HA   ARG  20           HA       ARG  20  -9.587  15.908  15.908
  133   1HB   ARG  20           HB1      ARG  20  -7.992  14.699  14.699
  134   2HB   ARG  20           HB2      ARG  20  -9.745  14.678  14.678
  135   1HG   ARG  20           HG1      ARG  20  -9.766  13.659  13.659
  136   2HG   ARG  20           HG2      ARG  20  -8.014  13.624  13.624
  137   1HD   ARG  20           HD1      ARG  20  -8.966  11.415  11.415
  138   2HD   ARG  20           HD2      ARG  20  -8.103  12.084  12.084
  139    HE   ARG  20           HE       ARG  20 -11.056  12.478  12.478
  140   1HH1  ARG  20          HH11      ARG  20  -9.054  13.043  13.043
  141   2HH1  ARG  20          HH12      ARG  20  -9.553  11.795  11.795
  142   1HH2  ARG  20          HH21      ARG  20 -11.382  10.095  10.095
  143   2HH2  ARG  20          HH22      ARG  20 -10.909  10.075  10.075
  144    HA   PRO  21           HA       PRO  21 -10.890  18.044  18.044
  145   1HB   PRO  21           HB1      PRO  21  -8.462  19.262  19.262
  146   2HB   PRO  21           HB2      PRO  21  -9.697  18.235  18.235
  147   1HG   PRO  21           HG1      PRO  21  -7.283  17.173  17.173
  148   2HG   PRO  21           HG2      PRO  21  -8.710  16.221  16.221
  149   1HD   PRO  21           HD1      PRO  21  -7.155  18.127  18.127
  150   2HD   PRO  21           HD2      PRO  21  -7.400  16.395  16.395
  151    H    LYS  22           HN       LYS  22  -8.617  19.596  19.596
  152    HA   LYS  22           HA       LYS  22  -9.535  22.340  22.340
  153   1HB   LYS  22           HB1      LYS  22  -7.123  21.717  21.717
  154   2HB   LYS  22           HB2      LYS  22  -7.549  21.220  21.220
  155   1HG   LYS  22           HG1      LYS  22  -8.348  23.570  23.570
  156   2HG   LYS  22           HG2      LYS  22  -7.809  24.035  24.035
  157   1HD   LYS  22           HD1      LYS  22  -5.481  23.246  23.246
  158   2HD   LYS  22           HD2      LYS  22  -6.065  22.895  22.895
  159   1HE   LYS  22           HE1      LYS  22  -4.993  25.092  25.092
  160   2HE   LYS  22           HE2      LYS  22  -6.720  25.307  25.307
  161   1HZ   LYS  22           HZ1      LYS  22  -6.785  26.590  26.590
  162   2HZ   LYS  22           HZ2      LYS  22  -6.213  25.331  25.331
  163   3HZ   LYS  22           HZ3      LYS  22  -5.115  26.388  26.388
  164    H    ILE  23           HN       ILE  23  -9.927  19.818  19.818
  165    HA   ILE  23           HA       ILE  23 -11.394  21.710  21.710
  166    HB   ILE  23           HB       ILE  23 -11.562  19.538  19.538
  167   1HG1  ILE  23          HG11      ILE  23  -9.109  18.780  18.780
  168   2HG1  ILE  23          HG12      ILE  23 -10.674  18.074  18.074
  169   1HG2  ILE  23          HG21      ILE  23 -10.179  21.526  21.526
  170   2HG2  ILE  23          HG22      ILE  23  -8.909  20.943  20.943
  171   3HG2  ILE  23          HG23      ILE  23  -9.287  20.071  20.071
  172   1HD1  ILE  23          HD11      ILE  23 -10.808  17.311  17.311
  173   2HD1  ILE  23          HD12      ILE  23  -9.206  17.969  17.969
  174   3HD1  ILE  23          HD13      ILE  23  -9.409  16.647  16.647
  175    H    LYS  24           HN       LYS  24 -11.786  19.380  19.380
  176    HA   LYS  24           HA       LYS  24 -14.567  18.693  18.693
  177   1HB   LYS  24           HB1      LYS  24 -12.866  17.124  17.124
  178   2HB   LYS  24           HB2      LYS  24 -12.703  18.135  18.135
  179   1HG   LYS  24           HG1      LYS  24 -14.949  17.691  17.691
  180   2HG   LYS  24           HG2      LYS  24 -15.421  16.958  16.958
  181   1HD   LYS  24           HD1      LYS  24 -15.073  15.223  15.223
  182   2HD   LYS  24           HD2      LYS  24 -13.893  15.055  15.055
  183   1HE   LYS  24           HE1      LYS  24 -12.191  16.205  16.205
  184   2HE   LYS  24           HE2      LYS  24 -13.394  16.356  16.356
  185   1HZ   LYS  24           HZ1      LYS  24 -13.358  13.703  13.703
  186   2HZ   LYS  24           HZ2      LYS  24 -11.750  14.181  14.181
  187   3HZ   LYS  24           HZ3      LYS  24 -12.894  14.330  14.330
  188    H    GLY  25           HN       GLY  25 -12.605  20.829  20.829
  189   1HA   GLY  25           HA1      GLY  25 -14.645  21.730  21.730
  190   2HA   GLY  25           HA2      GLY  25 -13.085  22.513  22.513
  191    H    GLU  26           HN       GLU  26 -13.291  22.755  22.755
  192    HA   GLU  26           HA       GLU  26 -14.932  25.130  25.130
  193   1HB   GLU  26           HB1      GLU  26 -13.107  23.653  23.653
  194   2HB   GLU  26           HB2      GLU  26 -13.873  25.177  25.177
  195   1HG   GLU  26           HG1      GLU  26 -12.119  24.783  24.783
  196   2HG   GLU  26           HG2      GLU  26 -11.458  25.290  25.290
  197    H    HIS  27           HN       HIS  27 -14.736  21.979  21.979
  198    HA   HIS  27           HA       HIS  27 -17.521  22.239  22.239
  199   1HB   HIS  27           HB1      HIS  27 -15.286  20.675  20.675
  200   2HB   HIS  27           HB2      HIS  27 -16.861  21.094  21.094
  201    HD1  HIS  27           HD1      HIS  27 -17.169  23.838  23.838
  202    HD2  HIS  27           HD2      HIS  27 -13.321  22.481  22.481
  203    HE1  HIS  27           HE1      HIS  27 -15.740  25.686  25.686
  204    HA   PRO  28           HA       PRO  28 -17.587  18.425  18.425
  205   1HB   PRO  28           HB1      PRO  28 -19.554  19.138  19.138
  206   2HB   PRO  28           HB2      PRO  28 -17.912  19.733  19.733
  207   1HG   PRO  28           HG1      PRO  28 -20.199  21.152  21.152
  208   2HG   PRO  28           HG2      PRO  28 -19.236  21.775  21.775
  209   1HD   PRO  28           HD1      PRO  28 -18.553  22.347  22.347
  210   2HD   PRO  28           HD2      PRO  28 -17.286  22.089  22.089
  211    H    GLY  29           HN       GLY  29 -18.489  18.995  18.995
  212   1HA   GLY  29           HA1      GLY  29 -21.021  17.499  17.499
  213   2HA   GLY  29           HA2      GLY  29 -20.906  19.000  19.000
  214    H    LEU  30           HN       LEU  30 -18.020  17.112  17.112
  215    HA   LEU  30           HA       LEU  30 -18.260  16.343  16.343
  216   1HB   LEU  30           HB1      LEU  30 -15.847  16.432  16.432
  217   2HB   LEU  30           HB2      LEU  30 -15.751  16.116  16.116
  218    HG   LEU  30           HG       LEU  30 -16.380  18.643  18.643
  219   1HD1  LEU  30          HD11      LEU  30 -14.297  17.958  17.958
  220   2HD1  LEU  30          HD12      LEU  30 -14.493  19.544  19.544
  221   3HD1  LEU  30          HD13      LEU  30 -14.033  18.178  18.178
  222   1HD2  LEU  30          HD21      LEU  30 -16.813  18.284  18.284
  223   2HD2  LEU  30          HD22      LEU  30 -18.065  18.611  18.611
  224   3HD2  LEU  30          HD23      LEU  30 -16.837  19.812  19.812
  225    H    SER  31           HN       SER  31 -17.352  14.305  14.305
  226    HA   SER  31           HA       SER  31 -17.791  12.092  12.092
  227   1HB   SER  31           HB1      SER  31 -18.038  12.093  12.093
  228   2HB   SER  31           HB2      SER  31 -18.428  10.741  10.741
  229    HG   SER  31           HG       SER  31 -19.879  12.934  12.934
  230    H    ILE  32           HN       ILE  32 -16.496  10.081  10.081
  231    HA   ILE  32           HA       ILE  32 -13.708  10.756  10.756
  232    HB   ILE  32           HB       ILE  32 -15.177   8.595   8.595
  233   1HG1  ILE  32          HG11      ILE  32 -12.895   8.655   8.655
  234   2HG1  ILE  32          HG12      ILE  32 -13.238   7.119   7.119
  235   1HG2  ILE  32          HG21      ILE  32 -15.891   8.108   8.108
  236   2HG2  ILE  32          HG22      ILE  32 -14.226   7.883   7.883
  237   3HG2  ILE  32          HG23      ILE  32 -14.948   6.766   6.766
  238   1HD1  ILE  32          HD11      ILE  32 -12.002   7.862   7.862
  239   2HD1  ILE  32          HD12      ILE  32 -11.633   9.389   9.389
  240   3HD1  ILE  32          HD13      ILE  32 -10.994   7.892   7.892
  241    H    GLY  33           HN       GLY  33 -15.730  11.129  11.129
  242   1HA   GLY  33           HA1      GLY  33 -13.744  10.746  10.746
  243   2HA   GLY  33           HA2      GLY  33 -15.484  10.882  10.882
  244    H    ASP  34           HN       ASP  34 -15.177  13.102  13.102
  245    HA   ASP  34           HA       ASP  34 -14.661  15.294  15.294
  246   1HB   ASP  34           HB1      ASP  34 -16.161  15.076  15.076
  247   2HB   ASP  34           HB2      ASP  34 -15.985  16.632  16.632
  248    H    VAL  35           HN       VAL  35 -14.081  14.201  14.201
  249    HA   VAL  35           HA       VAL  35 -12.200  16.177  16.177
  250    HB   VAL  35           HB       VAL  35 -12.725  13.267  13.267
  251   1HG1  VAL  35          HG11      VAL  35 -11.012  15.275  15.275
  252   2HG1  VAL  35          HG12      VAL  35 -11.465  13.692  13.692
  253   3HG1  VAL  35          HG13      VAL  35 -10.415  13.838  13.838
  254   1HG2  VAL  35          HG21      VAL  35 -13.527  15.858  15.858
  255   2HG2  VAL  35          HG22      VAL  35 -14.590  14.754  14.754
  256   3HG2  VAL  35          HG23      VAL  35 -13.824  14.243  14.243
  257    H    ALA  36           HN       ALA  36 -12.090  13.334  13.334
  258    HA   ALA  36           HA       ALA  36  -9.197  13.169  13.169
  259   1HB   ALA  36           HB1      ALA  36 -10.585  11.156  11.156
  260   2HB   ALA  36           HB2      ALA  36 -11.390  11.663  11.663
  261   3HB   ALA  36           HB3      ALA  36  -9.696  11.188  11.188
  262    H    LYS  37           HN       LYS  37 -11.866  14.082  14.082
  263    HA   LYS  37           HA       LYS  37 -10.062  14.542  14.542
  264   1HB   LYS  37           HB1      LYS  37 -12.549  14.069  14.069
  265   2HB   LYS  37           HB2      LYS  37 -12.833  15.735  15.735
  266   1HG   LYS  37           HG1      LYS  37 -11.337  16.412  16.412
  267   2HG   LYS  37           HG2      LYS  37 -11.301  14.710  14.710
  268   1HD   LYS  37           HD1      LYS  37 -13.821  14.777  14.777
  269   2HD   LYS  37           HD2      LYS  37 -13.767  16.503  16.503
  270   1HE   LYS  37           HE1      LYS  37 -12.248  16.798  16.798
  271   2HE   LYS  37           HE2      LYS  37 -12.435  15.088  15.088
  272   1HZ   LYS  37           HZ1      LYS  37 -14.977  16.212  16.212
  273   2HZ   LYS  37           HZ2      LYS  37 -14.098  17.175  17.175
  274   3HZ   LYS  37           HZ3      LYS  37 -14.289  15.517  15.517
  275    H    LYS  38           HN       LYS  38 -11.249  16.568  16.568
  276    HA   LYS  38           HA       LYS  38 -10.342  19.030  19.030
  277   1HB   LYS  38           HB1      LYS  38 -12.230  19.005  19.005
  278   2HB   LYS  38           HB2      LYS  38 -11.223  18.326  18.326
  279   1HG   LYS  38           HG1      LYS  38  -9.866  20.312  20.312
  280   2HG   LYS  38           HG2      LYS  38 -10.549  20.997  20.997
  281   1HD   LYS  38           HD1      LYS  38 -12.168  20.441  20.441
  282   2HD   LYS  38           HD2      LYS  38 -11.411  21.984  21.984
  283   1HE   LYS  38           HE1      LYS  38 -12.717  22.117  22.117
  284   2HE   LYS  38           HE2      LYS  38 -13.531  20.618  20.618
  285   1HZ   LYS  38           HZ1      LYS  38 -13.712  22.325  22.325
  286   2HZ   LYS  38           HZ2      LYS  38 -14.156  23.203  23.203
  287   3HZ   LYS  38           HZ3      LYS  38 -14.955  21.753  21.753
  288    H    LEU  39           HN       LEU  39  -9.130  17.009  17.009
  289    HA   LEU  39           HA       LEU  39  -6.751  18.696  18.696
  290   1HB   LEU  39           HB1      LEU  39  -6.504  17.711  17.711
  291   2HB   LEU  39           HB2      LEU  39  -8.162  17.247  17.247
  292    HG   LEU  39           HG       LEU  39  -7.240  15.149  15.149
  293   1HD1  LEU  39          HD11      LEU  39  -4.957  16.129  16.129
  294   2HD1  LEU  39          HD12      LEU  39  -5.065  14.503  14.503
  295   3HD1  LEU  39          HD13      LEU  39  -4.901  15.814  15.814
  296   1HD2  LEU  39          HD21      LEU  39  -8.496  15.333  15.333
  297   2HD2  LEU  39          HD22      LEU  39  -7.264  14.095  14.095
  298   3HD2  LEU  39          HD23      LEU  39  -6.959  15.660  15.660
  299    H    GLY  40           HN       GLY  40  -7.726  15.679  15.679
  300   1HA   GLY  40           HA1      GLY  40  -5.094  14.809  14.809
  301   2HA   GLY  40           HA2      GLY  40  -6.502  14.379  14.379
  302    H    GLU  41           HN       GLU  41  -7.181  17.154  17.154
  303    HA   GLU  41           HA       GLU  41  -5.573  17.579  17.579
  304   1HB   GLU  41           HB1      GLU  41  -7.446  19.242  19.242
  305   2HB   GLU  41           HB2      GLU  41  -6.535  20.019  20.019
  306   1HG   GLU  41           HG1      GLU  41  -8.314  17.570  17.570
  307   2HG   GLU  41           HG2      GLU  41  -8.799  19.209  19.209
  308    H    MET  42           HN       MET  42  -5.802  19.277  19.277
  309    HA   MET  42           HA       MET  42  -3.775  21.141  21.141
  310   1HB   MET  42           HB1      MET  42  -4.290  19.260  19.260
  311   2HB   MET  42           HB2      MET  42  -3.379  20.747  20.747
  312   1HG   MET  42           HG1      MET  42  -6.254  20.581  20.581
  313   2HG   MET  42           HG2      MET  42  -5.890  20.871  20.871
  314   1HE   MET  42           HE1      MET  42  -7.827  22.447  22.447
  315   2HE   MET  42           HE2      MET  42  -7.163  23.895  23.895
  316   3HE   MET  42           HE3      MET  42  -6.737  22.333  22.333
  317    H    TRP  43           HN       TRP  43  -3.432  17.885  17.885
  318    HA   TRP  43           HA       TRP  43  -0.732  17.569  17.569
  319   1HB   TRP  43           HB1      TRP  43  -2.446  15.811  15.811
  320   2HB   TRP  43           HB2      TRP  43  -2.666  15.532  15.532
  321    HD1  TRP  43           HD1      TRP  43  -1.194  13.702  13.702
  322    HE1  TRP  43           HE1      TRP  43   0.931  12.684  12.684
  323    HE3  TRP  43           HE3      TRP  43  -0.209  16.431  16.431
  324    HZ2  TRP  43           HZ2      TRP  43   2.949  12.881  12.881
  325    HZ3  TRP  43           HZ3      TRP  43   1.797  15.994  15.994
  326    HH2  TRP  43           HH2      TRP  43   3.392  14.237  14.237
  327    H    ASN  44           HN       ASN  44  -2.466  16.781  16.781
  328    HA   ASN  44           HA       ASN  44  -0.118  16.196  16.196
  329   1HB   ASN  44           HB1      ASN  44  -1.386  16.285  16.285
  330   2HB   ASN  44           HB2      ASN  44  -2.439  15.667  15.667
  331   1HD2  ASN  44          HD21      ASN  44  -4.940  17.789  17.789
  332   2HD2  ASN  44          HD22      ASN  44  -4.443  16.234  16.234
  333    H    ASN  45           HN       ASN  45  -1.275  19.214  19.214
  334    HA   ASN  45           HA       ASN  45   0.847  20.600  20.600
  335   1HB   ASN  45           HB1      ASN  45  -0.708  22.536  22.536
  336   2HB   ASN  45           HB2      ASN  45  -1.400  21.101  21.101
  337   1HD2  ASN  45          HD21      ASN  45  -4.280  21.348  21.348
  338   2HD2  ASN  45          HD22      ASN  45  -3.584  20.773  20.773
  339    H    THR  46           HN       THR  46   1.142  19.652  19.652
  340    HA   THR  46           HA       THR  46   0.688  21.942  21.942
  341    HB   THR  46           HB       THR  46   0.832  19.603  19.603
  342    HG1  THR  46           HG1      THR  46   1.539  20.688  20.688
  343   1HG2  THR  46          HG21      THR  46   3.857  19.788  19.788
  344   2HG2  THR  46          HG22      THR  46   3.017  18.537  18.537
  345   3HG2  THR  46          HG23      THR  46   2.794  18.688  18.688
  346    H    ALA  47           HN       ALA  47   3.310  20.589  20.589
  347    HA   ALA  47           HA       ALA  47   4.699  22.872  22.872
  348   1HB   ALA  47           HB1      ALA  47   5.934  21.681  21.681
  349   2HB   ALA  47           HB2      ALA  47   6.675  22.909  22.909
  350   3HB   ALA  47           HB3      ALA  47   5.238  23.290  23.290
  351    H    ALA  48           HN       ALA  48   5.335  19.838  19.838
  352    HA   ALA  48           HA       ALA  48   5.884  17.730  17.730
  353   1HB   ALA  48           HB1      ALA  48   6.114  18.754  18.754
  354   2HB   ALA  48           HB2      ALA  48   7.666  19.430  19.430
  355   3HB   ALA  48           HB3      ALA  48   7.434  17.687  17.687
  356    H    ASP  49           HN       ASP  49   7.752  20.602  20.602
  357    HA   ASP  49           HA       ASP  49  10.001  19.242  19.242
  358   1HB   ASP  49           HB1      ASP  49   9.356  22.069  22.069
  359   2HB   ASP  49           HB2      ASP  49  10.637  21.835  21.835
  360    H    ASP  50           HN       ASP  50   7.011  19.762  19.762
  361    HA   ASP  50           HA       ASP  50   7.626  20.470  20.470
  362   1HB   ASP  50           HB1      ASP  50   6.139  22.165  22.165
  363   2HB   ASP  50           HB2      ASP  50   5.026  20.876  20.876
  364    H    LYS  51           HN       LYS  51   6.866  18.158  18.158
  365    HA   LYS  51           HA       LYS  51   5.160  16.469  16.469
  366   1HB   LYS  51           HB1      LYS  51   6.503  15.906  15.906
  367   2HB   LYS  51           HB2      LYS  51   5.441  14.786  14.786
  368   1HG   LYS  51           HG1      LYS  51   3.628  16.539  16.539
  369   2HG   LYS  51           HG2      LYS  51   4.723  17.468  17.468
  370   1HD   LYS  51           HD1      LYS  51   4.902  15.539  15.539
  371   2HD   LYS  51           HD2      LYS  51   3.865  14.588  14.588
  372   1HE   LYS  51           HE1      LYS  51   2.399  15.405  15.405
  373   2HE   LYS  51           HE2      LYS  51   2.148  16.421  16.421
  374   1HZ   LYS  51           HZ1      LYS  51   4.166  17.609  17.609
  375   2HZ   LYS  51           HZ2      LYS  51   2.947  17.171  17.171
  376   3HZ   LYS  51           HZ3      LYS  51   2.577  18.159  18.159
  377    H    GLN  52           HN       GLN  52   8.270  16.463  16.463
  378    HA   GLN  52           HA       GLN  52   9.717  14.431  14.431
  379   1HB   GLN  52           HB1      GLN  52  10.285  17.168  17.168
  380   2HB   GLN  52           HB2      GLN  52  11.172  16.819  16.819
  381   1HG   GLN  52           HG1      GLN  52  12.598  16.399  16.399
  382   2HG   GLN  52           HG2      GLN  52  12.260  14.875  14.875
  383   1HE2  GLN  52          HE21      GLN  52   9.709  14.803  14.803
  384   2HE2  GLN  52          HE22      GLN  52   9.390  15.607  15.607
  385    HA   PRO  53           HA       PRO  53  10.330  15.335  15.335
  386   1HB   PRO  53           HB1      PRO  53   8.085  16.713  16.713
  387   2HB   PRO  53           HB2      PRO  53   9.673  17.420  17.420
  388   1HG   PRO  53           HG1      PRO  53   7.297  17.323  17.323
  389   2HG   PRO  53           HG2      PRO  53   8.262  18.733  18.733
  390   1HD   PRO  53           HD1      PRO  53   8.882  17.551  17.551
  391   2HD   PRO  53           HD2      PRO  53  10.228  17.867  17.867
  392    H    TYR  54           HN       TYR  54   6.937  15.322  15.322
  393    HA   TYR  54           HA       TYR  54   6.089  13.209  13.209
  394   1HB   TYR  54           HB1      TYR  54   4.886  14.314  14.314
  395   2HB   TYR  54           HB2      TYR  54   4.078  13.110  13.110
  396    HD1  TYR  54           HD1      TYR  54   4.358  13.979  13.979
  397    HD2  TYR  54           HD2      TYR  54   3.928  16.409  16.409
  398    HE1  TYR  54           HE1      TYR  54   3.423  15.774  15.774
  399    HE2  TYR  54           HE2      TYR  54   2.998  18.209  18.209
  400    HH   TYR  54           HH       TYR  54   1.685  18.209  18.209
  401    H    GLU  55           HN       GLU  55   6.723  13.401  13.401
  402    HA   GLU  55           HA       GLU  55   6.350  10.822  10.822
  403   1HB   GLU  55           HB1      GLU  55   7.562  13.212  13.212
  404   2HB   GLU  55           HB2      GLU  55   8.785  11.992  11.992
  405   1HG   GLU  55           HG1      GLU  55   7.047  10.574  10.574
  406   2HG   GLU  55           HG2      GLU  55   5.901  11.891  11.891
  407    H    LYS  56           HN       LYS  56   9.555  11.988  11.988
  408    HA   LYS  56           HA       LYS  56  11.001   9.705   9.705
  409   1HB   LYS  56           HB1      LYS  56  11.136  12.198  12.198
  410   2HB   LYS  56           HB2      LYS  56  11.834  10.875  10.875
  411   1HG   LYS  56           HG1      LYS  56  13.306  10.278  10.278
  412   2HG   LYS  56           HG2      LYS  56  12.565  11.456  11.456
  413   1HD   LYS  56           HD1      LYS  56  14.027  12.199  12.199
  414   2HD   LYS  56           HD2      LYS  56  14.804  12.136  12.136
  415   1HE   LYS  56           HE1      LYS  56  13.130  13.836  13.836
  416   2HE   LYS  56           HE2      LYS  56  12.492  13.970  13.970
  417   1HZ   LYS  56           HZ1      LYS  56  15.268  14.222  14.222
  418   2HZ   LYS  56           HZ2      LYS  56  14.710  15.246  15.246
  419   3HZ   LYS  56           HZ3      LYS  56  14.084  15.390  15.390
  420    H    LYS  57           HN       LYS  57   8.579  10.320  10.320
  421    HA   LYS  57           HA       LYS  57   9.429   7.972   7.972
  422   1HB   LYS  57           HB1      LYS  57   7.122   9.952   9.952
  423   2HB   LYS  57           HB2      LYS  57   7.165   8.515   8.515
  424   1HG   LYS  57           HG1      LYS  57   9.410   9.160   9.160
  425   2HG   LYS  57           HG2      LYS  57   9.404  10.598  10.598
  426   1HD   LYS  57           HD1      LYS  57   7.267  10.047  10.047
  427   2HD   LYS  57           HD2      LYS  57   8.751  10.896  10.896
  428   1HE   LYS  57           HE1      LYS  57   8.213  12.641  12.641
  429   2HE   LYS  57           HE2      LYS  57   6.737  11.800  11.800
  430   1HZ   LYS  57           HZ1      LYS  57   6.767  12.112  12.112
  431   2HZ   LYS  57           HZ2      LYS  57   7.119  13.613  13.613
  432   3HZ   LYS  57           HZ3      LYS  57   5.700  12.785  12.785
  433    H    ALA  58           HN       ALA  58   6.597   8.905   8.905
  434    HA   ALA  58           HA       ALA  58   5.178   6.509   6.509
  435   1HB   ALA  58           HB1      ALA  58   5.668   8.348   8.348
  436   2HB   ALA  58           HB2      ALA  58   4.356   7.185   7.185
  437   3HB   ALA  58           HB3      ALA  58   4.425   8.557   8.557
  438    H    ALA  59           HN       ALA  59   7.906   7.427   7.427
  439    HA   ALA  59           HA       ALA  59   8.209   5.197   5.197
  440   1HB   ALA  59           HB1      ALA  59   9.535   7.320   7.320
  441   2HB   ALA  59           HB2      ALA  59  10.403   6.933   6.933
  442   3HB   ALA  59           HB3      ALA  59  10.594   5.919   5.919
  443    H    LYS  60           HN       LYS  60  10.078   5.864   5.864
  444    HA   LYS  60           HA       LYS  60  11.414   3.627   3.627
  445   1HB   LYS  60           HB1      LYS  60  10.581   5.907   5.907
  446   2HB   LYS  60           HB2      LYS  60   9.910   4.648   4.648
  447   1HG   LYS  60           HG1      LYS  60  12.828   4.883   4.883
  448   2HG   LYS  60           HG2      LYS  60  12.234   5.386   5.386
  449   1HD   LYS  60           HD1      LYS  60  11.720   3.092   3.092
  450   2HD   LYS  60           HD2      LYS  60  12.065   2.498   2.498
  451   1HE   LYS  60           HE1      LYS  60  14.005   2.104   2.104
  452   2HE   LYS  60           HE2      LYS  60  14.440   3.215   3.215
  453   1HZ   LYS  60           HZ1      LYS  60  13.412   4.735   4.735
  454   2HZ   LYS  60           HZ2      LYS  60  14.517   3.637   3.637
  455   3HZ   LYS  60           HZ3      LYS  60  15.008   4.673   4.673
  456    H    LEU  61           HN       LEU  61   8.000   4.063   4.063
  457    HA   LEU  61           HA       LEU  61   7.584   1.414   1.414
  458   1HB   LEU  61           HB1      LEU  61   5.503   3.241   3.241
  459   2HB   LEU  61           HB2      LEU  61   5.224   1.989   1.989
  460    HG   LEU  61           HG       LEU  61   6.787   4.574   4.574
  461   1HD1  LEU  61          HD11      LEU  61   4.388   4.818   4.818
  462   2HD1  LEU  61          HD12      LEU  61   4.258   3.536   3.536
  463   3HD1  LEU  61          HD13      LEU  61   5.072   5.050   5.050
  464   1HD2  LEU  61          HD21      LEU  61   6.487   2.276   2.276
  465   2HD2  LEU  61          HD22      LEU  61   7.984   2.784   2.784
  466   3HD2  LEU  61          HD23      LEU  61   7.181   3.855   3.855
  467    H    LYS  62           HN       LYS  62   6.565   2.761   2.761
  468    HA   LYS  62           HA       LYS  62   5.613   0.407   0.407
  469   1HB   LYS  62           HB1      LYS  62   6.971   2.841   2.841
  470   2HB   LYS  62           HB2      LYS  62   7.055   1.441   1.441
  471   1HG   LYS  62           HG1      LYS  62   4.414   1.338   1.338
  472   2HG   LYS  62           HG2      LYS  62   4.652   3.046   3.046
  473   1HD   LYS  62           HD1      LYS  62   5.435   1.571   1.571
  474   2HD   LYS  62           HD2      LYS  62   4.038   2.610   2.610
  475   1HE   LYS  62           HE1      LYS  62   5.492   4.570   4.570
  476   2HE   LYS  62           HE2      LYS  62   6.930   3.557   3.557
  477   1HZ   LYS  62           HZ1      LYS  62   5.434   3.029   3.029
  478   2HZ   LYS  62           HZ2      LYS  62   5.607   4.710   4.710
  479   3HZ   LYS  62           HZ3      LYS  62   6.980   3.712   3.712
  480    H    GLU  63           HN       GLU  63   8.858   1.571   1.571
  481    HA   GLU  63           HA       GLU  63  10.363  -0.305  -0.305
  482   1HB   GLU  63           HB1      GLU  63  10.767   1.766   1.766
  483   2HB   GLU  63           HB2      GLU  63  11.795   0.416   0.416
  484   1HG   GLU  63           HG1      GLU  63  11.678   1.970   1.970
  485   2HG   GLU  63           HG2      GLU  63  12.973   2.012   2.012
  486    H    LYS  64           HN       LYS  64   9.431  -0.421  -0.421
  487    HA   LYS  64           HA       LYS  64  10.569  -3.007  -3.007
  488   1HB   LYS  64           HB1      LYS  64   8.208  -1.581  -1.581
  489   2HB   LYS  64           HB2      LYS  64   8.715  -3.171  -3.171
  490   1HG   LYS  64           HG1      LYS  64  11.083  -2.216  -2.216
  491   2HG   LYS  64           HG2      LYS  64  10.404  -0.628  -0.628
  492   1HD   LYS  64           HD1      LYS  64   9.406  -2.426  -2.426
  493   2HD   LYS  64           HD2      LYS  64  10.755  -1.340  -1.340
  494   1HE   LYS  64           HE1      LYS  64   8.779  -0.201  -0.201
  495   2HE   LYS  64           HE2      LYS  64   9.231   0.575   0.575
  496   1HZ   LYS  64           HZ1      LYS  64   7.506  -1.568  -1.568
  497   2HZ   LYS  64           HZ2      LYS  64   6.820  -0.620  -0.620
  498   3HZ   LYS  64           HZ3      LYS  64   7.253   0.092   0.092
  499    H    TYR  65           HN       TYR  65   7.294  -2.147  -2.147
  500    HA   TYR  65           HA       TYR  65   6.120  -4.692  -4.692
  501   1HB   TYR  65           HB1      TYR  65   4.645  -2.896  -2.896
  502   2HB   TYR  65           HB2      TYR  65   5.763  -1.988  -1.988
  503    HD1  TYR  65           HD1      TYR  65   4.328  -5.417  -5.417
  504    HD2  TYR  65           HD2      TYR  65   4.442  -1.359  -1.359
  505    HE1  TYR  65           HE1      TYR  65   2.977  -5.974  -5.974
  506    HE2  TYR  65           HE2      TYR  65   3.091  -1.925  -1.925
  507    HH   TYR  65           HH       TYR  65   1.254  -4.275  -4.275
  508    H    GLU  66           HN       GLU  66   7.579  -2.924  -2.924
  509    HA   GLU  66           HA       GLU  66   7.512  -4.738  -4.738
  510   1HB   GLU  66           HB1      GLU  66   9.764  -2.888  -2.888
  511   2HB   GLU  66           HB2      GLU  66   9.532  -3.617  -3.617
  512   1HG   GLU  66           HG1      GLU  66   7.239  -2.038  -2.038
  513   2HG   GLU  66           HG2      GLU  66   8.575  -1.133  -1.133
  514    H    LYS  67           HN       LYS  67   9.687  -4.818  -4.818
  515    HA   LYS  67           HA       LYS  67  11.392  -6.861  -6.861
  516   1HB   LYS  67           HB1      LYS  67  11.477  -5.250  -5.250
  517   2HB   LYS  67           HB2      LYS  67  12.294  -6.797  -6.797
  518   1HG   LYS  67           HG1      LYS  67  13.878  -5.125  -5.125
  519   2HG   LYS  67           HG2      LYS  67  13.587  -6.160  -6.160
  520   1HD   LYS  67           HD1      LYS  67  12.042  -4.409  -4.409
  521   2HD   LYS  67           HD2      LYS  67  12.411  -3.389  -3.389
  522   1HE   LYS  67           HE1      LYS  67  14.784  -3.334  -3.334
  523   2HE   LYS  67           HE2      LYS  67  14.498  -4.429  -4.429
  524   1HZ   LYS  67           HZ1      LYS  67  12.723  -2.270  -2.270
  525   2HZ   LYS  67           HZ2      LYS  67  14.287  -1.663  -1.663
  526   3HZ   LYS  67           HZ3      LYS  67  13.973  -2.721  -2.721
  527    H    ASP  68           HN       ASP  68   9.000  -6.645  -6.645
  528    HA   ASP  68           HA       ASP  68   9.219  -9.399  -9.399
  529   1HB   ASP  68           HB1      ASP  68   7.241  -7.181  -7.181
  530   2HB   ASP  68           HB2      ASP  68   7.150  -8.780  -8.780
  531    H    ILE  69           HN       ILE  69   7.666  -7.689  -7.689
  532    HA   ILE  69           HA       ILE  69   5.542  -9.739  -9.739
  533    HB   ILE  69           HB       ILE  69   5.344  -7.147  -7.147
  534   1HG1  ILE  69          HG11      ILE  69   3.401  -8.066  -8.066
  535   2HG1  ILE  69          HG12      ILE  69   3.865  -7.417  -7.417
  536   1HG2  ILE  69          HG21      ILE  69   7.238  -6.800  -6.800
  537   2HG2  ILE  69          HG22      ILE  69   6.509  -7.739  -7.739
  538   3HG2  ILE  69          HG23      ILE  69   5.779  -6.220  -6.220
  539   1HD1  ILE  69          HD11      ILE  69   4.679  -9.665  -9.665
  540   2HD1  ILE  69          HD12      ILE  69   4.159 -10.307 -10.307
  541   3HD1  ILE  69          HD13      ILE  69   2.973  -9.686  -9.686
  542    H    ALA  70           HN       ALA  70   8.403  -8.413  -8.413
  543    HA   ALA  70           HA       ALA  70   8.597 -10.077 -10.077
  544   1HB   ALA  70           HB1      ALA  70  10.854  -8.769  -8.769
  545   2HB   ALA  70           HB2      ALA  70  11.027  -9.447  -9.447
  546   3HB   ALA  70           HB3      ALA  70  10.023  -8.034  -8.034
  547    H    ALA  71           HN       ALA  71   9.260 -10.407 -10.407
  548    HA   ALA  71           HA       ALA  71  10.762 -12.910 -12.910
  549   1HB   ALA  71           HB1      ALA  71   9.669 -11.441 -11.441
  550   2HB   ALA  71           HB2      ALA  71  10.759 -12.822 -12.822
  551   3HB   ALA  71           HB3      ALA  71  11.308 -11.292 -11.292
  552    H    TYR  72           HN       TYR  72   7.587 -11.705 -11.705
  553    HA   TYR  72           HA       TYR  72   6.348 -14.056 -14.056
  554   1HB   TYR  72           HB1      TYR  72   5.376 -11.834 -11.834
  555   2HB   TYR  72           HB2      TYR  72   5.190 -11.803 -11.803
  556    HD1  TYR  72           HD1      TYR  72   4.212 -13.985 -13.985
  557    HD2  TYR  72           HD2      TYR  72   3.098 -12.272 -12.272
  558    HE1  TYR  72           HE1      TYR  72   1.983 -14.979 -14.979
  559    HE2  TYR  72           HE2      TYR  72   0.868 -13.263 -13.263
  560    HH   TYR  72           HH       TYR  72   0.070 -15.660 -15.660
  561    H    ARG  73           HN       ARG  73   6.742 -12.839 -12.839
  562    HA   ARG  73           HA       ARG  73   5.350 -15.059 -15.059
  563   1HB   ARG  73           HB1      ARG  73   6.957 -12.717 -12.717
  564   2HB   ARG  73           HB2      ARG  73   6.156 -13.896 -13.896
  565   1HG   ARG  73           HG1      ARG  73   3.956 -13.229 -13.229
  566   2HG   ARG  73           HG2      ARG  73   4.804 -12.035 -12.035
  567   1HD   ARG  73           HD1      ARG  73   3.763 -11.105 -11.105
  568   2HD   ARG  73           HD2      ARG  73   5.484 -10.779 -10.779
  569    HE   ARG  73           HE       ARG  73   5.895 -12.689 -12.689
  570   1HH1  ARG  73          HH11      ARG  73   3.961 -14.329 -14.329
  571   2HH1  ARG  73          HH12      ARG  73   2.942 -13.598 -13.598
  572   1HH2  ARG  73          HH21      ARG  73   4.126 -10.369 -10.369
  573   2HH2  ARG  73          HH22      ARG  73   3.039 -11.289 -11.289
  574    H    ALA  74           HN       ALA  74   8.524 -14.172 -14.172
  575    HA   ALA  74           HA       ALA  74   9.735 -16.164 -16.164
  576   1HB   ALA  74           HB1      ALA  74  10.948 -14.406 -14.406
  577   2HB   ALA  74           HB2      ALA  74  11.868 -15.402 -15.402
  578   3HB   ALA  74           HB3      ALA  74  10.903 -14.065 -14.065
  579    H    LYS  75           HN       LYS  75   8.538 -16.029 -16.029
  580    HA   LYS  75           HA       LYS  75   8.715 -18.783 -18.783
  581   1HB   LYS  75           HB1      LYS  75  11.257 -18.212 -18.212
  582   2HB   LYS  75           HB2      LYS  75  10.895 -17.184 -17.184
  583   1HG   LYS  75           HG1      LYS  75   9.873 -19.979 -19.979
  584   2HG   LYS  75           HG2      LYS  75  11.607 -19.866 -19.866
  585   1HD   LYS  75           HD1      LYS  75  11.544 -18.128 -18.128
  586   2HD   LYS  75           HD2      LYS  75   9.880 -18.620 -18.620
  587   1HE   LYS  75           HE1      LYS  75  11.371 -19.929 -19.929
  588   2HE   LYS  75           HE2      LYS  75  10.648 -20.991 -20.991
  589   1HZ   LYS  75           HZ1      LYS  75  12.981 -19.949 -19.949
  590   2HZ   LYS  75           HZ2      LYS  75  13.357 -20.474 -20.474
  591   3HZ   LYS  75           HZ3      LYS  75  12.659 -21.552 -21.552
  592    H    GLY  76           HN       GLY  76   6.600 -17.802 -17.802
  593   1HA   GLY  76           HA1      GLY  76   6.348 -16.560 -16.560
  594   2HA   GLY  76           HA2      GLY  76   5.149 -16.385 -16.385
  595    H    LYS  77           HN       LYS  77   4.797 -18.660 -18.660
  596    HA   LYS  77           HA       LYS  77   2.916 -20.145 -20.145
  597   1HB   LYS  77           HB1      LYS  77   5.631 -21.226 -21.226
  598   2HB   LYS  77           HB2      LYS  77   4.311 -22.339 -22.339
  599   1HG   LYS  77           HG1      LYS  77   4.555 -21.748 -21.748
  600   2HG   LYS  77           HG2      LYS  77   2.986 -21.265 -21.265
  601   1HD   LYS  77           HD1      LYS  77   3.653 -18.938 -18.938
  602   2HD   LYS  77           HD2      LYS  77   5.332 -19.324 -19.324
  603   1HE   LYS  77           HE1      LYS  77   2.945 -19.787 -19.787
  604   2HE   LYS  77           HE2      LYS  77   4.056 -18.429 -18.429
  605   1HZ   LYS  77           HZ1      LYS  77   5.587 -20.745 -20.745
  606   2HZ   LYS  77           HZ2      LYS  77   4.349 -21.003 -21.003
  607   3HZ   LYS  77           HZ3      LYS  77   5.382 -19.664 -19.664
  608    HA   PRO  78           HA       PRO  78   4.399 -23.028 -23.028
  609   1HB   PRO  78           HB1      PRO  78   6.708 -22.184 -22.184
  610   2HB   PRO  78           HB2      PRO  78   6.728 -23.362 -23.362
  611   1HG   PRO  78           HG1      PRO  78   7.086 -20.325 -20.325
  612   2HG   PRO  78           HG2      PRO  78   8.195 -21.562 -21.562
  613   1HD   PRO  78           HD1      PRO  78   6.504 -20.574 -20.574
  614   2HD   PRO  78           HD2      PRO  78   6.542 -22.337 -22.337
  615    H    ASP  79           HN       ASP  79   4.999 -19.686 -19.686
  616    HA   ASP  79           HA       ASP  79   3.419 -19.333 -19.333
  617   1HB   ASP  79           HB1      ASP  79   5.883 -18.558 -18.558
  618   2HB   ASP  79           HB2      ASP  79   5.404 -17.390 -17.390
  619    H    ALA  80           HN       ALA  80   1.789 -19.831 -19.831
  620    HA   ALA  80           HA       ALA  80   0.815 -17.370 -17.370
  621   1HB   ALA  80           HB1      ALA  80   0.268 -20.297 -20.297
  622   2HB   ALA  80           HB2      ALA  80  -0.395 -18.926 -18.926
  623   3HB   ALA  80           HB3      ALA  80   1.330 -19.226 -19.226
  624    H    ALA  81           HN       ALA  81   0.072 -19.915 -19.915
  625    HA   ALA  81           HA       ALA  81  -2.740 -18.985 -18.985
  626   1HB   ALA  81           HB1      ALA  81  -1.324 -21.489 -21.489
  627   2HB   ALA  81           HB2      ALA  81  -3.029 -21.135 -21.135
  628   3HB   ALA  81           HB3      ALA  81  -2.401 -21.407 -21.407
  629   1H1   BME  16           HE1      MER  16  -8.101   9.143   9.143
  630   2H1   BME  16           HE2      MER  16  -6.918   7.904   7.904
  631   1H2   BME  16           HZ1      MER  16  -5.806  10.096  10.096
  632   2H2   BME  16           HZ2      MER  16  -5.254   8.862   8.862
  633    HO1  BME  16           HH       MER  16  -7.468   6.872   6.872

  Start of MODEL   29
    1    H    ASN   3           HN       ASN   3  -1.370 -11.249 -11.249
    2    HA   ASN   3           HA       ASN   3  -1.026 -11.804 -11.804
    3   1HB   ASN   3           HB1      ASN   3  -3.130 -10.674 -10.674
    4   2HB   ASN   3           HB2      ASN   3  -2.137  -9.326  -9.326
    5   1HD2  ASN   3          HD21      ASN   3  -3.568  -9.234  -9.234
    6   2HD2  ASN   3          HD22      ASN   3  -4.205 -10.143 -10.143
    7    H    ALA   4           HN       ALA   4   0.546 -10.780 -10.780
    8    HA   ALA   4           HA       ALA   4   2.626  -9.344  -9.344
    9   1HB   ALA   4           HB1      ALA   4   2.829 -10.893 -10.893
   10   2HB   ALA   4           HB2      ALA   4   4.148 -10.032 -10.032
   11   3HB   ALA   4           HB3      ALA   4   3.347 -11.352 -11.352
   12    HA   PRO   5           HA       PRO   5   2.401  -6.517  -6.517
   13   1HB   PRO   5           HB1      PRO   5   0.280  -6.696  -6.696
   14   2HB   PRO   5           HB2      PRO   5   1.764  -7.623  -7.623
   15   1HG   PRO   5           HG1      PRO   5  -0.842  -8.497  -8.497
   16   2HG   PRO   5           HG2      PRO   5   0.098  -9.344  -9.344
   17   1HD   PRO   5           HD1      PRO   5   0.384  -9.973  -9.973
   18   2HD   PRO   5           HD2      PRO   5   1.826  -9.981  -9.981
   19    H    LYS   6           HN       LYS   6   2.048  -4.903  -4.903
   20    HA   LYS   6           HA       LYS   6  -0.690  -4.207  -4.207
   21   1HB   LYS   6           HB1      LYS   6   1.348  -4.602  -4.602
   22   2HB   LYS   6           HB2      LYS   6   1.954  -3.074  -3.074
   23   1HG   LYS   6           HG1      LYS   6   0.783  -2.597  -2.597
   24   2HG   LYS   6           HG2      LYS   6  -0.265  -2.021  -2.021
   25   1HD   LYS   6           HD1      LYS   6  -1.661  -4.022  -4.022
   26   2HD   LYS   6           HD2      LYS   6  -0.521  -4.807  -4.807
   27   1HE   LYS   6           HE1      LYS   6  -0.958  -2.901  -2.901
   28   2HE   LYS   6           HE2      LYS   6  -2.256  -2.376  -2.376
   29   1HZ   LYS   6           HZ1      LYS   6  -2.538  -5.118  -5.118
   30   2HZ   LYS   6           HZ2      LYS   6  -2.292  -4.408  -4.408
   31   3HZ   LYS   6           HZ3      LYS   6  -3.561  -3.869  -3.869
   32    H    ARG   7           HN       ARG   7  -0.360  -3.772  -3.772
   33    HA   ARG   7           HA       ARG   7   0.565  -1.994  -1.994
   34   1HB   ARG   7           HB1      ARG   7  -1.703  -3.170  -3.170
   35   2HB   ARG   7           HB2      ARG   7  -2.408  -1.712  -1.712
   36   1HG   ARG   7           HG1      ARG   7  -0.776  -0.627  -0.627
   37   2HG   ARG   7           HG2      ARG   7  -1.089  -2.197  -2.197
   38   1HD   ARG   7           HD1      ARG   7  -2.790  -0.704  -0.704
   39   2HD   ARG   7           HD2      ARG   7  -3.590  -1.721  -1.721
   40    HE   ARG   7           HE       ARG   7  -3.302   0.155   0.155
   41   1HH1  ARG   7          HH11      ARG   7  -1.323   1.772   1.772
   42   2HH1  ARG   7          HH12      ARG   7  -2.278   3.003   3.003
   43   1HH2  ARG   7          HH21      ARG   7  -5.266   1.214   1.214
   44   2HH2  ARG   7          HH22      ARG   7  -4.582   2.678   2.678
   45    HA   PRO   8           HA       PRO   8   0.704   1.500   1.500
   46   1HB   PRO   8           HB1      PRO   8   2.958   2.751   2.751
   47   2HB   PRO   8           HB2      PRO   8   3.022   1.332   1.332
   48   1HG   PRO   8           HG1      PRO   8   3.047   1.430   1.430
   49   2HG   PRO   8           HG2      PRO   8   4.190   0.652   0.652
   50   1HD   PRO   8           HD1      PRO   8   2.224  -0.818  -0.818
   51   2HD   PRO   8           HD2      PRO   8   2.607  -1.065  -1.065
   52    HA   PRO   9           HA       PRO   9  -1.053   5.246   5.246
   53   1HB   PRO   9           HB1      PRO   9   1.072   7.092   7.092
   54   2HB   PRO   9           HB2      PRO   9  -0.213   6.655   6.655
   55   1HG   PRO   9           HG1      PRO   9   2.548   5.383   5.383
   56   2HG   PRO   9           HG2      PRO   9   1.741   5.968   5.968
   57   1HD   PRO   9           HD1      PRO   9   1.597   3.394   3.394
   58   2HD   PRO   9           HD2      PRO   9   0.049   4.202   4.202
   59    H    SER  10           HN       SER  10  -0.289   7.370   7.370
   60    HA   SER  10           HA       SER  10   0.627   6.441   6.441
   61   1HB   SER  10           HB1      SER  10  -1.244   8.723   8.723
   62   2HB   SER  10           HB2      SER  10  -0.774   8.311   8.311
   63    HG   SER  10           HG       SER  10  -2.576   7.121   7.121
   64    H    ALA  11           HN       ALA  11   0.665   9.276   9.276
   65    HA   ALA  11           HA       ALA  11   3.149  10.145  10.145
   66   1HB   ALA  11           HB1      ALA  11   2.325  11.112  11.112
   67   2HB   ALA  11           HB2      ALA  11   3.727  11.654  11.654
   68   3HB   ALA  11           HB3      ALA  11   3.675  10.019  10.019
   69    H    PHE  12           HN       PHE  12   0.200  10.973  10.973
   70    HA   PHE  12           HA       PHE  12  -0.146  13.580  13.580
   71   1HB   PHE  12           HB1      PHE  12  -1.295  13.580  13.580
   72   2HB   PHE  12           HB2      PHE  12  -1.210  11.884  11.884
   73    HD1  PHE  12           HD1      PHE  12  -3.339  13.658  13.658
   74    HD2  PHE  12           HD2      PHE  12  -3.145  11.705  11.705
   75    HE1  PHE  12           HE1      PHE  12  -5.741  13.696  13.696
   76    HE2  PHE  12           HE2      PHE  12  -5.575  11.758  11.758
   77    HZ   PHE  12           HZ       PHE  12  -6.909  12.732  12.732
   78    H    PHE  13           HN       PHE  13  -0.852  10.260  10.260
   79    HA   PHE  13           HA       PHE  13  -2.966  10.582  10.582
   80   1HB   PHE  13           HB1      PHE  13  -1.700   8.387   8.387
   81   2HB   PHE  13           HB2      PHE  13  -0.640   8.755   8.755
   82    HD1  PHE  13           HD1      PHE  13  -1.797   9.219   9.219
   83    HD2  PHE  13           HD2      PHE  13  -3.793   7.338   7.338
   84    HE1  PHE  13           HE1      PHE  13  -3.501   8.358   8.358
   85    HE2  PHE  13           HE2      PHE  13  -5.493   6.477   6.477
   86    HZ   PHE  13           HZ       PHE  13  -5.352   6.985   6.985
   87    H    LEU  14           HN       LEU  14   0.530  10.988  10.988
   88    HA   LEU  14           HA       LEU  14   0.394  11.554  11.554
   89   1HB   LEU  14           HB1      LEU  14   2.276  12.832  12.832
   90   2HB   LEU  14           HB2      LEU  14   2.551  12.827  12.827
   91    HG   LEU  14           HG       LEU  14   4.045  11.224  11.224
   92   1HD1  LEU  14          HD11      LEU  14   2.947  10.296  10.296
   93   2HD1  LEU  14          HD12      LEU  14   1.706   9.547   9.547
   94   3HD1  LEU  14          HD13      LEU  14   3.380   9.029   9.029
   95   1HD2  LEU  14          HD21      LEU  14   3.333  10.978  10.978
   96   2HD2  LEU  14          HD22      LEU  14   3.612   9.411   9.411
   97   3HD2  LEU  14          HD23      LEU  14   1.971   9.966   9.966
   98    H    PHE  15           HN       PHE  15   0.516  13.799  13.799
   99    HA   PHE  15           HA       PHE  15   0.022  16.184  16.184
  100   1HB   PHE  15           HB1      PHE  15   0.828  16.436  16.436
  101   2HB   PHE  15           HB2      PHE  15  -0.018  15.047  15.047
  102    HD1  PHE  15           HD1      PHE  15  -2.243  15.222  15.222
  103    HD2  PHE  15           HD2      PHE  15  -0.100  18.724  18.724
  104    HE1  PHE  15           HE1      PHE  15  -3.758  16.568  16.568
  105    HE2  PHE  15           HE2      PHE  15  -1.630  20.082  20.082
  106    HZ   PHE  15           HZ       PHE  15  -3.457  19.001  19.001
  107    H    CYS  16           HN       MER  16  -2.374  14.049  14.049
  108    HA   CYS  16           HA       MER  16  -4.704  15.516  15.516
  109   1HB   CYS  16           HB1      MER  16  -5.942  13.444  13.444
  110   2HB   CYS  16           HB2      MER  16  -4.541  13.279  13.279
  111    H    SER  17           HN       SER  17  -3.237  13.047  13.047
  112    HA   SER  17           HA       SER  17  -5.017  13.177  13.177
  113   1HB   SER  17           HB1      SER  17  -1.973  12.849  12.849
  114   2HB   SER  17           HB2      SER  17  -3.131  12.461  12.461
  115    HG   SER  17           HG       SER  17  -3.465  10.662  10.662
  116    H    GLU  18           HN       GLU  18  -2.065  15.000  15.000
  117    HA   GLU  18           HA       GLU  18  -1.824  16.597  16.597
  118   1HB   GLU  18           HB1      GLU  18  -0.445  16.628  16.628
  119   2HB   GLU  18           HB2      GLU  18  -1.671  17.634  17.634
  120   1HG   GLU  18           HG1      GLU  18  -1.375  19.380  19.380
  121   2HG   GLU  18           HG2      GLU  18  -0.105  18.419  18.419
  122    H    TYR  19           HN       TYR  19  -4.036  17.376  17.376
  123    HA   TYR  19           HA       TYR  19  -5.569  19.044  19.044
  124   1HB   TYR  19           HB1      TYR  19  -5.636  20.923  20.923
  125   2HB   TYR  19           HB2      TYR  19  -3.960  20.428  20.428
  126    HD1  TYR  19           HD1      TYR  19  -3.298  18.565  18.565
  127    HD2  TYR  19           HD2      TYR  19  -6.284  21.576  21.576
  128    HE1  TYR  19           HE1      TYR  19  -3.180  18.559  18.559
  129    HE2  TYR  19           HE2      TYR  19  -6.168  21.590  21.590
  130    HH   TYR  19           HH       TYR  19  -5.402  20.543  20.543
  131    H    ARG  20           HN       ARG  20  -6.232  16.523  16.523
  132    HA   ARG  20           HA       ARG  20  -8.252  16.590  16.590
  133   1HB   ARG  20           HB1      ARG  20  -7.426  14.434  14.434
  134   2HB   ARG  20           HB2      ARG  20  -7.345  14.687  14.687
  135   1HG   ARG  20           HG1      ARG  20  -9.903  14.515  14.515
  136   2HG   ARG  20           HG2      ARG  20  -9.856  14.191  14.191
  137   1HD   ARG  20           HD1      ARG  20  -9.954  12.133  12.133
  138   2HD   ARG  20           HD2      ARG  20  -8.741  12.096  12.096
  139    HE   ARG  20           HE       ARG  20  -7.035  12.641  12.641
  140   1HH1  ARG  20          HH11      ARG  20 -10.035  11.576  11.576
  141   2HH1  ARG  20          HH12      ARG  20  -9.387  11.594  11.594
  142   1HH2  ARG  20          HH21      ARG  20  -6.305  12.883  12.883
  143   2HH2  ARG  20          HH22      ARG  20  -7.242  12.342  12.342
  144    HA   PRO  21           HA       PRO  21 -11.332  16.746  16.746
  145   1HB   PRO  21           HB1      PRO  21 -10.420  17.741  17.741
  146   2HB   PRO  21           HB2      PRO  21 -10.399  16.023  16.023
  147   1HG   PRO  21           HG1      PRO  21  -8.142  18.057  18.057
  148   2HG   PRO  21           HG2      PRO  21  -8.059  16.524  16.524
  149   1HD   PRO  21           HD1      PRO  21  -7.266  16.554  16.554
  150   2HD   PRO  21           HD2      PRO  21  -8.354  15.227  15.227
  151    H    LYS  22           HN       LYS  22  -8.874  19.118  19.118
  152    HA   LYS  22           HA       LYS  22 -10.452  21.433  21.433
  153   1HB   LYS  22           HB1      LYS  22  -7.852  21.095  21.095
  154   2HB   LYS  22           HB2      LYS  22  -8.551  22.662  22.662
  155   1HG   LYS  22           HG1      LYS  22  -8.556  22.045  22.045
  156   2HG   LYS  22           HG2      LYS  22  -7.738  20.545  20.545
  157   1HD   LYS  22           HD1      LYS  22  -5.822  21.757  21.757
  158   2HD   LYS  22           HD2      LYS  22  -6.645  23.298  23.298
  159   1HE   LYS  22           HE1      LYS  22  -6.732  22.922  22.922
  160   2HE   LYS  22           HE2      LYS  22  -5.817  21.436  21.436
  161   1HZ   LYS  22           HZ1      LYS  22  -4.497  23.484  23.484
  162   2HZ   LYS  22           HZ2      LYS  22  -4.869  24.048  24.048
  163   3HZ   LYS  22           HZ3      LYS  22  -3.979  22.615  22.615
  164    H    ILE  23           HN       ILE  23  -9.985  19.734  19.734
  165    HA   ILE  23           HA       ILE  23 -11.201  22.036  22.036
  166    HB   ILE  23           HB       ILE  23 -11.072  20.465  20.465
  167   1HG1  ILE  23          HG11      ILE  23  -9.236  18.747  18.747
  168   2HG1  ILE  23          HG12      ILE  23 -10.900  18.284  18.284
  169   1HG2  ILE  23          HG21      ILE  23  -9.402  22.227  22.227
  170   2HG2  ILE  23          HG22      ILE  23  -8.500  21.135  21.135
  171   3HG2  ILE  23          HG23      ILE  23  -8.597  20.829  20.829
  172   1HD1  ILE  23          HD11      ILE  23 -10.467  18.334  18.334
  173   2HD1  ILE  23          HD12      ILE  23  -8.785  18.729  18.729
  174   3HD1  ILE  23          HD13      ILE  23  -9.437  17.190  17.190
  175    H    LYS  24           HN       LYS  24 -11.846  18.837  18.837
  176    HA   LYS  24           HA       LYS  24 -14.401  18.405  18.405
  177   1HB   LYS  24           HB1      LYS  24 -12.741  16.816  16.816
  178   2HB   LYS  24           HB2      LYS  24 -13.081  17.509  17.509
  179   1HG   LYS  24           HG1      LYS  24 -15.627  16.729  16.729
  180   2HG   LYS  24           HG2      LYS  24 -14.553  15.358  15.358
  181   1HD   LYS  24           HD1      LYS  24 -15.375  16.957  16.957
  182   2HD   LYS  24           HD2      LYS  24 -15.954  15.356  15.356
  183   1HE   LYS  24           HE1      LYS  24 -13.136  16.153  16.153
  184   2HE   LYS  24           HE2      LYS  24 -14.225  15.124  15.124
  185   1HZ   LYS  24           HZ1      LYS  24 -13.895  14.003  14.003
  186   2HZ   LYS  24           HZ2      LYS  24 -12.359  14.406  14.406
  187   3HZ   LYS  24           HZ3      LYS  24 -13.379  13.397  13.397
  188    H    GLY  25           HN       GLY  25 -13.243  20.102  20.102
  189   1HA   GLY  25           HA1      GLY  25 -15.727  20.458  20.458
  190   2HA   GLY  25           HA2      GLY  25 -14.233  21.351  21.351
  191    H    GLU  26           HN       GLU  26 -13.784  22.640  22.640
  192    HA   GLU  26           HA       GLU  26 -15.682  24.790  24.790
  193   1HB   GLU  26           HB1      GLU  26 -13.478  24.294  24.294
  194   2HB   GLU  26           HB2      GLU  26 -14.297  25.824  25.824
  195   1HG   GLU  26           HG1      GLU  26 -13.489  25.492  25.492
  196   2HG   GLU  26           HG2      GLU  26 -12.377  24.356  24.356
  197    H    HIS  27           HN       HIS  27 -15.145  22.172  22.172
  198    HA   HIS  27           HA       HIS  27 -17.502  23.046  23.046
  199   1HB   HIS  27           HB1      HIS  27 -15.048  21.488  21.488
  200   2HB   HIS  27           HB2      HIS  27 -16.348  22.125  22.125
  201    HD1  HIS  27           HD1      HIS  27 -16.512  24.814  24.814
  202    HD2  HIS  27           HD2      HIS  27 -13.051  23.324  23.324
  203    HE1  HIS  27           HE1      HIS  27 -14.940  26.708  26.708
  204    HA   PRO  28           HA       PRO  28 -18.784  18.913  18.913
  205   1HB   PRO  28           HB1      PRO  28 -20.936  19.630  19.630
  206   2HB   PRO  28           HB2      PRO  28 -19.317  19.830  19.830
  207   1HG   PRO  28           HG1      PRO  28 -20.994  21.944  21.944
  208   2HG   PRO  28           HG2      PRO  28 -20.256  22.074  22.074
  209   1HD   PRO  28           HD1      PRO  28 -18.963  23.013  23.013
  210   2HD   PRO  28           HD2      PRO  28 -18.042  22.330  22.330
  211    H    GLY  29           HN       GLY  29 -18.808  20.006  20.006
  212   1HA   GLY  29           HA1      GLY  29 -21.533  19.668  19.668
  213   2HA   GLY  29           HA2      GLY  29 -20.390  20.853  20.853
  214    H    LEU  30           HN       LEU  30 -18.107  19.134  19.134
  215    HA   LEU  30           HA       LEU  30 -17.973  17.736  17.736
  216   1HB   LEU  30           HB1      LEU  30 -16.188  17.504  17.504
  217   2HB   LEU  30           HB2      LEU  30 -15.699  17.066  17.066
  218    HG   LEU  30           HG       LEU  30 -16.225  19.816  19.816
  219   1HD1  LEU  30          HD11      LEU  30 -13.746  18.548  18.548
  220   2HD1  LEU  30          HD12      LEU  30 -13.842  20.202  20.202
  221   3HD1  LEU  30          HD13      LEU  30 -14.025  18.870  18.870
  222   1HD2  LEU  30          HD21      LEU  30 -17.124  19.801  19.801
  223   2HD2  LEU  30          HD22      LEU  30 -15.688  20.792  20.792
  224   3HD2  LEU  30          HD23      LEU  30 -15.580  19.197  19.197
  225    H    SER  31           HN       SER  31 -17.328  15.503  15.503
  226    HA   SER  31           HA       SER  31 -18.708  13.644  13.644
  227   1HB   SER  31           HB1      SER  31 -19.692  13.841  13.841
  228   2HB   SER  31           HB2      SER  31 -18.163  13.133  13.133
  229    HG   SER  31           HG       SER  31 -19.022  11.769  11.769
  230    H    ILE  32           HN       ILE  32 -17.616  11.379  11.379
  231    HA   ILE  32           HA       ILE  32 -14.862  11.664  11.664
  232    HB   ILE  32           HB       ILE  32 -16.426   9.834   9.834
  233   1HG1  ILE  32          HG11      ILE  32 -14.916   7.870   7.870
  234   2HG1  ILE  32          HG12      ILE  32 -14.035   8.654   8.654
  235   1HG2  ILE  32          HG21      ILE  32 -16.258   8.910   8.910
  236   2HG2  ILE  32          HG22      ILE  32 -17.000   7.987   7.987
  237   3HG2  ILE  32          HG23      ILE  32 -17.678   9.531   9.531
  238   1HD1  ILE  32          HD11      ILE  32 -14.165   9.621   9.621
  239   2HD1  ILE  32          HD12      ILE  32 -12.797   8.826   8.826
  240   3HD1  ILE  32          HD13      ILE  32 -13.280  10.425  10.425
  241    H    GLY  33           HN       GLY  33 -16.294  11.957  11.957
  242   1HA   GLY  33           HA1      GLY  33 -13.917  11.103  11.103
  243   2HA   GLY  33           HA2      GLY  33 -15.539  11.328  11.328
  244    H    ASP  34           HN       ASP  34 -15.158  13.818  13.818
  245    HA   ASP  34           HA       ASP  34 -14.097  15.645  15.645
  246   1HB   ASP  34           HB1      ASP  34 -16.044  16.132  16.132
  247   2HB   ASP  34           HB2      ASP  34 -15.508  17.410  17.410
  248    H    VAL  35           HN       VAL  35 -14.373  14.959  14.959
  249    HA   VAL  35           HA       VAL  35 -12.417  16.811  16.811
  250    HB   VAL  35           HB       VAL  35 -13.258  14.031  14.031
  251   1HG1  VAL  35          HG11      VAL  35 -11.697  16.229  16.229
  252   2HG1  VAL  35          HG12      VAL  35 -12.271  14.745  14.745
  253   3HG1  VAL  35          HG13      VAL  35 -11.036  14.683  14.683
  254   1HG2  VAL  35          HG21      VAL  35 -14.140  16.791  16.791
  255   2HG2  VAL  35          HG22      VAL  35 -15.115  15.627  15.627
  256   3HG2  VAL  35          HG23      VAL  35 -14.597  15.272  15.272
  257    H    ALA  36           HN       ALA  36 -12.384  13.741  13.741
  258    HA   ALA  36           HA       ALA  36  -9.543  13.277  13.277
  259   1HB   ALA  36           HB1      ALA  36 -11.173  11.454  11.454
  260   2HB   ALA  36           HB2      ALA  36 -11.742  11.856  11.856
  261   3HB   ALA  36           HB3      ALA  36 -10.131  11.176  11.176
  262    H    LYS  37           HN       LYS  37 -11.731  13.988  13.988
  263    HA   LYS  37           HA       LYS  37  -9.417  14.123  14.123
  264   1HB   LYS  37           HB1      LYS  37 -12.307  14.829  14.829
  265   2HB   LYS  37           HB2      LYS  37 -11.113  15.249  15.249
  266   1HG   LYS  37           HG1      LYS  37 -10.434  12.846  12.846
  267   2HG   LYS  37           HG2      LYS  37 -11.700  12.447  12.447
  268   1HD   LYS  37           HD1      LYS  37 -12.471  12.094  12.094
  269   2HD   LYS  37           HD2      LYS  37 -13.410  13.353  13.353
  270   1HE   LYS  37           HE1      LYS  37 -12.182  15.118  15.118
  271   2HE   LYS  37           HE2      LYS  37 -11.020  13.966  13.966
  272   1HZ   LYS  37           HZ1      LYS  37 -13.611  13.156  13.156
  273   2HZ   LYS  37           HZ2      LYS  37 -13.439  14.805  14.805
  274   3HZ   LYS  37           HZ3      LYS  37 -12.343  13.675  13.675
  275    H    LYS  38           HN       LYS  38 -10.713  16.403  16.403
  276    HA   LYS  38           HA       LYS  38  -9.856  18.682  18.682
  277   1HB   LYS  38           HB1      LYS  38 -12.011  18.725  18.725
  278   2HB   LYS  38           HB2      LYS  38 -11.048  18.591  18.591
  279   1HG   LYS  38           HG1      LYS  38 -10.112  20.684  20.684
  280   2HG   LYS  38           HG2      LYS  38 -10.388  20.815  20.815
  281   1HD   LYS  38           HD1      LYS  38 -12.590  20.854  20.854
  282   2HD   LYS  38           HD2      LYS  38 -11.884  22.291  22.291
  283   1HE   LYS  38           HE1      LYS  38 -13.409  20.131  20.131
  284   2HE   LYS  38           HE2      LYS  38 -13.988  21.737  21.737
  285   1HZ   LYS  38           HZ1      LYS  38 -11.521  22.043  22.043
  286   2HZ   LYS  38           HZ2      LYS  38 -12.411  20.941  20.941
  287   3HZ   LYS  38           HZ3      LYS  38 -13.051  22.475  22.475
  288    H    LEU  39           HN       LEU  39  -9.359  17.097  17.097
  289    HA   LEU  39           HA       LEU  39  -6.994  18.491  18.491
  290   1HB   LEU  39           HB1      LEU  39  -8.409  17.188  17.188
  291   2HB   LEU  39           HB2      LEU  39  -8.130  15.760  15.760
  292    HG   LEU  39           HG       LEU  39  -5.917  15.751  15.751
  293   1HD1  LEU  39          HD11      LEU  39  -6.451  17.985  17.985
  294   2HD1  LEU  39          HD12      LEU  39  -4.938  17.101  17.101
  295   3HD1  LEU  39          HD13      LEU  39  -5.440  18.120  18.120
  296   1HD2  LEU  39          HD21      LEU  39  -7.679  15.851  15.851
  297   2HD2  LEU  39          HD22      LEU  39  -7.454  14.442  14.442
  298   3HD2  LEU  39          HD23      LEU  39  -6.128  15.067  15.067
  299    H    GLY  40           HN       GLY  40  -7.477  15.410  15.410
  300   1HA   GLY  40           HA1      GLY  40  -4.850  14.684  14.684
  301   2HA   GLY  40           HA2      GLY  40  -6.231  14.215  14.215
  302    H    GLU  41           HN       GLU  41  -6.947  16.846  16.846
  303    HA   GLU  41           HA       GLU  41  -5.130  17.094  17.094
  304   1HB   GLU  41           HB1      GLU  41  -7.386  18.719  18.719
  305   2HB   GLU  41           HB2      GLU  41  -6.489  19.320  19.320
  306   1HG   GLU  41           HG1      GLU  41  -7.037  17.401  17.401
  307   2HG   GLU  41           HG2      GLU  41  -7.666  16.503  16.503
  308    H    MET  42           HN       MET  42  -5.767  19.123  19.123
  309    HA   MET  42           HA       MET  42  -3.790  21.078  21.078
  310   1HB   MET  42           HB1      MET  42  -4.788  19.978  19.978
  311   2HB   MET  42           HB2      MET  42  -3.788  21.430  21.430
  312   1HG   MET  42           HG1      MET  42  -5.616  22.117  22.117
  313   2HG   MET  42           HG2      MET  42  -6.564  20.922  20.922
  314   1HE   MET  42           HE1      MET  42  -8.444  22.008  22.008
  315   2HE   MET  42           HE2      MET  42  -8.114  21.327  21.327
  316   3HE   MET  42           HE3      MET  42  -8.731  22.974  22.974
  317    H    TRP  43           HN       TRP  43  -3.548  17.967  17.967
  318    HA   TRP  43           HA       TRP  43  -0.915  18.063  18.063
  319   1HB   TRP  43           HB1      TRP  43  -2.193  16.120  16.120
  320   2HB   TRP  43           HB2      TRP  43  -2.604  15.849  15.849
  321    HD1  TRP  43           HD1      TRP  43  -1.047  14.312  14.312
  322    HE1  TRP  43           HE1      TRP  43   1.161  13.310  13.310
  323    HE3  TRP  43           HE3      TRP  43  -0.079  16.664  16.664
  324    HZ2  TRP  43           HZ2      TRP  43   3.209  13.398  13.398
  325    HZ3  TRP  43           HZ3      TRP  43   1.981  16.208  16.208
  326    HH2  TRP  43           HH2      TRP  43   3.639  14.577  14.577
  327    H    ASN  44           HN       ASN  44  -2.147  17.367  17.367
  328    HA   ASN  44           HA       ASN  44   0.477  16.965  16.965
  329   1HB   ASN  44           HB1      ASN  44  -2.191  17.455  17.455
  330   2HB   ASN  44           HB2      ASN  44  -0.728  16.866  16.866
  331   1HD2  ASN  44          HD21      ASN  44  -3.151  14.185  14.185
  332   2HD2  ASN  44          HD22      ASN  44  -3.604  15.752  15.752
  333    H    ASN  45           HN       ASN  45  -0.524  19.552  19.552
  334    HA   ASN  45           HA       ASN  45   0.932  21.448  21.448
  335   1HB   ASN  45           HB1      ASN  45  -1.887  22.142  22.142
  336   2HB   ASN  45           HB2      ASN  45  -0.866  23.096  23.096
  337   1HD2  ASN  45          HD21      ASN  45  -3.421  20.442  20.442
  338   2HD2  ASN  45          HD22      ASN  45  -3.388  20.916  20.916
  339    H    THR  46           HN       THR  46   1.269  20.153  20.153
  340    HA   THR  46           HA       THR  46   0.557  22.183  22.183
  341    HB   THR  46           HB       THR  46   0.821  19.805  19.805
  342    HG1  THR  46           HG1      THR  46   2.939  20.795  20.795
  343   1HG2  THR  46          HG21      THR  46   3.834  20.130  20.130
  344   2HG2  THR  46          HG22      THR  46   3.028  18.765  18.765
  345   3HG2  THR  46          HG23      THR  46   2.780  19.111  19.111
  346    H    ALA  47           HN       ALA  47   3.487  21.182  21.182
  347    HA   ALA  47           HA       ALA  47   4.627  23.745  23.745
  348   1HB   ALA  47           HB1      ALA  47   5.009  23.655  23.655
  349   2HB   ALA  47           HB2      ALA  47   5.872  22.146  22.146
  350   3HB   ALA  47           HB3      ALA  47   6.516  23.640  23.640
  351    H    ALA  48           HN       ALA  48   5.370  20.558  20.558
  352    HA   ALA  48           HA       ALA  48   6.049  18.708  18.708
  353   1HB   ALA  48           HB1      ALA  48   6.333  20.109  20.109
  354   2HB   ALA  48           HB2      ALA  48   7.827  20.761  20.761
  355   3HB   ALA  48           HB3      ALA  48   7.695  19.048  19.048
  356    H    ASP  49           HN       ASP  49   7.762  21.482  21.482
  357    HA   ASP  49           HA       ASP  49  10.074  20.028  20.028
  358   1HB   ASP  49           HB1      ASP  49   9.269  22.944  22.944
  359   2HB   ASP  49           HB2      ASP  49  10.862  22.265  22.265
  360    H    ASP  50           HN       ASP  50   7.046  20.092  20.092
  361    HA   ASP  50           HA       ASP  50   7.460  20.103  20.103
  362   1HB   ASP  50           HB1      ASP  50   5.093  21.018  21.018
  363   2HB   ASP  50           HB2      ASP  50   4.891  20.584  20.584
  364    H    LYS  51           HN       LYS  51   6.646  18.435  18.435
  365    HA   LYS  51           HA       LYS  51   5.069  16.340  16.340
  366   1HB   LYS  51           HB1      LYS  51   6.370  16.292  16.292
  367   2HB   LYS  51           HB2      LYS  51   5.325  15.052  15.052
  368   1HG   LYS  51           HG1      LYS  51   3.604  16.966  16.966
  369   2HG   LYS  51           HG2      LYS  51   4.628  17.854  17.854
  370   1HD   LYS  51           HD1      LYS  51   4.281  15.209  15.209
  371   2HD   LYS  51           HD2      LYS  51   2.729  15.713  15.713
  372   1HE   LYS  51           HE1      LYS  51   2.787  16.364  16.364
  373   2HE   LYS  51           HE2      LYS  51   2.886  17.810  17.810
  374   1HZ   LYS  51           HZ1      LYS  51   5.481  16.924  16.924
  375   2HZ   LYS  51           HZ2      LYS  51   4.678  16.945  16.945
  376   3HZ   LYS  51           HZ3      LYS  51   4.747  18.353  18.353
  377    H    GLN  52           HN       GLN  52   8.194  16.662  16.662
  378    HA   GLN  52           HA       GLN  52   9.546  14.462  14.462
  379   1HB   GLN  52           HB1      GLN  52  10.317  17.134  17.134
  380   2HB   GLN  52           HB2      GLN  52  11.012  16.632  16.632
  381   1HG   GLN  52           HG1      GLN  52  12.691  16.288  16.288
  382   2HG   GLN  52           HG2      GLN  52  12.142  14.710  14.710
  383   1HE2  GLN  52          HE21      GLN  52  10.131  15.247  15.247
  384   2HE2  GLN  52          HE22      GLN  52   9.641  15.912  15.912
  385    HA   PRO  53           HA       PRO  53  10.426  14.379  14.379
  386   1HB   PRO  53           HB1      PRO  53   8.494  15.677  15.677
  387   2HB   PRO  53           HB2      PRO  53  10.047  16.370  16.370
  388   1HG   PRO  53           HG1      PRO  53   7.401  16.621  16.621
  389   2HG   PRO  53           HG2      PRO  53   8.435  17.937  17.937
  390   1HD   PRO  53           HD1      PRO  53   8.765  17.185  17.185
  391   2HD   PRO  53           HD2      PRO  53  10.237  17.278  17.278
  392    H    TYR  54           HN       TYR  54   7.058  14.724  14.724
  393    HA   TYR  54           HA       TYR  54   6.122  12.432  12.432
  394   1HB   TYR  54           HB1      TYR  54   4.799  14.033  14.033
  395   2HB   TYR  54           HB2      TYR  54   3.951  12.915  12.915
  396    HD1  TYR  54           HD1      TYR  54   4.773  13.450  13.450
  397    HD2  TYR  54           HD2      TYR  54   4.298  16.238  16.238
  398    HE1  TYR  54           HE1      TYR  54   4.420  15.244  15.244
  399    HE2  TYR  54           HE2      TYR  54   3.949  18.035  18.035
  400    HH   TYR  54           HH       TYR  54   3.765  17.372  17.372
  401    H    GLU  55           HN       GLU  55   6.551  13.128  13.128
  402    HA   GLU  55           HA       GLU  55   5.758  10.682  10.682
  403   1HB   GLU  55           HB1      GLU  55   6.873  13.127  13.127
  404   2HB   GLU  55           HB2      GLU  55   8.048  11.940  11.940
  405   1HG   GLU  55           HG1      GLU  55   6.139  10.616  10.616
  406   2HG   GLU  55           HG2      GLU  55   5.083  11.959  11.959
  407    H    LYS  56           HN       LYS  56   9.071  11.670  11.670
  408    HA   LYS  56           HA       LYS  56  10.282   9.185   9.185
  409   1HB   LYS  56           HB1      LYS  56  11.424  11.443  11.443
  410   2HB   LYS  56           HB2      LYS  56  11.194  11.296  11.296
  411   1HG   LYS  56           HG1      LYS  56  12.590   9.284   9.284
  412   2HG   LYS  56           HG2      LYS  56  12.688   9.238   9.238
  413   1HD   LYS  56           HD1      LYS  56  13.827  11.492  11.492
  414   2HD   LYS  56           HD2      LYS  56  13.797  11.439  11.439
  415   1HE   LYS  56           HE1      LYS  56  15.188   9.384   9.384
  416   2HE   LYS  56           HE2      LYS  56  15.992  10.683  10.683
  417   1HZ   LYS  56           HZ1      LYS  56  14.391   9.307   9.307
  418   2HZ   LYS  56           HZ2      LYS  56  15.281   8.158   8.158
  419   3HZ   LYS  56           HZ3      LYS  56  16.086   9.406   9.406
  420    H    LYS  57           HN       LYS  57   8.444  10.314  10.314
  421    HA   LYS  57           HA       LYS  57   9.430   8.322   8.322
  422   1HB   LYS  57           HB1      LYS  57   7.925  10.554  10.554
  423   2HB   LYS  57           HB2      LYS  57   6.604   9.416   9.416
  424   1HG   LYS  57           HG1      LYS  57   7.654   7.987   7.987
  425   2HG   LYS  57           HG2      LYS  57   8.943   9.166   9.166
  426   1HD   LYS  57           HD1      LYS  57   7.111  10.905  10.905
  427   2HD   LYS  57           HD2      LYS  57   5.992   9.555   9.555
  428   1HE   LYS  57           HE1      LYS  57   8.503   9.932   9.932
  429   2HE   LYS  57           HE2      LYS  57   6.846  10.080  10.080
  430   1HZ   LYS  57           HZ1      LYS  57   7.142   7.590   7.590
  431   2HZ   LYS  57           HZ2      LYS  57   8.417   7.790   7.790
  432   3HZ   LYS  57           HZ3      LYS  57   6.809   7.931   7.931
  433    H    ALA  58           HN       ALA  58   6.421   8.665   8.665
  434    HA   ALA  58           HA       ALA  58   5.196   6.207   6.207
  435   1HB   ALA  58           HB1      ALA  58   4.269   8.025   8.025
  436   2HB   ALA  58           HB2      ALA  58   5.495   7.697   7.697
  437   3HB   ALA  58           HB3      ALA  58   4.267   6.494   6.494
  438    H    ALA  59           HN       ALA  59   7.648   7.001   7.001
  439    HA   ALA  59           HA       ALA  59   8.074   4.521   4.521
  440   1HB   ALA  59           HB1      ALA  59  10.174   6.615   6.615
  441   2HB   ALA  59           HB2      ALA  59  10.382   5.360   5.360
  442   3HB   ALA  59           HB3      ALA  59   9.182   6.619   6.619
  443    H    LYS  60           HN       LYS  60   9.972   5.784   5.784
  444    HA   LYS  60           HA       LYS  60  11.482   3.573   3.573
  445   1HB   LYS  60           HB1      LYS  60  11.591   5.902   5.902
  446   2HB   LYS  60           HB2      LYS  60  10.206   5.495   5.495
  447   1HG   LYS  60           HG1      LYS  60  11.464   3.623   3.623
  448   2HG   LYS  60           HG2      LYS  60  12.821   3.938   3.938
  449   1HD   LYS  60           HD1      LYS  60  12.971   6.271   6.271
  450   2HD   LYS  60           HD2      LYS  60  11.712   5.807   5.807
  451   1HE   LYS  60           HE1      LYS  60  13.923   5.497   5.497
  452   2HE   LYS  60           HE2      LYS  60  13.171   3.925   3.925
  453   1HZ   LYS  60           HZ1      LYS  60  14.599   4.575   4.575
  454   2HZ   LYS  60           HZ2      LYS  60  15.615   4.850   4.850
  455   3HZ   LYS  60           HZ3      LYS  60  14.899   3.326   3.326
  456    H    LEU  61           HN       LEU  61   8.178   4.285   4.285
  457    HA   LEU  61           HA       LEU  61   7.995   1.908   1.908
  458   1HB   LEU  61           HB1      LEU  61   5.749   3.513   3.513
  459   2HB   LEU  61           HB2      LEU  61   5.580   2.442   2.442
  460    HG   LEU  61           HG       LEU  61   7.183   5.042   5.042
  461   1HD1  LEU  61          HD11      LEU  61   4.809   5.326   5.326
  462   2HD1  LEU  61          HD12      LEU  61   4.846   4.217   4.217
  463   3HD1  LEU  61          HD13      LEU  61   5.700   5.758   5.758
  464   1HD2  LEU  61          HD21      LEU  61   7.176   3.061   3.061
  465   2HD2  LEU  61          HD22      LEU  61   8.555   3.446   3.446
  466   3HD2  LEU  61          HD23      LEU  61   7.883   4.673   4.673
  467    H    LYS  62           HN       LYS  62   6.763   2.536   2.536
  468    HA   LYS  62           HA       LYS  62   5.759  -0.053  -0.053
  469   1HB   LYS  62           HB1      LYS  62   5.904   1.987   1.987
  470   2HB   LYS  62           HB2      LYS  62   7.460   1.302   1.302
  471   1HG   LYS  62           HG1      LYS  62   5.740  -0.966  -0.966
  472   2HG   LYS  62           HG2      LYS  62   4.713   0.264   0.264
  473   1HD   LYS  62           HD1      LYS  62   7.391  -0.626  -0.626
  474   2HD   LYS  62           HD2      LYS  62   5.817  -1.065  -1.065
  475   1HE   LYS  62           HE1      LYS  62   5.365   1.408   1.408
  476   2HE   LYS  62           HE2      LYS  62   7.045   1.720   1.720
  477   1HZ   LYS  62           HZ1      LYS  62   6.963  -0.378  -0.378
  478   2HZ   LYS  62           HZ2      LYS  62   6.032   0.907   0.907
  479   3HZ   LYS  62           HZ3      LYS  62   7.655   1.163   1.163
  480    H    GLU  63           HN       GLU  63   9.072   1.111   1.111
  481    HA   GLU  63           HA       GLU  63  10.374  -1.208  -1.208
  482   1HB   GLU  63           HB1      GLU  63  11.423   1.113   1.113
  483   2HB   GLU  63           HB2      GLU  63  11.382   0.845   0.845
  484   1HG   GLU  63           HG1      GLU  63  12.924  -1.133  -1.133
  485   2HG   GLU  63           HG2      GLU  63  13.011  -0.772  -0.772
  486    H    LYS  64           HN       LYS  64   9.786  -0.135  -0.135
  487    HA   LYS  64           HA       LYS  64  10.768  -2.324  -2.324
  488   1HB   LYS  64           HB1      LYS  64   9.663  -0.014  -0.014
  489   2HB   LYS  64           HB2      LYS  64   8.177  -0.928  -0.928
  490   1HG   LYS  64           HG1      LYS  64   9.112  -0.872  -0.872
  491   2HG   LYS  64           HG2      LYS  64   9.249  -2.514  -2.514
  492   1HD   LYS  64           HD1      LYS  64  11.603  -2.288  -2.288
  493   2HD   LYS  64           HD2      LYS  64  11.542  -0.536  -0.536
  494   1HE   LYS  64           HE1      LYS  64  12.544  -1.490  -1.490
  495   2HE   LYS  64           HE2      LYS  64  11.051  -0.643  -0.643
  496   1HZ   LYS  64           HZ1      LYS  64  10.428  -3.302  -3.302
  497   2HZ   LYS  64           HZ2      LYS  64  11.705  -3.301  -3.301
  498   3HZ   LYS  64           HZ3      LYS  64  10.262  -2.482  -2.482
  499    H    TYR  65           HN       TYR  65   7.537  -1.818  -1.818
  500    HA   TYR  65           HA       TYR  65   6.215  -4.148  -4.148
  501   1HB   TYR  65           HB1      TYR  65   4.958  -2.280  -2.280
  502   2HB   TYR  65           HB2      TYR  65   5.976  -1.977  -1.977
  503    HD1  TYR  65           HD1      TYR  65   5.764  -3.376  -3.376
  504    HD2  TYR  65           HD2      TYR  65   2.904  -3.555  -3.555
  505    HE1  TYR  65           HE1      TYR  65   4.167  -4.359  -4.359
  506    HE2  TYR  65           HE2      TYR  65   1.289  -4.533  -4.533
  507    HH   TYR  65           HH       TYR  65   2.040  -4.988  -4.988
  508    H    GLU  66           HN       GLU  66   7.738  -3.463  -3.463
  509    HA   GLU  66           HA       GLU  66   7.496  -5.902  -5.902
  510   1HB   GLU  66           HB1      GLU  66   9.909  -4.133  -4.133
  511   2HB   GLU  66           HB2      GLU  66   9.509  -5.390  -5.390
  512   1HG   GLU  66           HG1      GLU  66   7.169  -3.746  -3.746
  513   2HG   GLU  66           HG2      GLU  66   8.530  -2.645  -2.645
  514    H    LYS  67           HN       LYS  67   9.681  -5.125  -5.125
  515    HA   LYS  67           HA       LYS  67  11.434  -7.380  -7.380
  516   1HB   LYS  67           HB1      LYS  67  11.291  -5.228  -5.228
  517   2HB   LYS  67           HB2      LYS  67  12.058  -6.707  -6.707
  518   1HG   LYS  67           HG1      LYS  67  13.724  -5.252  -5.252
  519   2HG   LYS  67           HG2      LYS  67  13.575  -6.574  -6.574
  520   1HD   LYS  67           HD1      LYS  67  12.165  -5.089  -5.089
  521   2HD   LYS  67           HD2      LYS  67  12.391  -3.792  -3.792
  522   1HE   LYS  67           HE1      LYS  67  14.671  -5.170  -5.170
  523   2HE   LYS  67           HE2      LYS  67  13.991  -3.608  -3.608
  524   1HZ   LYS  67           HZ1      LYS  67  14.553  -3.567  -3.567
  525   2HZ   LYS  67           HZ2      LYS  67  15.921  -4.183  -4.183
  526   3HZ   LYS  67           HZ3      LYS  67  15.287  -2.671  -2.671
  527    H    ASP  68           HN       ASP  68   8.870  -6.796  -6.796
  528    HA   ASP  68           HA       ASP  68   9.170  -9.353  -9.353
  529   1HB   ASP  68           HB1      ASP  68   7.276  -7.011  -7.011
  530   2HB   ASP  68           HB2      ASP  68   7.005  -8.521  -8.521
  531    H    ILE  69           HN       ILE  69   7.571  -8.035  -8.035
  532    HA   ILE  69           HA       ILE  69   5.500 -10.157 -10.157
  533    HB   ILE  69           HB       ILE  69   5.238  -7.684  -7.684
  534   1HG1  ILE  69          HG11      ILE  69   3.409  -8.885  -8.885
  535   2HG1  ILE  69          HG12      ILE  69   3.766  -8.441  -8.441
  536   1HG2  ILE  69          HG21      ILE  69   7.161  -7.680  -7.680
  537   2HG2  ILE  69          HG22      ILE  69   6.463  -8.859  -8.859
  538   3HG2  ILE  69          HG23      ILE  69   5.728  -7.262  -7.262
  539   1HD1  ILE  69          HD11      ILE  69   4.842 -10.724 -10.724
  540   2HD1  ILE  69          HD12      ILE  69   4.327 -11.168 -11.168
  541   3HD1  ILE  69          HD13      ILE  69   3.134 -10.844 -10.844
  542    H    ALA  70           HN       ALA  70   8.381  -9.118  -9.118
  543    HA   ALA  70           HA       ALA  70   8.517 -11.350 -11.350
  544   1HB   ALA  70           HB1      ALA  70  10.766  -9.562  -9.562
  545   2HB   ALA  70           HB2      ALA  70  10.874 -10.638 -10.638
  546   3HB   ALA  70           HB3      ALA  70   9.795  -9.261  -9.261
  547    H    ALA  71           HN       ALA  71   9.210 -10.891 -10.891
  548    HA   ALA  71           HA       ALA  71  11.100 -13.087 -13.087
  549   1HB   ALA  71           HB1      ALA  71   9.463 -11.601 -11.601
  550   2HB   ALA  71           HB2      ALA  71  10.753 -12.740 -12.740
  551   3HB   ALA  71           HB3      ALA  71  11.120 -11.218 -11.218
  552    H    TYR  72           HN       TYR  72   7.703 -12.386 -12.386
  553    HA   TYR  72           HA       TYR  72   6.998 -14.965 -14.965
  554   1HB   TYR  72           HB1      TYR  72   5.529 -12.635 -12.635
  555   2HB   TYR  72           HB2      TYR  72   4.648 -14.141 -14.141
  556    HD1  TYR  72           HD1      TYR  72   7.255 -12.473 -12.473
  557    HD2  TYR  72           HD2      TYR  72   3.296 -14.021 -14.021
  558    HE1  TYR  72           HE1      TYR  72   6.916 -11.954 -11.954
  559    HE2  TYR  72           HE2      TYR  72   2.958 -13.509 -13.509
  560    HH   TYR  72           HH       TYR  72   5.473 -11.900 -11.900
  561    H    ARG  73           HN       ARG  73   6.839 -13.616 -13.616
  562    HA   ARG  73           HA       ARG  73   5.743 -15.888 -15.888
  563   1HB   ARG  73           HB1      ARG  73   7.331 -13.475 -13.475
  564   2HB   ARG  73           HB2      ARG  73   6.757 -14.672 -14.672
  565   1HG   ARG  73           HG1      ARG  73   4.873 -13.277 -13.277
  566   2HG   ARG  73           HG2      ARG  73   5.255 -12.589 -12.589
  567   1HD   ARG  73           HD1      ARG  73   4.038 -15.368 -15.368
  568   2HD   ARG  73           HD2      ARG  73   3.153 -13.936 -13.936
  569    HE   ARG  73           HE       ARG  73   5.369 -15.183 -15.183
  570   1HH1  ARG  73          HH11      ARG  73   3.678 -12.409 -12.409
  571   2HH1  ARG  73          HH12      ARG  73   2.875 -12.679 -12.679
  572   1HH2  ARG  73          HH21      ARG  73   3.843 -16.048 -16.048
  573   2HH2  ARG  73          HH22      ARG  73   2.971 -14.800 -14.800
  574    H    ALA  74           HN       ALA  74   8.841 -15.030 -15.030
  575    HA   ALA  74           HA       ALA  74  10.231 -17.048 -17.048
  576   1HB   ALA  74           HB1      ALA  74  11.179 -15.037 -15.037
  577   2HB   ALA  74           HB2      ALA  74  12.252 -16.057 -16.057
  578   3HB   ALA  74           HB3      ALA  74  11.242 -14.860 -14.860
  579    H    LYS  75           HN       LYS  75   8.370 -18.171 -18.171
  580    HA   LYS  75           HA       LYS  75   8.057 -19.883 -19.883
  581   1HB   LYS  75           HB1      LYS  75  10.078 -20.746 -20.746
  582   2HB   LYS  75           HB2      LYS  75  11.116 -20.217 -20.217
  583   1HG   LYS  75           HG1      LYS  75  10.810 -22.409 -22.409
  584   2HG   LYS  75           HG2      LYS  75   9.427 -21.696 -21.696
  585   1HD   LYS  75           HD1      LYS  75   7.937 -22.298 -22.298
  586   2HD   LYS  75           HD2      LYS  75   9.275 -22.943 -22.943
  587   1HE   LYS  75           HE1      LYS  75   8.249 -24.039 -24.039
  588   2HE   LYS  75           HE2      LYS  75   8.070 -24.767 -24.767
  589   1HZ   LYS  75           HZ1      LYS  75  10.779 -24.331 -24.331
  590   2HZ   LYS  75           HZ2      LYS  75  10.229 -25.010 -25.010
  591   3HZ   LYS  75           HZ3      LYS  75   9.945 -25.812 -25.812
  592    H    GLY  76           HN       GLY  76   7.965 -17.469 -17.469
  593   1HA   GLY  76           HA1      GLY  76   9.668 -17.299 -17.299
  594   2HA   GLY  76           HA2      GLY  76   8.708 -15.985 -15.985
  595    H    LYS  77           HN       LYS  77   8.217 -19.276 -19.276
  596    HA   LYS  77           HA       LYS  77   5.778 -18.523 -18.523
  597   1HB   LYS  77           HB1      LYS  77   6.453 -21.192 -21.192
  598   2HB   LYS  77           HB2      LYS  77   5.035 -20.896 -20.896
  599   1HG   LYS  77           HG1      LYS  77   5.791 -19.378 -19.378
  600   2HG   LYS  77           HG2      LYS  77   4.614 -20.682 -20.682
  601   1HD   LYS  77           HD1      LYS  77   3.373 -19.296 -19.296
  602   2HD   LYS  77           HD2      LYS  77   4.474 -17.976 -17.976
  603   1HE   LYS  77           HE1      LYS  77   3.787 -17.893 -17.893
  604   2HE   LYS  77           HE2      LYS  77   2.754 -19.304 -19.304
  605   1HZ   LYS  77           HZ1      LYS  77   2.077 -17.426 -17.426
  606   2HZ   LYS  77           HZ2      LYS  77   2.145 -16.623 -16.623
  607   3HZ   LYS  77           HZ3      LYS  77   1.144 -17.982 -17.982
  608    HA   PRO  78           HA       PRO  78   7.641 -21.917 -21.917
  609   1HB   PRO  78           HB1      PRO  78  10.590 -21.835 -21.835
  610   2HB   PRO  78           HB2      PRO  78   9.577 -23.232 -23.232
  611   1HG   PRO  78           HG1      PRO  78  10.203 -22.796 -22.796
  612   2HG   PRO  78           HG2      PRO  78   8.525 -23.188 -23.188
  613   1HD   PRO  78           HD1      PRO  78   9.746 -20.406 -20.406
  614   2HD   PRO  78           HD2      PRO  78   8.358 -21.076 -21.076
  615    H    ASP  79           HN       ASP  79   9.587 -19.238 -19.238
  616    HA   ASP  79           HA       ASP  79   9.487 -18.266 -18.266
  617   1HB   ASP  79           HB1      ASP  79  12.020 -18.299 -18.299
  618   2HB   ASP  79           HB2      ASP  79  11.885 -17.479 -17.479
  619    H    ALA  80           HN       ALA  80   7.743 -17.118 -17.118
  620    HA   ALA  80           HA       ALA  80   7.023 -15.417 -15.417
  621   1HB   ALA  80           HB1      ALA  80   6.278 -15.108 -15.108
  622   2HB   ALA  80           HB2      ALA  80   7.764 -14.269 -14.269
  623   3HB   ALA  80           HB3      ALA  80   6.630 -13.544 -13.544
  624    H    ALA  81           HN       ALA  81   9.597 -13.873 -13.873
  625    HA   ALA  81           HA       ALA  81  10.644 -12.599 -12.599
  626   1HB   ALA  81           HB1      ALA  81   9.415 -10.961 -10.961
  627   2HB   ALA  81           HB2      ALA  81  10.430 -11.372 -11.372
  628   3HB   ALA  81           HB3      ALA  81  11.130 -10.587 -10.587
  629   1H1   BME  16           HE1      MER  16  -7.980   9.110   9.110
  630   2H1   BME  16           HE2      MER  16  -8.803   9.781   9.781
  631   1H2   BME  16           HZ1      MER  16  -5.811   9.806   9.806
  632   2H2   BME  16           HZ2      MER  16  -6.841  11.185  11.185
  633    HO1  BME  16           HH       MER  16  -8.260   8.021   8.021

  Start of MODEL   30
    1    H    ASN   3           HN       ASN   3   2.518 -11.042 -11.042
    2    HA   ASN   3           HA       ASN   3   3.586 -11.643 -11.643
    3   1HB   ASN   3           HB1      ASN   3   0.761 -12.427 -12.427
    4   2HB   ASN   3           HB2      ASN   3   1.737 -13.288 -13.288
    5   1HD2  ASN   3          HD21      ASN   3   3.933 -13.626 -13.626
    6   2HD2  ASN   3          HD22      ASN   3   3.960 -12.264 -12.264
    7    H    ALA   4           HN       ALA   4   2.978 -11.719 -11.719
    8    HA   ALA   4           HA       ALA   4   2.574 -10.369 -10.369
    9   1HB   ALA   4           HB1      ALA   4   0.908 -12.195 -12.195
   10   2HB   ALA   4           HB2      ALA   4  -0.177 -11.189 -11.189
   11   3HB   ALA   4           HB3      ALA   4   0.214 -10.743 -10.743
   12    HA   PRO   5           HA       PRO   5   1.561  -6.387  -6.387
   13   1HB   PRO   5           HB1      PRO   5   4.072  -5.611  -5.611
   14   2HB   PRO   5           HB2      PRO   5   3.573  -5.274  -5.274
   15   1HG   PRO   5           HG1      PRO   5   5.485  -7.126  -7.126
   16   2HG   PRO   5           HG2      PRO   5   4.301  -7.388  -7.388
   17   1HD   PRO   5           HD1      PRO   5   4.270  -8.558  -8.558
   18   2HD   PRO   5           HD2      PRO   5   3.971  -9.349  -9.349
   19    H    LYS   6           HN       LYS   6   0.064  -5.488  -5.488
   20    HA   LYS   6           HA       LYS   6  -0.167  -5.631  -5.631
   21   1HB   LYS   6           HB1      LYS   6  -2.038  -5.487  -5.487
   22   2HB   LYS   6           HB2      LYS   6  -1.789  -3.760  -3.760
   23   1HG   LYS   6           HG1      LYS   6  -2.248  -4.073  -4.073
   24   2HG   LYS   6           HG2      LYS   6  -2.761  -5.685  -5.685
   25   1HD   LYS   6           HD1      LYS   6  -3.972  -3.111  -3.111
   26   2HD   LYS   6           HD2      LYS   6  -4.678  -4.124  -4.124
   27   1HE   LYS   6           HE1      LYS   6  -4.862  -6.017  -6.017
   28   2HE   LYS   6           HE2      LYS   6  -4.157  -5.005  -5.005
   29   1HZ   LYS   6           HZ1      LYS   6  -6.246  -3.571  -3.571
   30   2HZ   LYS   6           HZ2      LYS   6  -6.820  -5.142  -5.142
   31   3HZ   LYS   6           HZ3      LYS   6  -6.138  -4.233  -4.233
   32    H    ARG   7           HN       ARG   7  -0.867  -3.035  -3.035
   33    HA   ARG   7           HA       ARG   7   1.765  -1.761  -1.761
   34   1HB   ARG   7           HB1      ARG   7   1.046  -0.326  -0.326
   35   2HB   ARG   7           HB2      ARG   7   0.612  -1.971  -1.971
   36   1HG   ARG   7           HG1      ARG   7  -1.286  -0.848  -0.848
   37   2HG   ARG   7           HG2      ARG   7  -1.781  -1.309  -1.309
   38   1HD   ARG   7           HD1      ARG   7  -1.307   0.962   0.962
   39   2HD   ARG   7           HD2      ARG   7  -0.526   1.391   1.391
   40    HE   ARG   7           HE       ARG   7  -3.442   0.722   0.722
   41   1HH1  ARG   7          HH11      ARG   7  -1.839   1.214   1.214
   42   2HH1  ARG   7          HH12      ARG   7  -2.282   2.850   2.850
   43   1HH2  ARG   7          HH21      ARG   7  -3.577   3.385   3.385
   44   2HH2  ARG   7          HH22      ARG   7  -3.300   4.123   4.123
   45    HA   PRO   8           HA       PRO   8   0.324   0.918   0.918
   46   1HB   PRO   8           HB1      PRO   8   2.446   2.616   2.616
   47   2HB   PRO   8           HB2      PRO   8   2.632   0.902   0.902
   48   1HG   PRO   8           HG1      PRO   8   3.079   2.268   2.268
   49   2HG   PRO   8           HG2      PRO   8   4.265   1.355   1.355
   50   1HD   PRO   8           HD1      PRO   8   2.847   0.101   0.101
   51   2HD   PRO   8           HD2      PRO   8   3.087  -0.729  -0.729
   52    HA   PRO   9           HA       PRO   9  -1.274   5.105   5.105
   53   1HB   PRO   9           HB1      PRO   9   0.968   6.578   6.578
   54   2HB   PRO   9           HB2      PRO   9  -0.630   6.313   6.313
   55   1HG   PRO   9           HG1      PRO   9   1.880   4.655   4.655
   56   2HG   PRO   9           HG2      PRO   9   0.658   5.118   5.118
   57   1HD   PRO   9           HD1      PRO   9   0.523   2.658   2.658
   58   2HD   PRO   9           HD2      PRO   9  -0.984   3.593   3.593
   59    H    SER  10           HN       SER  10  -0.412   7.261   7.261
   60    HA   SER  10           HA       SER  10   1.047   6.580   6.580
   61   1HB   SER  10           HB1      SER  10  -0.206   8.552   8.552
   62   2HB   SER  10           HB2      SER  10  -1.282   7.318   7.318
   63    HG   SER  10           HG       SER  10  -0.913   9.848   9.848
   64    H    ALA  11           HN       ALA  11   0.732   9.190   9.190
   65    HA   ALA  11           HA       ALA  11   3.107  10.093  10.093
   66   1HB   ALA  11           HB1      ALA  11   2.593  11.298  11.298
   67   2HB   ALA  11           HB2      ALA  11   3.855  11.805  11.805
   68   3HB   ALA  11           HB3      ALA  11   3.945  10.231  10.231
   69    H    PHE  12           HN       PHE  12   0.560  11.033  11.033
   70    HA   PHE  12           HA       PHE  12  -0.308  13.490  13.490
   71   1HB   PHE  12           HB1      PHE  12  -1.156  13.089  13.089
   72   2HB   PHE  12           HB2      PHE  12  -1.263  11.334  11.334
   73    HD1  PHE  12           HD1      PHE  12  -3.469  12.930  12.930
   74    HD2  PHE  12           HD2      PHE  12  -3.000  11.898  11.898
   75    HE1  PHE  12           HE1      PHE  12  -5.901  12.989  12.989
   76    HE2  PHE  12           HE2      PHE  12  -5.422  11.965  11.965
   77    HZ   PHE  12           HZ       PHE  12  -6.886  12.496  12.496
   78    H    PHE  13           HN       PHE  13  -0.983  10.100  10.100
   79    HA   PHE  13           HA       PHE  13  -3.108  10.354  10.354
   80   1HB   PHE  13           HB1      PHE  13  -1.941   8.217   8.217
   81   2HB   PHE  13           HB2      PHE  13  -0.789   8.473   8.473
   82    HD1  PHE  13           HD1      PHE  13  -1.751   8.687   8.687
   83    HD2  PHE  13           HD2      PHE  13  -4.100   7.317   7.317
   84    HE1  PHE  13           HE1      PHE  13  -3.405   7.768   7.768
   85    HE2  PHE  13           HE2      PHE  13  -5.759   6.409   6.409
   86    HZ   PHE  13           HZ       PHE  13  -5.414   6.636   6.636
   87    H    LEU  14           HN       LEU  14   0.364  10.607  10.607
   88    HA   LEU  14           HA       LEU  14  -0.017  11.012  11.012
   89   1HB   LEU  14           HB1      LEU  14   2.013  12.428  12.428
   90   2HB   LEU  14           HB2      LEU  14   2.115  12.314  12.314
   91    HG   LEU  14           HG       LEU  14   3.665  10.783  10.783
   92   1HD1  LEU  14          HD11      LEU  14   2.275   9.606   9.606
   93   2HD1  LEU  14          HD12      LEU  14   1.227   8.990   8.990
   94   3HD1  LEU  14          HD13      LEU  14   2.904   8.482   8.482
   95   1HD2  LEU  14          HD21      LEU  14   3.261  10.834  10.834
   96   2HD2  LEU  14          HD22      LEU  14   3.464   9.173   9.173
   97   3HD2  LEU  14          HD23      LEU  14   1.867   9.777   9.777
   98    H    PHE  15           HN       PHE  15   0.328  13.392  13.392
   99    HA   PHE  15           HA       PHE  15  -0.299  15.794  15.794
  100   1HB   PHE  15           HB1      PHE  15   0.681  15.910  15.910
  101   2HB   PHE  15           HB2      PHE  15  -0.368  14.629  14.629
  102    HD1  PHE  15           HD1      PHE  15  -0.413  18.262  18.262
  103    HD2  PHE  15           HD2      PHE  15  -2.083  15.115  15.115
  104    HE1  PHE  15           HE1      PHE  15  -1.738  19.893  19.893
  105    HE2  PHE  15           HE2      PHE  15  -3.394  16.750  16.750
  106    HZ   PHE  15           HZ       PHE  15  -3.235  19.133  19.133
  107    H    CYS  16           HN       MER  16  -2.518  13.666  13.666
  108    HA   CYS  16           HA       MER  16  -4.969  14.973  14.973
  109   1HB   CYS  16           HB1      MER  16  -6.009  12.998  12.998
  110   2HB   CYS  16           HB2      MER  16  -4.418  12.737  12.737
  111    H    SER  17           HN       SER  17  -3.396  12.612  12.612
  112    HA   SER  17           HA       SER  17  -5.328  12.520  12.520
  113   1HB   SER  17           HB1      SER  17  -2.277  12.256  12.256
  114   2HB   SER  17           HB2      SER  17  -3.510  11.603  11.603
  115    HG   SER  17           HG       SER  17  -2.634  10.638  10.638
  116    H    GLU  18           HN       GLU  18  -2.660  14.667  14.667
  117    HA   GLU  18           HA       GLU  18  -2.984  16.248  16.248
  118   1HB   GLU  18           HB1      GLU  18  -0.846  15.868  15.868
  119   2HB   GLU  18           HB2      GLU  18  -1.505  16.954  16.954
  120   1HG   GLU  18           HG1      GLU  18  -0.280  18.476  18.476
  121   2HG   GLU  18           HG2      GLU  18  -1.802  18.606  18.606
  122    H    TYR  19           HN       TYR  19  -4.634  16.071  16.071
  123    HA   TYR  19           HA       TYR  19  -5.525  18.903  18.903
  124   1HB   TYR  19           HB1      TYR  19  -5.224  16.716  16.716
  125   2HB   TYR  19           HB2      TYR  19  -6.764  17.600  17.600
  126    HD1  TYR  19           HD1      TYR  19  -3.221  18.471  18.471
  127    HD2  TYR  19           HD2      TYR  19  -6.669  19.345  19.345
  128    HE1  TYR  19           HE1      TYR  19  -2.018  20.311  20.311
  129    HE2  TYR  19           HE2      TYR  19  -5.473  21.184  21.184
  130    HH   TYR  19           HH       TYR  19  -3.656  22.538  22.538
  131    H    ARG  20           HN       ARG  20  -6.770  15.764  15.764
  132    HA   ARG  20           HA       ARG  20  -9.395  15.711  15.711
  133   1HB   ARG  20           HB1      ARG  20  -7.587  14.594  14.594
  134   2HB   ARG  20           HB2      ARG  20  -9.002  15.124  15.124
  135   1HG   ARG  20           HG1      ARG  20 -10.451  13.886  13.886
  136   2HG   ARG  20           HG2      ARG  20  -8.997  13.286  13.286
  137   1HD   ARG  20           HD1      ARG  20  -9.690  12.824  12.824
  138   2HD   ARG  20           HD2      ARG  20  -9.938  11.650  11.650
  139    HE   ARG  20           HE       ARG  20  -7.221  12.701  12.701
  140   1HH1  ARG  20          HH11      ARG  20  -6.917  11.193  11.193
  141   2HH1  ARG  20          HH12      ARG  20  -6.835   9.535   9.535
  142   1HH2  ARG  20          HH21      ARG  20  -8.226  10.225  10.225
  143   2HH2  ARG  20          HH22      ARG  20  -7.600   8.967   8.967
  144    HA   PRO  21           HA       PRO  21 -10.733  18.288  18.288
  145   1HB   PRO  21           HB1      PRO  21  -8.315  19.652  19.652
  146   2HB   PRO  21           HB2      PRO  21  -9.503  18.646  18.646
  147   1HG   PRO  21           HG1      PRO  21  -7.040  17.661  17.661
  148   2HG   PRO  21           HG2      PRO  21  -8.436  16.609  16.609
  149   1HD   PRO  21           HD1      PRO  21  -7.011  18.333  18.333
  150   2HD   PRO  21           HD2      PRO  21  -7.238  16.577  16.577
  151    H    LYS  22           HN       LYS  22  -8.321  19.718  19.718
  152    HA   LYS  22           HA       LYS  22  -9.300  22.463  22.463
  153   1HB   LYS  22           HB1      LYS  22  -7.229  21.018  21.018
  154   2HB   LYS  22           HB2      LYS  22  -7.545  22.709  22.709
  155   1HG   LYS  22           HG1      LYS  22  -7.103  22.034  22.034
  156   2HG   LYS  22           HG2      LYS  22  -5.786  21.473  21.473
  157   1HD   LYS  22           HD1      LYS  22  -5.219  23.685  23.685
  158   2HD   LYS  22           HD2      LYS  22  -5.545  23.803  23.803
  159   1HE   LYS  22           HE1      LYS  22  -7.663  24.440  24.440
  160   2HE   LYS  22           HE2      LYS  22  -6.549  25.644  25.644
  161   1HZ   LYS  22           HZ1      LYS  22  -7.655  24.381  24.381
  162   2HZ   LYS  22           HZ2      LYS  22  -8.933  24.724  24.724
  163   3HZ   LYS  22           HZ3      LYS  22  -7.900  25.963  25.963
  164    H    ILE  23           HN       ILE  23  -9.773  19.671  19.671
  165    HA   ILE  23           HA       ILE  23 -10.998  21.303  21.303
  166    HB   ILE  23           HB       ILE  23 -11.142  18.260  18.260
  167   1HG1  ILE  23          HG11      ILE  23  -9.205  19.896  19.896
  168   2HG1  ILE  23          HG12      ILE  23  -8.762  19.144  19.144
  169   1HG2  ILE  23          HG21      ILE  23 -12.836  19.351  19.351
  170   2HG2  ILE  23          HG22      ILE  23 -11.526  20.083  20.083
  171   3HG2  ILE  23          HG23      ILE  23 -11.736  18.342  18.342
  172   1HD1  ILE  23          HD11      ILE  23  -9.400  16.935  16.935
  173   2HD1  ILE  23          HD12      ILE  23  -9.826  17.661  17.661
  174   3HD1  ILE  23          HD13      ILE  23  -8.166  17.702  17.702
  175    H    LYS  24           HN       LYS  24 -11.760  19.002  19.002
  176    HA   LYS  24           HA       LYS  24 -14.532  18.867  18.867
  177   1HB   LYS  24           HB1      LYS  24 -12.901  17.550  17.550
  178   2HB   LYS  24           HB2      LYS  24 -12.692  18.924  18.924
  179   1HG   LYS  24           HG1      LYS  24 -15.500  18.657  18.657
  180   2HG   LYS  24           HG2      LYS  24 -15.012  16.998  16.998
  181   1HD   LYS  24           HD1      LYS  24 -15.218  17.400  17.400
  182   2HD   LYS  24           HD2      LYS  24 -13.519  17.174  17.174
  183   1HE   LYS  24           HE1      LYS  24 -13.127  19.599  19.599
  184   2HE   LYS  24           HE2      LYS  24 -14.845  19.930  19.930
  185   1HZ   LYS  24           HZ1      LYS  24 -14.029  18.118  18.118
  186   2HZ   LYS  24           HZ2      LYS  24 -13.010  19.478  19.478
  187   3HZ   LYS  24           HZ3      LYS  24 -14.690  19.675  19.675
  188    H    GLY  25           HN       GLY  25 -12.430  21.214  21.214
  189   1HA   GLY  25           HA1      GLY  25 -14.396  22.724  22.724
  190   2HA   GLY  25           HA2      GLY  25 -12.757  23.237  23.237
  191    H    GLU  26           HN       GLU  26 -13.030  22.924  22.924
  192    HA   GLU  26           HA       GLU  26 -14.362  25.442  25.442
  193   1HB   GLU  26           HB1      GLU  26 -12.642  23.595  23.595
  194   2HB   GLU  26           HB2      GLU  26 -13.175  25.186  25.186
  195   1HG   GLU  26           HG1      GLU  26 -11.635  24.711  24.711
  196   2HG   GLU  26           HG2      GLU  26 -10.818  25.049  25.049
  197    H    HIS  27           HN       HIS  27 -14.649  22.131  22.131
  198    HA   HIS  27           HA       HIS  27 -17.296  22.728  22.728
  199   1HB   HIS  27           HB1      HIS  27 -15.266  20.839  20.839
  200   2HB   HIS  27           HB2      HIS  27 -16.726  21.515  21.515
  201    HD1  HIS  27           HD1      HIS  27 -16.556  24.248  24.248
  202    HD2  HIS  27           HD2      HIS  27 -12.991  22.293  22.293
  203    HE1  HIS  27           HE1      HIS  27 -14.809  25.824  25.824
  204    HA   PRO  28           HA       PRO  28 -17.810  18.945  18.945
  205   1HB   PRO  28           HB1      PRO  28 -19.584  19.860  19.860
  206   2HB   PRO  28           HB2      PRO  28 -17.870  20.248  20.248
  207   1HG   PRO  28           HG1      PRO  28 -20.046  21.970  21.970
  208   2HG   PRO  28           HG2      PRO  28 -18.923  22.443  22.443
  209   1HD   PRO  28           HD1      PRO  28 -18.372  22.948  22.948
  210   2HD   PRO  28           HD2      PRO  28 -17.064  22.596  22.596
  211    H    GLY  29           HN       GLY  29 -18.653  19.501  19.501
  212   1HA   GLY  29           HA1      GLY  29 -21.457  18.588  18.588
  213   2HA   GLY  29           HA2      GLY  29 -20.952  19.885  19.885
  214    H    LEU  30           HN       LEU  30 -18.284  18.027  18.027
  215    HA   LEU  30           HA       LEU  30 -19.035  16.651  16.651
  216   1HB   LEU  30           HB1      LEU  30 -16.395  16.235  16.235
  217   2HB   LEU  30           HB2      LEU  30 -17.069  17.731  17.731
  218    HG   LEU  30           HG       LEU  30 -16.627  18.783  18.783
  219   1HD1  LEU  30          HD11      LEU  30 -15.886  16.036  16.036
  220   2HD1  LEU  30          HD12      LEU  30 -15.530  17.548  17.548
  221   3HD1  LEU  30          HD13      LEU  30 -17.173  17.038  17.038
  222   1HD2  LEU  30          HD21      LEU  30 -14.277  17.144  17.144
  223   2HD2  LEU  30          HD22      LEU  30 -14.777  18.717  18.717
  224   3HD2  LEU  30          HD23      LEU  30 -14.150  18.549  18.549
  225    H    SER  31           HN       SER  31 -17.716  14.620  14.620
  226    HA   SER  31           HA       SER  31 -18.201  12.588  12.588
  227   1HB   SER  31           HB1      SER  31 -19.603  12.443  12.443
  228   2HB   SER  31           HB2      SER  31 -18.093  12.112  12.112
  229    HG   SER  31           HG       SER  31 -18.127  10.193  10.193
  230    H    ILE  32           HN       ILE  32 -16.877  10.559  10.559
  231    HA   ILE  32           HA       ILE  32 -14.122  11.217  11.217
  232    HB   ILE  32           HB       ILE  32 -15.870   8.920   8.920
  233   1HG1  ILE  32          HG11      ILE  32 -14.024   7.941   7.941
  234   2HG1  ILE  32          HG12      ILE  32 -12.901   9.132   9.132
  235   1HG2  ILE  32          HG21      ILE  32 -15.192   8.152   8.152
  236   2HG2  ILE  32          HG22      ILE  32 -13.511   8.150   8.150
  237   3HG2  ILE  32          HG23      ILE  32 -14.652   7.045   7.045
  238   1HD1  ILE  32          HD11      ILE  32 -15.354   9.739   9.739
  239   2HD1  ILE  32          HD12      ILE  32 -13.684   9.783   9.783
  240   3HD1  ILE  32          HD13      ILE  32 -14.254  10.960  10.960
  241    H    GLY  33           HN       GLY  33 -15.941  11.051  11.051
  242   1HA   GLY  33           HA1      GLY  33 -13.608  10.472  10.472
  243   2HA   GLY  33           HA2      GLY  33 -15.294  10.530  10.530
  244    H    ASP  34           HN       ASP  34 -15.089  13.037  13.037
  245    HA   ASP  34           HA       ASP  34 -14.463  14.955  14.955
  246   1HB   ASP  34           HB1      ASP  34 -16.180  15.004  15.004
  247   2HB   ASP  34           HB2      ASP  34 -15.933  16.489  16.489
  248    H    VAL  35           HN       VAL  35 -14.104  14.284  14.284
  249    HA   VAL  35           HA       VAL  35 -12.281  16.361  16.361
  250    HB   VAL  35           HB       VAL  35 -12.687  13.529  13.529
  251   1HG1  VAL  35          HG11      VAL  35 -11.258  15.904  15.904
  252   2HG1  VAL  35          HG12      VAL  35 -11.577  14.374  14.374
  253   3HG1  VAL  35          HG13      VAL  35 -10.465  14.437  14.437
  254   1HG2  VAL  35          HG21      VAL  35 -14.637  15.015  15.015
  255   2HG2  VAL  35          HG22      VAL  35 -13.994  14.614  14.614
  256   3HG2  VAL  35          HG23      VAL  35 -13.675  16.189  16.189
  257    H    ALA  36           HN       ALA  36 -12.020  13.292  13.292
  258    HA   ALA  36           HA       ALA  36  -9.133  13.109  13.109
  259   1HB   ALA  36           HB1      ALA  36 -10.598  11.132  11.132
  260   2HB   ALA  36           HB2      ALA  36 -11.309  11.529  11.529
  261   3HB   ALA  36           HB3      ALA  36  -9.633  10.994  10.994
  262    H    LYS  37           HN       LYS  37 -11.716  13.616  13.616
  263    HA   LYS  37           HA       LYS  37  -9.878  14.014  14.014
  264   1HB   LYS  37           HB1      LYS  37 -12.109  13.455  13.455
  265   2HB   LYS  37           HB2      LYS  37 -12.769  14.665  14.665
  266   1HG   LYS  37           HG1      LYS  37 -12.132  16.459  16.459
  267   2HG   LYS  37           HG2      LYS  37 -11.154  15.420  15.420
  268   1HD   LYS  37           HD1      LYS  37 -13.129  14.320  14.320
  269   2HD   LYS  37           HD2      LYS  37 -14.166  15.052  15.052
  270   1HE   LYS  37           HE1      LYS  37 -13.784  17.282  17.282
  271   2HE   LYS  37           HE2      LYS  37 -12.628  16.639  16.639
  272   1HZ   LYS  37           HZ1      LYS  37 -15.012  15.186  15.186
  273   2HZ   LYS  37           HZ2      LYS  37 -15.387  16.843  16.843
  274   3HZ   LYS  37           HZ3      LYS  37 -14.277  16.196  16.196
  275    H    LYS  38           HN       LYS  38 -11.003  16.112  16.112
  276    HA   LYS  38           HA       LYS  38 -10.257  18.573  18.573
  277   1HB   LYS  38           HB1      LYS  38 -12.080  18.234  18.234
  278   2HB   LYS  38           HB2      LYS  38 -10.770  18.185  18.185
  279   1HG   LYS  38           HG1      LYS  38 -11.399  20.453  20.453
  280   2HG   LYS  38           HG2      LYS  38 -10.081  20.488  20.488
  281   1HD   LYS  38           HD1      LYS  38 -11.717  20.278  20.278
  282   2HD   LYS  38           HD2      LYS  38 -13.033  20.187  20.187
  283   1HE   LYS  38           HE1      LYS  38 -12.399  22.487  22.487
  284   2HE   LYS  38           HE2      LYS  38 -11.213  22.566  22.566
  285   1HZ   LYS  38           HZ1      LYS  38 -13.622  21.761  21.761
  286   2HZ   LYS  38           HZ2      LYS  38 -13.960  23.078  23.078
  287   3HZ   LYS  38           HZ3      LYS  38 -12.800  23.230  23.230
  288    H    LEU  39           HN       LEU  39  -9.072  16.957  16.957
  289    HA   LEU  39           HA       LEU  39  -6.652  18.519  18.519
  290   1HB   LEU  39           HB1      LEU  39  -6.381  17.685  17.685
  291   2HB   LEU  39           HB2      LEU  39  -8.074  17.337  17.337
  292    HG   LEU  39           HG       LEU  39  -7.217  15.057  15.057
  293   1HD1  LEU  39          HD11      LEU  39  -4.964  16.139  16.139
  294   2HD1  LEU  39          HD12      LEU  39  -5.156  14.442  14.442
  295   3HD1  LEU  39          HD13      LEU  39  -4.839  15.505  15.505
  296   1HD2  LEU  39          HD21      LEU  39  -8.634  15.487  15.487
  297   2HD2  LEU  39          HD22      LEU  39  -7.472  14.202  14.202
  298   3HD2  LEU  39          HD23      LEU  39  -7.158  15.812  15.812
  299    H    GLY  40           HN       GLY  40  -7.626  15.644  15.644
  300   1HA   GLY  40           HA1      GLY  40  -4.937  14.582  14.582
  301   2HA   GLY  40           HA2      GLY  40  -6.307  14.118  14.118
  302    H    GLU  41           HN       GLU  41  -7.032  16.765  16.765
  303    HA   GLU  41           HA       GLU  41  -5.140  17.131  17.131
  304   1HB   GLU  41           HB1      GLU  41  -7.354  18.839  18.839
  305   2HB   GLU  41           HB2      GLU  41  -6.458  19.332  19.332
  306   1HG   GLU  41           HG1      GLU  41  -8.016  16.713  16.713
  307   2HG   GLU  41           HG2      GLU  41  -8.597  18.138  18.138
  308    H    MET  42           HN       MET  42  -5.921  18.877  18.877
  309    HA   MET  42           HA       MET  42  -4.104  20.974  20.974
  310   1HB   MET  42           HB1      MET  42  -4.838  19.267  19.267
  311   2HB   MET  42           HB2      MET  42  -4.000  20.804  20.804
  312   1HG   MET  42           HG1      MET  42  -6.663  20.519  20.519
  313   2HG   MET  42           HG2      MET  42  -6.593  20.896  20.896
  314   1HE   MET  42           HE1      MET  42  -6.142  22.000  22.000
  315   2HE   MET  42           HE2      MET  42  -7.751  22.254  22.254
  316   3HE   MET  42           HE3      MET  42  -6.784  23.620  23.620
  317    H    TRP  43           HN       TRP  43  -3.536  17.735  17.735
  318    HA   TRP  43           HA       TRP  43  -0.888  17.804  17.804
  319   1HB   TRP  43           HB1      TRP  43  -2.239  15.820  15.820
  320   2HB   TRP  43           HB2      TRP  43  -2.480  15.646  15.646
  321    HD1  TRP  43           HD1      TRP  43  -0.883  14.129  14.129
  322    HE1  TRP  43           HE1      TRP  43   1.343  13.193  13.193
  323    HE3  TRP  43           HE3      TRP  43  -0.140  16.521  16.521
  324    HZ2  TRP  43           HZ2      TRP  43   3.320  13.355  13.355
  325    HZ3  TRP  43           HZ3      TRP  43   1.834  16.155  16.155
  326    HH2  TRP  43           HH2      TRP  43   3.601  14.561  14.561
  327    H    ASN  44           HN       ASN  44  -2.158  17.206  17.206
  328    HA   ASN  44           HA       ASN  44   0.379  16.910  16.910
  329   1HB   ASN  44           HB1      ASN  44  -2.294  17.707  17.707
  330   2HB   ASN  44           HB2      ASN  44  -0.863  17.162  17.162
  331   1HD2  ASN  44          HD21      ASN  44  -3.306  14.364  14.364
  332   2HD2  ASN  44          HD22      ASN  44  -3.742  15.964  15.964
  333    H    ASN  45           HN       ASN  45  -0.932  19.596  19.596
  334    HA   ASN  45           HA       ASN  45   0.998  21.405  21.405
  335   1HB   ASN  45           HB1      ASN  45  -0.755  23.135  23.135
  336   2HB   ASN  45           HB2      ASN  45  -1.133  21.673  21.673
  337   1HD2  ASN  45          HD21      ASN  45  -4.267  21.331  21.331
  338   2HD2  ASN  45          HD22      ASN  45  -3.268  20.892  20.892
  339    H    THR  46           HN       THR  46   0.966  20.248  20.248
  340    HA   THR  46           HA       THR  46  -0.138  22.217  22.217
  341    HB   THR  46           HB       THR  46   0.152  19.862  19.862
  342    HG1  THR  46           HG1      THR  46   1.158  22.067  22.067
  343   1HG2  THR  46          HG21      THR  46   2.304  19.229  19.229
  344   2HG2  THR  46          HG22      THR  46   3.189  20.280  20.280
  345   3HG2  THR  46          HG23      THR  46   2.340  18.880  18.880
  346    H    ALA  47           HN       ALA  47   3.057  21.300  21.300
  347    HA   ALA  47           HA       ALA  47   4.034  23.985  23.985
  348   1HB   ALA  47           HB1      ALA  47   4.283  23.721  23.721
  349   2HB   ALA  47           HB2      ALA  47   5.257  22.285  22.285
  350   3HB   ALA  47           HB3      ALA  47   5.831  23.859  23.859
  351    H    ALA  48           HN       ALA  48   4.948  20.784  20.784
  352    HA   ALA  48           HA       ALA  48   5.801  19.097  19.097
  353   1HB   ALA  48           HB1      ALA  48   6.139  20.693  20.693
  354   2HB   ALA  48           HB2      ALA  48   7.549  21.355  21.355
  355   3HB   ALA  48           HB3      ALA  48   7.529  19.674  19.674
  356    H    ASP  49           HN       ASP  49   7.270  21.871  21.871
  357    HA   ASP  49           HA       ASP  49   9.577  20.477  20.477
  358   1HB   ASP  49           HB1      ASP  49   9.642  22.809  22.809
  359   2HB   ASP  49           HB2      ASP  49   8.633  23.371  23.371
  360    H    ASP  50           HN       ASP  50   6.443  20.508  20.508
  361    HA   ASP  50           HA       ASP  50   6.827  20.401  20.401
  362   1HB   ASP  50           HB1      ASP  50   4.441  21.431  21.431
  363   2HB   ASP  50           HB2      ASP  50   4.328  21.026  21.026
  364    H    LYS  51           HN       LYS  51   6.520  18.722  18.722
  365    HA   LYS  51           HA       LYS  51   4.632  16.651  16.651
  366   1HB   LYS  51           HB1      LYS  51   6.306  16.736  16.736
  367   2HB   LYS  51           HB2      LYS  51   5.070  15.562  15.562
  368   1HG   LYS  51           HG1      LYS  51   3.374  17.361  17.361
  369   2HG   LYS  51           HG2      LYS  51   4.618  18.550  18.550
  370   1HD   LYS  51           HD1      LYS  51   3.570  18.035  18.035
  371   2HD   LYS  51           HD2      LYS  51   5.112  17.191  17.191
  372   1HE   LYS  51           HE1      LYS  51   3.956  15.118  15.118
  373   2HE   LYS  51           HE2      LYS  51   2.438  16.017  16.017
  374   1HZ   LYS  51           HZ1      LYS  51   3.790  16.400  16.400
  375   2HZ   LYS  51           HZ2      LYS  51   3.877  14.740  14.740
  376   3HZ   LYS  51           HZ3      LYS  51   2.365  15.514  15.514
  377    H    GLN  52           HN       GLN  52   7.890  17.064  17.064
  378    HA   GLN  52           HA       GLN  52   9.291  14.896  14.896
  379   1HB   GLN  52           HB1      GLN  52   9.939  17.617  17.617
  380   2HB   GLN  52           HB2      GLN  52  10.582  17.110  17.110
  381   1HG   GLN  52           HG1      GLN  52  12.321  16.886  16.886
  382   2HG   GLN  52           HG2      GLN  52  11.864  15.287  15.287
  383   1HE2  GLN  52          HE21      GLN  52   9.921  15.608  15.608
  384   2HE2  GLN  52          HE22      GLN  52   9.341  16.267  16.267
  385    HA   PRO  53           HA       PRO  53   9.730  15.025  15.025
  386   1HB   PRO  53           HB1      PRO  53   7.446  16.172  16.172
  387   2HB   PRO  53           HB2      PRO  53   9.019  16.950  16.950
  388   1HG   PRO  53           HG1      PRO  53   6.657  17.109  17.109
  389   2HG   PRO  53           HG2      PRO  53   7.579  18.449  18.449
  390   1HD   PRO  53           HD1      PRO  53   8.272  17.668  17.668
  391   2HD   PRO  53           HD2      PRO  53   9.590  17.812  17.812
  392    H    TYR  54           HN       TYR  54   6.417  15.086  15.086
  393    HA   TYR  54           HA       TYR  54   5.519  12.750  12.750
  394   1HB   TYR  54           HB1      TYR  54   4.393  14.197  14.197
  395   2HB   TYR  54           HB2      TYR  54   3.539  12.923  12.923
  396    HD1  TYR  54           HD1      TYR  54   3.852  13.494  13.494
  397    HD2  TYR  54           HD2      TYR  54   3.509  16.293  16.293
  398    HE1  TYR  54           HE1      TYR  54   3.048  15.192  15.192
  399    HE2  TYR  54           HE2      TYR  54   2.706  17.989  17.989
  400    HH   TYR  54           HH       TYR  54   2.655  18.521  18.521
  401    H    GLU  55           HN       GLU  55   6.298  13.426  13.426
  402    HA   GLU  55           HA       GLU  55   5.950  10.944  10.944
  403   1HB   GLU  55           HB1      GLU  55   7.174  13.460  13.460
  404   2HB   GLU  55           HB2      GLU  55   8.375  12.255  12.255
  405   1HG   GLU  55           HG1      GLU  55   6.648  11.046  11.046
  406   2HG   GLU  55           HG2      GLU  55   5.475  12.280  12.280
  407    H    LYS  56           HN       LYS  56   9.039  12.062  12.062
  408    HA   LYS  56           HA       LYS  56  10.620   9.854   9.854
  409   1HB   LYS  56           HB1      LYS  56  10.442  11.757  11.757
  410   2HB   LYS  56           HB2      LYS  56  11.665  10.501  10.501
  411   1HG   LYS  56           HG1      LYS  56  12.525  11.406  11.406
  412   2HG   LYS  56           HG2      LYS  56  11.258  12.604  12.604
  413   1HD   LYS  56           HD1      LYS  56  13.366  13.601  13.601
  414   2HD   LYS  56           HD2      LYS  56  12.131  13.664  13.664
  415   1HE   LYS  56           HE1      LYS  56  14.357  12.939  12.939
  416   2HE   LYS  56           HE2      LYS  56  13.147  11.692  11.692
  417   1HZ   LYS  56           HZ1      LYS  56  14.334  11.327  11.327
  418   2HZ   LYS  56           HZ2      LYS  56  15.568  11.525  11.525
  419   3HZ   LYS  56           HZ3      LYS  56  14.396  10.314  10.314
  420    H    LYS  57           HN       LYS  57   8.130  10.267  10.267
  421    HA   LYS  57           HA       LYS  57   8.753   7.839   7.839
  422   1HB   LYS  57           HB1      LYS  57   6.123   9.408   9.408
  423   2HB   LYS  57           HB2      LYS  57   6.480   8.135   8.135
  424   1HG   LYS  57           HG1      LYS  57   8.419   9.459   9.459
  425   2HG   LYS  57           HG2      LYS  57   8.017  10.754  10.754
  426   1HD   LYS  57           HD1      LYS  57   5.805  11.037  11.037
  427   2HD   LYS  57           HD2      LYS  57   6.144   9.682   9.682
  428   1HE   LYS  57           HE1      LYS  57   6.612  11.786  11.786
  429   2HE   LYS  57           HE2      LYS  57   8.111  10.910  10.910
  430   1HZ   LYS  57           HZ1      LYS  57   7.652  12.577  12.577
  431   2HZ   LYS  57           HZ2      LYS  57   7.479  13.492  13.492
  432   3HZ   LYS  57           HZ3      LYS  57   8.913  12.632  12.632
  433    H    ALA  58           HN       ALA  58   6.137   8.710   8.710
  434    HA   ALA  58           HA       ALA  58   4.920   6.246   6.246
  435   1HB   ALA  58           HB1      ALA  58   5.612   8.237   8.237
  436   2HB   ALA  58           HB2      ALA  58   4.392   6.981   6.981
  437   3HB   ALA  58           HB3      ALA  58   4.189   8.306   8.306
  438    H    ALA  59           HN       ALA  59   7.714   7.453   7.453
  439    HA   ALA  59           HA       ALA  59   8.352   5.227   5.227
  440   1HB   ALA  59           HB1      ALA  59   9.505   7.455   7.455
  441   2HB   ALA  59           HB2      ALA  59  10.291   7.197   7.197
  442   3HB   ALA  59           HB3      ALA  59  10.687   6.169   6.169
  443    H    LYS  60           HN       LYS  60   9.960   6.062   6.062
  444    HA   LYS  60           HA       LYS  60  11.406   3.867   3.867
  445   1HB   LYS  60           HB1      LYS  60  11.351   5.839   5.839
  446   2HB   LYS  60           HB2      LYS  60   9.680   5.584   5.584
  447   1HG   LYS  60           HG1      LYS  60  10.236   3.601   3.601
  448   2HG   LYS  60           HG2      LYS  60  11.906   3.658   3.658
  449   1HD   LYS  60           HD1      LYS  60  12.286   5.777   5.777
  450   2HD   LYS  60           HD2      LYS  60  10.575   5.971   5.971
  451   1HE   LYS  60           HE1      LYS  60  12.249   3.695   3.695
  452   2HE   LYS  60           HE2      LYS  60  11.876   5.184   5.184
  453   1HZ   LYS  60           HZ1      LYS  60   9.501   4.190   4.190
  454   2HZ   LYS  60           HZ2      LYS  60  10.285   2.905   2.905
  455   3HZ   LYS  60           HZ3      LYS  60   9.948   4.343   4.343
  456    H    LEU  61           HN       LEU  61   7.956   4.147   4.147
  457    HA   LEU  61           HA       LEU  61   7.712   1.500   1.500
  458   1HB   LEU  61           HB1      LEU  61   5.577   3.221   3.221
  459   2HB   LEU  61           HB2      LEU  61   5.291   1.915   1.915
  460    HG   LEU  61           HG       LEU  61   6.806   4.509   4.509
  461   1HD1  LEU  61          HD11      LEU  61   4.147   3.490   3.490
  462   2HD1  LEU  61          HD12      LEU  61   4.947   4.972   4.972
  463   3HD1  LEU  61          HD13      LEU  61   4.426   4.793   4.793
  464   1HD2  LEU  61          HD21      LEU  61   6.319   2.162   2.162
  465   2HD2  LEU  61          HD22      LEU  61   7.875   2.682   2.682
  466   3HD2  LEU  61          HD23      LEU  61   6.988   3.726   3.726
  467    H    LYS  62           HN       LYS  62   6.697   2.689   2.689
  468    HA   LYS  62           HA       LYS  62   5.919   0.291   0.291
  469   1HB   LYS  62           HB1      LYS  62   5.980   2.631   2.631
  470   2HB   LYS  62           HB2      LYS  62   7.697   2.395   2.395
  471   1HG   LYS  62           HG1      LYS  62   7.217   0.388   0.388
  472   2HG   LYS  62           HG2      LYS  62   5.494   0.600   0.600
  473   1HD   LYS  62           HD1      LYS  62   5.714   2.934   2.934
  474   2HD   LYS  62           HD2      LYS  62   7.376   2.550   2.550
  475   1HE   LYS  62           HE1      LYS  62   4.899   1.075   1.075
  476   2HE   LYS  62           HE2      LYS  62   5.926   2.141   2.141
  477   1HZ   LYS  62           HZ1      LYS  62   7.554   0.192   0.192
  478   2HZ   LYS  62           HZ2      LYS  62   6.230  -0.589  -0.589
  479   3HZ   LYS  62           HZ3      LYS  62   7.213   0.443   0.443
  480    H    GLU  63           HN       GLU  63   9.120   1.590   1.590
  481    HA   GLU  63           HA       GLU  63  10.720  -0.359  -0.359
  482   1HB   GLU  63           HB1      GLU  63  11.106   2.048   2.048
  483   2HB   GLU  63           HB2      GLU  63  11.836   0.858   0.858
  484   1HG   GLU  63           HG1      GLU  63  13.331   0.126   0.126
  485   2HG   GLU  63           HG2      GLU  63  12.579   1.331   1.331
  486    H    LYS  64           HN       LYS  64   9.896  -0.019  -0.019
  487    HA   LYS  64           HA       LYS  64  11.065  -2.336  -2.336
  488   1HB   LYS  64           HB1      LYS  64   8.399  -1.018  -1.018
  489   2HB   LYS  64           HB2      LYS  64   9.051  -2.342  -2.342
  490   1HG   LYS  64           HG1      LYS  64  10.602   0.227   0.227
  491   2HG   LYS  64           HG2      LYS  64   9.551   0.004   0.004
  492   1HD   LYS  64           HD1      LYS  64  10.916  -1.996  -1.996
  493   2HD   LYS  64           HD2      LYS  64  11.969  -1.735  -1.735
  494   1HE   LYS  64           HE1      LYS  64  12.941  -0.751  -0.751
  495   2HE   LYS  64           HE2      LYS  64  12.600   0.504   0.504
  496   1HZ   LYS  64           HZ1      LYS  64  10.343   0.085   0.085
  497   2HZ   LYS  64           HZ2      LYS  64  11.714   0.355   0.355
  498   3HZ   LYS  64           HZ3      LYS  64  11.267   1.490   1.490
  499    H    TYR  65           HN       TYR  65   7.850  -2.010  -2.010
  500    HA   TYR  65           HA       TYR  65   6.947  -4.655  -4.655
  501   1HB   TYR  65           HB1      TYR  65   5.359  -3.037  -3.037
  502   2HB   TYR  65           HB2      TYR  65   6.430  -2.328  -2.328
  503    HD1  TYR  65           HD1      TYR  65   5.497  -5.943  -5.943
  504    HD2  TYR  65           HD2      TYR  65   4.994  -2.317  -2.317
  505    HE1  TYR  65           HE1      TYR  65   4.309  -7.154  -7.154
  506    HE2  TYR  65           HE2      TYR  65   3.801  -3.538  -3.538
  507    HH   TYR  65           HH       TYR  65   3.906  -6.267  -6.267
  508    H    GLU  66           HN       GLU  66   8.245  -3.195  -3.195
  509    HA   GLU  66           HA       GLU  66   8.553  -5.339  -5.339
  510   1HB   GLU  66           HB1      GLU  66  10.600  -3.177  -3.177
  511   2HB   GLU  66           HB2      GLU  66  10.451  -4.179  -4.179
  512   1HG   GLU  66           HG1      GLU  66   7.989  -2.667  -2.667
  513   2HG   GLU  66           HG2      GLU  66   9.236  -1.738  -1.738
  514    H    LYS  67           HN       LYS  67  10.633  -4.704  -4.704
  515    HA   LYS  67           HA       LYS  67  12.550  -6.783  -6.783
  516   1HB   LYS  67           HB1      LYS  67  12.385  -4.796  -4.796
  517   2HB   LYS  67           HB2      LYS  67  13.403  -6.199  -6.199
  518   1HG   LYS  67           HG1      LYS  67  14.746  -4.421  -4.421
  519   2HG   LYS  67           HG2      LYS  67  14.626  -5.640  -5.640
  520   1HD   LYS  67           HD1      LYS  67  12.920  -4.251  -4.251
  521   2HD   LYS  67           HD2      LYS  67  13.022  -3.046  -3.046
  522   1HE   LYS  67           HE1      LYS  67  15.423  -2.691  -2.691
  523   2HE   LYS  67           HE2      LYS  67  15.352  -3.902  -3.902
  524   1HZ   LYS  67           HZ1      LYS  67  13.288  -2.053  -2.053
  525   2HZ   LYS  67           HZ2      LYS  67  14.738  -1.201  -1.201
  526   3HZ   LYS  67           HZ3      LYS  67  14.637  -2.374  -2.374
  527    H    ASP  68           HN       ASP  68  10.063  -6.338  -6.338
  528    HA   ASP  68           HA       ASP  68  10.491  -8.801  -8.801
  529   1HB   ASP  68           HB1      ASP  68   8.362  -6.667  -6.667
  530   2HB   ASP  68           HB2      ASP  68   8.218  -8.151  -8.151
  531    H    ILE  69           HN       ILE  69   8.871  -7.776  -7.776
  532    HA   ILE  69           HA       ILE  69   6.993 -10.040 -10.040
  533    HB   ILE  69           HB       ILE  69   6.217  -7.933  -7.933
  534   1HG1  ILE  69          HG11      ILE  69   5.447  -8.724  -8.724
  535   2HG1  ILE  69          HG12      ILE  69   6.780  -9.870  -9.870
  536   1HG2  ILE  69          HG21      ILE  69   8.414  -7.159  -7.159
  537   2HG2  ILE  69          HG22      ILE  69   8.424  -8.350  -8.350
  538   3HG2  ILE  69          HG23      ILE  69   7.216  -7.078  -7.078
  539   1HD1  ILE  69          HD11      ILE  69   4.607  -9.982  -9.982
  540   2HD1  ILE  69          HD12      ILE  69   4.699 -10.999 -10.999
  541   3HD1  ILE  69          HD13      ILE  69   5.922 -11.138 -11.138
  542    H    ALA  70           HN       ALA  70   9.756  -8.894  -8.894
  543    HA   ALA  70           HA       ALA  70  10.274 -11.087 -11.087
  544   1HB   ALA  70           HB1      ALA  70  11.534  -8.907  -8.907
  545   2HB   ALA  70           HB2      ALA  70  12.335  -9.262  -9.262
  546   3HB   ALA  70           HB3      ALA  70  12.652 -10.255 -10.255
  547    H    ALA  71           HN       ALA  71  10.816 -10.552 -10.552
  548    HA   ALA  71           HA       ALA  71  12.371 -13.000 -13.000
  549   1HB   ALA  71           HB1      ALA  71  11.284 -10.951 -10.951
  550   2HB   ALA  71           HB2      ALA  71  12.389 -12.258 -12.258
  551   3HB   ALA  71           HB3      ALA  71  12.914 -10.969 -10.969
  552    H    TYR  72           HN       TYR  72   9.147 -11.761 -11.761
  553    HA   TYR  72           HA       TYR  72   8.042 -13.832 -13.832
  554   1HB   TYR  72           HB1      TYR  72   6.939 -11.731 -11.731
  555   2HB   TYR  72           HB2      TYR  72   6.807 -11.974 -11.974
  556    HD1  TYR  72           HD1      TYR  72   5.734 -13.599 -13.599
  557    HD2  TYR  72           HD2      TYR  72   4.832 -12.725 -12.725
  558    HE1  TYR  72           HE1      TYR  72   3.513 -14.603 -14.603
  559    HE2  TYR  72           HE2      TYR  72   2.615 -13.721 -13.721
  560    HH   TYR  72           HH       TYR  72   1.718 -15.716 -15.716
  561    H    ARG  73           HN       ARG  73   8.172 -13.378 -13.378
  562    HA   ARG  73           HA       ARG  73   6.801 -15.863 -15.863
  563   1HB   ARG  73           HB1      ARG  73   7.137 -15.195 -15.195
  564   2HB   ARG  73           HB2      ARG  73   6.732 -13.757 -13.757
  565   1HG   ARG  73           HG1      ARG  73   9.094 -13.064 -13.064
  566   2HG   ARG  73           HG2      ARG  73   9.552 -14.511 -14.511
  567   1HD   ARG  73           HD1      ARG  73   8.315 -13.878 -13.878
  568   2HD   ARG  73           HD2      ARG  73   7.480 -12.581 -12.581
  569    HE   ARG  73           HE       ARG  73   9.665 -11.397 -11.397
  570   1HH1  ARG  73          HH11      ARG  73  11.828 -12.902 -12.902
  571   2HH1  ARG  73          HH12      ARG  73  12.034 -12.908 -12.908
  572   1HH2  ARG  73          HH21      ARG  73   8.726 -11.859 -11.859
  573   2HH2  ARG  73          HH22      ARG  73  10.212 -12.294 -12.294
  574    H    ALA  74           HN       ALA  74  10.011 -14.682 -14.682
  575    HA   ALA  74           HA       ALA  74  11.615 -16.598 -16.598
  576   1HB   ALA  74           HB1      ALA  74  12.525 -14.739 -14.739
  577   2HB   ALA  74           HB2      ALA  74  11.986 -15.552 -15.552
  578   3HB   ALA  74           HB3      ALA  74  13.251 -16.258 -16.258
  579    H    LYS  75           HN       LYS  75   9.984 -16.903 -16.903
  580    HA   LYS  75           HA       LYS  75  10.048 -19.870 -19.870
  581   1HB   LYS  75           HB1      LYS  75  11.943 -19.041 -19.041
  582   2HB   LYS  75           HB2      LYS  75  10.785 -18.188 -18.188
  583   1HG   LYS  75           HG1      LYS  75  11.231 -20.235 -20.235
  584   2HG   LYS  75           HG2      LYS  75   9.652 -20.455 -20.455
  585   1HD   LYS  75           HD1      LYS  75  10.686 -21.723 -21.723
  586   2HD   LYS  75           HD2      LYS  75  12.280 -21.445 -21.445
  587   1HE   LYS  75           HE1      LYS  75  11.494 -23.700 -23.700
  588   2HE   LYS  75           HE2      LYS  75  11.591 -22.715 -22.715
  589   1HZ   LYS  75           HZ1      LYS  75   9.056 -22.380 -22.380
  590   2HZ   LYS  75           HZ2      LYS  75   9.383 -24.043 -24.043
  591   3HZ   LYS  75           HZ3      LYS  75   9.466 -23.089 -23.089
  592    H    GLY  76           HN       GLY  76   9.094 -17.474 -17.474
  593   1HA   GLY  76           HA1      GLY  76   7.064 -16.685 -16.685
  594   2HA   GLY  76           HA2      GLY  76   6.315 -17.326 -17.326
  595    H    LYS  77           HN       LYS  77   5.251 -19.004 -19.004
  596    HA   LYS  77           HA       LYS  77   3.950 -20.787 -20.787
  597   1HB   LYS  77           HB1      LYS  77   6.604 -21.349 -21.349
  598   2HB   LYS  77           HB2      LYS  77   5.336 -22.535 -22.535
  599   1HG   LYS  77           HG1      LYS  77   6.431 -21.184 -21.184
  600   2HG   LYS  77           HG2      LYS  77   7.224 -22.578 -22.578
  601   1HD   LYS  77           HD1      LYS  77   5.125 -23.905 -23.905
  602   2HD   LYS  77           HD2      LYS  77   4.256 -22.500 -22.500
  603   1HE   LYS  77           HE1      LYS  77   5.706 -22.413 -22.413
  604   2HE   LYS  77           HE2      LYS  77   6.632 -23.788 -23.788
  605   1HZ   LYS  77           HZ1      LYS  77   3.914 -24.454 -24.454
  606   2HZ   LYS  77           HZ2      LYS  77   4.273 -23.796 -23.796
  607   3HZ   LYS  77           HZ3      LYS  77   5.153 -25.128 -25.128
  608    HA   PRO  78           HA       PRO  78   1.978 -20.161 -20.161
  609   1HB   PRO  78           HB1      PRO  78   2.558 -23.094 -23.094
  610   2HB   PRO  78           HB2      PRO  78   1.062 -22.181 -22.181
  611   1HG   PRO  78           HG1      PRO  78   1.261 -23.753 -23.753
  612   2HG   PRO  78           HG2      PRO  78   0.676 -22.109 -22.109
  613   1HD   PRO  78           HD1      PRO  78   3.507 -23.168 -23.168
  614   2HD   PRO  78           HD2      PRO  78   2.589 -22.203 -22.203
  615    H    ASP  79           HN       ASP  79   4.872 -22.103 -22.103
  616    HA   ASP  79           HA       ASP  79   5.684 -20.399 -20.399
  617   1HB   ASP  79           HB1      ASP  79   6.231 -23.376 -23.376
  618   2HB   ASP  79           HB2      ASP  79   6.698 -22.401 -22.401
  619    H    ALA  80           HN       ALA  80   6.886 -19.052 -19.052
  620    HA   ALA  80           HA       ALA  80   8.737 -19.389 -19.389
  621   1HB   ALA  80           HB1      ALA  80   9.220 -17.749 -17.749
  622   2HB   ALA  80           HB2      ALA  80  10.062 -17.518 -17.518
  623   3HB   ALA  80           HB3      ALA  80   8.339 -17.216 -17.216
  624    H    ALA  81           HN       ALA  81   9.474 -19.868 -19.868
  625    HA   ALA  81           HA       ALA  81  12.139 -20.782 -20.782
  626   1HB   ALA  81           HB1      ALA  81  10.007 -21.459 -21.459
  627   2HB   ALA  81           HB2      ALA  81  11.730 -21.705 -21.705
  628   3HB   ALA  81           HB3      ALA  81  11.088 -20.077 -20.077
  629   1H1   BME  16           HE1      MER  16  -9.346   9.773   9.773
  630   2H1   BME  16           HE2      MER  16  -7.883   8.790   8.790
  631   1H2   BME  16           HZ1      MER  16  -8.549  11.349  11.349
  632   2H2   BME  16           HZ2      MER  16  -7.346  11.175  11.175
  633    HO1  BME  16           HH       MER  16  -8.910   9.245   9.245

  Start of MODEL   31
    1    H    ASN   3           HN       ASN   3  -2.683 -12.445 -12.445
    2    HA   ASN   3           HA       ASN   3   0.022 -11.264 -11.264
    3   1HB   ASN   3           HB1      ASN   3   0.613 -13.245 -13.245
    4   2HB   ASN   3           HB2      ASN   3  -0.016 -13.698 -13.698
    5   1HD2  ASN   3          HD21      ASN   3  -2.155 -14.573 -14.573
    6   2HD2  ASN   3          HD22      ASN   3  -0.681 -13.736 -13.736
    7    H    ALA   4           HN       ALA   4   1.102 -11.014 -11.014
    8    HA   ALA   4           HA       ALA   4   1.382 -10.204 -10.204
    9   1HB   ALA   4           HB1      ALA   4  -0.612 -11.550 -11.550
   10   2HB   ALA   4           HB2      ALA   4  -1.686 -10.247 -10.247
   11   3HB   ALA   4           HB3      ALA   4  -0.526  -9.989  -9.989
   12    HA   PRO   5           HA       PRO   5   0.778  -6.121  -6.121
   13   1HB   PRO   5           HB1      PRO   5   3.474  -5.981  -5.981
   14   2HB   PRO   5           HB2      PRO   5   2.962  -5.301  -5.301
   15   1HG   PRO   5           HG1      PRO   5   4.356  -7.567  -7.567
   16   2HG   PRO   5           HG2      PRO   5   2.888  -7.490  -7.490
   17   1HD   PRO   5           HD1      PRO   5   3.211  -8.732  -8.732
   18   2HD   PRO   5           HD2      PRO   5   2.447  -9.439  -9.439
   19    H    LYS   6           HN       LYS   6  -0.820  -5.380  -5.380
   20    HA   LYS   6           HA       LYS   6  -0.804  -5.084  -5.084
   21   1HB   LYS   6           HB1      LYS   6  -2.748  -4.898  -4.898
   22   2HB   LYS   6           HB2      LYS   6  -2.514  -3.208  -3.208
   23   1HG   LYS   6           HG1      LYS   6  -4.053  -3.548  -3.548
   24   2HG   LYS   6           HG2      LYS   6  -2.721  -4.245  -4.245
   25   1HD   LYS   6           HD1      LYS   6  -3.277  -6.509  -6.509
   26   2HD   LYS   6           HD2      LYS   6  -4.602  -5.807  -5.807
   27   1HE   LYS   6           HE1      LYS   6  -5.524  -6.795  -6.795
   28   2HE   LYS   6           HE2      LYS   6  -5.644  -5.048  -5.048
   29   1HZ   LYS   6           HZ1      LYS   6  -3.163  -5.851  -5.851
   30   2HZ   LYS   6           HZ2      LYS   6  -4.363  -6.836  -6.836
   31   3HZ   LYS   6           HZ3      LYS   6  -4.469  -5.149  -5.149
   32    H    ARG   7           HN       ARG   7  -1.113  -2.704  -2.704
   33    HA   ARG   7           HA       ARG   7   1.363  -1.439  -1.439
   34   1HB   ARG   7           HB1      ARG   7   0.269  -1.289  -1.289
   35   2HB   ARG   7           HB2      ARG   7  -1.105  -0.451  -0.451
   36   1HG   ARG   7           HG1      ARG   7   0.292   1.515   1.515
   37   2HG   ARG   7           HG2      ARG   7   1.739   0.668   0.668
   38   1HD   ARG   7           HD1      ARG   7  -0.641   1.291   1.291
   39   2HD   ARG   7           HD2      ARG   7   0.843   2.233   2.233
   40    HE   ARG   7           HE       ARG   7   2.055   0.178   0.178
   41   1HH1  ARG   7          HH11      ARG   7   1.070  -2.142  -2.142
   42   2HH1  ARG   7          HH12      ARG   7  -0.059  -2.226  -2.226
   43   1HH2  ARG   7          HH21      ARG   7  -0.434   1.251   1.251
   44   2HH2  ARG   7          HH22      ARG   7  -0.931  -0.256  -0.256
   45    HA   PRO   8           HA       PRO   8  -0.017   0.706   0.706
   46   1HB   PRO   8           HB1      PRO   8   2.379   2.033   2.033
   47   2HB   PRO   8           HB2      PRO   8   2.154   0.308   0.308
   48   1HG   PRO   8           HG1      PRO   8   3.285   1.678   1.678
   49   2HG   PRO   8           HG2      PRO   8   4.042   0.419   0.419
   50   1HD   PRO   8           HD1      PRO   8   2.714  -0.259  -0.259
   51   2HD   PRO   8           HD2      PRO   8   2.476  -1.257  -1.257
   52    HA   PRO   9           HA       PRO   9  -1.075   5.138   5.138
   53   1HB   PRO   9           HB1      PRO   9   1.622   5.538   5.538
   54   2HB   PRO   9           HB2      PRO   9   0.216   6.613   6.613
   55   1HG   PRO   9           HG1      PRO   9   0.428   4.819   4.819
   56   2HG   PRO   9           HG2      PRO   9  -1.140   4.955   4.955
   57   1HD   PRO   9           HD1      PRO   9   0.967   2.813   2.813
   58   2HD   PRO   9           HD2      PRO   9  -0.797   2.652   2.652
   59    H    SER  10           HN       SER  10  -0.425   7.156   7.156
   60    HA   SER  10           HA       SER  10   0.992   6.594   6.594
   61   1HB   SER  10           HB1      SER  10  -0.235   8.655   8.655
   62   2HB   SER  10           HB2      SER  10  -1.307   7.378   7.378
   63    HG   SER  10           HG       SER  10  -0.930   9.854   9.854
   64    H    ALA  11           HN       ALA  11   0.767   9.265   9.265
   65    HA   ALA  11           HA       ALA  11   3.189  10.094  10.094
   66   1HB   ALA  11           HB1      ALA  11   2.676  11.263  11.263
   67   2HB   ALA  11           HB2      ALA  11   3.963  11.746  11.746
   68   3HB   ALA  11           HB3      ALA  11   4.001  10.165  10.165
   69    H    PHE  12           HN       PHE  12   0.404  10.979  10.979
   70    HA   PHE  12           HA       PHE  12  -0.068  13.490  13.490
   71   1HB   PHE  12           HB1      PHE  12  -1.177  13.852  13.852
   72   2HB   PHE  12           HB2      PHE  12  -0.956  12.148  12.148
   73    HD1  PHE  12           HD1      PHE  12  -3.384  13.779  13.779
   74    HD2  PHE  12           HD2      PHE  12  -2.737  11.485  11.485
   75    HE1  PHE  12           HE1      PHE  12  -5.806  13.525  13.525
   76    HE2  PHE  12           HE2      PHE  12  -5.159  11.247  11.247
   77    HZ   PHE  12           HZ       PHE  12  -6.699  12.248  12.248
   78    H    PHE  13           HN       PHE  13  -0.454  10.220  10.220
   79    HA   PHE  13           HA       PHE  13  -2.942  10.288  10.288
   80   1HB   PHE  13           HB1      PHE  13  -1.275   8.285   8.285
   81   2HB   PHE  13           HB2      PHE  13  -0.817   8.489   8.489
   82    HD1  PHE  13           HD1      PHE  13  -3.682   7.968   7.968
   83    HD2  PHE  13           HD2      PHE  13  -2.356   7.830   7.830
   84    HE1  PHE  13           HE1      PHE  13  -5.794   6.902   6.902
   85    HE2  PHE  13           HE2      PHE  13  -4.472   6.765   6.765
   86    HZ   PHE  13           HZ       PHE  13  -6.193   6.302   6.302
   87    H    LEU  14           HN       LEU  14   0.475  10.753  10.753
   88    HA   LEU  14           HA       LEU  14   0.094  11.200  11.200
   89   1HB   LEU  14           HB1      LEU  14   2.096  12.618  12.618
   90   2HB   LEU  14           HB2      LEU  14   2.221  12.509  12.509
   91    HG   LEU  14           HG       LEU  14   3.780  10.986  10.986
   92   1HD1  LEU  14          HD11      LEU  14   2.464   9.856   9.856
   93   2HD1  LEU  14          HD12      LEU  14   1.360   9.217   9.217
   94   3HD1  LEU  14          HD13      LEU  14   3.041   8.701   8.701
   95   1HD2  LEU  14          HD21      LEU  14   3.337  10.975  10.975
   96   2HD2  LEU  14          HD22      LEU  14   3.548   9.332   9.332
   97   3HD2  LEU  14          HD23      LEU  14   1.944   9.923   9.923
   98    H    PHE  15           HN       PHE  15   0.373  13.481  13.481
   99    HA   PHE  15           HA       PHE  15  -0.303  15.925  15.925
  100   1HB   PHE  15           HB1      PHE  15   0.575  15.734  15.734
  101   2HB   PHE  15           HB2      PHE  15  -0.726  14.621  14.621
  102    HD1  PHE  15           HD1      PHE  15  -0.588  18.195  18.195
  103    HD2  PHE  15           HD2      PHE  15  -2.041  15.408  15.408
  104    HE1  PHE  15           HE1      PHE  15  -1.795  19.991  19.991
  105    HE2  PHE  15           HE2      PHE  15  -3.242  17.208  17.208
  106    HZ   PHE  15           HZ       PHE  15  -3.119  19.500  19.500
  107    H    CYS  16           HN       MER  16  -2.561  13.802  13.802
  108    HA   CYS  16           HA       MER  16  -4.997  15.054  15.054
  109   1HB   CYS  16           HB1      MER  16  -6.061  13.080  13.080
  110   2HB   CYS  16           HB2      MER  16  -4.522  12.935  12.935
  111    H    SER  17           HN       SER  17  -3.381  12.628  12.628
  112    HA   SER  17           HA       SER  17  -5.351  12.391  12.391
  113   1HB   SER  17           HB1      SER  17  -2.300  12.238  12.238
  114   2HB   SER  17           HB2      SER  17  -3.514  11.539  11.539
  115    HG   SER  17           HG       SER  17  -3.596   9.935   9.935
  116    H    GLU  18           HN       GLU  18  -2.683  14.610  14.610
  117    HA   GLU  18           HA       GLU  18  -3.254  16.065  16.065
  118   1HB   GLU  18           HB1      GLU  18  -1.000  15.834  15.834
  119   2HB   GLU  18           HB2      GLU  18  -1.560  16.803  16.803
  120   1HG   GLU  18           HG1      GLU  18  -1.911  18.747  18.747
  121   2HG   GLU  18           HG2      GLU  18  -1.528  17.790  17.790
  122    H    TYR  19           HN       TYR  19  -4.768  16.020  16.020
  123    HA   TYR  19           HA       TYR  19  -5.646  18.858  18.858
  124   1HB   TYR  19           HB1      TYR  19  -5.333  16.793  16.793
  125   2HB   TYR  19           HB2      TYR  19  -6.823  17.761  17.761
  126    HD1  TYR  19           HD1      TYR  19  -3.294  18.380  18.380
  127    HD2  TYR  19           HD2      TYR  19  -6.565  19.639  19.639
  128    HE1  TYR  19           HE1      TYR  19  -1.951  20.243  20.243
  129    HE2  TYR  19           HE2      TYR  19  -5.226  21.507  21.507
  130    HH   TYR  19           HH       TYR  19  -3.179  22.417  22.417
  131    H    ARG  20           HN       ARG  20  -6.987  15.658  15.658
  132    HA   ARG  20           HA       ARG  20  -9.566  15.633  15.633
  133   1HB   ARG  20           HB1      ARG  20  -7.915  14.687  14.687
  134   2HB   ARG  20           HB2      ARG  20  -9.643  14.722  14.722
  135   1HG   ARG  20           HG1      ARG  20  -9.818  13.461  13.461
  136   2HG   ARG  20           HG2      ARG  20  -8.089  13.202  13.202
  137   1HD   ARG  20           HD1      ARG  20 -10.153  12.414  12.414
  138   2HD   ARG  20           HD2      ARG  20  -9.439  11.302  11.302
  139    HE   ARG  20           HE       ARG  20  -7.763  12.796  12.796
  140   1HH1  ARG  20          HH11      ARG  20  -6.540  11.059  11.059
  141   2HH1  ARG  20          HH12      ARG  20  -6.300   9.564   9.564
  142   1HH2  ARG  20          HH21      ARG  20  -8.470  10.471  10.471
  143   2HH2  ARG  20          HH22      ARG  20  -7.431   9.219   9.219
  144    HA   PRO  21           HA       PRO  21 -11.361  17.863  17.863
  145   1HB   PRO  21           HB1      PRO  21 -10.113  18.635  18.635
  146   2HB   PRO  21           HB2      PRO  21 -10.100  16.913  16.913
  147   1HG   PRO  21           HG1      PRO  21  -7.920  18.975  18.975
  148   2HG   PRO  21           HG2      PRO  21  -7.745  17.460  17.460
  149   1HD   PRO  21           HD1      PRO  21  -7.329  17.607  17.607
  150   2HD   PRO  21           HD2      PRO  21  -7.970  16.151  16.151
  151    H    LYS  22           HN       LYS  22  -8.708  19.428  19.428
  152    HA   LYS  22           HA       LYS  22  -9.515  22.163  22.163
  153   1HB   LYS  22           HB1      LYS  22  -7.079  21.201  21.201
  154   2HB   LYS  22           HB2      LYS  22  -7.391  21.429  21.429
  155   1HG   LYS  22           HG1      LYS  22  -8.067  23.865  23.865
  156   2HG   LYS  22           HG2      LYS  22  -7.487  23.513  23.513
  157   1HD   LYS  22           HD1      LYS  22  -5.671  24.609  24.609
  158   2HD   LYS  22           HD2      LYS  22  -5.236  22.912  22.912
  159   1HE   LYS  22           HE1      LYS  22  -5.974  22.650  22.650
  160   2HE   LYS  22           HE2      LYS  22  -6.469  24.340  24.340
  161   1HZ   LYS  22           HZ1      LYS  22  -3.841  24.241  24.241
  162   2HZ   LYS  22           HZ2      LYS  22  -3.935  23.261  23.261
  163   3HZ   LYS  22           HZ3      LYS  22  -4.434  24.885  24.885
  164    H    ILE  23           HN       ILE  23  -9.721  19.983  19.983
  165    HA   ILE  23           HA       ILE  23 -10.825  22.214  22.214
  166    HB   ILE  23           HB       ILE  23 -10.973  20.407  20.407
  167   1HG1  ILE  23          HG11      ILE  23  -9.113  18.853  18.853
  168   2HG1  ILE  23          HG12      ILE  23 -10.808  18.436  18.436
  169   1HG2  ILE  23          HG21      ILE  23  -9.179  22.123  22.123
  170   2HG2  ILE  23          HG22      ILE  23  -8.251  21.079  21.079
  171   3HG2  ILE  23          HG23      ILE  23  -8.521  20.623  20.623
  172   1HD1  ILE  23          HD11      ILE  23  -8.754  18.549  18.549
  173   2HD1  ILE  23          HD12      ILE  23  -9.360  17.100  17.100
  174   3HD1  ILE  23          HD13      ILE  23 -10.444  18.118  18.118
  175    H    LYS  24           HN       LYS  24 -11.636  19.475  19.475
  176    HA   LYS  24           HA       LYS  24 -14.355  19.156  19.156
  177   1HB   LYS  24           HB1      LYS  24 -12.879  17.423  17.423
  178   2HB   LYS  24           HB2      LYS  24 -12.855  18.247  18.247
  179   1HG   LYS  24           HG1      LYS  24 -15.216  17.825  17.825
  180   2HG   LYS  24           HG2      LYS  24 -15.483  17.311  17.311
  181   1HD   LYS  24           HD1      LYS  24 -15.420  15.325  15.325
  182   2HD   LYS  24           HD2      LYS  24 -13.992  15.325  15.325
  183   1HE   LYS  24           HE1      LYS  24 -13.332  14.690  14.690
  184   2HE   LYS  24           HE2      LYS  24 -12.691  16.293  16.293
  185   1HZ   LYS  24           HZ1      LYS  24 -15.283  16.546  16.546
  186   2HZ   LYS  24           HZ2      LYS  24 -14.414  15.465  15.465
  187   3HZ   LYS  24           HZ3      LYS  24 -13.810  17.026  17.026
  188    H    GLY  25           HN       GLY  25 -12.589  20.996  20.996
  189   1HA   GLY  25           HA1      GLY  25 -14.845  21.846  21.846
  190   2HA   GLY  25           HA2      GLY  25 -13.211  22.534  22.534
  191    H    GLU  26           HN       GLU  26 -12.970  23.106  23.106
  192    HA   GLU  26           HA       GLU  26 -14.334  25.633  25.633
  193   1HB   GLU  26           HB1      GLU  26 -12.530  24.131  24.131
  194   2HB   GLU  26           HB2      GLU  26 -13.068  25.776  25.776
  195   1HG   GLU  26           HG1      GLU  26 -11.611  24.913  24.913
  196   2HG   GLU  26           HG2      GLU  26 -10.763  25.519  25.519
  197    H    HIS  27           HN       HIS  27 -14.386  22.684  22.684
  198    HA   HIS  27           HA       HIS  27 -17.006  23.408  23.408
  199   1HB   HIS  27           HB1      HIS  27 -14.814  21.744  21.744
  200   2HB   HIS  27           HB2      HIS  27 -16.260  22.405  22.405
  201    HD1  HIS  27           HD1      HIS  27 -16.271  25.183  25.183
  202    HD2  HIS  27           HD2      HIS  27 -12.626  23.374  23.374
  203    HE1  HIS  27           HE1      HIS  27 -14.588  26.933  26.933
  204    HA   PRO  28           HA       PRO  28 -17.829  19.362  19.362
  205   1HB   PRO  28           HB1      PRO  28 -19.781  20.131  20.131
  206   2HB   PRO  28           HB2      PRO  28 -18.092  20.422  20.422
  207   1HG   PRO  28           HG1      PRO  28 -20.022  22.366  22.366
  208   2HG   PRO  28           HG2      PRO  28 -19.116  22.654  22.654
  209   1HD   PRO  28           HD1      PRO  28 -18.126  23.455  23.455
  210   2HD   PRO  28           HD2      PRO  28 -17.005  22.854  22.854
  211    H    GLY  29           HN       GLY  29 -18.263  20.143  20.143
  212   1HA   GLY  29           HA1      GLY  29 -21.112  19.655  19.655
  213   2HA   GLY  29           HA2      GLY  29 -20.153  20.800  20.800
  214    H    LEU  30           HN       LEU  30 -17.726  19.133  19.133
  215    HA   LEU  30           HA       LEU  30 -17.940  17.604  17.604
  216   1HB   LEU  30           HB1      LEU  30 -15.872  17.440  17.440
  217   2HB   LEU  30           HB2      LEU  30 -15.619  16.907  16.907
  218    HG   LEU  30           HG       LEU  30 -16.138  19.772  19.772
  219   1HD1  LEU  30          HD11      LEU  30 -13.545  18.425  18.425
  220   2HD1  LEU  30          HD12      LEU  30 -13.731  20.141  20.141
  221   3HD1  LEU  30          HD13      LEU  30 -13.956  18.988  18.988
  222   1HD2  LEU  30          HD21      LEU  30 -16.819  19.339  19.339
  223   2HD2  LEU  30          HD22      LEU  30 -15.414  20.383  20.383
  224   3HD2  LEU  30          HD23      LEU  30 -15.211  18.693  18.693
  225    H    SER  31           HN       SER  31 -17.199  15.405  15.405
  226    HA   SER  31           HA       SER  31 -18.488  13.520  13.520
  227   1HB   SER  31           HB1      SER  31 -19.456  13.657  13.657
  228   2HB   SER  31           HB2      SER  31 -17.909  12.946  12.946
  229    HG   SER  31           HG       SER  31 -19.984  11.734  11.734
  230    H    ILE  32           HN       ILE  32 -17.324  11.278  11.278
  231    HA   ILE  32           HA       ILE  32 -14.539  11.762  11.762
  232    HB   ILE  32           HB       ILE  32 -16.154  10.004  10.004
  233   1HG1  ILE  32          HG11      ILE  32 -14.407   8.216   8.216
  234   2HG1  ILE  32          HG12      ILE  32 -13.440   9.018   9.018
  235   1HG2  ILE  32          HG21      ILE  32 -17.093   9.168   9.168
  236   2HG2  ILE  32          HG22      ILE  32 -15.519   8.558   8.558
  237   3HG2  ILE  32          HG23      ILE  32 -16.351   7.843   7.843
  238   1HD1  ILE  32          HD11      ILE  32 -14.253  10.246  10.246
  239   2HD1  ILE  32          HD12      ILE  32 -12.649   9.643   9.643
  240   3HD1  ILE  32          HD13      ILE  32 -13.284  11.058  11.058
  241    H    GLY  33           HN       GLY  33 -16.089  11.765  11.765
  242   1HA   GLY  33           HA1      GLY  33 -13.899  10.660  10.660
  243   2HA   GLY  33           HA2      GLY  33 -15.578  10.848  10.848
  244    H    ASP  34           HN       ASP  34 -15.194  13.475  13.475
  245    HA   ASP  34           HA       ASP  34 -14.277  15.128  15.128
  246   1HB   ASP  34           HB1      ASP  34 -16.025  15.696  15.696
  247   2HB   ASP  34           HB2      ASP  34 -15.581  16.980  16.980
  248    H    VAL  35           HN       VAL  35 -14.190  14.793  14.793
  249    HA   VAL  35           HA       VAL  35 -12.182  16.704  16.704
  250    HB   VAL  35           HB       VAL  35 -12.934  14.008  14.008
  251   1HG1  VAL  35          HG11      VAL  35 -10.586  14.553  14.553
  252   2HG1  VAL  35          HG12      VAL  35 -11.124  16.134  16.134
  253   3HG1  VAL  35          HG13      VAL  35 -11.660  14.696  14.696
  254   1HG2  VAL  35          HG21      VAL  35 -13.518  16.864  16.864
  255   2HG2  VAL  35          HG22      VAL  35 -14.669  15.724  15.724
  256   3HG2  VAL  35          HG23      VAL  35 -13.977  15.427  15.427
  257    H    ALA  36           HN       ALA  36 -12.158  13.485  13.485
  258    HA   ALA  36           HA       ALA  36  -9.341  13.049  13.049
  259   1HB   ALA  36           HB1      ALA  36 -10.990  11.272  11.272
  260   2HB   ALA  36           HB2      ALA  36 -11.679  11.610  11.610
  261   3HB   ALA  36           HB3      ALA  36 -10.069  10.906  10.906
  262    H    LYS  37           HN       LYS  37 -11.660  13.651  13.651
  263    HA   LYS  37           HA       LYS  37  -9.392  13.638  13.638
  264   1HB   LYS  37           HB1      LYS  37 -10.967  13.830  13.830
  265   2HB   LYS  37           HB2      LYS  37 -11.805  12.922  12.922
  266   1HG   LYS  37           HG1      LYS  37 -13.468  14.423  14.423
  267   2HG   LYS  37           HG2      LYS  37 -12.653  15.355  15.355
  268   1HD   LYS  37           HD1      LYS  37 -11.519  16.755  16.755
  269   2HD   LYS  37           HD2      LYS  37 -11.877  15.663  15.663
  270   1HE   LYS  37           HE1      LYS  37 -13.957  17.249  17.249
  271   2HE   LYS  37           HE2      LYS  37 -13.331  17.694  17.694
  272   1HZ   LYS  37           HZ1      LYS  37 -14.161  15.026  15.026
  273   2HZ   LYS  37           HZ2      LYS  37 -15.409  15.938  15.938
  274   3HZ   LYS  37           HZ3      LYS  37 -14.796  16.366  16.366
  275    H    LYS  38           HN       LYS  38 -10.829  15.978  15.978
  276    HA   LYS  38           HA       LYS  38 -10.099  18.266  18.266
  277   1HB   LYS  38           HB1      LYS  38 -12.033  18.348  18.348
  278   2HB   LYS  38           HB2      LYS  38 -10.913  18.125  18.125
  279   1HG   LYS  38           HG1      LYS  38  -9.743  20.228  20.228
  280   2HG   LYS  38           HG2      LYS  38 -10.847  20.435  20.435
  281   1HD   LYS  38           HD1      LYS  38 -12.764  20.571  20.571
  282   2HD   LYS  38           HD2      LYS  38 -11.643  20.379  20.379
  283   1HE   LYS  38           HE1      LYS  38 -11.564  22.657  22.657
  284   2HE   LYS  38           HE2      LYS  38 -12.184  22.787  22.787
  285   1HZ   LYS  38           HZ1      LYS  38  -9.623  21.660  21.660
  286   2HZ   LYS  38           HZ2      LYS  38  -9.559  23.051  23.051
  287   3HZ   LYS  38           HZ3      LYS  38 -10.152  23.149  23.149
  288    H    LEU  39           HN       LEU  39  -9.031  16.855  16.855
  289    HA   LEU  39           HA       LEU  39  -6.615  18.467  18.467
  290   1HB   LEU  39           HB1      LEU  39  -6.427  17.869  17.869
  291   2HB   LEU  39           HB2      LEU  39  -8.096  17.398  17.398
  292    HG   LEU  39           HG       LEU  39  -7.051  15.113  15.113
  293   1HD1  LEU  39          HD11      LEU  39  -4.960  16.548  16.548
  294   2HD1  LEU  39          HD12      LEU  39  -4.973  14.827  14.827
  295   3HD1  LEU  39          HD13      LEU  39  -4.687  15.855  15.855
  296   1HD2  LEU  39          HD21      LEU  39  -8.556  15.677  15.677
  297   2HD2  LEU  39          HD22      LEU  39  -7.301  14.551  14.551
  298   3HD2  LEU  39          HD23      LEU  39  -7.140  16.248  16.248
  299    H    GLY  40           HN       GLY  40  -7.565  15.378  15.378
  300   1HA   GLY  40           HA1      GLY  40  -4.864  14.340  14.340
  301   2HA   GLY  40           HA2      GLY  40  -6.209  13.808  13.808
  302    H    GLU  41           HN       GLU  41  -6.884  16.458  16.458
  303    HA   GLU  41           HA       GLU  41  -4.977  16.701  16.701
  304   1HB   GLU  41           HB1      GLU  41  -7.451  18.100  18.100
  305   2HB   GLU  41           HB2      GLU  41  -6.420  18.970  18.970
  306   1HG   GLU  41           HG1      GLU  41  -8.038  17.792  17.792
  307   2HG   GLU  41           HG2      GLU  41  -6.472  17.059  17.059
  308    H    MET  42           HN       MET  42  -5.809  18.638  18.638
  309    HA   MET  42           HA       MET  42  -4.066  20.781  20.781
  310   1HB   MET  42           HB1      MET  42  -4.736  19.232  19.232
  311   2HB   MET  42           HB2      MET  42  -3.906  20.778  20.778
  312   1HG   MET  42           HG1      MET  42  -6.575  20.373  20.373
  313   2HG   MET  42           HG2      MET  42  -6.517  20.836  20.836
  314   1HE   MET  42           HE1      MET  42  -6.232  21.758  21.758
  315   2HE   MET  42           HE2      MET  42  -7.801  22.046  22.046
  316   3HE   MET  42           HE3      MET  42  -6.869  23.386  23.386
  317    H    TRP  43           HN       TRP  43  -3.434  17.681  17.681
  318    HA   TRP  43           HA       TRP  43  -0.765  17.813  17.813
  319   1HB   TRP  43           HB1      TRP  43  -2.046  15.866  15.866
  320   2HB   TRP  43           HB2      TRP  43  -2.433  15.553  15.553
  321    HD1  TRP  43           HD1      TRP  43  -0.820  14.053  14.053
  322    HE1  TRP  43           HE1      TRP  43   1.444  13.138  13.138
  323    HE3  TRP  43           HE3      TRP  43  -0.023  16.499  16.499
  324    HZ2  TRP  43           HZ2      TRP  43   3.476  13.353  13.353
  325    HZ3  TRP  43           HZ3      TRP  43   1.965  16.174  16.174
  326    HH2  TRP  43           HH2      TRP  43   3.754  14.599  14.599
  327    H    ASN  44           HN       ASN  44  -2.124  16.963  16.963
  328    HA   ASN  44           HA       ASN  44   0.360  16.514  16.514
  329   1HB   ASN  44           HB1      ASN  44  -2.291  17.371  17.371
  330   2HB   ASN  44           HB2      ASN  44  -0.892  16.719  16.719
  331   1HD2  ASN  44          HD21      ASN  44  -3.437  14.085  14.085
  332   2HD2  ASN  44          HD22      ASN  44  -3.807  15.670  15.670
  333    H    ASN  45           HN       ASN  45  -0.906  19.350  19.350
  334    HA   ASN  45           HA       ASN  45   1.132  21.013  21.013
  335   1HB   ASN  45           HB1      ASN  45  -0.592  22.768  22.768
  336   2HB   ASN  45           HB2      ASN  45  -0.943  21.285  21.285
  337   1HD2  ASN  45          HD21      ASN  45  -4.117  20.978  20.978
  338   2HD2  ASN  45          HD22      ASN  45  -3.091  20.513  20.513
  339    H    THR  46           HN       THR  46   1.067  20.042  20.042
  340    HA   THR  46           HA       THR  46  -0.016  22.148  22.148
  341    HB   THR  46           HB       THR  46   0.175  19.847  19.847
  342    HG1  THR  46           HG1      THR  46   0.551  20.905  20.905
  343   1HG2  THR  46          HG21      THR  46   2.381  19.102  19.102
  344   2HG2  THR  46          HG22      THR  46   3.232  20.186  20.186
  345   3HG2  THR  46          HG23      THR  46   2.322  18.847  18.847
  346    H    ALA  47           HN       ALA  47   3.255  21.135  21.135
  347    HA   ALA  47           HA       ALA  47   4.206  23.826  23.826
  348   1HB   ALA  47           HB1      ALA  47   4.205  23.714  23.714
  349   2HB   ALA  47           HB2      ALA  47   5.230  22.289  22.289
  350   3HB   ALA  47           HB3      ALA  47   5.832  23.839  23.839
  351    H    ALA  48           HN       ALA  48   5.072  20.575  20.575
  352    HA   ALA  48           HA       ALA  48   6.299  18.959  18.959
  353   1HB   ALA  48           HB1      ALA  48   6.229  20.341  20.341
  354   2HB   ALA  48           HB2      ALA  48   7.596  21.282  21.282
  355   3HB   ALA  48           HB3      ALA  48   7.778  19.570  19.570
  356    H    ASP  49           HN       ASP  49   6.995  21.572  21.572
  357    HA   ASP  49           HA       ASP  49   9.674  20.813  20.813
  358   1HB   ASP  49           HB1      ASP  49   9.571  23.052  23.052
  359   2HB   ASP  49           HB2      ASP  49   8.152  23.462  23.462
  360    H    ASP  50           HN       ASP  50   6.441  20.631  20.631
  361    HA   ASP  50           HA       ASP  50   6.625  20.564  20.564
  362   1HB   ASP  50           HB1      ASP  50   5.012  22.297  22.297
  363   2HB   ASP  50           HB2      ASP  50   4.230  21.098  21.098
  364    H    LYS  51           HN       LYS  51   6.387  18.881  18.881
  365    HA   LYS  51           HA       LYS  51   4.787  16.634  16.634
  366   1HB   LYS  51           HB1      LYS  51   6.502  16.815  16.815
  367   2HB   LYS  51           HB2      LYS  51   5.286  15.604  15.604
  368   1HG   LYS  51           HG1      LYS  51   3.545  17.344  17.344
  369   2HG   LYS  51           HG2      LYS  51   4.747  18.580  18.580
  370   1HD   LYS  51           HD1      LYS  51   3.751  18.019  18.019
  371   2HD   LYS  51           HD2      LYS  51   5.318  17.222  17.222
  372   1HE   LYS  51           HE1      LYS  51   4.262  15.126  15.126
  373   2HE   LYS  51           HE2      LYS  51   2.697  15.949  15.949
  374   1HZ   LYS  51           HZ1      LYS  51   3.991  16.372  16.372
  375   2HZ   LYS  51           HZ2      LYS  51   4.083  14.715  14.715
  376   3HZ   LYS  51           HZ3      LYS  51   2.568  15.486  15.486
  377    H    GLN  52           HN       GLN  52   8.075  17.285  17.285
  378    HA   GLN  52           HA       GLN  52   9.558  15.158  15.158
  379   1HB   GLN  52           HB1      GLN  52  10.090  17.908  17.908
  380   2HB   GLN  52           HB2      GLN  52  10.674  17.409  17.409
  381   1HG   GLN  52           HG1      GLN  52  12.516  17.275  17.275
  382   2HG   GLN  52           HG2      GLN  52  12.074  15.640  15.640
  383   1HE2  GLN  52          HE21      GLN  52  10.312  16.048  16.048
  384   2HE2  GLN  52          HE22      GLN  52   9.640  16.625  16.625
  385    HA   PRO  53           HA       PRO  53   9.786  15.179  15.179
  386   1HB   PRO  53           HB1      PRO  53   7.514  16.281  16.281
  387   2HB   PRO  53           HB2      PRO  53   9.064  17.110  17.110
  388   1HG   PRO  53           HG1      PRO  53   6.668  17.158  17.158
  389   2HG   PRO  53           HG2      PRO  53   7.520  18.543  18.543
  390   1HD   PRO  53           HD1      PRO  53   8.248  17.808  17.808
  391   2HD   PRO  53           HD2      PRO  53   9.558  18.027  18.027
  392    H    TYR  54           HN       TYR  54   6.564  15.148  15.148
  393    HA   TYR  54           HA       TYR  54   5.669  12.796  12.796
  394   1HB   TYR  54           HB1      TYR  54   4.508  14.181  14.181
  395   2HB   TYR  54           HB2      TYR  54   3.675  12.968  12.968
  396    HD1  TYR  54           HD1      TYR  54   4.057  13.680  13.680
  397    HD2  TYR  54           HD2      TYR  54   3.696  16.314  16.314
  398    HE1  TYR  54           HE1      TYR  54   3.294  15.458  15.458
  399    HE2  TYR  54           HE2      TYR  54   2.931  18.095  18.095
  400    HH   TYR  54           HH       TYR  54   3.335  18.087  18.087
  401    H    GLU  55           HN       GLU  55   6.480  13.491  13.491
  402    HA   GLU  55           HA       GLU  55   6.189  10.939  10.939
  403   1HB   GLU  55           HB1      GLU  55   7.334  13.487  13.487
  404   2HB   GLU  55           HB2      GLU  55   8.519  12.283  12.283
  405   1HG   GLU  55           HG1      GLU  55   6.671  11.019  11.019
  406   2HG   GLU  55           HG2      GLU  55   5.569  12.310  12.310
  407    H    LYS  56           HN       LYS  56   9.115  12.289  12.289
  408    HA   LYS  56           HA       LYS  56  10.920  10.258  10.258
  409   1HB   LYS  56           HB1      LYS  56  11.383  12.465  12.465
  410   2HB   LYS  56           HB2      LYS  56  10.399  12.068  12.068
  411   1HG   LYS  56           HG1      LYS  56  12.748  10.285  10.285
  412   2HG   LYS  56           HG2      LYS  56  13.065  11.859  11.859
  413   1HD   LYS  56           HD1      LYS  56  11.594  11.320  11.320
  414   2HD   LYS  56           HD2      LYS  56  11.251   9.736   9.736
  415   1HE   LYS  56           HE1      LYS  56  13.044   9.583   9.583
  416   2HE   LYS  56           HE2      LYS  56  13.678   9.163   9.163
  417   1HZ   LYS  56           HZ1      LYS  56  13.923  11.929  11.929
  418   2HZ   LYS  56           HZ2      LYS  56  14.546  11.156  11.156
  419   3HZ   LYS  56           HZ3      LYS  56  15.147  10.765  10.765
  420    H    LYS  57           HN       LYS  57   8.252  10.426  10.426
  421    HA   LYS  57           HA       LYS  57   8.993   7.993   7.993
  422   1HB   LYS  57           HB1      LYS  57   6.403   9.622   9.622
  423   2HB   LYS  57           HB2      LYS  57   6.558   8.146   8.146
  424   1HG   LYS  57           HG1      LYS  57   8.475   9.125   9.125
  425   2HG   LYS  57           HG2      LYS  57   8.290  10.622  10.622
  426   1HD   LYS  57           HD1      LYS  57   6.107  11.045  11.045
  427   2HD   LYS  57           HD2      LYS  57   5.988   9.423   9.423
  428   1HE   LYS  57           HE1      LYS  57   8.061  11.480  11.480
  429   2HE   LYS  57           HE2      LYS  57   6.575  11.108  11.108
  430   1HZ   LYS  57           HZ1      LYS  57   7.869   8.699   8.699
  431   2HZ   LYS  57           HZ2      LYS  57   9.021   9.766   9.766
  432   3HZ   LYS  57           HZ3      LYS  57   7.595   9.434   9.434
  433    H    ALA  58           HN       ALA  58   6.462   8.870   8.870
  434    HA   ALA  58           HA       ALA  58   5.210   6.467   6.467
  435   1HB   ALA  58           HB1      ALA  58   4.677   8.558   8.558
  436   2HB   ALA  58           HB2      ALA  58   6.163   8.414   8.414
  437   3HB   ALA  58           HB3      ALA  58   4.893   7.219   7.219
  438    H    ALA  59           HN       ALA  59   8.211   7.558   7.558
  439    HA   ALA  59           HA       ALA  59   8.901   5.357   5.357
  440   1HB   ALA  59           HB1      ALA  59  10.185   7.502   7.502
  441   2HB   ALA  59           HB2      ALA  59  10.777   7.127   7.127
  442   3HB   ALA  59           HB3      ALA  59  11.270   6.142   6.142
  443    H    LYS  60           HN       LYS  60  10.071   5.943   5.943
  444    HA   LYS  60           HA       LYS  60  11.313   3.498   3.498
  445   1HB   LYS  60           HB1      LYS  60  11.198   5.636   5.636
  446   2HB   LYS  60           HB2      LYS  60   9.714   4.989   4.989
  447   1HG   LYS  60           HG1      LYS  60  12.255   3.312   3.312
  448   2HG   LYS  60           HG2      LYS  60  11.987   4.471   4.471
  449   1HD   LYS  60           HD1      LYS  60  10.162   3.307   3.307
  450   2HD   LYS  60           HD2      LYS  60   9.829   2.399   2.399
  451   1HE   LYS  60           HE1      LYS  60  10.900   0.984   0.984
  452   2HE   LYS  60           HE2      LYS  60  11.913   1.087   1.087
  453   1HZ   LYS  60           HZ1      LYS  60  12.579   3.197   3.197
  454   2HZ   LYS  60           HZ2      LYS  60  12.563   1.755   1.755
  455   3HZ   LYS  60           HZ3      LYS  60  13.525   1.878   1.878
  456    H    LEU  61           HN       LEU  61   7.896   4.286   4.286
  457    HA   LEU  61           HA       LEU  61   7.125   1.725   1.725
  458   1HB   LEU  61           HB1      LEU  61   5.451   3.645   3.645
  459   2HB   LEU  61           HB2      LEU  61   4.818   2.406   2.406
  460    HG   LEU  61           HG       LEU  61   6.534   4.795   4.795
  461   1HD1  LEU  61          HD11      LEU  61   3.616   4.189   4.189
  462   2HD1  LEU  61          HD12      LEU  61   4.521   5.550   5.550
  463   3HD1  LEU  61          HD13      LEU  61   4.267   5.423   5.423
  464   1HD2  LEU  61          HD21      LEU  61   5.326   2.598   2.598
  465   2HD2  LEU  61          HD22      LEU  61   7.038   2.844   2.844
  466   3HD2  LEU  61          HD23      LEU  61   6.133   4.047   4.047
  467    H    LYS  62           HN       LYS  62   6.793   2.903   2.903
  468    HA   LYS  62           HA       LYS  62   5.988   0.566   0.566
  469   1HB   LYS  62           HB1      LYS  62   6.343   2.662   2.662
  470   2HB   LYS  62           HB2      LYS  62   8.053   2.649   2.649
  471   1HG   LYS  62           HG1      LYS  62   8.279   0.504   0.504
  472   2HG   LYS  62           HG2      LYS  62   6.588   0.621   0.621
  473   1HD   LYS  62           HD1      LYS  62   6.922   2.557   2.557
  474   2HD   LYS  62           HD2      LYS  62   8.428   2.965   2.965
  475   1HE   LYS  62           HE1      LYS  62   8.066   0.512   0.512
  476   2HE   LYS  62           HE2      LYS  62   8.799   2.025   2.025
  477   1HZ   LYS  62           HZ1      LYS  62   9.977   1.217   1.217
  478   2HZ   LYS  62           HZ2      LYS  62  10.007  -0.089  -0.089
  479   3HZ   LYS  62           HZ3      LYS  62  10.697   1.398   1.398
  480    H    GLU  63           HN       GLU  63   9.253   1.534   1.534
  481    HA   GLU  63           HA       GLU  63  10.747  -0.679  -0.679
  482   1HB   GLU  63           HB1      GLU  63  11.367   1.735   1.735
  483   2HB   GLU  63           HB2      GLU  63  11.465   0.725   0.725
  484   1HG   GLU  63           HG1      GLU  63  13.207  -0.689  -0.689
  485   2HG   GLU  63           HG2      GLU  63  13.115   0.332   0.332
  486    H    LYS  64           HN       LYS  64   9.304  -0.042  -0.042
  487    HA   LYS  64           HA       LYS  64   9.977  -2.319  -2.319
  488   1HB   LYS  64           HB1      LYS  64   8.562  -0.251  -0.251
  489   2HB   LYS  64           HB2      LYS  64   7.173  -1.114  -1.114
  490   1HG   LYS  64           HG1      LYS  64   7.693  -3.043  -3.043
  491   2HG   LYS  64           HG2      LYS  64   8.991  -2.094  -2.094
  492   1HD   LYS  64           HD1      LYS  64   7.253  -0.280  -0.280
  493   2HD   LYS  64           HD2      LYS  64   6.019  -1.421  -1.421
  494   1HE   LYS  64           HE1      LYS  64   7.991  -1.829  -1.829
  495   2HE   LYS  64           HE2      LYS  64   6.271  -1.513  -1.513
  496   1HZ   LYS  64           HZ1      LYS  64   6.582  -3.707  -3.707
  497   2HZ   LYS  64           HZ2      LYS  64   7.574  -3.963  -3.963
  498   3HZ   LYS  64           HZ3      LYS  64   5.914  -3.667  -3.667
  499    H    TYR  65           HN       TYR  65   7.110  -1.862  -1.862
  500    HA   TYR  65           HA       TYR  65   5.916  -4.372  -4.372
  501   1HB   TYR  65           HB1      TYR  65   4.750  -2.625  -2.625
  502   2HB   TYR  65           HB2      TYR  65   6.139  -2.226  -2.226
  503    HD1  TYR  65           HD1      TYR  65   5.226  -5.784  -5.784
  504    HD2  TYR  65           HD2      TYR  65   4.438  -2.000  -2.000
  505    HE1  TYR  65           HE1      TYR  65   4.186  -6.895  -6.895
  506    HE2  TYR  65           HE2      TYR  65   3.397  -3.114  -3.114
  507    HH   TYR  65           HH       TYR  65   3.829  -6.013  -6.013
  508    H    GLU  66           HN       GLU  66   8.048  -3.267  -3.267
  509    HA   GLU  66           HA       GLU  66   8.532  -5.561  -5.561
  510   1HB   GLU  66           HB1      GLU  66  10.566  -3.477  -3.477
  511   2HB   GLU  66           HB2      GLU  66  10.709  -4.595  -4.595
  512   1HG   GLU  66           HG1      GLU  66   8.185  -2.946  -2.946
  513   2HG   GLU  66           HG2      GLU  66   9.644  -2.062  -2.062
  514    H    LYS  67           HN       LYS  67   9.839  -4.854  -4.854
  515    HA   LYS  67           HA       LYS  67  11.820  -7.006  -7.006
  516   1HB   LYS  67           HB1      LYS  67  11.163  -4.756  -4.756
  517   2HB   LYS  67           HB2      LYS  67  11.916  -6.159  -6.159
  518   1HG   LYS  67           HG1      LYS  67  13.589  -4.536  -4.536
  519   2HG   LYS  67           HG2      LYS  67  13.778  -5.998  -5.998
  520   1HD   LYS  67           HD1      LYS  67  12.675  -4.863  -4.863
  521   2HD   LYS  67           HD2      LYS  67  12.466  -3.417  -3.417
  522   1HE   LYS  67           HE1      LYS  67  14.477  -3.221  -3.221
  523   2HE   LYS  67           HE2      LYS  67  14.913  -3.204  -3.204
  524   1HZ   LYS  67           HZ1      LYS  67  14.872  -5.861  -5.861
  525   2HZ   LYS  67           HZ2      LYS  67  15.749  -4.977  -4.977
  526   3HZ   LYS  67           HZ3      LYS  67  16.205  -4.929  -4.929
  527    H    ASP  68           HN       ASP  68   8.835  -6.322  -6.322
  528    HA   ASP  68           HA       ASP  68   8.688  -8.628  -8.628
  529   1HB   ASP  68           HB1      ASP  68   6.742  -6.519  -6.519
  530   2HB   ASP  68           HB2      ASP  68   6.262  -7.877  -7.877
  531    H    ILE  69           HN       ILE  69   8.000  -7.825  -7.825
  532    HA   ILE  69           HA       ILE  69   6.168 -10.110 -10.110
  533    HB   ILE  69           HB       ILE  69   5.687  -8.069  -8.069
  534   1HG1  ILE  69          HG11      ILE  69   5.502  -8.998  -8.998
  535   2HG1  ILE  69          HG12      ILE  69   6.832 -10.118 -10.118
  536   1HG2  ILE  69          HG21      ILE  69   8.015  -7.301  -7.301
  537   2HG2  ILE  69          HG22      ILE  69   8.357  -8.544  -8.544
  538   3HG2  ILE  69          HG23      ILE  69   7.194  -7.282  -7.282
  539   1HD1  ILE  69          HD11      ILE  69   4.199 -10.156 -10.156
  540   2HD1  ILE  69          HD12      ILE  69   4.657 -11.270 -11.270
  541   3HD1  ILE  69          HD13      ILE  69   5.529 -11.290 -11.290
  542    H    ALA  70           HN       ALA  70   9.265  -9.035  -9.035
  543    HA   ALA  70           HA       ALA  70  10.163 -11.314 -11.314
  544   1HB   ALA  70           HB1      ALA  70  11.827  -9.479  -9.479
  545   2HB   ALA  70           HB2      ALA  70  12.497 -10.533 -10.533
  546   3HB   ALA  70           HB3      ALA  70  11.506  -9.164  -9.164
  547    H    ALA  71           HN       ALA  71   9.937 -10.537 -10.537
  548    HA   ALA  71           HA       ALA  71  11.256 -12.942 -12.942
  549   1HB   ALA  71           HB1      ALA  71   9.520 -10.913 -10.913
  550   2HB   ALA  71           HB2      ALA  71  10.479 -12.171 -12.171
  551   3HB   ALA  71           HB3      ALA  71  11.275 -10.874 -10.874
  552    H    TYR  72           HN       TYR  72   7.944 -11.760 -11.760
  553    HA   TYR  72           HA       TYR  72   6.622 -13.989 -13.989
  554   1HB   TYR  72           HB1      TYR  72   5.391 -12.000 -12.000
  555   2HB   TYR  72           HB2      TYR  72   5.833 -11.929 -11.929
  556    HD1  TYR  72           HD1      TYR  72   4.346 -14.652 -14.652
  557    HD2  TYR  72           HD2      TYR  72   3.962 -12.178 -12.178
  558    HE1  TYR  72           HE1      TYR  72   2.310 -15.851 -15.851
  559    HE2  TYR  72           HE2      TYR  72   1.932 -13.370 -13.370
  560    HH   TYR  72           HH       TYR  72   1.103 -16.106 -16.106
  561    H    ARG  73           HN       ARG  73   7.540 -13.500 -13.500
  562    HA   ARG  73           HA       ARG  73   6.275 -15.952 -15.952
  563   1HB   ARG  73           HB1      ARG  73   6.950 -15.290 -15.290
  564   2HB   ARG  73           HB2      ARG  73   6.869 -13.748 -13.748
  565   1HG   ARG  73           HG1      ARG  73   9.362 -13.887 -13.887
  566   2HG   ARG  73           HG2      ARG  73   9.386 -15.344 -15.344
  567   1HD   ARG  73           HD1      ARG  73   7.971 -13.433 -13.433
  568   2HD   ARG  73           HD2      ARG  73   9.338 -12.569 -12.569
  569    HE   ARG  73           HE       ARG  73  10.803 -14.387 -14.387
  570   1HH1  ARG  73          HH11      ARG  73   8.471 -16.159 -16.159
  571   2HH1  ARG  73          HH12      ARG  73   8.361 -15.889 -15.889
  572   1HH2  ARG  73          HH21      ARG  73  10.337 -12.995 -12.995
  573   2HH2  ARG  73          HH22      ARG  73   9.447 -14.049 -14.049
  574    H    ALA  74           HN       ALA  74   9.287 -14.913 -14.913
  575    HA   ALA  74           HA       ALA  74  10.825 -17.243 -17.243
  576   1HB   ALA  74           HB1      ALA  74  11.242 -15.314 -15.314
  577   2HB   ALA  74           HB2      ALA  74  12.438 -16.452 -16.452
  578   3HB   ALA  74           HB3      ALA  74  11.899 -15.130 -15.130
  579    H    LYS  75           HN       LYS  75   8.832 -16.345 -16.345
  580    HA   LYS  75           HA       LYS  75   7.368 -17.702 -17.702
  581   1HB   LYS  75           HB1      LYS  75   8.336 -19.945 -19.945
  582   2HB   LYS  75           HB2      LYS  75   9.672 -19.787 -19.787
  583   1HG   LYS  75           HG1      LYS  75   8.080 -21.214 -21.214
  584   2HG   LYS  75           HG2      LYS  75   7.940 -19.673 -19.673
  585   1HD   LYS  75           HD1      LYS  75   5.681 -20.098 -20.098
  586   2HD   LYS  75           HD2      LYS  75   6.006 -19.274 -19.274
  587   1HE   LYS  75           HE1      LYS  75   6.419 -21.496 -21.496
  588   2HE   LYS  75           HE2      LYS  75   5.996 -22.284 -22.284
  589   1HZ   LYS  75           HZ1      LYS  75   3.987 -20.447 -20.447
  590   2HZ   LYS  75           HZ2      LYS  75   4.294 -21.375 -21.375
  591   3HZ   LYS  75           HZ3      LYS  75   3.892 -22.140 -22.140
  592    H    GLY  76           HN       GLY  76   8.296 -15.636 -15.636
  593   1HA   GLY  76           HA1      GLY  76   9.990 -15.895 -15.895
  594   2HA   GLY  76           HA2      GLY  76  10.032 -14.485 -14.485
  595    H    LYS  77           HN       LYS  77   7.818 -16.440 -16.440
  596    HA   LYS  77           HA       LYS  77   6.116 -14.109 -14.109
  597   1HB   LYS  77           HB1      LYS  77   5.757 -17.100 -17.100
  598   2HB   LYS  77           HB2      LYS  77   4.807 -16.209 -16.209
  599   1HG   LYS  77           HG1      LYS  77   4.002 -14.752 -14.752
  600   2HG   LYS  77           HG2      LYS  77   4.802 -15.864 -15.864
  601   1HD   LYS  77           HD1      LYS  77   3.376 -17.712 -17.712
  602   2HD   LYS  77           HD2      LYS  77   2.761 -16.840 -16.840
  603   1HE   LYS  77           HE1      LYS  77   2.309 -15.984 -15.984
  604   2HE   LYS  77           HE2      LYS  77   1.114 -16.821 -16.821
  605   1HZ   LYS  77           HZ1      LYS  77   2.107 -14.643 -14.643
  606   2HZ   LYS  77           HZ2      LYS  77   1.657 -14.095 -14.095
  607   3HZ   LYS  77           HZ3      LYS  77   0.529 -14.909 -14.909
  608    HA   PRO  78           HA       PRO  78   7.479 -14.003 -14.003
  609   1HB   PRO  78           HB1      PRO  78   4.649 -13.865 -13.865
  610   2HB   PRO  78           HB2      PRO  78   5.906 -12.629 -12.629
  611   1HG   PRO  78           HG1      PRO  78   3.866 -12.262 -12.262
  612   2HG   PRO  78           HG2      PRO  78   5.509 -11.859 -11.859
  613   1HD   PRO  78           HD1      PRO  78   4.020 -14.499 -14.499
  614   2HD   PRO  78           HD2      PRO  78   4.743 -13.426 -13.426
  615    H    ASP  79           HN       ASP  79   6.048 -16.552 -16.552
  616    HA   ASP  79           HA       ASP  79   6.428 -18.189 -18.189
  617   1HB   ASP  79           HB1      ASP  79   4.186 -18.515 -18.515
  618   2HB   ASP  79           HB2      ASP  79   4.403 -19.496 -19.496
  619    H    ALA  80           HN       ALA  80   8.386 -17.806 -17.806
  620    HA   ALA  80           HA       ALA  80   9.094 -19.105 -19.105
  621   1HB   ALA  80           HB1      ALA  80  10.779 -18.296 -18.296
  622   2HB   ALA  80           HB2      ALA  80  10.515 -19.686 -19.686
  623   3HB   ALA  80           HB3      ALA  80  11.210 -19.901 -19.901
  624    H    ALA  81           HN       ALA  81   8.569 -21.018 -21.018
  625    HA   ALA  81           HA       ALA  81   8.331 -23.522 -23.522
  626   1HB   ALA  81           HB1      ALA  81   8.923 -23.128 -23.128
  627   2HB   ALA  81           HB2      ALA  81   8.832 -24.679 -24.679
  628   3HB   ALA  81           HB3      ALA  81  10.110 -23.542 -23.542
  629   1H1   BME  16           HE1      MER  16  -9.318  11.239  11.239
  630   2H1   BME  16           HE2      MER  16  -8.413  12.541  12.541
  631   1H2   BME  16           HZ1      MER  16  -7.342  10.864  10.864
  632   2H2   BME  16           HZ2      MER  16  -8.219   9.581   9.581
  633    HO1  BME  16           HH       MER  16 -10.612  11.267  11.267

  Start of MODEL   32
    1    H    ASN   3           HN       ASN   3  -3.952 -11.583 -11.583
    2    HA   ASN   3           HA       ASN   3  -1.362 -11.912 -11.912
    3   1HB   ASN   3           HB1      ASN   3  -2.395 -13.396 -13.396
    4   2HB   ASN   3           HB2      ASN   3  -0.744 -13.500 -13.500
    5   1HD2  ASN   3          HD21      ASN   3  -2.320 -15.015 -15.015
    6   2HD2  ASN   3          HD22      ASN   3  -1.720 -13.449 -13.449
    7    H    ALA   4           HN       ALA   4   0.509 -11.519 -11.519
    8    HA   ALA   4           HA       ALA   4   1.742 -10.176 -10.176
    9   1HB   ALA   4           HB1      ALA   4   0.342 -10.993 -10.993
   10   2HB   ALA   4           HB2      ALA   4  -0.862  -9.743  -9.743
   11   3HB   ALA   4           HB3      ALA   4   0.747  -9.303  -9.303
   12    HA   PRO   5           HA       PRO   5   1.317  -5.865  -5.865
   13   1HB   PRO   5           HB1      PRO   5   3.826  -6.274  -6.274
   14   2HB   PRO   5           HB2      PRO   5   3.595  -5.160  -5.160
   15   1HG   PRO   5           HG1      PRO   5   4.840  -7.452  -7.452
   16   2HG   PRO   5           HG2      PRO   5   3.491  -7.043  -7.043
   17   1HD   PRO   5           HD1      PRO   5   3.439  -8.962  -8.962
   18   2HD   PRO   5           HD2      PRO   5   2.784  -9.206  -9.206
   19    H    LYS   6           HN       LYS   6  -0.208  -5.100  -5.100
   20    HA   LYS   6           HA       LYS   6  -0.376  -5.435  -5.435
   21   1HB   LYS   6           HB1      LYS   6  -2.310  -5.874  -5.874
   22   2HB   LYS   6           HB2      LYS   6  -2.423  -4.144  -4.144
   23   1HG   LYS   6           HG1      LYS   6  -2.935  -5.774  -5.774
   24   2HG   LYS   6           HG2      LYS   6  -4.119  -4.903  -4.903
   25   1HD   LYS   6           HD1      LYS   6  -2.793  -2.746  -2.746
   26   2HD   LYS   6           HD2      LYS   6  -1.974  -3.750  -3.750
   27   1HE   LYS   6           HE1      LYS   6  -4.967  -3.214  -3.214
   28   2HE   LYS   6           HE2      LYS   6  -3.847  -2.663  -2.663
   29   1HZ   LYS   6           HZ1      LYS   6  -3.617  -5.438  -5.438
   30   2HZ   LYS   6           HZ2      LYS   6  -5.265  -5.054  -5.054
   31   3HZ   LYS   6           HZ3      LYS   6  -4.198  -4.511  -4.511
   32    H    ARG   7           HN       ARG   7   0.721  -4.089  -4.089
   33    HA   ARG   7           HA       ARG   7   2.111  -2.076  -2.076
   34   1HB   ARG   7           HB1      ARG   7   1.152  -2.841  -2.841
   35   2HB   ARG   7           HB2      ARG   7  -0.339  -1.973  -1.973
   36   1HG   ARG   7           HG1      ARG   7   0.809   0.181   0.181
   37   2HG   ARG   7           HG2      ARG   7   2.379  -0.596  -0.596
   38   1HD   ARG   7           HD1      ARG   7   1.719   0.202   0.202
   39   2HD   ARG   7           HD2      ARG   7   1.836  -1.554  -1.554
   40    HE   ARG   7           HE       ARG   7  -0.865  -0.551  -0.551
   41   1HH1  ARG   7          HH11      ARG   7   0.304  -3.063  -3.063
   42   2HH1  ARG   7          HH12      ARG   7  -0.307  -2.747  -2.747
   43   1HH2  ARG   7          HH21      ARG   7  -1.143   0.565   0.565
   44   2HH2  ARG   7          HH22      ARG   7  -1.144  -0.648  -0.648
   45    HA   PRO   8           HA       PRO   8   0.373   1.017   1.017
   46   1HB   PRO   8           HB1      PRO   8   2.589   2.686   2.686
   47   2HB   PRO   8           HB2      PRO   8   2.524   1.141   1.141
   48   1HG   PRO   8           HG1      PRO   8   3.606   1.741   1.741
   49   2HG   PRO   8           HG2      PRO   8   4.455   0.954   0.954
   50   1HD   PRO   8           HD1      PRO   8   3.292  -0.531  -0.531
   51   2HD   PRO   8           HD2      PRO   8   3.079  -1.045  -1.045
   52    HA   PRO   9           HA       PRO   9  -1.159   4.982   4.982
   53   1HB   PRO   9           HB1      PRO   9   1.447   5.861   5.861
   54   2HB   PRO   9           HB2      PRO   9  -0.025   6.812   6.812
   55   1HG   PRO   9           HG1      PRO   9   0.229   5.460   5.460
   56   2HG   PRO   9           HG2      PRO   9  -1.310   5.319   5.319
   57   1HD   PRO   9           HD1      PRO   9   0.923   3.327   3.327
   58   2HD   PRO   9           HD2      PRO   9  -0.810   3.015   3.015
   59    H    SER  10           HN       SER  10  -0.307   7.125   7.125
   60    HA   SER  10           HA       SER  10   0.824   6.439   6.439
   61   1HB   SER  10           HB1      SER  10  -1.491   7.232   7.232
   62   2HB   SER  10           HB2      SER  10  -1.014   8.714   8.714
   63    HG   SER  10           HG       SER  10  -0.790   8.103   8.103
   64    H    ALA  11           HN       ALA  11   0.626   9.255   9.255
   65    HA   ALA  11           HA       ALA  11   3.133  10.071  10.071
   66   1HB   ALA  11           HB1      ALA  11   2.423  11.151  11.151
   67   2HB   ALA  11           HB2      ALA  11   3.792  11.664  11.664
   68   3HB   ALA  11           HB3      ALA  11   3.768  10.055  10.055
   69    H    PHE  12           HN       PHE  12   0.509  11.006  11.006
   70    HA   PHE  12           HA       PHE  12  -0.255  13.524  13.524
   71   1HB   PHE  12           HB1      PHE  12  -1.076  12.959  12.959
   72   2HB   PHE  12           HB2      PHE  12  -1.432  11.285  11.285
   73    HD1  PHE  12           HD1      PHE  12  -3.207  13.511  13.511
   74    HD2  PHE  12           HD2      PHE  12  -3.201  11.875  11.875
   75    HE1  PHE  12           HE1      PHE  12  -5.630  13.864  13.864
   76    HE2  PHE  12           HE2      PHE  12  -5.612  12.248  12.248
   77    HZ   PHE  12           HZ       PHE  12  -6.833  13.239  13.239
   78    H    PHE  13           HN       PHE  13  -1.115  10.167  10.167
   79    HA   PHE  13           HA       PHE  13  -3.149  10.445  10.445
   80   1HB   PHE  13           HB1      PHE  13  -1.659   8.348   8.348
   81   2HB   PHE  13           HB2      PHE  13  -1.014   8.525   8.525
   82    HD1  PHE  13           HD1      PHE  13  -2.893   8.885   8.885
   83    HD2  PHE  13           HD2      PHE  13  -3.626   7.097   7.097
   84    HE1  PHE  13           HE1      PHE  13  -4.942   7.858   7.858
   85    HE2  PHE  13           HE2      PHE  13  -5.675   6.071   6.071
   86    HZ   PHE  13           HZ       PHE  13  -6.333   6.443   6.443
   87    H    LEU  14           HN       LEU  14   0.307  10.703  10.703
   88    HA   LEU  14           HA       LEU  14   0.030  11.070  11.070
   89   1HB   LEU  14           HB1      LEU  14   2.037  12.447  12.447
   90   2HB   LEU  14           HB2      LEU  14   2.166  12.344  12.344
   91    HG   LEU  14           HG       LEU  14   3.658  10.775  10.775
   92   1HD1  LEU  14          HD11      LEU  14   2.275   9.691   9.691
   93   2HD1  LEU  14          HD12      LEU  14   1.173   9.094   9.094
   94   3HD1  LEU  14          HD13      LEU  14   2.830   8.511   8.511
   95   1HD2  LEU  14          HD21      LEU  14   3.221  10.783  10.783
   96   2HD2  LEU  14          HD22      LEU  14   3.374   9.129   9.129
   97   3HD2  LEU  14          HD23      LEU  14   1.788   9.779   9.779
   98    H    PHE  15           HN       PHE  15   0.434  13.535  13.535
   99    HA   PHE  15           HA       PHE  15  -0.190  15.828  15.828
  100   1HB   PHE  15           HB1      PHE  15   0.804  16.335  16.335
  101   2HB   PHE  15           HB2      PHE  15   0.104  14.902  14.902
  102    HD1  PHE  15           HD1      PHE  15  -0.593  18.484  18.484
  103    HD2  PHE  15           HD2      PHE  15  -1.625  15.052  15.052
  104    HE1  PHE  15           HE1      PHE  15  -2.058  19.862  19.862
  105    HE2  PHE  15           HE2      PHE  15  -3.069  16.425  16.425
  106    HZ   PHE  15           HZ       PHE  15  -3.292  18.822  18.822
  107    H    CYS  16           HN       MER  16  -2.425  13.904  13.904
  108    HA   CYS  16           HA       MER  16  -4.816  15.249  15.249
  109   1HB   CYS  16           HB1      MER  16  -4.918  13.465  13.465
  110   2HB   CYS  16           HB2      MER  16  -4.351  12.287  12.287
  111    H    SER  17           HN       SER  17  -3.457  12.572  12.572
  112    HA   SER  17           HA       SER  17  -5.580  12.465  12.465
  113   1HB   SER  17           HB1      SER  17  -3.993  11.307  11.307
  114   2HB   SER  17           HB2      SER  17  -3.659  10.820  10.820
  115    HG   SER  17           HG       SER  17  -2.321  13.065  13.065
  116    H    GLU  18           HN       GLU  18  -2.791  14.516  14.516
  117    HA   GLU  18           HA       GLU  18  -3.299  15.848  15.848
  118   1HB   GLU  18           HB1      GLU  18  -1.055  15.501  15.501
  119   2HB   GLU  18           HB2      GLU  18  -1.517  16.629  16.629
  120   1HG   GLU  18           HG1      GLU  18  -1.746  18.454  18.454
  121   2HG   GLU  18           HG2      GLU  18  -1.468  17.361  17.361
  122    H    TYR  19           HN       TYR  19  -4.705  16.055  16.055
  123    HA   TYR  19           HA       TYR  19  -5.465  18.920  18.920
  124   1HB   TYR  19           HB1      TYR  19  -5.177  16.938  16.938
  125   2HB   TYR  19           HB2      TYR  19  -6.615  17.980  17.980
  126    HD1  TYR  19           HD1      TYR  19  -2.981  18.186  18.186
  127    HD2  TYR  19           HD2      TYR  19  -6.338  20.089  20.089
  128    HE1  TYR  19           HE1      TYR  19  -1.536  20.006  20.006
  129    HE2  TYR  19           HE2      TYR  19  -4.902  21.913  21.913
  130    HH   TYR  19           HH       TYR  19  -2.846  22.704  22.704
  131    H    ARG  20           HN       ARG  20  -6.871  15.752  15.752
  132    HA   ARG  20           HA       ARG  20  -9.471  15.825  15.825
  133   1HB   ARG  20           HB1      ARG  20  -7.871  14.539  14.539
  134   2HB   ARG  20           HB2      ARG  20  -9.619  14.359  14.359
  135   1HG   ARG  20           HG1      ARG  20  -9.507  13.384  13.384
  136   2HG   ARG  20           HG2      ARG  20  -7.763  13.596  13.596
  137   1HD   ARG  20           HD1      ARG  20  -7.517  12.089  12.089
  138   2HD   ARG  20           HD2      ARG  20  -9.260  11.986  11.986
  139    HE   ARG  20           HE       ARG  20  -7.806  10.910  10.910
  140   1HH1  ARG  20          HH11      ARG  20 -10.282  10.704  10.704
  141   2HH1  ARG  20          HH12      ARG  20 -11.090   9.398   9.398
  142   1HH2  ARG  20          HH21      ARG  20  -8.770   9.360   9.360
  143   2HH2  ARG  20          HH22      ARG  20 -10.201   8.608   8.608
  144    HA   PRO  21           HA       PRO  21 -11.101  17.339  17.339
  145   1HB   PRO  21           HB1      PRO  21  -9.534  18.268  18.268
  146   2HB   PRO  21           HB2      PRO  21  -9.658  16.527  16.527
  147   1HG   PRO  21           HG1      PRO  21  -7.557  18.448  18.448
  148   2HG   PRO  21           HG2      PRO  21  -7.256  17.033  17.033
  149   1HD   PRO  21           HD1      PRO  21  -7.192  16.693  16.693
  150   2HD   PRO  21           HD2      PRO  21  -8.141  15.529  15.529
  151    H    LYS  22           HN       LYS  22  -8.738  19.154  19.154
  152    HA   LYS  22           HA       LYS  22  -9.617  21.807  21.807
  153   1HB   LYS  22           HB1      LYS  22  -7.240  21.272  21.272
  154   2HB   LYS  22           HB2      LYS  22  -7.663  20.905  20.905
  155   1HG   LYS  22           HG1      LYS  22  -8.555  23.335  23.335
  156   2HG   LYS  22           HG2      LYS  22  -7.733  23.617  23.617
  157   1HD   LYS  22           HD1      LYS  22  -6.452  22.629  22.629
  158   2HD   LYS  22           HD2      LYS  22  -6.312  24.249  24.249
  159   1HE   LYS  22           HE1      LYS  22  -5.233  21.736  21.736
  160   2HE   LYS  22           HE2      LYS  22  -4.281  22.928  22.928
  161   1HZ   LYS  22           HZ1      LYS  22  -5.849  24.286  24.286
  162   2HZ   LYS  22           HZ2      LYS  22  -5.110  22.982  22.982
  163   3HZ   LYS  22           HZ3      LYS  22  -4.158  24.114  24.114
  164    H    ILE  23           HN       ILE  23  -9.969  19.719  19.719
  165    HA   ILE  23           HA       ILE  23 -11.411  21.890  21.890
  166    HB   ILE  23           HB       ILE  23 -11.542  19.050  19.050
  167   1HG1  ILE  23          HG11      ILE  23  -9.038  20.785  20.785
  168   2HG1  ILE  23          HG12      ILE  23  -9.119  19.358  19.358
  169   1HG2  ILE  23          HG21      ILE  23 -12.609  21.034  21.034
  170   2HG2  ILE  23          HG22      ILE  23 -11.036  21.800  21.800
  171   3HG2  ILE  23          HG23      ILE  23 -11.368  20.336  20.336
  172   1HD1  ILE  23          HD11      ILE  23  -9.762  17.972  17.972
  173   2HD1  ILE  23          HD12      ILE  23  -9.630  19.351  19.351
  174   3HD1  ILE  23          HD13      ILE  23  -8.202  18.733  18.733
  175    H    LYS  24           HN       LYS  24 -11.846  18.903  18.903
  176    HA   LYS  24           HA       LYS  24 -14.645  18.533  18.533
  177   1HB   LYS  24           HB1      LYS  24 -12.802  16.925  16.925
  178   2HB   LYS  24           HB2      LYS  24 -12.682  17.514  17.514
  179   1HG   LYS  24           HG1      LYS  24 -14.833  16.713  16.713
  180   2HG   LYS  24           HG2      LYS  24 -15.346  16.436  16.436
  181   1HD   LYS  24           HD1      LYS  24 -13.076  14.918  14.918
  182   2HD   LYS  24           HD2      LYS  24 -14.716  14.320  14.320
  183   1HE   LYS  24           HE1      LYS  24 -12.892  14.974  14.974
  184   2HE   LYS  24           HE2      LYS  24 -13.279  13.370  13.370
  185   1HZ   LYS  24           HZ1      LYS  24 -15.679  14.747  14.747
  186   2HZ   LYS  24           HZ2      LYS  24 -14.724  14.957  14.957
  187   3HZ   LYS  24           HZ3      LYS  24 -15.090  13.392  13.392
  188    H    GLY  25           HN       GLY  25 -12.702  20.417  20.417
  189   1HA   GLY  25           HA1      GLY  25 -14.668  20.728  20.728
  190   2HA   GLY  25           HA2      GLY  25 -13.128  21.578  21.578
  191    H    GLU  26           HN       GLU  26 -13.460  22.547  22.547
  192    HA   GLU  26           HA       GLU  26 -15.156  24.856  24.856
  193   1HB   GLU  26           HB1      GLU  26 -13.407  24.110  24.110
  194   2HB   GLU  26           HB2      GLU  26 -14.139  25.677  25.677
  195   1HG   GLU  26           HG1      GLU  26 -12.226  24.441  24.441
  196   2HG   GLU  26           HG2      GLU  26 -11.666  25.441  25.441
  197    H    HIS  27           HN       HIS  27 -15.000  22.257  22.257
  198    HA   HIS  27           HA       HIS  27 -17.769  22.775  22.775
  199   1HB   HIS  27           HB1      HIS  27 -15.553  21.542  21.542
  200   2HB   HIS  27           HB2      HIS  27 -17.099  22.182  22.182
  201    HD1  HIS  27           HD1      HIS  27 -17.284  24.892  24.892
  202    HD2  HIS  27           HD2      HIS  27 -13.505  23.359  23.359
  203    HE1  HIS  27           HE1      HIS  27 -15.776  26.816  26.816
  204    HA   PRO  28           HA       PRO  28 -17.906  18.431  18.431
  205   1HB   PRO  28           HB1      PRO  28 -19.781  18.686  18.686
  206   2HB   PRO  28           HB2      PRO  28 -18.110  19.143  19.143
  207   1HG   PRO  28           HG1      PRO  28 -20.398  20.976  20.976
  208   2HG   PRO  28           HG2      PRO  28 -19.378  21.176  21.176
  209   1HD   PRO  28           HD1      PRO  28 -18.763  22.431  22.431
  210   2HD   PRO  28           HD2      PRO  28 -17.464  21.857  21.857
  211    H    GLY  29           HN       GLY  29 -18.664  19.535  19.535
  212   1HA   GLY  29           HA1      GLY  29 -21.462  18.720  18.720
  213   2HA   GLY  29           HA2      GLY  29 -20.770  20.134  20.134
  214    H    LEU  30           HN       LEU  30 -18.111  18.668  18.668
  215    HA   LEU  30           HA       LEU  30 -18.477  17.545  17.545
  216   1HB   LEU  30           HB1      LEU  30 -16.090  17.390  17.390
  217   2HB   LEU  30           HB2      LEU  30 -16.027  17.093  17.093
  218    HG   LEU  30           HG       LEU  30 -16.527  19.676  19.676
  219   1HD1  LEU  30          HD11      LEU  30 -14.309  18.844  18.844
  220   2HD1  LEU  30          HD12      LEU  30 -14.485  20.447  20.447
  221   3HD1  LEU  30          HD13      LEU  30 -14.185  19.073  19.073
  222   1HD2  LEU  30          HD21      LEU  30 -16.686  19.276  19.276
  223   2HD2  LEU  30          HD22      LEU  30 -18.031  19.695  19.695
  224   3HD2  LEU  30          HD23      LEU  30 -16.712  20.824  20.824
  225    H    SER  31           HN       SER  31 -17.456  15.494  15.494
  226    HA   SER  31           HA       SER  31 -18.292  13.273  13.273
  227   1HB   SER  31           HB1      SER  31 -18.661  11.957  11.957
  228   2HB   SER  31           HB2      SER  31 -19.549  13.477  13.477
  229    HG   SER  31           HG       SER  31 -18.284  13.978  13.978
  230    H    ILE  32           HN       ILE  32 -17.008  11.228  11.228
  231    HA   ILE  32           HA       ILE  32 -14.234  11.814  11.814
  232    HB   ILE  32           HB       ILE  32 -15.591   9.811   9.811
  233   1HG1  ILE  32          HG11      ILE  32 -13.812   8.092   8.092
  234   2HG1  ILE  32          HG12      ILE  32 -13.064   9.080   9.080
  235   1HG2  ILE  32          HG21      ILE  32 -15.312   8.904   8.904
  236   2HG2  ILE  32          HG22      ILE  32 -15.906   7.899   7.899
  237   3HG2  ILE  32          HG23      ILE  32 -16.806   9.319   9.319
  238   1HD1  ILE  32          HD11      ILE  32 -13.368   9.875   9.875
  239   2HD1  ILE  32          HD12      ILE  32 -11.883   9.350   9.350
  240   3HD1  ILE  32          HD13      ILE  32 -12.618  10.872  10.872
  241    H    GLY  33           HN       GLY  33 -16.009  12.063  12.063
  242   1HA   GLY  33           HA1      GLY  33 -13.860  11.411  11.411
  243   2HA   GLY  33           HA2      GLY  33 -15.571  11.587  11.587
  244    H    ASP  34           HN       ASP  34 -15.075  13.953  13.953
  245    HA   ASP  34           HA       ASP  34 -14.431  15.977  15.977
  246   1HB   ASP  34           HB1      ASP  34 -16.208  15.899  15.899
  247   2HB   ASP  34           HB2      ASP  34 -15.678  17.465  17.465
  248    H    VAL  35           HN       VAL  35 -14.144  15.141  15.141
  249    HA   VAL  35           HA       VAL  35 -12.142  17.062  17.062
  250    HB   VAL  35           HB       VAL  35 -12.822  14.264  14.264
  251   1HG1  VAL  35          HG11      VAL  35 -10.519  14.948  14.948
  252   2HG1  VAL  35          HG12      VAL  35 -11.168  16.452  16.452
  253   3HG1  VAL  35          HG13      VAL  35 -11.610  14.922  14.922
  254   1HG2  VAL  35          HG21      VAL  35 -13.611  17.029  17.029
  255   2HG2  VAL  35          HG22      VAL  35 -14.672  15.866  15.866
  256   3HG2  VAL  35          HG23      VAL  35 -13.998  15.509  15.509
  257    H    ALA  36           HN       ALA  36 -12.174  14.009  14.009
  258    HA   ALA  36           HA       ALA  36  -9.314  13.612  13.612
  259   1HB   ALA  36           HB1      ALA  36 -10.868  11.738  11.738
  260   2HB   ALA  36           HB2      ALA  36 -11.624  12.190  12.190
  261   3HB   ALA  36           HB3      ALA  36  -9.977  11.566  11.566
  262    H    LYS  37           HN       LYS  37 -11.832  14.323  14.323
  263    HA   LYS  37           HA       LYS  37  -9.753  14.520  14.520
  264   1HB   LYS  37           HB1      LYS  37 -12.680  15.286  15.286
  265   2HB   LYS  37           HB2      LYS  37 -11.653  15.641  15.641
  266   1HG   LYS  37           HG1      LYS  37 -11.003  13.230  13.230
  267   2HG   LYS  37           HG2      LYS  37 -12.086  12.865  12.865
  268   1HD   LYS  37           HD1      LYS  37 -14.037  13.516  13.516
  269   2HD   LYS  37           HD2      LYS  37 -13.045  14.193  14.193
  270   1HE   LYS  37           HE1      LYS  37 -13.914  11.941  11.941
  271   2HE   LYS  37           HE2      LYS  37 -12.163  11.932  11.932
  272   1HZ   LYS  37           HZ1      LYS  37 -13.174  11.332  11.332
  273   2HZ   LYS  37           HZ2      LYS  37 -13.979  10.356  10.356
  274   3HZ   LYS  37           HZ3      LYS  37 -12.284  10.337  10.337
  275    H    LYS  38           HN       LYS  38 -11.036  16.784  16.784
  276    HA   LYS  38           HA       LYS  38 -10.175  19.095  19.095
  277   1HB   LYS  38           HB1      LYS  38 -12.130  19.107  19.107
  278   2HB   LYS  38           HB2      LYS  38 -10.977  18.916  18.916
  279   1HG   LYS  38           HG1      LYS  38  -9.859  21.034  21.034
  280   2HG   LYS  38           HG2      LYS  38 -10.955  21.211  21.211
  281   1HD   LYS  38           HD1      LYS  38 -12.889  21.278  21.278
  282   2HD   LYS  38           HD2      LYS  38 -11.746  21.196  21.196
  283   1HE   LYS  38           HE1      LYS  38 -10.680  23.314  23.314
  284   2HE   LYS  38           HE2      LYS  38 -11.836  23.396  23.396
  285   1HZ   LYS  38           HZ1      LYS  38 -13.230  23.038  23.038
  286   2HZ   LYS  38           HZ2      LYS  38 -12.139  24.328  24.328
  287   3HZ   LYS  38           HZ3      LYS  38 -13.275  24.352  24.352
  288    H    LEU  39           HN       LEU  39  -9.093  17.394  17.394
  289    HA   LEU  39           HA       LEU  39  -6.703  19.057  19.057
  290   1HB   LEU  39           HB1      LEU  39  -6.653  18.310  18.310
  291   2HB   LEU  39           HB2      LEU  39  -8.248  17.702  17.702
  292    HG   LEU  39           HG       LEU  39  -6.980  15.559  15.559
  293   1HD1  LEU  39          HD11      LEU  39  -4.996  17.053  17.053
  294   2HD1  LEU  39          HD12      LEU  39  -4.778  15.393  15.393
  295   3HD1  LEU  39          HD13      LEU  39  -4.857  16.652  16.652
  296   1HD2  LEU  39          HD21      LEU  39  -8.391  15.843  15.843
  297   2HD2  LEU  39          HD22      LEU  39  -6.999  14.802  14.802
  298   3HD2  LEU  39          HD23      LEU  39  -6.939  16.467  16.467
  299    H    GLY  40           HN       GLY  40  -7.567  15.907  15.907
  300   1HA   GLY  40           HA1      GLY  40  -4.881  15.020  15.020
  301   2HA   GLY  40           HA2      GLY  40  -6.256  14.474  14.474
  302    H    GLU  41           HN       GLU  41  -7.013  17.135  17.135
  303    HA   GLU  41           HA       GLU  41  -5.200  17.291  17.291
  304   1HB   GLU  41           HB1      GLU  41  -7.289  19.161  19.161
  305   2HB   GLU  41           HB2      GLU  41  -6.359  19.616  19.616
  306   1HG   GLU  41           HG1      GLU  41  -8.066  17.093  17.093
  307   2HG   GLU  41           HG2      GLU  41  -8.525  18.557  18.557
  308    H    MET  42           HN       MET  42  -5.704  19.257  19.257
  309    HA   MET  42           HA       MET  42  -3.764  21.219  21.219
  310   1HB   MET  42           HB1      MET  42  -4.405  19.727  19.727
  311   2HB   MET  42           HB2      MET  42  -3.513  21.239  21.239
  312   1HG   MET  42           HG1      MET  42  -6.292  20.893  20.893
  313   2HG   MET  42           HG2      MET  42  -6.102  21.430  21.430
  314   1HE   MET  42           HE1      MET  42  -7.218  22.385  22.385
  315   2HE   MET  42           HE2      MET  42  -6.274  23.738  23.738
  316   3HE   MET  42           HE3      MET  42  -5.556  22.137  22.137
  317    H    TRP  43           HN       TRP  43  -3.339  18.067  18.067
  318    HA   TRP  43           HA       TRP  43  -0.632  17.959  17.959
  319   1HB   TRP  43           HB1      TRP  43  -2.092  16.096  16.096
  320   2HB   TRP  43           HB2      TRP  43  -2.445  15.809  15.809
  321    HD1  TRP  43           HD1      TRP  43  -0.917  14.189  14.189
  322    HE1  TRP  43           HE1      TRP  43   1.269  13.151  13.151
  323    HE3  TRP  43           HE3      TRP  43  -0.058  16.652  16.652
  324    HZ2  TRP  43           HZ2      TRP  43   3.265  13.284  13.284
  325    HZ3  TRP  43           HZ3      TRP  43   1.919  16.233  16.233
  326    HH2  TRP  43           HH2      TRP  43   3.594  14.537  14.537
  327    H    ASN  44           HN       ASN  44  -2.191  17.113  17.113
  328    HA   ASN  44           HA       ASN  44   0.124  16.459  16.459
  329   1HB   ASN  44           HB1      ASN  44  -1.239  16.312  16.312
  330   2HB   ASN  44           HB2      ASN  44  -2.508  16.449  16.449
  331   1HD2  ASN  44          HD21      ASN  44  -3.960  19.096  19.096
  332   2HD2  ASN  44          HD22      ASN  44  -4.135  17.748  17.748
  333    H    ASN  45           HN       ASN  45  -1.143  19.528  19.528
  334    HA   ASN  45           HA       ASN  45   1.250  20.925  20.925
  335   1HB   ASN  45           HB1      ASN  45  -0.279  22.846  22.846
  336   2HB   ASN  45           HB2      ASN  45  -0.741  21.402  21.402
  337   1HD2  ASN  45          HD21      ASN  45  -3.922  21.244  21.244
  338   2HD2  ASN  45          HD22      ASN  45  -2.895  20.637  20.637
  339    H    THR  46           HN       THR  46   1.184  20.049  20.049
  340    HA   THR  46           HA       THR  46   0.225  22.218  22.218
  341    HB   THR  46           HB       THR  46   0.407  19.967  19.967
  342    HG1  THR  46           HG1      THR  46   2.435  20.996  20.996
  343   1HG2  THR  46          HG21      THR  46   2.457  19.020  19.020
  344   2HG2  THR  46          HG22      THR  46   3.467  20.097  20.097
  345   3HG2  THR  46          HG23      THR  46   2.522  18.861  18.861
  346    H    ALA  47           HN       ALA  47   3.446  21.100  21.100
  347    HA   ALA  47           HA       ALA  47   4.465  23.792  23.792
  348   1HB   ALA  47           HB1      ALA  47   4.704  23.495  23.495
  349   2HB   ALA  47           HB2      ALA  47   5.628  22.031  22.031
  350   3HB   ALA  47           HB3      ALA  47   6.264  23.590  23.590
  351    H    ALA  48           HN       ALA  48   5.272  20.553  20.553
  352    HA   ALA  48           HA       ALA  48   6.035  18.827  18.827
  353   1HB   ALA  48           HB1      ALA  48   6.289  20.350  20.350
  354   2HB   ALA  48           HB2      ALA  48   7.758  21.014  21.014
  355   3HB   ALA  48           HB3      ALA  48   7.680  19.317  19.317
  356    H    ASP  49           HN       ASP  49   7.488  21.502  21.502
  357    HA   ASP  49           HA       ASP  49   9.833  20.032  20.032
  358   1HB   ASP  49           HB1      ASP  49  10.210  22.214  22.214
  359   2HB   ASP  49           HB2      ASP  49   9.066  22.990  22.990
  360    H    ASP  50           HN       ASP  50   6.832  20.033  20.033
  361    HA   ASP  50           HA       ASP  50   7.144  20.318  20.318
  362   1HB   ASP  50           HB1      ASP  50   5.691  22.143  22.143
  363   2HB   ASP  50           HB2      ASP  50   4.673  20.917  20.917
  364    H    LYS  51           HN       LYS  51   6.524  18.501  18.501
  365    HA   LYS  51           HA       LYS  51   4.858  16.422  16.422
  366   1HB   LYS  51           HB1      LYS  51   6.385  16.365  16.365
  367   2HB   LYS  51           HB2      LYS  51   5.079  15.298  15.298
  368   1HG   LYS  51           HG1      LYS  51   3.519  17.168  17.168
  369   2HG   LYS  51           HG2      LYS  51   4.805  18.312  18.312
  370   1HD   LYS  51           HD1      LYS  51   3.721  18.030  18.030
  371   2HD   LYS  51           HD2      LYS  51   5.155  17.025  17.025
  372   1HE   LYS  51           HE1      LYS  51   2.517  15.947  15.947
  373   2HE   LYS  51           HE2      LYS  51   2.996  16.034  16.034
  374   1HZ   LYS  51           HZ1      LYS  51   5.092  14.890  14.890
  375   2HZ   LYS  51           HZ2      LYS  51   3.665  14.069  14.069
  376   3HZ   LYS  51           HZ3      LYS  51   4.134  14.178  14.178
  377    H    GLN  52           HN       GLN  52   8.068  16.805  16.805
  378    HA   GLN  52           HA       GLN  52   9.461  14.637  14.637
  379   1HB   GLN  52           HB1      GLN  52  10.144  17.326  17.326
  380   2HB   GLN  52           HB2      GLN  52  10.754  16.891  16.891
  381   1HG   GLN  52           HG1      GLN  52  12.546  16.568  16.568
  382   2HG   GLN  52           HG2      GLN  52  12.026  14.990  14.990
  383   1HE2  GLN  52          HE21      GLN  52  10.199  15.328  15.328
  384   2HE2  GLN  52          HE22      GLN  52   9.615  16.049  16.049
  385    HA   PRO  53           HA       PRO  53   9.966  14.613  14.613
  386   1HB   PRO  53           HB1      PRO  53   7.852  15.848  15.848
  387   2HB   PRO  53           HB2      PRO  53   9.430  16.585  16.585
  388   1HG   PRO  53           HG1      PRO  53   6.937  16.798  16.798
  389   2HG   PRO  53           HG2      PRO  53   7.905  18.122  18.122
  390   1HD   PRO  53           HD1      PRO  53   8.457  17.377  17.377
  391   2HD   PRO  53           HD2      PRO  53   9.836  17.507  17.507
  392    H    TYR  54           HN       TYR  54   6.598  14.885  14.885
  393    HA   TYR  54           HA       TYR  54   5.654  12.576  12.576
  394   1HB   TYR  54           HB1      TYR  54   4.512  14.029  14.029
  395   2HB   TYR  54           HB2      TYR  54   3.637  12.829  12.829
  396    HD1  TYR  54           HD1      TYR  54   3.953  13.456  13.456
  397    HD2  TYR  54           HD2      TYR  54   3.878  16.206  16.206
  398    HE1  TYR  54           HE1      TYR  54   3.242  15.235  15.235
  399    HE2  TYR  54           HE2      TYR  54   3.169  17.986  17.986
  400    HH   TYR  54           HH       TYR  54   1.791  17.790  17.790
  401    H    GLU  55           HN       GLU  55   6.421  13.194  13.194
  402    HA   GLU  55           HA       GLU  55   5.941  10.658  10.658
  403   1HB   GLU  55           HB1      GLU  55   7.128  13.144  13.144
  404   2HB   GLU  55           HB2      GLU  55   8.318  11.942  11.942
  405   1HG   GLU  55           HG1      GLU  55   6.461  10.672  10.672
  406   2HG   GLU  55           HG2      GLU  55   5.383  12.004  12.004
  407    H    LYS  56           HN       LYS  56   9.035  11.845  11.845
  408    HA   LYS  56           HA       LYS  56  10.613   9.604   9.604
  409   1HB   LYS  56           HB1      LYS  56  11.343  11.872  11.872
  410   2HB   LYS  56           HB2      LYS  56  10.604  11.413  11.413
  411   1HG   LYS  56           HG1      LYS  56  12.168   9.416   9.416
  412   2HG   LYS  56           HG2      LYS  56  12.877   9.923   9.923
  413   1HD   LYS  56           HD1      LYS  56  14.394  10.743  10.743
  414   2HD   LYS  56           HD2      LYS  56  13.459  12.146  12.146
  415   1HE   LYS  56           HE1      LYS  56  12.742  10.449  10.449
  416   2HE   LYS  56           HE2      LYS  56  13.803  11.842  11.842
  417   1HZ   LYS  56           HZ1      LYS  56  11.516  12.627  12.627
  418   2HZ   LYS  56           HZ2      LYS  56  11.016  11.785  11.785
  419   3HZ   LYS  56           HZ3      LYS  56  12.055  13.119  13.119
  420    H    LYS  57           HN       LYS  57   8.209  10.308  10.308
  421    HA   LYS  57           HA       LYS  57   8.842   8.070   8.070
  422   1HB   LYS  57           HB1      LYS  57   6.145   9.469   9.469
  423   2HB   LYS  57           HB2      LYS  57   6.444   8.203   8.203
  424   1HG   LYS  57           HG1      LYS  57   8.275   9.665   9.665
  425   2HG   LYS  57           HG2      LYS  57   7.775  10.945  10.945
  426   1HD   LYS  57           HD1      LYS  57   6.625  11.330  11.330
  427   2HD   LYS  57           HD2      LYS  57   5.427  10.763  10.763
  428   1HE   LYS  57           HE1      LYS  57   5.763   8.389   8.389
  429   2HE   LYS  57           HE2      LYS  57   6.769   9.149   9.149
  430   1HZ   LYS  57           HZ1      LYS  57   4.404  10.597  10.597
  431   2HZ   LYS  57           HZ2      LYS  57   3.992   8.952   8.952
  432   3HZ   LYS  57           HZ3      LYS  57   4.958   9.630   9.630
  433    H    ALA  58           HN       ALA  58   6.237   8.509   8.509
  434    HA   ALA  58           HA       ALA  58   5.098   6.028   6.028
  435   1HB   ALA  58           HB1      ALA  58   4.480   7.881   7.881
  436   2HB   ALA  58           HB2      ALA  58   5.980   7.641   7.641
  437   3HB   ALA  58           HB3      ALA  58   4.750   6.392   6.392
  438    H    ALA  59           HN       ALA  59   7.988   6.926   6.926
  439    HA   ALA  59           HA       ALA  59   8.684   4.406   4.406
  440   1HB   ALA  59           HB1      ALA  59  10.550   6.649   6.649
  441   2HB   ALA  59           HB2      ALA  59  10.995   5.342   5.342
  442   3HB   ALA  59           HB3      ALA  59   9.793   6.525   6.525
  443    H    LYS  60           HN       LYS  60  10.064   5.908   5.908
  444    HA   LYS  60           HA       LYS  60  11.608   3.901   3.901
  445   1HB   LYS  60           HB1      LYS  60  11.308   6.260   6.260
  446   2HB   LYS  60           HB2      LYS  60   9.810   5.768   5.768
  447   1HG   LYS  60           HG1      LYS  60  10.989   4.167   4.167
  448   2HG   LYS  60           HG2      LYS  60  12.498   4.461   4.461
  449   1HD   LYS  60           HD1      LYS  60  12.396   6.874   6.874
  450   2HD   LYS  60           HD2      LYS  60  10.929   6.512   6.512
  451   1HE   LYS  60           HE1      LYS  60  12.156   4.915   4.915
  452   2HE   LYS  60           HE2      LYS  60  13.623   5.166   5.166
  453   1HZ   LYS  60           HZ1      LYS  60  12.666   7.663   7.663
  454   2HZ   LYS  60           HZ2      LYS  60  12.665   6.652   6.652
  455   3HZ   LYS  60           HZ3      LYS  60  14.094   6.874   6.874
  456    H    LEU  61           HN       LEU  61   8.129   4.268   4.268
  457    HA   LEU  61           HA       LEU  61   7.869   1.939   1.939
  458   1HB   LEU  61           HB1      LEU  61   5.750   3.318   3.318
  459   2HB   LEU  61           HB2      LEU  61   5.445   2.269   2.269
  460    HG   LEU  61           HG       LEU  61   6.907   4.956   4.956
  461   1HD1  LEU  61          HD11      LEU  61   4.269   4.089   4.089
  462   2HD1  LEU  61          HD12      LEU  61   5.028   5.661   5.661
  463   3HD1  LEU  61          HD13      LEU  61   4.512   5.157   5.157
  464   1HD2  LEU  61          HD21      LEU  61   6.441   3.036   3.036
  465   2HD2  LEU  61          HD22      LEU  61   7.996   3.440   3.440
  466   3HD2  LEU  61          HD23      LEU  61   7.083   4.668   4.668
  467    H    LYS  62           HN       LYS  62   6.933   2.396   2.396
  468    HA   LYS  62           HA       LYS  62   6.285  -0.193  -0.193
  469   1HB   LYS  62           HB1      LYS  62   7.815   1.939   1.939
  470   2HB   LYS  62           HB2      LYS  62   7.918   0.301   0.301
  471   1HG   LYS  62           HG1      LYS  62   5.435   0.191   0.191
  472   2HG   LYS  62           HG2      LYS  62   5.330   1.835   1.835
  473   1HD   LYS  62           HD1      LYS  62   5.173   1.789   1.789
  474   2HD   LYS  62           HD2      LYS  62   6.615   2.646   2.646
  475   1HE   LYS  62           HE1      LYS  62   8.012   0.639   0.639
  476   2HE   LYS  62           HE2      LYS  62   6.569  -0.280  -0.280
  477   1HZ   LYS  62           HZ1      LYS  62   6.538   2.066   2.066
  478   2HZ   LYS  62           HZ2      LYS  62   8.098   1.410   1.410
  479   3HZ   LYS  62           HZ3      LYS  62   6.750   0.472   0.472
  480    H    GLU  63           HN       GLU  63   9.518   1.109   1.109
  481    HA   GLU  63           HA       GLU  63  11.099  -1.106  -1.106
  482   1HB   GLU  63           HB1      GLU  63  11.845   1.333   1.333
  483   2HB   GLU  63           HB2      GLU  63  11.672   1.170   1.170
  484   1HG   GLU  63           HG1      GLU  63  13.472  -0.584  -0.584
  485   2HG   GLU  63           HG2      GLU  63  13.666  -0.364  -0.364
  486    H    LYS  64           HN       LYS  64  10.008   0.047   0.047
  487    HA   LYS  64           HA       LYS  64  11.208  -2.022  -2.022
  488   1HB   LYS  64           HB1      LYS  64  10.139   0.074   0.074
  489   2HB   LYS  64           HB2      LYS  64   8.557  -0.610  -0.610
  490   1HG   LYS  64           HG1      LYS  64   8.841  -2.383  -2.383
  491   2HG   LYS  64           HG2      LYS  64  10.560  -2.097  -2.097
  492   1HD   LYS  64           HD1      LYS  64   8.365  -0.146  -0.146
  493   2HD   LYS  64           HD2      LYS  64   9.165  -1.248  -1.248
  494   1HE   LYS  64           HE1      LYS  64  11.369  -0.165  -0.165
  495   2HE   LYS  64           HE2      LYS  64  10.549   0.985   0.985
  496   1HZ   LYS  64           HZ1      LYS  64   9.252   0.939   0.939
  497   2HZ   LYS  64           HZ2      LYS  64  10.919   1.139   1.139
  498   3HZ   LYS  64           HZ3      LYS  64  10.081   2.213   2.213
  499    H    TYR  65           HN       TYR  65   7.996  -1.809  -1.809
  500    HA   TYR  65           HA       TYR  65   6.880  -4.251  -4.251
  501   1HB   TYR  65           HB1      TYR  65   5.348  -2.880  -2.880
  502   2HB   TYR  65           HB2      TYR  65   6.549  -2.300  -2.300
  503    HD1  TYR  65           HD1      TYR  65   5.574  -5.881  -5.881
  504    HD2  TYR  65           HD2      TYR  65   5.266  -2.442  -2.442
  505    HE1  TYR  65           HE1      TYR  65   4.544  -7.238  -7.238
  506    HE2  TYR  65           HE2      TYR  65   4.244  -3.802  -3.802
  507    HH   TYR  65           HH       TYR  65   2.841  -6.068  -6.068
  508    H    GLU  66           HN       GLU  66   8.507  -3.620  -3.620
  509    HA   GLU  66           HA       GLU  66   8.676  -6.092  -6.092
  510   1HB   GLU  66           HB1      GLU  66  10.893  -4.063  -4.063
  511   2HB   GLU  66           HB2      GLU  66  10.834  -5.364  -5.364
  512   1HG   GLU  66           HG1      GLU  66   8.430  -3.531  -3.531
  513   2HG   GLU  66           HG2      GLU  66   9.850  -2.884  -2.884
  514    H    LYS  67           HN       LYS  67  10.617  -4.968  -4.968
  515    HA   LYS  67           HA       LYS  67  12.356  -7.292  -7.292
  516   1HB   LYS  67           HB1      LYS  67  12.093  -4.812  -4.812
  517   2HB   LYS  67           HB2      LYS  67  12.883  -6.176  -6.176
  518   1HG   LYS  67           HG1      LYS  67  14.548  -4.826  -4.826
  519   2HG   LYS  67           HG2      LYS  67  14.427  -6.309  -6.309
  520   1HD   LYS  67           HD1      LYS  67  13.063  -5.091  -5.091
  521   2HD   LYS  67           HD2      LYS  67  13.230  -3.620  -3.620
  522   1HE   LYS  67           HE1      LYS  67  15.688  -3.721  -3.721
  523   2HE   LYS  67           HE2      LYS  67  15.552  -5.200  -5.200
  524   1HZ   LYS  67           HZ1      LYS  67  13.878  -3.260  -3.260
  525   2HZ   LYS  67           HZ2      LYS  67  15.415  -2.577  -2.577
  526   3HZ   LYS  67           HZ3      LYS  67  15.251  -4.006  -4.006
  527    H    ASP  68           HN       ASP  68   9.557  -6.413  -6.413
  528    HA   ASP  68           HA       ASP  68   9.672  -8.507  -8.507
  529   1HB   ASP  68           HB1      ASP  68   7.480  -6.566  -6.566
  530   2HB   ASP  68           HB2      ASP  68   7.405  -7.700  -7.700
  531    H    ILE  69           HN       ILE  69   8.452  -7.960  -7.960
  532    HA   ILE  69           HA       ILE  69   6.617 -10.256 -10.256
  533    HB   ILE  69           HB       ILE  69   5.903  -8.407  -8.407
  534   1HG1  ILE  69          HG11      ILE  69   5.408  -9.542  -9.542
  535   2HG1  ILE  69          HG12      ILE  69   6.810 -10.602 -10.602
  536   1HG2  ILE  69          HG21      ILE  69   8.094  -7.544  -7.544
  537   2HG2  ILE  69          HG22      ILE  69   8.399  -8.900  -8.900
  538   3HG2  ILE  69          HG23      ILE  69   7.118  -7.756  -7.756
  539   1HD1  ILE  69          HD11      ILE  69   4.427 -10.548 -10.548
  540   2HD1  ILE  69          HD12      ILE  69   4.740 -11.779 -11.779
  541   3HD1  ILE  69          HD13      ILE  69   5.805 -11.628 -11.628
  542    H    ALA  70           HN       ALA  70   9.590  -9.305  -9.305
  543    HA   ALA  70           HA       ALA  70  10.323 -11.720 -11.720
  544   1HB   ALA  70           HB1      ALA  70  12.189  -9.749  -9.749
  545   2HB   ALA  70           HB2      ALA  70  12.695 -10.925 -10.925
  546   3HB   ALA  70           HB3      ALA  70  11.654  -9.595  -9.595
  547    H    ALA  71           HN       ALA  71  10.427 -10.664 -10.664
  548    HA   ALA  71           HA       ALA  71  11.865 -12.957 -12.957
  549   1HB   ALA  71           HB1      ALA  71  10.306 -10.745 -10.745
  550   2HB   ALA  71           HB2      ALA  71  11.337 -11.918 -11.918
  551   3HB   ALA  71           HB3      ALA  71  12.037 -10.748 -10.748
  552    H    TYR  72           HN       TYR  72   8.552 -11.856 -11.856
  553    HA   TYR  72           HA       TYR  72   7.287 -13.870 -13.870
  554   1HB   TYR  72           HB1      TYR  72   6.120 -11.892 -11.892
  555   2HB   TYR  72           HB2      TYR  72   6.405 -12.120 -12.120
  556    HD1  TYR  72           HD1      TYR  72   5.192 -14.003 -14.003
  557    HD2  TYR  72           HD2      TYR  72   4.141 -12.714 -12.714
  558    HE1  TYR  72           HE1      TYR  72   3.002 -15.075 -15.075
  559    HE2  TYR  72           HE2      TYR  72   1.949 -13.787 -13.787
  560    HH   TYR  72           HH       TYR  72   1.147 -15.978 -15.978
  561    H    ARG  73           HN       ARG  73   8.067 -13.737 -13.737
  562    HA   ARG  73           HA       ARG  73   6.860 -16.237 -16.237
  563   1HB   ARG  73           HB1      ARG  73   9.151 -14.667 -14.667
  564   2HB   ARG  73           HB2      ARG  73   8.443 -16.082 -16.082
  565   1HG   ARG  73           HG1      ARG  73   6.972 -13.487 -13.487
  566   2HG   ARG  73           HG2      ARG  73   7.591 -13.985 -13.985
  567   1HD   ARG  73           HD1      ARG  73   6.087 -16.178 -16.178
  568   2HD   ARG  73           HD2      ARG  73   5.200 -14.999 -14.999
  569    HE   ARG  73           HE       ARG  73   5.725 -14.737 -14.737
  570   1HH1  ARG  73          HH11      ARG  73   4.994 -12.326 -12.326
  571   2HH1  ARG  73          HH12      ARG  73   3.319 -12.159 -12.159
  572   1HH2  ARG  73          HH21      ARG  73   3.144 -15.376 -15.376
  573   2HH2  ARG  73          HH22      ARG  73   2.239 -13.940 -13.940
  574    H    ALA  74           HN       ALA  74   9.845 -15.115 -15.115
  575    HA   ALA  74           HA       ALA  74  11.280 -17.628 -17.628
  576   1HB   ALA  74           HB1      ALA  74  12.429 -15.453 -15.453
  577   2HB   ALA  74           HB2      ALA  74  11.878 -15.147 -15.147
  578   3HB   ALA  74           HB3      ALA  74  13.009 -16.453 -16.453
  579    H    LYS  75           HN       LYS  75   9.108 -16.240 -16.240
  580    HA   LYS  75           HA       LYS  75   9.483 -18.545 -18.545
  581   1HB   LYS  75           HB1      LYS  75   9.108 -15.591 -15.591
  582   2HB   LYS  75           HB2      LYS  75   8.913 -16.878 -16.878
  583   1HG   LYS  75           HG1      LYS  75  11.213 -17.539 -17.539
  584   2HG   LYS  75           HG2      LYS  75  11.470 -16.561 -16.561
  585   1HD   LYS  75           HD1      LYS  75  11.216 -14.497 -14.497
  586   2HD   LYS  75           HD2      LYS  75  10.717 -15.354 -15.354
  587   1HE   LYS  75           HE1      LYS  75  13.441 -15.698 -15.698
  588   2HE   LYS  75           HE2      LYS  75  13.145 -14.630 -14.630
  589   1HZ   LYS  75           HZ1      LYS  75  12.075 -17.157 -17.157
  590   2HZ   LYS  75           HZ2      LYS  75  13.667 -17.362 -17.362
  591   3HZ   LYS  75           HZ3      LYS  75  13.345 -16.337 -16.337
  592    H    GLY  76           HN       GLY  76   7.270 -15.860 -15.860
  593   1HA   GLY  76           HA1      GLY  76   4.981 -15.669 -15.669
  594   2HA   GLY  76           HA2      GLY  76   5.012 -17.214 -17.214
  595    H    LYS  77           HN       LYS  77   6.347 -18.225 -18.225
  596    HA   LYS  77           HA       LYS  77   3.919 -18.445 -18.445
  597   1HB   LYS  77           HB1      LYS  77   5.158 -20.942 -20.942
  598   2HB   LYS  77           HB2      LYS  77   3.667 -20.522 -20.522
  599   1HG   LYS  77           HG1      LYS  77   4.760 -20.262 -20.262
  600   2HG   LYS  77           HG2      LYS  77   6.363 -20.335 -20.335
  601   1HD   LYS  77           HD1      LYS  77   5.973 -22.602 -22.602
  602   2HD   LYS  77           HD2      LYS  77   4.331 -22.568 -22.568
  603   1HE   LYS  77           HE1      LYS  77   6.901 -22.320 -22.320
  604   2HE   LYS  77           HE2      LYS  77   5.866 -23.741 -23.741
  605   1HZ   LYS  77           HZ1      LYS  77   4.259 -21.560 -21.560
  606   2HZ   LYS  77           HZ2      LYS  77   5.616 -21.494 -21.494
  607   3HZ   LYS  77           HZ3      LYS  77   4.655 -22.894 -22.894
  608    HA   PRO  78           HA       PRO  78   7.022 -20.053 -20.053
  609   1HB   PRO  78           HB1      PRO  78   9.775 -19.734 -19.734
  610   2HB   PRO  78           HB2      PRO  78   8.885 -21.133 -21.133
  611   1HG   PRO  78           HG1      PRO  78   9.452 -18.472 -18.472
  612   2HG   PRO  78           HG2      PRO  78   9.896 -20.082 -20.082
  613   1HD   PRO  78           HD1      PRO  78   7.628 -19.042 -19.042
  614   2HD   PRO  78           HD2      PRO  78   7.532 -20.707 -20.707
  615    H    ASP  79           HN       ASP  79   7.582 -17.252 -17.252
  616    HA   ASP  79           HA       ASP  79   7.758 -15.628 -15.628
  617   1HB   ASP  79           HB1      ASP  79   9.977 -15.775 -15.775
  618   2HB   ASP  79           HB2      ASP  79   9.260 -15.081 -15.081
  619    H    ALA  80           HN       ALA  80   5.422 -16.279 -16.279
  620    HA   ALA  80           HA       ALA  80   4.501 -13.671 -13.671
  621   1HB   ALA  80           HB1      ALA  80   3.456 -16.489 -16.489
  622   2HB   ALA  80           HB2      ALA  80   2.790 -15.029 -15.029
  623   3HB   ALA  80           HB3      ALA  80   4.422 -15.546 -15.546
  624    H    ALA  81           HN       ALA  81   4.483 -13.251 -13.251
  625    HA   ALA  81           HA       ALA  81   3.491 -13.454 -13.454
  626   1HB   ALA  81           HB1      ALA  81   3.285 -11.262 -11.262
  627   2HB   ALA  81           HB2      ALA  81   1.806 -11.749 -11.749
  628   3HB   ALA  81           HB3      ALA  81   1.834 -11.575 -11.575
  629   1H1   BME  16           HE1      MER  16  -9.355   9.350   9.350
  630   2H1   BME  16           HE2      MER  16  -8.208   8.002   8.002
  631   1H2   BME  16           HZ1      MER  16  -7.416  10.012  10.012
  632   2H2   BME  16           HZ2      MER  16  -6.302   9.570   9.570
  633    HO1  BME  16           HH       MER  16  -9.005   9.339   9.339

  Start of MODEL   33
    1    H    ASN   3           HN       ASN   3   2.540  -8.709  -8.709
    2    HA   ASN   3           HA       ASN   3   4.674  -9.452  -9.452
    3   1HB   ASN   3           HB1      ASN   3   2.365 -11.053 -11.053
    4   2HB   ASN   3           HB2      ASN   3   3.629 -11.682 -11.682
    5   1HD2  ASN   3          HD21      ASN   3   5.144 -12.620 -12.620
    6   2HD2  ASN   3          HD22      ASN   3   4.254 -13.171 -13.171
    7    H    ALA   4           HN       ALA   4   4.020 -10.431 -10.431
    8    HA   ALA   4           HA       ALA   4   3.046 -10.501 -10.501
    9   1HB   ALA   4           HB1      ALA   4   1.042 -11.338 -11.338
   10   2HB   ALA   4           HB2      ALA   4   0.499  -9.694  -9.694
   11   3HB   ALA   4           HB3      ALA   4   0.573 -10.261 -10.261
   12    HA   PRO   5           HA       PRO   5   3.679  -6.513  -6.513
   13   1HB   PRO   5           HB1      PRO   5   2.760  -6.742  -6.742
   14   2HB   PRO   5           HB2      PRO   5   4.176  -7.624  -7.624
   15   1HG   PRO   5           HG1      PRO   5   1.288  -8.660  -8.660
   16   2HG   PRO   5           HG2      PRO   5   2.716  -9.395  -9.395
   17   1HD   PRO   5           HD1      PRO   5   2.015 -10.206 -10.206
   18   2HD   PRO   5           HD2      PRO   5   3.706  -9.889  -9.889
   19    H    LYS   6           HN       LYS   6   2.433  -5.393  -5.393
   20    HA   LYS   6           HA       LYS   6  -0.146  -4.473  -4.473
   21   1HB   LYS   6           HB1      LYS   6  -0.328  -5.987  -5.987
   22   2HB   LYS   6           HB2      LYS   6   0.564  -4.777  -4.777
   23   1HG   LYS   6           HG1      LYS   6  -1.313  -3.110  -3.110
   24   2HG   LYS   6           HG2      LYS   6  -2.160  -4.410  -4.410
   25   1HD   LYS   6           HD1      LYS   6  -3.152  -4.230  -4.230
   26   2HD   LYS   6           HD2      LYS   6  -2.151  -5.663  -5.663
   27   1HE   LYS   6           HE1      LYS   6  -1.169  -2.954  -2.954
   28   2HE   LYS   6           HE2      LYS   6  -1.979  -4.121  -4.121
   29   1HZ   LYS   6           HZ1      LYS   6   0.015  -5.488  -5.488
   30   2HZ   LYS   6           HZ2      LYS   6   0.706  -4.046  -4.046
   31   3HZ   LYS   6           HZ3      LYS   6  -0.070  -5.116  -5.116
   32    H    ARG   7           HN       ARG   7   1.042  -2.865  -2.865
   33    HA   ARG   7           HA       ARG   7   2.557  -0.834  -0.834
   34   1HB   ARG   7           HB1      ARG   7   0.860   0.754   0.754
   35   2HB   ARG   7           HB2      ARG   7   1.373  -0.675  -0.675
   36   1HG   ARG   7           HG1      ARG   7  -0.692  -1.863  -1.863
   37   2HG   ARG   7           HG2      ARG   7  -1.221  -0.539  -0.539
   38   1HD   ARG   7           HD1      ARG   7  -1.444   0.944   0.944
   39   2HD   ARG   7           HD2      ARG   7  -0.658  -0.217  -0.217
   40    HE   ARG   7           HE       ARG   7  -2.631  -1.722  -1.722
   41   1HH1  ARG   7          HH11      ARG   7  -4.475  -1.221  -1.221
   42   2HH1  ARG   7          HH12      ARG   7  -5.504   0.053   0.053
   43   1HH2  ARG   7          HH21      ARG   7  -3.153   1.168   1.168
   44   2HH2  ARG   7          HH22      ARG   7  -4.732   1.445   1.445
   45    HA   PRO   8           HA       PRO   8   1.063   1.006   1.006
   46   1HB   PRO   8           HB1      PRO   8   3.516   2.245   2.245
   47   2HB   PRO   8           HB2      PRO   8   3.151   0.591   0.591
   48   1HG   PRO   8           HG1      PRO   8   4.512   1.575   1.575
   49   2HG   PRO   8           HG2      PRO   8   5.109   0.368   0.368
   50   1HD   PRO   8           HD1      PRO   8   3.858  -0.457  -0.457
   51   2HD   PRO   8           HD2      PRO   8   3.397  -1.247  -1.247
   52    HA   PRO   9           HA       PRO   9  -0.173   5.222   5.222
   53   1HB   PRO   9           HB1      PRO   9   2.646   5.910   5.910
   54   2HB   PRO   9           HB2      PRO   9   1.205   6.926   6.926
   55   1HG   PRO   9           HG1      PRO   9   1.863   5.277   5.277
   56   2HG   PRO   9           HG2      PRO   9   0.170   5.430   5.430
   57   1HD   PRO   9           HD1      PRO   9   1.988   3.099   3.099
   58   2HD   PRO   9           HD2      PRO   9   0.221   3.138   3.138
   59    H    SER  10           HN       SER  10  -0.398   6.657   6.657
   60    HA   SER  10           HA       SER  10   0.772   6.146   6.146
   61   1HB   SER  10           HB1      SER  10  -1.260   8.232   8.232
   62   2HB   SER  10           HB2      SER  10  -0.883   7.781   7.781
   63    HG   SER  10           HG       SER  10  -2.408   6.501   6.501
   64    H    ALA  11           HN       ALA  11   0.931   8.814   8.814
   65    HA   ALA  11           HA       ALA  11   3.176  10.055  10.055
   66   1HB   ALA  11           HB1      ALA  11   2.225  10.811  10.811
   67   2HB   ALA  11           HB2      ALA  11   3.598  11.499  11.499
   68   3HB   ALA  11           HB3      ALA  11   3.671   9.850   9.850
   69    H    PHE  12           HN       PHE  12   0.275  10.412  10.412
   70    HA   PHE  12           HA       PHE  12  -0.579  13.005  13.005
   71   1HB   PHE  12           HB1      PHE  12  -1.190  12.512  12.512
   72   2HB   PHE  12           HB2      PHE  12  -1.629  10.834  10.834
   73    HD1  PHE  12           HD1      PHE  12  -2.793  14.381  14.381
   74    HD2  PHE  12           HD2      PHE  12  -3.780  10.275  10.275
   75    HE1  PHE  12           HE1      PHE  12  -5.176  14.965  14.965
   76    HE2  PHE  12           HE2      PHE  12  -6.143  10.856  10.856
   77    HZ   PHE  12           HZ       PHE  12  -6.850  13.205  13.205
   78    H    PHE  13           HN       PHE  13  -0.278  10.066  10.066
   79    HA   PHE  13           HA       PHE  13  -2.893   9.934   9.934
   80   1HB   PHE  13           HB1      PHE  13  -1.454   7.915   7.915
   81   2HB   PHE  13           HB2      PHE  13  -0.476   8.259   8.259
   82    HD1  PHE  13           HD1      PHE  13  -1.813   8.465   8.465
   83    HD2  PHE  13           HD2      PHE  13  -3.397   6.648   6.648
   84    HE1  PHE  13           HE1      PHE  13  -3.511   7.313   7.313
   85    HE2  PHE  13           HE2      PHE  13  -5.090   5.500   5.500
   86    HZ   PHE  13           HZ       PHE  13  -5.148   5.828   5.828
   87    H    LEU  14           HN       LEU  14   0.541  10.407  10.407
   88    HA   LEU  14           HA       LEU  14   0.230  10.987  10.987
   89   1HB   LEU  14           HB1      LEU  14   2.196  12.359  12.359
   90   2HB   LEU  14           HB2      LEU  14   2.360  12.301  12.301
   91    HG   LEU  14           HG       LEU  14   3.946  10.779  10.779
   92   1HD1  LEU  14          HD11      LEU  14   1.580   9.026   9.026
   93   2HD1  LEU  14          HD12      LEU  14   3.263   8.525   8.525
   94   3HD1  LEU  14          HD13      LEU  14   2.742   9.735   9.735
   95   1HD2  LEU  14          HD21      LEU  14   3.335  10.647  10.647
   96   2HD2  LEU  14          HD22      LEU  14   3.672   9.056   9.056
   97   3HD2  LEU  14          HD23      LEU  14   2.016   9.539   9.539
   98    H    PHE  15           HN       PHE  15   0.446  13.177  13.177
   99    HA   PHE  15           HA       PHE  15  -0.331  15.572  15.572
  100   1HB   PHE  15           HB1      PHE  15   0.870  15.932  15.932
  101   2HB   PHE  15           HB2      PHE  15   0.191  14.487  14.487
  102    HD1  PHE  15           HD1      PHE  15  -1.921  14.581  14.581
  103    HD2  PHE  15           HD2      PHE  15  -0.039  18.137  18.137
  104    HE1  PHE  15           HE1      PHE  15  -3.287  15.923  15.923
  105    HE2  PHE  15           HE2      PHE  15  -1.435  19.476  19.476
  106    HZ   PHE  15           HZ       PHE  15  -3.055  18.358  18.358
  107    H    CYS  16           HN       MER  16  -2.408  13.391  13.391
  108    HA   CYS  16           HA       MER  16  -4.790  14.919  14.919
  109   1HB   CYS  16           HB1      MER  16  -6.088  12.967  12.967
  110   2HB   CYS  16           HB2      MER  16  -4.714  12.909  12.909
  111    H    SER  17           HN       SER  17  -3.424  12.406  12.406
  112    HA   SER  17           HA       SER  17  -5.546  12.242  12.242
  113   1HB   SER  17           HB1      SER  17  -2.531  12.046  12.046
  114   2HB   SER  17           HB2      SER  17  -3.788  11.461  11.461
  115    HG   SER  17           HG       SER  17  -2.830  10.300  10.300
  116    H    GLU  18           HN       GLU  18  -2.784  14.359  14.359
  117    HA   GLU  18           HA       GLU  18  -3.429  15.861  15.861
  118   1HB   GLU  18           HB1      GLU  18  -1.174  15.597  15.597
  119   2HB   GLU  18           HB2      GLU  18  -1.660  16.510  16.510
  120   1HG   GLU  18           HG1      GLU  18  -2.037  18.523  18.523
  121   2HG   GLU  18           HG2      GLU  18  -1.706  17.635  17.635
  122    H    TYR  19           HN       TYR  19  -4.806  15.942  15.942
  123    HA   TYR  19           HA       TYR  19  -5.632  18.777  18.777
  124   1HB   TYR  19           HB1      TYR  19  -5.524  16.699  16.699
  125   2HB   TYR  19           HB2      TYR  19  -6.882  17.846  17.846
  126    HD1  TYR  19           HD1      TYR  19  -3.204  17.971  17.971
  127    HD2  TYR  19           HD2      TYR  19  -6.517  19.711  19.711
  128    HE1  TYR  19           HE1      TYR  19  -1.729  19.682  19.682
  129    HE2  TYR  19           HE2      TYR  19  -5.047  21.425  21.425
  130    HH   TYR  19           HH       TYR  19  -2.059  22.113  22.113
  131    H    ARG  20           HN       ARG  20  -7.127  15.638  15.638
  132    HA   ARG  20           HA       ARG  20  -9.726  15.848  15.848
  133   1HB   ARG  20           HB1      ARG  20  -8.117  14.424  14.424
  134   2HB   ARG  20           HB2      ARG  20  -9.840  14.496  14.496
  135   1HG   ARG  20           HG1      ARG  20 -10.019  13.699  13.699
  136   2HG   ARG  20           HG2      ARG  20  -8.350  13.215  13.215
  137   1HD   ARG  20           HD1      ARG  20 -10.630  12.378  12.378
  138   2HD   ARG  20           HD2      ARG  20 -10.039  11.393  11.393
  139    HE   ARG  20           HE       ARG  20  -8.171  12.277  12.277
  140   1HH1  ARG  20          HH11      ARG  20  -6.952  10.521  10.521
  141   2HH1  ARG  20          HH12      ARG  20  -7.226   8.934   8.934
  142   1HH2  ARG  20          HH21      ARG  20  -9.768   9.998   9.998
  143   2HH2  ARG  20          HH22      ARG  20  -8.859   8.628   8.628
  144    HA   PRO  21           HA       PRO  21 -11.229  17.499  17.499
  145   1HB   PRO  21           HB1      PRO  21  -9.592  18.330  18.330
  146   2HB   PRO  21           HB2      PRO  21  -9.859  16.606  16.606
  147   1HG   PRO  21           HG1      PRO  21  -7.589  18.343  18.343
  148   2HG   PRO  21           HG2      PRO  21  -7.437  16.880  16.880
  149   1HD   PRO  21           HD1      PRO  21  -7.376  16.625  16.625
  150   2HD   PRO  21           HD2      PRO  21  -8.369  15.493  15.493
  151    H    LYS  22           HN       LYS  22  -8.842  19.248  19.248
  152    HA   LYS  22           HA       LYS  22  -9.758  21.888  21.888
  153   1HB   LYS  22           HB1      LYS  22  -7.622  21.182  21.182
  154   2HB   LYS  22           HB2      LYS  22  -7.939  22.776  22.776
  155   1HG   LYS  22           HG1      LYS  22  -7.515  21.646  21.646
  156   2HG   LYS  22           HG2      LYS  22  -6.792  20.347  20.347
  157   1HD   LYS  22           HD1      LYS  22  -5.228  21.957  21.957
  158   2HD   LYS  22           HD2      LYS  22  -5.974  23.278  23.278
  159   1HE   LYS  22           HE1      LYS  22  -5.330  22.125  22.125
  160   2HE   LYS  22           HE2      LYS  22  -4.452  20.938  20.938
  161   1HZ   LYS  22           HZ1      LYS  22  -3.698  23.471  23.471
  162   2HZ   LYS  22           HZ2      LYS  22  -3.627  23.472  23.472
  163   3HZ   LYS  22           HZ3      LYS  22  -2.758  22.311  22.311
  164    H    ILE  23           HN       ILE  23  -9.993  19.827  19.827
  165    HA   ILE  23           HA       ILE  23 -11.264  22.082  22.082
  166    HB   ILE  23           HB       ILE  23 -11.655  19.951  19.951
  167   1HG1  ILE  23          HG11      ILE  23  -9.076  19.237  19.237
  168   2HG1  ILE  23          HG12      ILE  23 -10.546  18.283  18.283
  169   1HG2  ILE  23          HG21      ILE  23 -10.553  22.085  22.085
  170   2HG2  ILE  23          HG22      ILE  23  -9.106  21.551  21.551
  171   3HG2  ILE  23          HG23      ILE  23  -9.586  20.781  20.781
  172   1HD1  ILE  23          HD11      ILE  23 -10.402  18.036  18.036
  173   2HD1  ILE  23          HD12      ILE  23  -8.861  18.854  18.854
  174   3HD1  ILE  23          HD13      ILE  23  -9.054  17.309  17.309
  175    H    LYS  24           HN       LYS  24 -11.881  19.197  19.197
  176    HA   LYS  24           HA       LYS  24 -14.664  18.900  18.900
  177   1HB   LYS  24           HB1      LYS  24 -13.008  17.195  17.195
  178   2HB   LYS  24           HB2      LYS  24 -12.909  17.964  17.964
  179   1HG   LYS  24           HG1      LYS  24 -15.401  17.596  17.596
  180   2HG   LYS  24           HG2      LYS  24 -15.445  16.732  16.732
  181   1HD   LYS  24           HD1      LYS  24 -13.904  15.943  15.943
  182   2HD   LYS  24           HD2      LYS  24 -15.320  15.145  15.145
  183   1HE   LYS  24           HE1      LYS  24 -12.582  15.251  15.251
  184   2HE   LYS  24           HE2      LYS  24 -13.329  13.852  13.852
  185   1HZ   LYS  24           HZ1      LYS  24 -15.132  14.909  14.909
  186   2HZ   LYS  24           HZ2      LYS  24 -13.617  14.780  14.780
  187   3HZ   LYS  24           HZ3      LYS  24 -14.330  13.416  13.416
  188    H    GLY  25           HN       GLY  25 -12.667  20.565  20.565
  189   1HA   GLY  25           HA1      GLY  25 -14.720  21.311  21.311
  190   2HA   GLY  25           HA2      GLY  25 -13.101  22.003  22.003
  191    H    GLU  26           HN       GLU  26 -13.188  22.857  22.857
  192    HA   GLU  26           HA       GLU  26 -14.586  25.367  25.367
  193   1HB   GLU  26           HB1      GLU  26 -13.036  24.139  24.139
  194   2HB   GLU  26           HB2      GLU  26 -13.587  25.799  25.799
  195   1HG   GLU  26           HG1      GLU  26 -11.858  24.727  24.727
  196   2HG   GLU  26           HG2      GLU  26 -11.117  25.243  25.243
  197    H    HIS  27           HN       HIS  27 -14.825  22.582  22.582
  198    HA   HIS  27           HA       HIS  27 -17.570  23.359  23.359
  199   1HB   HIS  27           HB1      HIS  27 -15.695  21.732  21.732
  200   2HB   HIS  27           HB2      HIS  27 -17.123  22.659  22.659
  201    HD1  HIS  27           HD1      HIS  27 -16.740  25.348  25.348
  202    HD2  HIS  27           HD2      HIS  27 -13.321  23.104  23.104
  203    HE1  HIS  27           HE1      HIS  27 -14.889  26.911  26.911
  204    HA   PRO  28           HA       PRO  28 -18.078  19.137  19.137
  205   1HB   PRO  28           HB1      PRO  28 -19.805  19.705  19.705
  206   2HB   PRO  28           HB2      PRO  28 -18.080  19.986  19.986
  207   1HG   PRO  28           HG1      PRO  28 -20.204  22.015  22.015
  208   2HG   PRO  28           HG2      PRO  28 -19.044  22.172  22.172
  209   1HD   PRO  28           HD1      PRO  28 -18.523  23.221  23.221
  210   2HD   PRO  28           HD2      PRO  28 -17.209  22.600  22.600
  211    H    GLY  29           HN       GLY  29 -18.877  20.191  20.191
  212   1HA   GLY  29           HA1      GLY  29 -21.772  19.635  19.635
  213   2HA   GLY  29           HA2      GLY  29 -21.031  20.938  20.938
  214    H    LEU  30           HN       LEU  30 -18.583  19.035  19.035
  215    HA   LEU  30           HA       LEU  30 -19.646  17.737  17.737
  216   1HB   LEU  30           HB1      LEU  30 -16.819  17.266  17.266
  217   2HB   LEU  30           HB2      LEU  30 -17.663  18.200  18.200
  218    HG   LEU  30           HG       LEU  30 -16.815  19.349  19.349
  219   1HD1  LEU  30          HD11      LEU  30 -15.419  19.433  19.433
  220   2HD1  LEU  30          HD12      LEU  30 -14.901  20.312  20.312
  221   3HD1  LEU  30          HD13      LEU  30 -14.845  18.565  18.565
  222   1HD2  LEU  30          HD21      LEU  30 -17.640  20.604  20.604
  223   2HD2  LEU  30          HD22      LEU  30 -18.633  20.603  20.603
  224   3HD2  LEU  30          HD23      LEU  30 -17.123  21.495  21.495
  225    H    SER  31           HN       SER  31 -18.216  15.690  15.690
  226    HA   SER  31           HA       SER  31 -18.585  13.731  13.731
  227   1HB   SER  31           HB1      SER  31 -18.877  13.343  13.343
  228   2HB   SER  31           HB2      SER  31 -19.059  12.062  12.062
  229    HG   SER  31           HG       SER  31 -20.799  13.960  13.960
  230    H    ILE  32           HN       ILE  32 -17.260  11.695  11.695
  231    HA   ILE  32           HA       ILE  32 -14.504  12.408  12.408
  232    HB   ILE  32           HB       ILE  32 -16.066  10.226  10.226
  233   1HG1  ILE  32          HG11      ILE  32 -14.029  10.738  10.738
  234   2HG1  ILE  32          HG12      ILE  32 -14.057   9.062   9.062
  235   1HG2  ILE  32          HG21      ILE  32 -14.403   9.216   9.216
  236   2HG2  ILE  32          HG22      ILE  32 -15.270   8.207   8.207
  237   3HG2  ILE  32          HG23      ILE  32 -16.158   9.286   9.286
  238   1HD1  ILE  32          HD11      ILE  32 -12.510   9.580   9.580
  239   2HD1  ILE  32          HD12      ILE  32 -12.479  11.268  11.268
  240   3HD1  ILE  32          HD13      ILE  32 -11.813  10.025  10.025
  241    H    GLY  33           HN       GLY  33 -16.449  12.211  12.211
  242   1HA   GLY  33           HA1      GLY  33 -14.346  11.447  11.447
  243   2HA   GLY  33           HA2      GLY  33 -16.060  11.635  11.635
  244    H    ASP  34           HN       ASP  34 -15.710  14.184  14.184
  245    HA   ASP  34           HA       ASP  34 -15.032  15.996  15.996
  246   1HB   ASP  34           HB1      ASP  34 -16.547  16.248  16.248
  247   2HB   ASP  34           HB2      ASP  34 -16.276  17.664  17.664
  248    H    VAL  35           HN       VAL  35 -14.542  15.324  15.324
  249    HA   VAL  35           HA       VAL  35 -12.526  17.267  17.267
  250    HB   VAL  35           HB       VAL  35 -13.331  14.554  14.554
  251   1HG1  VAL  35          HG11      VAL  35 -11.030  15.178  15.178
  252   2HG1  VAL  35          HG12      VAL  35 -11.675  16.702  16.702
  253   3HG1  VAL  35          HG13      VAL  35 -12.212  15.199  15.199
  254   1HG2  VAL  35          HG21      VAL  35 -15.120  16.313  16.313
  255   2HG2  VAL  35          HG22      VAL  35 -14.537  15.930  15.930
  256   3HG2  VAL  35          HG23      VAL  35 -14.016  17.403  17.403
  257    H    ALA  36           HN       ALA  36 -12.585  14.206  14.206
  258    HA   ALA  36           HA       ALA  36  -9.693  13.839  13.839
  259   1HB   ALA  36           HB1      ALA  36 -11.926  12.282  12.282
  260   2HB   ALA  36           HB2      ALA  36 -10.257  11.727  11.727
  261   3HB   ALA  36           HB3      ALA  36 -11.201  11.925  11.925
  262    H    LYS  37           HN       LYS  37 -12.266  14.647  14.647
  263    HA   LYS  37           HA       LYS  37 -10.574  14.685  14.685
  264   1HB   LYS  37           HB1      LYS  37 -13.034  14.518  14.518
  265   2HB   LYS  37           HB2      LYS  37 -13.149  16.205  16.205
  266   1HG   LYS  37           HG1      LYS  37 -11.993  15.095  15.095
  267   2HG   LYS  37           HG2      LYS  37 -13.637  15.677  15.677
  268   1HD   LYS  37           HD1      LYS  37 -12.545  17.976  17.976
  269   2HD   LYS  37           HD2      LYS  37 -11.063  17.297  17.297
  270   1HE   LYS  37           HE1      LYS  37 -13.636  17.606  17.606
  271   2HE   LYS  37           HE2      LYS  37 -12.191  18.588  18.588
  272   1HZ   LYS  37           HZ1      LYS  37 -11.457  15.896  15.896
  273   2HZ   LYS  37           HZ2      LYS  37 -12.781  16.160  16.160
  274   3HZ   LYS  37           HZ3      LYS  37 -11.378  17.105  17.105
  275    H    LYS  38           HN       LYS  38 -11.527  17.254  17.254
  276    HA   LYS  38           HA       LYS  38 -10.176  19.313  19.313
  277   1HB   LYS  38           HB1      LYS  38 -12.016  19.203  19.203
  278   2HB   LYS  38           HB2      LYS  38 -10.544  19.838  19.838
  279   1HG   LYS  38           HG1      LYS  38 -10.460  21.587  21.587
  280   2HG   LYS  38           HG2      LYS  38 -11.990  20.972  20.972
  281   1HD   LYS  38           HD1      LYS  38 -13.018  21.411  21.411
  282   2HD   LYS  38           HD2      LYS  38 -11.493  22.107  22.107
  283   1HE   LYS  38           HE1      LYS  38 -11.665  23.798  23.798
  284   2HE   LYS  38           HE2      LYS  38 -13.234  23.121  23.121
  285   1HZ   LYS  38           HZ1      LYS  38 -13.220  23.633  23.633
  286   2HZ   LYS  38           HZ2      LYS  38 -12.631  25.015  25.015
  287   3HZ   LYS  38           HZ3      LYS  38 -14.147  24.377  24.377
  288    H    LEU  39           HN       LEU  39  -9.390  17.593  17.593
  289    HA   LEU  39           HA       LEU  39  -6.818  18.884  18.884
  290   1HB   LEU  39           HB1      LEU  39  -7.070  18.069  18.069
  291   2HB   LEU  39           HB2      LEU  39  -8.544  17.303  17.303
  292    HG   LEU  39           HG       LEU  39  -7.062  15.389  15.389
  293   1HD1  LEU  39          HD11      LEU  39  -4.980  16.728  16.728
  294   2HD1  LEU  39          HD12      LEU  39  -5.307  16.810  16.810
  295   3HD1  LEU  39          HD13      LEU  39  -4.926  15.255  15.255
  296   1HD2  LEU  39          HD21      LEU  39  -7.310  16.013  16.013
  297   2HD2  LEU  39          HD22      LEU  39  -8.568  15.230  15.230
  298   3HD2  LEU  39          HD23      LEU  39  -7.050  14.409  14.409
  299    H    GLY  40           HN       GLY  40  -7.930  15.910  15.910
  300   1HA   GLY  40           HA1      GLY  40  -5.513  14.609  14.609
  301   2HA   GLY  40           HA2      GLY  40  -6.916  14.516  14.516
  302    H    GLU  41           HN       GLU  41  -7.134  17.148  17.148
  303    HA   GLU  41           HA       GLU  41  -5.088  17.134  17.134
  304   1HB   GLU  41           HB1      GLU  41  -6.352  18.987  18.987
  305   2HB   GLU  41           HB2      GLU  41  -7.395  17.694  17.694
  306   1HG   GLU  41           HG1      GLU  41  -8.004  18.900  18.900
  307   2HG   GLU  41           HG2      GLU  41  -6.895  20.226  20.226
  308    H    MET  42           HN       MET  42  -5.778  19.099  19.099
  309    HA   MET  42           HA       MET  42  -3.911  21.169  21.169
  310   1HB   MET  42           HB1      MET  42  -4.728  19.674  19.674
  311   2HB   MET  42           HB2      MET  42  -3.753  21.142  21.142
  312   1HG   MET  42           HG1      MET  42  -6.430  21.022  21.022
  313   2HG   MET  42           HG2      MET  42  -6.353  21.400  21.400
  314   1HE   MET  42           HE1      MET  42  -5.399  22.390  22.390
  315   2HE   MET  42           HE2      MET  42  -7.080  22.807  22.807
  316   3HE   MET  42           HE3      MET  42  -5.906  24.063  24.063
  317    H    TRP  43           HN       TRP  43  -3.553  18.022  18.022
  318    HA   TRP  43           HA       TRP  43  -0.858  17.923  17.923
  319   1HB   TRP  43           HB1      TRP  43  -2.345  16.200  16.200
  320   2HB   TRP  43           HB2      TRP  43  -2.757  15.880  15.880
  321    HD1  TRP  43           HD1      TRP  43  -1.376  14.111  14.111
  322    HE1  TRP  43           HE1      TRP  43   0.729  12.928  12.928
  323    HE3  TRP  43           HE3      TRP  43  -0.137  16.504  16.504
  324    HZ2  TRP  43           HZ2      TRP  43   2.778  12.878  12.878
  325    HZ3  TRP  43           HZ3      TRP  43   1.875  15.866  15.866
  326    HH2  TRP  43           HH2      TRP  43   3.343  14.054  14.054
  327    H    ASN  44           HN       ASN  44  -2.343  17.053  17.053
  328    HA   ASN  44           HA       ASN  44   0.009  16.428  16.428
  329   1HB   ASN  44           HB1      ASN  44  -1.549  15.903  15.903
  330   2HB   ASN  44           HB2      ASN  44  -2.789  16.624  16.624
  331   1HD2  ASN  44          HD21      ASN  44  -3.537  19.028  19.028
  332   2HD2  ASN  44          HD22      ASN  44  -3.975  18.189  18.189
  333    H    ASN  45           HN       ASN  45  -1.227  19.457  19.457
  334    HA   ASN  45           HA       ASN  45   1.012  20.901  20.901
  335   1HB   ASN  45           HB1      ASN  45  -1.549  22.374  22.374
  336   2HB   ASN  45           HB2      ASN  45  -0.383  22.706  22.706
  337   1HD2  ASN  45          HD21      ASN  45  -3.655  20.507  20.507
  338   2HD2  ASN  45          HD22      ASN  45  -3.353  21.350  21.350
  339    H    THR  46           HN       THR  46   1.134  19.779  19.779
  340    HA   THR  46           HA       THR  46   0.560  21.917  21.917
  341    HB   THR  46           HB       THR  46   0.731  19.470  19.470
  342    HG1  THR  46           HG1      THR  46   1.106  20.472  20.472
  343   1HG2  THR  46          HG21      THR  46   3.778  19.907  19.907
  344   2HG2  THR  46          HG22      THR  46   2.930  18.528  18.528
  345   3HG2  THR  46          HG23      THR  46   2.919  18.810  18.810
  346    H    ALA  47           HN       ALA  47   3.470  20.705  20.705
  347    HA   ALA  47           HA       ALA  47   4.724  23.198  23.198
  348   1HB   ALA  47           HB1      ALA  47   5.017  23.246  23.246
  349   2HB   ALA  47           HB2      ALA  47   5.846  21.703  21.703
  350   3HB   ALA  47           HB3      ALA  47   6.553  23.134  23.134
  351    H    ALA  48           HN       ALA  48   5.347  19.957  19.957
  352    HA   ALA  48           HA       ALA  48   6.170  18.070  18.070
  353   1HB   ALA  48           HB1      ALA  48   6.045  19.254  19.254
  354   2HB   ALA  48           HB2      ALA  48   7.582  20.039  20.039
  355   3HB   ALA  48           HB3      ALA  48   7.499  18.299  18.299
  356    H    ASP  49           HN       ASP  49   7.520  20.812  20.812
  357    HA   ASP  49           HA       ASP  49  10.124  19.627  19.627
  358   1HB   ASP  49           HB1      ASP  49  10.181  21.810  21.810
  359   2HB   ASP  49           HB2      ASP  49   9.107  22.509  22.509
  360    H    ASP  50           HN       ASP  50   7.024  20.080  20.080
  361    HA   ASP  50           HA       ASP  50   7.630  20.262  20.262
  362   1HB   ASP  50           HB1      ASP  50   6.102  22.060  22.060
  363   2HB   ASP  50           HB2      ASP  50   5.032  20.806  20.806
  364    H    LYS  51           HN       LYS  51   6.898  18.252  18.252
  365    HA   LYS  51           HA       LYS  51   5.169  16.364  16.364
  366   1HB   LYS  51           HB1      LYS  51   6.692  16.069  16.069
  367   2HB   LYS  51           HB2      LYS  51   5.545  14.913  14.913
  368   1HG   LYS  51           HG1      LYS  51   3.776  16.674  16.674
  369   2HG   LYS  51           HG2      LYS  51   4.935  17.745  17.745
  370   1HD   LYS  51           HD1      LYS  51   5.242  16.054  16.054
  371   2HD   LYS  51           HD2      LYS  51   4.120  14.984  14.984
  372   1HE   LYS  51           HE1      LYS  51   2.873  16.078  16.078
  373   2HE   LYS  51           HE2      LYS  51   2.383  16.733  16.733
  374   1HZ   LYS  51           HZ1      LYS  51   4.455  18.320  18.320
  375   2HZ   LYS  51           HZ2      LYS  51   3.423  18.083  18.083
  376   3HZ   LYS  51           HZ3      LYS  51   2.814  18.726  18.726
  377    H    GLN  52           HN       GLN  52   8.447  16.638  16.638
  378    HA   GLN  52           HA       GLN  52   9.788  14.446  14.446
  379   1HB   GLN  52           HB1      GLN  52  10.489  17.182  17.182
  380   2HB   GLN  52           HB2      GLN  52  11.128  16.643  16.643
  381   1HG   GLN  52           HG1      GLN  52  12.864  16.342  16.342
  382   2HG   GLN  52           HG2      GLN  52  12.305  14.755  14.755
  383   1HE2  GLN  52          HE21      GLN  52  10.383  15.340  15.340
  384   2HE2  GLN  52          HE22      GLN  52   9.855  15.977  15.977
  385    HA   PRO  53           HA       PRO  53  10.071  14.732  14.732
  386   1HB   PRO  53           HB1      PRO  53   7.857  16.017  16.017
  387   2HB   PRO  53           HB2      PRO  53   9.446  16.735  16.735
  388   1HG   PRO  53           HG1      PRO  53   7.079  16.845  16.845
  389   2HG   PRO  53           HG2      PRO  53   8.019  18.205  18.205
  390   1HD   PRO  53           HD1      PRO  53   8.718  17.310  17.310
  391   2HD   PRO  53           HD2      PRO  53  10.030  17.484  17.484
  392    H    TYR  54           HN       TYR  54   6.870  14.761  14.761
  393    HA   TYR  54           HA       TYR  54   5.876  12.531  12.531
  394   1HB   TYR  54           HB1      TYR  54   4.753  13.922  13.922
  395   2HB   TYR  54           HB2      TYR  54   3.887  12.692  12.692
  396    HD1  TYR  54           HD1      TYR  54   4.329  13.406  13.406
  397    HD2  TYR  54           HD2      TYR  54   3.804  16.002  16.002
  398    HE1  TYR  54           HE1      TYR  54   3.522  15.172  15.172
  399    HE2  TYR  54           HE2      TYR  54   3.005  17.766  17.766
  400    HH   TYR  54           HH       TYR  54   3.497  18.161  18.161
  401    H    GLU  55           HN       GLU  55   6.592  13.062  13.062
  402    HA   GLU  55           HA       GLU  55   6.220  10.490  10.490
  403   1HB   GLU  55           HB1      GLU  55   7.548  12.971  12.971
  404   2HB   GLU  55           HB2      GLU  55   8.435  11.616  11.616
  405   1HG   GLU  55           HG1      GLU  55   6.158  10.730  10.730
  406   2HG   GLU  55           HG2      GLU  55   5.460  12.250  12.250
  407    H    LYS  56           HN       LYS  56   9.359  11.754  11.754
  408    HA   LYS  56           HA       LYS  56  10.847   9.415   9.415
  409   1HB   LYS  56           HB1      LYS  56  11.762  11.707  11.707
  410   2HB   LYS  56           HB2      LYS  56  11.212  11.646  11.646
  411   1HG   LYS  56           HG1      LYS  56  13.636  11.179  11.179
  412   2HG   LYS  56           HG2      LYS  56  12.781   9.827   9.827
  413   1HD   LYS  56           HD1      LYS  56  12.865   8.586   8.586
  414   2HD   LYS  56           HD2      LYS  56  13.489   9.987   9.987
  415   1HE   LYS  56           HE1      LYS  56  14.953   8.612   8.612
  416   2HE   LYS  56           HE2      LYS  56  15.270   8.285   8.285
  417   1HZ   LYS  56           HZ1      LYS  56  15.287  11.053  11.053
  418   2HZ   LYS  56           HZ2      LYS  56  16.287  10.345  10.345
  419   3HZ   LYS  56           HZ3      LYS  56  16.560  10.036  10.036
  420    H    LYS  57           HN       LYS  57   8.583  10.240  10.240
  421    HA   LYS  57           HA       LYS  57   9.560   8.290   8.290
  422   1HB   LYS  57           HB1      LYS  57   8.271  10.433  10.433
  423   2HB   LYS  57           HB2      LYS  57   6.822   9.672   9.672
  424   1HG   LYS  57           HG1      LYS  57   7.078   7.823   7.823
  425   2HG   LYS  57           HG2      LYS  57   8.504   8.605   8.605
  426   1HD   LYS  57           HD1      LYS  57   5.674   9.741   9.741
  427   2HD   LYS  57           HD2      LYS  57   6.538   9.057   9.057
  428   1HE   LYS  57           HE1      LYS  57   6.788  11.415  11.415
  429   2HE   LYS  57           HE2      LYS  57   8.321  10.908  10.908
  430   1HZ   LYS  57           HZ1      LYS  57   6.543  11.457  11.457
  431   2HZ   LYS  57           HZ2      LYS  57   6.515  12.764  12.764
  432   3HZ   LYS  57           HZ3      LYS  57   7.986  12.252  12.252
  433    H    ALA  58           HN       ALA  58   6.745   8.642   8.642
  434    HA   ALA  58           HA       ALA  58   5.560   6.125   6.125
  435   1HB   ALA  58           HB1      ALA  58   5.961   7.710   7.710
  436   2HB   ALA  58           HB2      ALA  58   4.764   6.449   6.449
  437   3HB   ALA  58           HB3      ALA  58   4.646   7.949   7.949
  438    H    ALA  59           HN       ALA  59   8.141   7.110   7.110
  439    HA   ALA  59           HA       ALA  59   8.794   4.736   4.736
  440   1HB   ALA  59           HB1      ALA  59  10.729   6.866   6.866
  441   2HB   ALA  59           HB2      ALA  59  11.096   5.700   5.700
  442   3HB   ALA  59           HB3      ALA  59   9.872   6.930   6.930
  443    H    LYS  60           HN       LYS  60  10.403   5.944   5.944
  444    HA   LYS  60           HA       LYS  60  11.980   3.864   3.864
  445   1HB   LYS  60           HB1      LYS  60  11.627   6.054   6.054
  446   2HB   LYS  60           HB2      LYS  60  10.165   5.396   5.396
  447   1HG   LYS  60           HG1      LYS  60  11.459   3.562   3.562
  448   2HG   LYS  60           HG2      LYS  60  12.936   4.193   4.193
  449   1HD   LYS  60           HD1      LYS  60  11.145   5.715   5.715
  450   2HD   LYS  60           HD2      LYS  60  12.603   4.858   4.858
  451   1HE   LYS  60           HE1      LYS  60  13.935   6.360   6.360
  452   2HE   LYS  60           HE2      LYS  60  12.467   7.258   7.258
  453   1HZ   LYS  60           HZ1      LYS  60  12.677   7.032   7.032
  454   2HZ   LYS  60           HZ2      LYS  60  14.178   7.553   7.553
  455   3HZ   LYS  60           HZ3      LYS  60  12.770   8.428   8.428
  456    H    LEU  61           HN       LEU  61   8.484   4.036   4.036
  457    HA   LEU  61           HA       LEU  61   8.405   1.438   1.438
  458   1HB   LEU  61           HB1      LEU  61   6.076   2.937   2.937
  459   2HB   LEU  61           HB2      LEU  61   6.010   1.779   1.779
  460    HG   LEU  61           HG       LEU  61   7.314   4.544   4.544
  461   1HD1  LEU  61          HD11      LEU  61   4.966   3.412   3.412
  462   2HD1  LEU  61          HD12      LEU  61   5.661   5.017   5.017
  463   3HD1  LEU  61          HD13      LEU  61   4.912   4.586   4.586
  464   1HD2  LEU  61          HD21      LEU  61   7.351   2.460   2.460
  465   2HD2  LEU  61          HD22      LEU  61   8.749   2.999   2.999
  466   3HD2  LEU  61          HD23      LEU  61   7.911   4.124   4.124
  467    H    LYS  62           HN       LYS  62   7.315   2.493   2.493
  468    HA   LYS  62           HA       LYS  62   6.495   0.077   0.077
  469   1HB   LYS  62           HB1      LYS  62   6.450   2.069   2.069
  470   2HB   LYS  62           HB2      LYS  62   8.179   2.308   2.308
  471   1HG   LYS  62           HG1      LYS  62   8.654   0.349   0.349
  472   2HG   LYS  62           HG2      LYS  62   6.968  -0.128  -0.128
  473   1HD   LYS  62           HD1      LYS  62   8.040   2.519   2.519
  474   2HD   LYS  62           HD2      LYS  62   7.873   1.081   1.081
  475   1HE   LYS  62           HE1      LYS  62   5.540   2.414   2.414
  476   2HE   LYS  62           HE2      LYS  62   5.890   2.569   2.569
  477   1HZ   LYS  62           HZ1      LYS  62   5.924  -0.143  -0.143
  478   2HZ   LYS  62           HZ2      LYS  62   4.501   0.532   0.532
  479   3HZ   LYS  62           HZ3      LYS  62   4.853   0.691   0.691
  480    H    GLU  63           HN       GLU  63   9.719   1.300   1.300
  481    HA   GLU  63           HA       GLU  63  11.293  -0.746  -0.746
  482   1HB   GLU  63           HB1      GLU  63  12.054   1.578   1.578
  483   2HB   GLU  63           HB2      GLU  63  11.876   1.212   1.212
  484   1HG   GLU  63           HG1      GLU  63  14.198   1.074   1.074
  485   2HG   GLU  63           HG2      GLU  63  13.676  -0.586  -0.586
  486    H    LYS  64           HN       LYS  64  10.217  -0.243  -0.243
  487    HA   LYS  64           HA       LYS  64  11.419  -2.508  -2.508
  488   1HB   LYS  64           HB1      LYS  64  10.210  -0.618  -0.618
  489   2HB   LYS  64           HB2      LYS  64   8.690  -1.333  -1.333
  490   1HG   LYS  64           HG1      LYS  64   8.741  -2.755  -2.755
  491   2HG   LYS  64           HG2      LYS  64  10.216  -3.476  -3.476
  492   1HD   LYS  64           HD1      LYS  64  10.097  -0.976  -0.976
  493   2HD   LYS  64           HD2      LYS  64  10.445  -2.586  -2.586
  494   1HE   LYS  64           HE1      LYS  64  12.472  -2.692  -2.692
  495   2HE   LYS  64           HE2      LYS  64  12.140  -1.072  -1.072
  496   1HZ   LYS  64           HZ1      LYS  64  12.075  -1.047  -1.047
  497   2HZ   LYS  64           HZ2      LYS  64  13.512  -1.796  -1.796
  498   3HZ   LYS  64           HZ3      LYS  64  13.130  -0.233  -0.233
  499    H    TYR  65           HN       TYR  65   8.291  -2.128  -2.128
  500    HA   TYR  65           HA       TYR  65   7.200  -4.700  -4.700
  501   1HB   TYR  65           HB1      TYR  65   5.591  -3.348  -3.348
  502   2HB   TYR  65           HB2      TYR  65   6.811  -2.293  -2.293
  503    HD1  TYR  65           HD1      TYR  65   6.273  -5.900  -5.900
  504    HD2  TYR  65           HD2      TYR  65   5.693  -1.846  -1.846
  505    HE1  TYR  65           HE1      TYR  65   5.640  -6.615  -6.615
  506    HE2  TYR  65           HE2      TYR  65   5.047  -2.570  -2.570
  507    HH   TYR  65           HH       TYR  65   5.717  -5.472  -5.472
  508    H    GLU  66           HN       GLU  66   8.913  -3.515  -3.515
  509    HA   GLU  66           HA       GLU  66   9.235  -5.792  -5.792
  510   1HB   GLU  66           HB1      GLU  66  11.413  -3.807  -3.807
  511   2HB   GLU  66           HB2      GLU  66  11.306  -4.876  -4.876
  512   1HG   GLU  66           HG1      GLU  66   9.025  -2.950  -2.950
  513   2HG   GLU  66           HG2      GLU  66  10.434  -2.349  -2.349
  514    H    LYS  67           HN       LYS  67  10.955  -5.094  -5.094
  515    HA   LYS  67           HA       LYS  67  12.770  -7.381  -7.381
  516   1HB   LYS  67           HB1      LYS  67  12.547  -5.182  -5.182
  517   2HB   LYS  67           HB2      LYS  67  13.422  -6.632  -6.632
  518   1HG   LYS  67           HG1      LYS  67  14.963  -5.005  -5.005
  519   2HG   LYS  67           HG2      LYS  67  14.885  -6.353  -6.353
  520   1HD   LYS  67           HD1      LYS  67  13.471  -5.027  -5.027
  521   2HD   LYS  67           HD2      LYS  67  13.418  -3.709  -3.709
  522   1HE   LYS  67           HE1      LYS  67  15.112  -3.258  -3.258
  523   2HE   LYS  67           HE2      LYS  67  15.878  -3.424  -3.424
  524   1HZ   LYS  67           HZ1      LYS  67  15.697  -5.957  -5.957
  525   2HZ   LYS  67           HZ2      LYS  67  16.335  -4.890  -4.890
  526   3HZ   LYS  67           HZ3      LYS  67  17.092  -5.056  -5.056
  527    H    ASP  68           HN       ASP  68  10.014  -6.602  -6.602
  528    HA   ASP  68           HA       ASP  68  10.030  -8.899  -8.899
  529   1HB   ASP  68           HB1      ASP  68   9.076  -6.588  -6.588
  530   2HB   ASP  68           HB2      ASP  68   7.733  -6.998  -6.998
  531    H    ILE  69           HN       ILE  69   8.907  -8.022  -8.022
  532    HA   ILE  69           HA       ILE  69   6.995 -10.250 -10.250
  533    HB   ILE  69           HB       ILE  69   6.910  -7.891  -7.891
  534   1HG1  ILE  69          HG11      ILE  69   5.185  -9.085  -9.085
  535   2HG1  ILE  69          HG12      ILE  69   5.952  -8.880  -8.880
  536   1HG2  ILE  69          HG21      ILE  69   9.080  -7.847  -7.847
  537   2HG2  ILE  69          HG22      ILE  69   8.730  -9.177  -9.177
  538   3HG2  ILE  69          HG23      ILE  69   7.899  -7.631  -7.631
  539   1HD1  ILE  69          HD11      ILE  69   7.021 -11.143 -11.143
  540   2HD1  ILE  69          HD12      ILE  69   6.096 -11.370 -11.370
  541   3HD1  ILE  69          HD13      ILE  69   5.267 -11.243 -11.243
  542    H    ALA  70           HN       ALA  70  10.186  -9.247  -9.247
  543    HA   ALA  70           HA       ALA  70  10.937 -11.556 -11.556
  544   1HB   ALA  70           HB1      ALA  70  12.691  -9.674  -9.674
  545   2HB   ALA  70           HB2      ALA  70  13.296 -10.803 -10.803
  546   3HB   ALA  70           HB3      ALA  70  12.287  -9.453  -9.453
  547    H    ALA  71           HN       ALA  71  10.574 -10.896 -10.896
  548    HA   ALA  71           HA       ALA  71  12.057 -13.250 -13.250
  549   1HB   ALA  71           HB1      ALA  71  10.373 -11.213 -11.213
  550   2HB   ALA  71           HB2      ALA  71  11.367 -12.467 -12.467
  551   3HB   ALA  71           HB3      ALA  71  12.123 -11.166 -11.166
  552    H    TYR  72           HN       TYR  72   8.790 -12.044 -12.044
  553    HA   TYR  72           HA       TYR  72   7.295 -14.078 -14.078
  554   1HB   TYR  72           HB1      TYR  72   6.238 -12.103 -12.103
  555   2HB   TYR  72           HB2      TYR  72   6.757 -12.411 -12.411
  556    HD1  TYR  72           HD1      TYR  72   4.408 -13.491 -13.491
  557    HD2  TYR  72           HD2      TYR  72   5.526 -13.858 -13.858
  558    HE1  TYR  72           HE1      TYR  72   2.305 -14.658 -14.658
  559    HE2  TYR  72           HE2      TYR  72   3.425 -15.027 -15.027
  560    HH   TYR  72           HH       TYR  72   1.694 -16.518 -16.518
  561    H    ARG  73           HN       ARG  73   8.596 -13.837 -13.837
  562    HA   ARG  73           HA       ARG  73   7.636 -16.435 -16.435
  563   1HB   ARG  73           HB1      ARG  73   9.770 -14.577 -14.577
  564   2HB   ARG  73           HB2      ARG  73   9.131 -15.973 -15.973
  565   1HG   ARG  73           HG1      ARG  73   6.875 -14.875 -14.875
  566   2HG   ARG  73           HG2      ARG  73   7.550 -13.491 -13.491
  567   1HD   ARG  73           HD1      ARG  73   9.246 -13.287 -13.287
  568   2HD   ARG  73           HD2      ARG  73   8.318 -14.516 -14.516
  569    HE   ARG  73           HE       ARG  73   7.215 -11.854 -11.854
  570   1HH1  ARG  73          HH11      ARG  73   5.222 -13.908 -13.908
  571   2HH1  ARG  73          HH12      ARG  73   4.970 -13.633 -13.633
  572   1HH2  ARG  73          HH21      ARG  73   7.920 -11.755 -11.755
  573   2HH2  ARG  73          HH22      ARG  73   6.550 -12.374 -12.374
  574    H    ALA  74           HN       ALA  74  10.532 -15.056 -15.056
  575    HA   ALA  74           HA       ALA  74  12.368 -17.143 -17.143
  576   1HB   ALA  74           HB1      ALA  74  13.002 -14.984 -14.984
  577   2HB   ALA  74           HB2      ALA  74  12.143 -15.404 -15.404
  578   3HB   ALA  74           HB3      ALA  74  13.557 -16.315 -16.315
  579    H    LYS  75           HN       LYS  75  10.062 -16.768 -16.768
  580    HA   LYS  75           HA       LYS  75   9.994 -19.678 -19.678
  581   1HB   LYS  75           HB1      LYS  75  11.950 -18.633 -18.633
  582   2HB   LYS  75           HB2      LYS  75  10.686 -17.958 -17.958
  583   1HG   LYS  75           HG1      LYS  75  11.246 -20.024 -20.024
  584   2HG   LYS  75           HG2      LYS  75   9.750 -20.357 -20.357
  585   1HD   LYS  75           HD1      LYS  75  11.124 -22.224 -22.224
  586   2HD   LYS  75           HD2      LYS  75  11.223 -21.219 -21.219
  587   1HE   LYS  75           HE1      LYS  75  13.484 -21.931 -21.931
  588   2HE   LYS  75           HE2      LYS  75  13.396 -20.242 -20.242
  589   1HZ   LYS  75           HZ1      LYS  75  12.590 -21.771 -21.771
  590   2HZ   LYS  75           HZ2      LYS  75  14.024 -22.447 -22.447
  591   3HZ   LYS  75           HZ3      LYS  75  13.982 -20.813 -20.813
  592    H    GLY  76           HN       GLY  76   8.785 -16.543 -16.543
  593   1HA   GLY  76           HA1      GLY  76   6.642 -17.228 -17.228
  594   2HA   GLY  76           HA2      GLY  76   6.745 -15.762 -15.762
  595    H    LYS  77           HN       LYS  77   5.808 -19.121 -19.121
  596    HA   LYS  77           HA       LYS  77   3.650 -18.457 -18.457
  597   1HB   LYS  77           HB1      LYS  77   4.916 -21.221 -21.221
  598   2HB   LYS  77           HB2      LYS  77   3.927 -20.692 -20.692
  599   1HG   LYS  77           HG1      LYS  77   5.786 -18.993 -18.993
  600   2HG   LYS  77           HG2      LYS  77   6.780 -19.899 -19.899
  601   1HD   LYS  77           HD1      LYS  77   6.136 -22.017 -22.017
  602   2HD   LYS  77           HD2      LYS  77   5.499 -20.911 -20.911
  603   1HE   LYS  77           HE1      LYS  77   7.774 -21.433 -21.433
  604   2HE   LYS  77           HE2      LYS  77   7.787 -19.783 -19.783
  605   1HZ   LYS  77           HZ1      LYS  77   8.175 -21.509 -21.509
  606   2HZ   LYS  77           HZ2      LYS  77   9.244 -21.966 -21.966
  607   3HZ   LYS  77           HZ3      LYS  77   9.255 -20.370 -20.370
  608    HA   PRO  78           HA       PRO  78   0.937 -20.544 -20.544
  609   1HB   PRO  78           HB1      PRO  78   0.364 -22.831 -22.831
  610   2HB   PRO  78           HB2      PRO  78  -0.782 -21.786 -21.786
  611   1HG   PRO  78           HG1      PRO  78  -0.377 -21.329 -21.329
  612   2HG   PRO  78           HG2      PRO  78  -0.386 -19.936 -19.936
  613   1HD   PRO  78           HD1      PRO  78   2.045 -21.509 -21.509
  614   2HD   PRO  78           HD2      PRO  78   1.775 -19.752 -19.752
  615    H    ASP  79           HN       ASP  79   3.779 -21.651 -21.651
  616    HA   ASP  79           HA       ASP  79   3.880 -23.790 -23.790
  617   1HB   ASP  79           HB1      ASP  79   5.406 -23.712 -23.712
  618   2HB   ASP  79           HB2      ASP  79   5.470 -25.009 -25.009
  619    H    ALA  80           HN       ALA  80   4.233 -21.630 -21.630
  620    HA   ALA  80           HA       ALA  80   6.904 -20.436 -20.436
  621   1HB   ALA  80           HB1      ALA  80   4.936 -18.998 -18.998
  622   2HB   ALA  80           HB2      ALA  80   4.634 -19.809 -19.809
  623   3HB   ALA  80           HB3      ALA  80   6.084 -18.839 -18.839
  624    H    ALA  81           HN       ALA  81   7.981 -22.348 -22.348
  625    HA   ALA  81           HA       ALA  81   9.476 -23.531 -23.531
  626   1HB   ALA  81           HB1      ALA  81   9.857 -21.426 -21.426
  627   2HB   ALA  81           HB2      ALA  81   8.494 -21.766 -21.766
  628   3HB   ALA  81           HB3      ALA  81   9.900 -22.800 -22.800
  629   1H1   BME  16           HE1      MER  16  -8.776  10.063  10.063
  630   2H1   BME  16           HE2      MER  16  -7.562  11.346  11.346
  631   1H2   BME  16           HZ1      MER  16  -8.114   9.140   9.140
  632   2H2   BME  16           HZ2      MER  16  -6.758   9.146   9.146
  633    HO1  BME  16           HH       MER  16 -10.002  11.167  11.167

  Start of MODEL   34
    1    H    ASN   3           HN       ASN   3   2.287 -14.904 -14.904
    2    HA   ASN   3           HA       ASN   3   2.606 -12.124 -12.124
    3   1HB   ASN   3           HB1      ASN   3   4.567 -13.795 -13.795
    4   2HB   ASN   3           HB2      ASN   3   4.802 -12.091 -12.091
    5   1HD2  ASN   3          HD21      ASN   3   6.044 -12.717 -12.717
    6   2HD2  ASN   3          HD22      ASN   3   5.755 -11.590 -11.590
    7    H    ALA   4           HN       ALA   4   3.441 -10.836 -10.836
    8    HA   ALA   4           HA       ALA   4   3.223 -10.420 -10.420
    9   1HB   ALA   4           HB1      ALA   4   0.286 -11.204 -11.204
   10   2HB   ALA   4           HB2      ALA   4   0.933 -10.589 -10.589
   11   3HB   ALA   4           HB3      ALA   4   1.441 -12.160 -12.160
   12    HA   PRO   5           HA       PRO   5   2.479  -6.902  -6.902
   13   1HB   PRO   5           HB1      PRO   5   4.108  -5.779  -5.779
   14   2HB   PRO   5           HB2      PRO   5   4.122  -5.338  -5.338
   15   1HG   PRO   5           HG1      PRO   5   5.967  -7.082  -7.082
   16   2HG   PRO   5           HG2      PRO   5   5.018  -7.502  -7.502
   17   1HD   PRO   5           HD1      PRO   5   4.647  -8.508  -8.508
   18   2HD   PRO   5           HD2      PRO   5   4.594  -9.435  -9.435
   19    H    LYS   6           HN       LYS   6   2.569  -6.136  -6.136
   20    HA   LYS   6           HA       LYS   6   0.516  -5.811  -5.811
   21   1HB   LYS   6           HB1      LYS   6  -1.145  -4.116  -4.116
   22   2HB   LYS   6           HB2      LYS   6  -1.059  -5.375  -5.375
   23   1HG   LYS   6           HG1      LYS   6   0.735  -3.648  -3.648
   24   2HG   LYS   6           HG2      LYS   6  -0.114  -2.506  -2.506
   25   1HD   LYS   6           HD1      LYS   6  -2.197  -2.844  -2.844
   26   2HD   LYS   6           HD2      LYS   6  -1.735  -4.393  -4.393
   27   1HE   LYS   6           HE1      LYS   6  -0.070  -3.184  -3.184
   28   2HE   LYS   6           HE2      LYS   6  -0.710  -1.657  -1.657
   29   1HZ   LYS   6           HZ1      LYS   6  -2.846  -3.282  -3.282
   30   2HZ   LYS   6           HZ2      LYS   6  -1.688  -3.259  -3.259
   31   3HZ   LYS   6           HZ3      LYS   6  -2.331  -1.801  -1.801
   32    H    ARG   7           HN       ARG   7  -0.071  -3.232  -3.232
   33    HA   ARG   7           HA       ARG   7   2.644  -2.125  -2.125
   34   1HB   ARG   7           HB1      ARG   7   0.075  -1.419  -1.419
   35   2HB   ARG   7           HB2      ARG   7   1.705  -0.960  -0.960
   36   1HG   ARG   7           HG1      ARG   7   2.223  -3.457  -3.457
   37   2HG   ARG   7           HG2      ARG   7   0.499  -3.748  -3.748
   38   1HD   ARG   7           HD1      ARG   7   0.076  -2.100  -2.100
   39   2HD   ARG   7           HD2      ARG   7   1.817  -2.003  -2.003
   40    HE   ARG   7           HE       ARG   7   1.710  -4.518  -4.518
   41   1HH1  ARG   7          HH11      ARG   7  -1.344  -4.311  -4.311
   42   2HH1  ARG   7          HH12      ARG   7  -1.986  -4.454  -4.454
   43   1HH2  ARG   7          HH21      ARG   7   1.118  -3.873  -3.873
   44   2HH2  ARG   7          HH22      ARG   7  -0.559  -4.199  -4.199
   45    HA   PRO   8           HA       PRO   8   1.481   1.039   1.039
   46   1HB   PRO   8           HB1      PRO   8   3.589   2.789   2.789
   47   2HB   PRO   8           HB2      PRO   8   3.747   1.333   1.333
   48   1HG   PRO   8           HG1      PRO   8   4.241   1.701   1.701
   49   2HG   PRO   8           HG2      PRO   8   5.309   1.048   1.048
   50   1HD   PRO   8           HD1      PRO   8   3.896  -0.632  -0.632
   51   2HD   PRO   8           HD2      PRO   8   3.982  -0.976  -0.976
   52    HA   PRO   9           HA       PRO   9  -0.622   4.703   4.703
   53   1HB   PRO   9           HB1      PRO   9   1.931   6.112   6.112
   54   2HB   PRO   9           HB2      PRO   9   0.277   6.715   6.715
   55   1HG   PRO   9           HG1      PRO   9   1.211   5.593   5.593
   56   2HG   PRO   9           HG2      PRO   9  -0.365   5.009   5.009
   57   1HD   PRO   9           HD1      PRO   9   2.361   3.743   3.743
   58   2HD   PRO   9           HD2      PRO   9   0.829   2.940   2.940
   59    H    SER  10           HN       SER  10  -0.239   6.852   6.852
   60    HA   SER  10           HA       SER  10   0.765   6.137   6.137
   61   1HB   SER  10           HB1      SER  10  -1.386   8.111   8.111
   62   2HB   SER  10           HB2      SER  10  -0.906   7.768   7.768
   63    HG   SER  10           HG       SER  10  -2.013   6.012   6.012
   64    H    ALA  11           HN       ALA  11   0.829   8.646   8.646
   65    HA   ALA  11           HA       ALA  11   3.006   9.936   9.936
   66   1HB   ALA  11           HB1      ALA  11   2.198  10.813  10.813
   67   2HB   ALA  11           HB2      ALA  11   3.511  11.483  11.483
   68   3HB   ALA  11           HB3      ALA  11   3.635   9.856   9.856
   69    H    PHE  12           HN       PHE  12   0.283  10.464  10.464
   70    HA   PHE  12           HA       PHE  12  -0.656  12.988  12.988
   71   1HB   PHE  12           HB1      PHE  12  -1.413  12.110  12.110
   72   2HB   PHE  12           HB2      PHE  12  -1.892  10.569  10.569
   73    HD1  PHE  12           HD1      PHE  12  -2.753  14.060  14.060
   74    HD2  PHE  12           HD2      PHE  12  -4.084  10.385  10.385
   75    HE1  PHE  12           HE1      PHE  12  -4.992  14.986  14.986
   76    HE2  PHE  12           HE2      PHE  12  -6.356  11.320  11.320
   77    HZ   PHE  12           HZ       PHE  12  -6.807  13.621  13.621
   78    H    PHE  13           HN       PHE  13  -0.898   9.746   9.746
   79    HA   PHE  13           HA       PHE  13  -3.135  10.102  10.102
   80   1HB   PHE  13           HB1      PHE  13  -1.763   7.943   7.943
   81   2HB   PHE  13           HB2      PHE  13  -0.906   8.265   8.265
   82    HD1  PHE  13           HD1      PHE  13  -2.425   8.696   8.696
   83    HD2  PHE  13           HD2      PHE  13  -3.834   6.848   6.848
   84    HE1  PHE  13           HE1      PHE  13  -4.352   7.794   7.794
   85    HE2  PHE  13           HE2      PHE  13  -5.758   5.945   5.945
   86    HZ   PHE  13           HZ       PHE  13  -6.022   6.414   6.414
   87    H    LEU  14           HN       LEU  14   0.358  10.436  10.436
   88    HA   LEU  14           HA       LEU  14   0.132  11.005  11.005
   89   1HB   LEU  14           HB1      LEU  14   2.094  12.276  12.276
   90   2HB   LEU  14           HB2      LEU  14   2.276  12.330  12.330
   91    HG   LEU  14           HG       LEU  14   3.812  10.752  10.752
   92   1HD1  LEU  14          HD11      LEU  14   2.630   9.806   9.806
   93   2HD1  LEU  14          HD12      LEU  14   1.458   9.026   9.026
   94   3HD1  LEU  14          HD13      LEU  14   3.148   8.541   8.541
   95   1HD2  LEU  14          HD21      LEU  14   3.208  10.539  10.539
   96   2HD2  LEU  14          HD22      LEU  14   3.490   8.948   8.948
   97   3HD2  LEU  14          HD23      LEU  14   1.849   9.487   9.487
   98    H    PHE  15           HN       PHE  15   0.200  13.389  13.389
   99    HA   PHE  15           HA       PHE  15  -0.419  15.522  15.522
  100   1HB   PHE  15           HB1      PHE  15   0.483  16.719  16.719
  101   2HB   PHE  15           HB2      PHE  15   0.603  15.210  15.210
  102    HD1  PHE  15           HD1      PHE  15  -1.489  14.515  14.515
  103    HD2  PHE  15           HD2      PHE  15  -0.740  18.493  18.493
  104    HE1  PHE  15           HE1      PHE  15  -3.013  15.372  15.372
  105    HE2  PHE  15           HE2      PHE  15  -2.279  19.356  19.356
  106    HZ   PHE  15           HZ       PHE  15  -3.418  17.783  17.783
  107    H    CYS  16           HN       MER  16  -2.434  13.617  13.617
  108    HA   CYS  16           HA       MER  16  -4.821  15.110  15.110
  109   1HB   CYS  16           HB1      MER  16  -6.036  13.159  13.159
  110   2HB   CYS  16           HB2      MER  16  -4.532  13.036  13.036
  111    H    SER  17           HN       SER  17  -3.478  12.572  12.572
  112    HA   SER  17           HA       SER  17  -5.597  12.387  12.387
  113   1HB   SER  17           HB1      SER  17  -3.631  10.858  10.858
  114   2HB   SER  17           HB2      SER  17  -2.595  12.164  12.164
  115    HG   SER  17           HG       SER  17  -4.228  10.588  10.588
  116    H    GLU  18           HN       GLU  18  -2.727  14.403  14.403
  117    HA   GLU  18           HA       GLU  18  -3.306  15.882  15.882
  118   1HB   GLU  18           HB1      GLU  18  -1.099  15.761  15.761
  119   2HB   GLU  18           HB2      GLU  18  -1.636  16.464  16.464
  120   1HG   GLU  18           HG1      GLU  18  -2.045  18.622  18.622
  121   2HG   GLU  18           HG2      GLU  18  -1.751  17.945  17.945
  122    H    TYR  19           HN       TYR  19  -4.747  16.065  16.065
  123    HA   TYR  19           HA       TYR  19  -5.724  18.842  18.842
  124   1HB   TYR  19           HB1      TYR  19  -5.546  16.907  16.907
  125   2HB   TYR  19           HB2      TYR  19  -6.871  18.096  18.096
  126    HD1  TYR  19           HD1      TYR  19  -3.194  18.122  18.122
  127    HD2  TYR  19           HD2      TYR  19  -6.454  19.953  19.953
  128    HE1  TYR  19           HE1      TYR  19  -1.695  19.856  19.856
  129    HE2  TYR  19           HE2      TYR  19  -4.966  21.686  21.686
  130    HH   TYR  19           HH       TYR  19  -2.453  22.630  22.630
  131    H    ARG  20           HN       ARG  20  -7.090  15.691  15.691
  132    HA   ARG  20           HA       ARG  20  -9.681  15.796  15.796
  133   1HB   ARG  20           HB1      ARG  20  -8.611  13.744  13.744
  134   2HB   ARG  20           HB2      ARG  20  -8.091  14.172  14.172
  135   1HG   ARG  20           HG1      ARG  20 -10.508  14.131  14.131
  136   2HG   ARG  20           HG2      ARG  20 -10.987  13.734  13.734
  137   1HD   ARG  20           HD1      ARG  20  -9.586  11.654  11.654
  138   2HD   ARG  20           HD2      ARG  20  -9.154  12.064  12.064
  139    HE   ARG  20           HE       ARG  20 -11.995  11.585  11.585
  140   1HH1  ARG  20          HH11      ARG  20 -12.415  12.151  12.151
  141   2HH1  ARG  20          HH12      ARG  20 -11.917  10.802  10.802
  142   1HH2  ARG  20          HH21      ARG  20  -9.970   9.423   9.423
  143   2HH2  ARG  20          HH22      ARG  20 -10.498   9.216   9.216
  144    HA   PRO  21           HA       PRO  21 -11.209  16.793  16.793
  145   1HB   PRO  21           HB1      PRO  21  -9.628  17.364  17.364
  146   2HB   PRO  21           HB2      PRO  21  -9.803  15.698  15.698
  147   1HG   PRO  21           HG1      PRO  21  -7.626  17.710  17.710
  148   2HG   PRO  21           HG2      PRO  21  -7.399  16.121  16.121
  149   1HD   PRO  21           HD1      PRO  21  -7.320  16.313  16.313
  150   2HD   PRO  21           HD2      PRO  21  -8.218  14.971  14.971
  151    H    LYS  22           HN       LYS  22  -8.808  18.769  18.769
  152    HA   LYS  22           HA       LYS  22  -9.785  21.270  21.270
  153   1HB   LYS  22           HB1      LYS  22  -7.604  20.902  20.902
  154   2HB   LYS  22           HB2      LYS  22  -7.916  22.337  22.337
  155   1HG   LYS  22           HG1      LYS  22  -7.565  20.656  20.656
  156   2HG   LYS  22           HG2      LYS  22  -6.744  19.689  19.689
  157   1HD   LYS  22           HD1      LYS  22  -5.172  21.465  21.465
  158   2HD   LYS  22           HD2      LYS  22  -6.053  22.606  22.606
  159   1HE   LYS  22           HE1      LYS  22  -5.604  21.112  21.112
  160   2HE   LYS  22           HE2      LYS  22  -4.585  20.117  20.117
  161   1HZ   LYS  22           HZ1      LYS  22  -3.838  22.787  22.787
  162   2HZ   LYS  22           HZ2      LYS  22  -3.938  22.475  22.475
  163   3HZ   LYS  22           HZ3      LYS  22  -2.942  21.514  21.514
  164    H    ILE  23           HN       ILE  23  -9.965  19.507  19.507
  165    HA   ILE  23           HA       ILE  23 -11.027  21.841  21.841
  166    HB   ILE  23           HB       ILE  23 -11.298  18.901  18.901
  167   1HG1  ILE  23          HG11      ILE  23  -9.057  20.830  20.830
  168   2HG1  ILE  23          HG12      ILE  23  -8.851  19.526  19.526
  169   1HG2  ILE  23          HG21      ILE  23 -12.701  20.663  20.663
  170   2HG2  ILE  23          HG22      ILE  23 -11.231  21.537  21.537
  171   3HG2  ILE  23          HG23      ILE  23 -11.545  19.964  19.964
  172   1HD1  ILE  23          HD11      ILE  23  -9.555  17.881  17.881
  173   2HD1  ILE  23          HD12      ILE  23  -9.757  19.153  19.153
  174   3HD1  ILE  23          HD13      ILE  23  -8.167  18.781  18.781
  175    H    LYS  24           HN       LYS  24 -11.938  18.840  18.840
  176    HA   LYS  24           HA       LYS  24 -14.720  18.832  18.832
  177   1HB   LYS  24           HB1      LYS  24 -13.111  17.007  17.007
  178   2HB   LYS  24           HB2      LYS  24 -12.974  17.713  17.713
  179   1HG   LYS  24           HG1      LYS  24 -15.440  17.333  17.333
  180   2HG   LYS  24           HG2      LYS  24 -15.596  16.681  16.681
  181   1HD   LYS  24           HD1      LYS  24 -15.421  14.764  14.764
  182   2HD   LYS  24           HD2      LYS  24 -13.856  14.907  14.907
  183   1HE   LYS  24           HE1      LYS  24 -13.419  14.514  14.514
  184   2HE   LYS  24           HE2      LYS  24 -13.099  16.219  16.219
  185   1HZ   LYS  24           HZ1      LYS  24 -15.806  15.948  15.948
  186   2HZ   LYS  24           HZ2      LYS  24 -14.925  15.073  15.073
  187   3HZ   LYS  24           HZ3      LYS  24 -14.591  16.719  16.719
  188    H    GLY  25           HN       GLY  25 -12.614  20.337  20.337
  189   1HA   GLY  25           HA1      GLY  25 -14.525  21.014  21.014
  190   2HA   GLY  25           HA2      GLY  25 -12.936  21.744  21.744
  191    H    GLU  26           HN       GLU  26 -13.234  22.709  22.709
  192    HA   GLU  26           HA       GLU  26 -14.696  25.169  25.169
  193   1HB   GLU  26           HB1      GLU  26 -13.045  24.177  24.177
  194   2HB   GLU  26           HB2      GLU  26 -13.596  25.830  25.830
  195   1HG   GLU  26           HG1      GLU  26 -11.885  24.378  24.378
  196   2HG   GLU  26           HG2      GLU  26 -11.192  25.346  25.346
  197    H    HIS  27           HN       HIS  27 -14.772  22.594  22.594
  198    HA   HIS  27           HA       HIS  27 -17.488  23.297  23.297
  199   1HB   HIS  27           HB1      HIS  27 -15.329  21.873  21.873
  200   2HB   HIS  27           HB2      HIS  27 -16.821  22.587  22.587
  201    HD1  HIS  27           HD1      HIS  27 -16.844  25.325  25.325
  202    HD2  HIS  27           HD2      HIS  27 -13.173  23.534  23.534
  203    HE1  HIS  27           HE1      HIS  27 -15.205  27.139  27.139
  204    HA   PRO  28           HA       PRO  28 -17.910  19.016  19.016
  205   1HB   PRO  28           HB1      PRO  28 -19.822  19.465  19.465
  206   2HB   PRO  28           HB2      PRO  28 -18.144  19.865  19.865
  207   1HG   PRO  28           HG1      PRO  28 -20.298  21.754  21.754
  208   2HG   PRO  28           HG2      PRO  28 -19.326  21.974  21.974
  209   1HD   PRO  28           HD1      PRO  28 -18.540  23.078  23.078
  210   2HD   PRO  28           HD2      PRO  28 -17.319  22.460  22.460
  211    H    GLY  29           HN       GLY  29 -18.557  20.122  20.122
  212   1HA   GLY  29           HA1      GLY  29 -21.358  19.363  19.363
  213   2HA   GLY  29           HA2      GLY  29 -20.608  20.755  20.755
  214    H    LEU  30           HN       LEU  30 -17.992  19.091  19.091
  215    HA   LEU  30           HA       LEU  30 -18.342  17.965  17.965
  216   1HB   LEU  30           HB1      LEU  30 -15.975  17.892  17.892
  217   2HB   LEU  30           HB2      LEU  30 -15.874  17.494  17.494
  218    HG   LEU  30           HG       LEU  30 -16.256  20.141  20.141
  219   1HD1  LEU  30          HD11      LEU  30 -14.266  19.142  19.142
  220   2HD1  LEU  30          HD12      LEU  30 -14.303  20.778  20.778
  221   3HD1  LEU  30          HD13      LEU  30 -13.969  19.429  19.429
  222   1HD2  LEU  30          HD21      LEU  30 -16.719  19.672  19.672
  223   2HD2  LEU  30          HD22      LEU  30 -17.945  20.163  20.163
  224   3HD2  LEU  30          HD23      LEU  30 -16.615  21.235  21.235
  225    H    SER  31           HN       SER  31 -17.530  15.877  15.877
  226    HA   SER  31           HA       SER  31 -18.264  13.713  13.713
  227   1HB   SER  31           HB1      SER  31 -19.734  13.964  13.964
  228   2HB   SER  31           HB2      SER  31 -18.279  13.601  13.601
  229    HG   SER  31           HG       SER  31 -18.540  11.609  11.609
  230    H    ILE  32           HN       ILE  32 -17.119  11.623  11.623
  231    HA   ILE  32           HA       ILE  32 -14.289  12.022  12.022
  232    HB   ILE  32           HB       ILE  32 -15.925  10.019  10.019
  233   1HG1  ILE  32          HG11      ILE  32 -13.574   9.721   9.721
  234   2HG1  ILE  32          HG12      ILE  32 -14.268   8.254   8.254
  235   1HG2  ILE  32          HG21      ILE  32 -16.898   9.701   9.701
  236   2HG2  ILE  32          HG22      ILE  32 -15.340   9.265   9.265
  237   3HG2  ILE  32          HG23      ILE  32 -16.106   8.218   8.218
  238   1HD1  ILE  32          HD11      ILE  32 -13.163   8.745   8.745
  239   2HD1  ILE  32          HD12      ILE  32 -12.389  10.142  10.142
  240   3HD1  ILE  32          HD13      ILE  32 -12.032   8.539   8.539
  241    H    GLY  33           HN       GLY  33 -16.359  12.346  12.346
  242   1HA   GLY  33           HA1      GLY  33 -14.312  11.831  11.831
  243   2HA   GLY  33           HA2      GLY  33 -16.033  12.081  12.081
  244    H    ASP  34           HN       ASP  34 -15.501  14.377  14.377
  245    HA   ASP  34           HA       ASP  34 -14.832  16.404  16.404
  246   1HB   ASP  34           HB1      ASP  34 -16.293  16.539  16.539
  247   2HB   ASP  34           HB2      ASP  34 -16.026  17.982  17.982
  248    H    VAL  35           HN       VAL  35 -14.314  15.454  15.454
  249    HA   VAL  35           HA       VAL  35 -12.260  17.340  17.340
  250    HB   VAL  35           HB       VAL  35 -12.969  14.560  14.560
  251   1HG1  VAL  35          HG11      VAL  35 -11.164  16.689  16.689
  252   2HG1  VAL  35          HG12      VAL  35 -11.621  15.189  15.189
  253   3HG1  VAL  35          HG13      VAL  35 -10.599  15.156  15.156
  254   1HG2  VAL  35          HG21      VAL  35 -13.616  17.324  17.324
  255   2HG2  VAL  35          HG22      VAL  35 -14.743  16.192  16.192
  256   3HG2  VAL  35          HG23      VAL  35 -13.989  15.801  15.801
  257    H    ALA  36           HN       ALA  36 -12.439  14.327  14.327
  258    HA   ALA  36           HA       ALA  36  -9.557  13.934  13.934
  259   1HB   ALA  36           HB1      ALA  36 -11.094  12.027  12.027
  260   2HB   ALA  36           HB2      ALA  36 -11.841  12.470  12.470
  261   3HB   ALA  36           HB3      ALA  36 -10.181  11.887  11.887
  262    H    LYS  37           HN       LYS  37 -12.186  14.831  14.831
  263    HA   LYS  37           HA       LYS  37 -10.552  14.948  14.948
  264   1HB   LYS  37           HB1      LYS  37 -12.925  14.776  14.776
  265   2HB   LYS  37           HB2      LYS  37 -13.149  16.256  16.256
  266   1HG   LYS  37           HG1      LYS  37 -12.202  17.540  17.540
  267   2HG   LYS  37           HG2      LYS  37 -11.855  16.058  16.058
  268   1HD   LYS  37           HD1      LYS  37 -13.951  16.954  16.954
  269   2HD   LYS  37           HD2      LYS  37 -14.325  15.523  15.523
  270   1HE   LYS  37           HE1      LYS  37 -15.933  17.353  17.353
  271   2HE   LYS  37           HE2      LYS  37 -15.033  16.940  16.940
  272   1HZ   LYS  37           HZ1      LYS  37 -13.618  18.905  18.905
  273   2HZ   LYS  37           HZ2      LYS  37 -15.231  19.406  19.406
  274   3HZ   LYS  37           HZ3      LYS  37 -14.328  19.008  19.008
  275    H    LYS  38           HN       LYS  38 -11.457  17.421  17.421
  276    HA   LYS  38           HA       LYS  38 -10.211  19.586  19.586
  277   1HB   LYS  38           HB1      LYS  38 -12.005  19.508  19.508
  278   2HB   LYS  38           HB2      LYS  38 -10.632  19.373  19.373
  279   1HG   LYS  38           HG1      LYS  38 -11.081  21.715  21.715
  280   2HG   LYS  38           HG2      LYS  38  -9.647  21.468  21.468
  281   1HD   LYS  38           HD1      LYS  38 -10.783  22.650  22.650
  282   2HD   LYS  38           HD2      LYS  38 -11.616  21.148  21.148
  283   1HE   LYS  38           HE1      LYS  38 -12.587  23.401  23.401
  284   2HE   LYS  38           HE2      LYS  38 -13.285  22.880  22.880
  285   1HZ   LYS  38           HZ1      LYS  38 -13.197  20.667  20.667
  286   2HZ   LYS  38           HZ2      LYS  38 -13.852  21.962  21.962
  287   3HZ   LYS  38           HZ3      LYS  38 -14.550  21.484  21.484
  288    H    LEU  39           HN       LEU  39  -9.194  17.773  17.773
  289    HA   LEU  39           HA       LEU  39  -6.599  19.001  19.001
  290   1HB   LEU  39           HB1      LEU  39  -6.515  18.095  18.095
  291   2HB   LEU  39           HB2      LEU  39  -8.179  17.688  17.688
  292    HG   LEU  39           HG       LEU  39  -7.336  15.497  15.497
  293   1HD1  LEU  39          HD11      LEU  39  -4.943  16.183  16.183
  294   2HD1  LEU  39          HD12      LEU  39  -5.032  16.409  16.409
  295   3HD1  LEU  39          HD13      LEU  39  -5.183  14.803  14.803
  296   1HD2  LEU  39          HD21      LEU  39  -8.541  15.851  15.851
  297   2HD2  LEU  39          HD22      LEU  39  -7.335  14.591  14.591
  298   3HD2  LEU  39          HD23      LEU  39  -6.977  16.200  16.200
  299    H    GLY  40           HN       GLY  40  -7.972  16.189  16.189
  300   1HA   GLY  40           HA1      GLY  40  -5.735  14.650  14.650
  301   2HA   GLY  40           HA2      GLY  40  -7.159  14.809  14.809
  302    H    GLU  41           HN       GLU  41  -7.042  17.638  17.638
  303    HA   GLU  41           HA       GLU  41  -5.246  17.720  17.720
  304   1HB   GLU  41           HB1      GLU  41  -7.164  19.603  19.603
  305   2HB   GLU  41           HB2      GLU  41  -6.288  20.004  20.004
  306   1HG   GLU  41           HG1      GLU  41  -7.411  18.170  18.170
  307   2HG   GLU  41           HG2      GLU  41  -8.135  17.572  17.572
  308    H    MET  42           HN       MET  42  -5.798  19.454  19.454
  309    HA   MET  42           HA       MET  42  -3.811  21.368  21.368
  310   1HB   MET  42           HB1      MET  42  -4.735  19.552  19.552
  311   2HB   MET  42           HB2      MET  42  -3.776  21.000  21.000
  312   1HG   MET  42           HG1      MET  42  -6.561  21.018  21.018
  313   2HG   MET  42           HG2      MET  42  -5.559  22.384  22.384
  314   1HE   MET  42           HE1      MET  42  -4.767  23.173  23.173
  315   2HE   MET  42           HE2      MET  42  -6.216  23.591  23.591
  316   3HE   MET  42           HE3      MET  42  -6.093  24.043  24.043
  317    H    TRP  43           HN       TRP  43  -3.533  18.090  18.090
  318    HA   TRP  43           HA       TRP  43  -0.836  17.844  17.844
  319   1HB   TRP  43           HB1      TRP  43  -2.479  16.146  16.146
  320   2HB   TRP  43           HB2      TRP  43  -2.797  15.930  15.930
  321    HD1  TRP  43           HD1      TRP  43  -1.500  14.100  14.100
  322    HE1  TRP  43           HE1      TRP  43   0.618  12.896  12.896
  323    HE3  TRP  43           HE3      TRP  43  -0.155  16.522  16.522
  324    HZ2  TRP  43           HZ2      TRP  43   2.694  12.856  12.856
  325    HZ3  TRP  43           HZ3      TRP  43   1.848  15.888  15.888
  326    HH2  TRP  43           HH2      TRP  43   3.302  14.057  14.057
  327    H    ASN  44           HN       ASN  44  -2.440  17.087  17.087
  328    HA   ASN  44           HA       ASN  44  -0.292  16.432  16.432
  329   1HB   ASN  44           HB1      ASN  44  -2.077  16.145  16.145
  330   2HB   ASN  44           HB2      ASN  44  -3.108  17.111  17.111
  331   1HD2  ASN  44          HD21      ASN  44  -3.417  19.618  19.618
  332   2HD2  ASN  44          HD22      ASN  44  -3.978  18.888  18.888
  333    H    ASN  45           HN       ASN  45  -1.413  19.587  19.587
  334    HA   ASN  45           HA       ASN  45   1.028  20.859  20.859
  335   1HB   ASN  45           HB1      ASN  45  -0.396  22.894  22.894
  336   2HB   ASN  45           HB2      ASN  45  -1.052  21.523  21.523
  337   1HD2  ASN  45          HD21      ASN  45  -4.114  21.642  21.642
  338   2HD2  ASN  45          HD22      ASN  45  -3.260  21.062  21.062
  339    H    THR  46           HN       THR  46   1.063  19.811  19.811
  340    HA   THR  46           HA       THR  46   0.436  21.843  21.843
  341    HB   THR  46           HB       THR  46   0.715  19.436  19.436
  342    HG1  THR  46           HG1      THR  46   2.796  20.537  20.537
  343   1HG2  THR  46          HG21      THR  46   2.768  18.794  18.794
  344   2HG2  THR  46          HG22      THR  46   3.746  19.823  19.823
  345   3HG2  THR  46          HG23      THR  46   2.938  18.432  18.432
  346    H    ALA  47           HN       ALA  47   3.309  20.872  20.872
  347    HA   ALA  47           HA       ALA  47   4.529  23.384  23.384
  348   1HB   ALA  47           HB1      ALA  47   4.920  23.302  23.302
  349   2HB   ALA  47           HB2      ALA  47   5.748  21.774  21.774
  350   3HB   ALA  47           HB3      ALA  47   6.422  23.241  23.241
  351    H    ALA  48           HN       ALA  48   5.110  20.148  20.148
  352    HA   ALA  48           HA       ALA  48   5.722  18.258  18.258
  353   1HB   ALA  48           HB1      ALA  48   5.985  19.620  19.620
  354   2HB   ALA  48           HB2      ALA  48   7.531  20.210  20.210
  355   3HB   ALA  48           HB3      ALA  48   7.304  18.499  18.499
  356    H    ASP  49           HN       ASP  49   7.541  21.015  21.015
  357    HA   ASP  49           HA       ASP  49   9.867  19.572  19.572
  358   1HB   ASP  49           HB1      ASP  49   9.166  22.527  22.527
  359   2HB   ASP  49           HB2      ASP  49  10.766  21.807  21.807
  360    H    ASP  50           HN       ASP  50   6.856  19.908  19.908
  361    HA   ASP  50           HA       ASP  50   7.442  20.069  20.069
  362   1HB   ASP  50           HB1      ASP  50   5.924  21.900  21.900
  363   2HB   ASP  50           HB2      ASP  50   4.848  20.698  20.698
  364    H    LYS  51           HN       LYS  51   6.608  18.119  18.119
  365    HA   LYS  51           HA       LYS  51   4.917  16.227  16.227
  366   1HB   LYS  51           HB1      LYS  51   6.339  15.862  15.862
  367   2HB   LYS  51           HB2      LYS  51   5.250  14.708  14.708
  368   1HG   LYS  51           HG1      LYS  51   3.427  16.400  16.400
  369   2HG   LYS  51           HG2      LYS  51   4.537  17.459  17.459
  370   1HD   LYS  51           HD1      LYS  51   4.821  15.776  15.776
  371   2HD   LYS  51           HD2      LYS  51   3.840  14.623  14.623
  372   1HE   LYS  51           HE1      LYS  51   1.898  16.125  16.125
  373   2HE   LYS  51           HE2      LYS  51   2.861  17.304  17.304
  374   1HZ   LYS  51           HZ1      LYS  51   3.132  14.821  14.821
  375   2HZ   LYS  51           HZ2      LYS  51   1.476  15.099  15.099
  376   3HZ   LYS  51           HZ3      LYS  51   2.400  16.234  16.234
  377    H    GLN  52           HN       GLN  52   8.101  16.397  16.397
  378    HA   GLN  52           HA       GLN  52   9.462  14.234  14.234
  379   1HB   GLN  52           HB1      GLN  52  10.192  16.909  16.909
  380   2HB   GLN  52           HB2      GLN  52  10.853  16.531  16.531
  381   1HG   GLN  52           HG1      GLN  52  12.569  16.065  16.065
  382   2HG   GLN  52           HG2      GLN  52  12.020  14.534  14.534
  383   1HE2  GLN  52          HE21      GLN  52  10.049  14.810  14.810
  384   2HE2  GLN  52          HE22      GLN  52   9.548  15.612  15.612
  385    HA   PRO  53           HA       PRO  53  10.050  14.604  14.604
  386   1HB   PRO  53           HB1      PRO  53   7.905  15.928  15.928
  387   2HB   PRO  53           HB2      PRO  53   9.489  16.630  16.630
  388   1HG   PRO  53           HG1      PRO  53   7.031  16.719  16.719
  389   2HG   PRO  53           HG2      PRO  53   7.994  18.092  18.092
  390   1HD   PRO  53           HD1      PRO  53   8.579  17.158  17.158
  391   2HD   PRO  53           HD2      PRO  53   9.944  17.336  17.336
  392    H    TYR  54           HN       TYR  54   6.733  14.716  14.716
  393    HA   TYR  54           HA       TYR  54   5.799  12.507  12.507
  394   1HB   TYR  54           HB1      TYR  54   4.590  13.836  13.836
  395   2HB   TYR  54           HB2      TYR  54   3.754  12.655  12.655
  396    HD1  TYR  54           HD1      TYR  54   4.117  13.377  13.377
  397    HD2  TYR  54           HD2      TYR  54   3.917  16.020  16.020
  398    HE1  TYR  54           HE1      TYR  54   3.391  15.190  15.190
  399    HE2  TYR  54           HE2      TYR  54   3.193  17.834  17.834
  400    HH   TYR  54           HH       TYR  54   3.555  17.830  17.830
  401    H    GLU  55           HN       GLU  55   6.420  12.968  12.968
  402    HA   GLU  55           HA       GLU  55   5.924  10.400  10.400
  403   1HB   GLU  55           HB1      GLU  55   7.020  12.851  12.851
  404   2HB   GLU  55           HB2      GLU  55   8.213  11.650  11.650
  405   1HG   GLU  55           HG1      GLU  55   6.330  10.272  10.272
  406   2HG   GLU  55           HG2      GLU  55   5.240  11.597  11.597
  407    H    LYS  56           HN       LYS  56   9.163  11.587  11.587
  408    HA   LYS  56           HA       LYS  56  10.531   9.155   9.155
  409   1HB   LYS  56           HB1      LYS  56  11.434  11.601  11.601
  410   2HB   LYS  56           HB2      LYS  56  11.304  11.119  11.119
  411   1HG   LYS  56           HG1      LYS  56  12.707   9.031   9.031
  412   2HG   LYS  56           HG2      LYS  56  12.934   9.767   9.767
  413   1HD   LYS  56           HD1      LYS  56  14.887  10.365  10.365
  414   2HD   LYS  56           HD2      LYS  56  13.897  11.809  11.809
  415   1HE   LYS  56           HE1      LYS  56  13.100  11.351  11.351
  416   2HE   LYS  56           HE2      LYS  56  13.929   9.800   9.800
  417   1HZ   LYS  56           HZ1      LYS  56  15.788  11.758  11.758
  418   2HZ   LYS  56           HZ2      LYS  56  14.935  12.309  12.309
  419   3HZ   LYS  56           HZ3      LYS  56  15.719  10.804  10.804
  420    H    LYS  57           HN       LYS  57   8.468  10.241  10.241
  421    HA   LYS  57           HA       LYS  57   9.425   8.297   8.297
  422   1HB   LYS  57           HB1      LYS  57   8.223  10.371  10.371
  423   2HB   LYS  57           HB2      LYS  57   6.746   9.796   9.796
  424   1HG   LYS  57           HG1      LYS  57   6.649   7.874   7.874
  425   2HG   LYS  57           HG2      LYS  57   8.173   8.335   8.335
  426   1HD   LYS  57           HD1      LYS  57   5.732  10.152  10.152
  427   2HD   LYS  57           HD2      LYS  57   6.046   8.977   8.977
  428   1HE   LYS  57           HE1      LYS  57   6.978  11.028  11.028
  429   2HE   LYS  57           HE2      LYS  57   8.363  10.104  10.104
  430   1HZ   LYS  57           HZ1      LYS  57   7.359  11.614  11.614
  431   2HZ   LYS  57           HZ2      LYS  57   7.566  12.629  12.629
  432   3HZ   LYS  57           HZ3      LYS  57   8.874  11.712  11.712
  433    H    ALA  58           HN       ALA  58   6.524   8.526   8.526
  434    HA   ALA  58           HA       ALA  58   5.383   6.020   6.020
  435   1HB   ALA  58           HB1      ALA  58   5.734   7.465   7.465
  436   2HB   ALA  58           HB2      ALA  58   4.595   6.159   6.159
  437   3HB   ALA  58           HB3      ALA  58   4.400   7.692   7.692
  438    H    ALA  59           HN       ALA  59   7.903   6.854   6.854
  439    HA   ALA  59           HA       ALA  59   8.536   4.345   4.345
  440   1HB   ALA  59           HB1      ALA  59   9.513   6.504   6.504
  441   2HB   ALA  59           HB2      ALA  59  10.477   6.612   6.612
  442   3HB   ALA  59           HB3      ALA  59  10.780   5.327   5.327
  443    H    LYS  60           HN       LYS  60  10.253   5.894   5.894
  444    HA   LYS  60           HA       LYS  60  11.905   3.906   3.906
  445   1HB   LYS  60           HB1      LYS  60  11.787   6.140   6.140
  446   2HB   LYS  60           HB2      LYS  60  10.208   5.815   5.815
  447   1HG   LYS  60           HG1      LYS  60  11.159   4.021   4.021
  448   2HG   LYS  60           HG2      LYS  60  12.752   4.351   4.351
  449   1HD   LYS  60           HD1      LYS  60  12.869   6.510   6.510
  450   2HD   LYS  60           HD2      LYS  60  11.136   6.598   6.598
  451   1HE   LYS  60           HE1      LYS  60  13.002   4.652   4.652
  452   2HE   LYS  60           HE2      LYS  60  12.369   6.140   6.140
  453   1HZ   LYS  60           HZ1      LYS  60  10.234   4.697   4.697
  454   2HZ   LYS  60           HZ2      LYS  60  11.145   3.640   3.640
  455   3HZ   LYS  60           HZ3      LYS  60  10.534   5.083   5.083
  456    H    LEU  61           HN       LEU  61   8.494   4.204   4.204
  457    HA   LEU  61           HA       LEU  61   8.444   1.818   1.818
  458   1HB   LEU  61           HB1      LEU  61   6.126   2.971   2.971
  459   2HB   LEU  61           HB2      LEU  61   6.010   2.004   2.004
  460    HG   LEU  61           HG       LEU  61   7.170   4.808   4.808
  461   1HD1  LEU  61          HD11      LEU  61   4.823   3.731   3.731
  462   2HD1  LEU  61          HD12      LEU  61   5.406   5.396   5.396
  463   3HD1  LEU  61          HD13      LEU  61   4.779   4.714   4.714
  464   1HD2  LEU  61          HD21      LEU  61   7.240   3.028   3.028
  465   2HD2  LEU  61          HD22      LEU  61   8.638   3.551   3.551
  466   3HD2  LEU  61          HD23      LEU  61   7.691   4.731   4.731
  467    H    LYS  62           HN       LYS  62   7.350   2.280   2.280
  468    HA   LYS  62           HA       LYS  62   6.746  -0.330  -0.330
  469   1HB   LYS  62           HB1      LYS  62   6.598   1.739   1.739
  470   2HB   LYS  62           HB2      LYS  62   8.337   1.714   1.714
  471   1HG   LYS  62           HG1      LYS  62   8.288  -0.383  -0.383
  472   2HG   LYS  62           HG2      LYS  62   6.575  -0.614  -0.614
  473   1HD   LYS  62           HD1      LYS  62   6.028   1.429   1.429
  474   2HD   LYS  62           HD2      LYS  62   7.732   1.730   1.730
  475   1HE   LYS  62           HE1      LYS  62   6.259  -0.770  -0.770
  476   2HE   LYS  62           HE2      LYS  62   6.583   0.630   0.630
  477   1HZ   LYS  62           HZ1      LYS  62   8.977  -0.134  -0.134
  478   2HZ   LYS  62           HZ2      LYS  62   8.268  -1.521  -1.521
  479   3HZ   LYS  62           HZ3      LYS  62   8.574  -0.166  -0.166
  480    H    GLU  63           HN       GLU  63   9.877   1.200   1.200
  481    HA   GLU  63           HA       GLU  63  11.597  -0.802  -0.802
  482   1HB   GLU  63           HB1      GLU  63  11.957   1.762   1.762
  483   2HB   GLU  63           HB2      GLU  63  12.351   1.046   1.046
  484   1HG   GLU  63           HG1      GLU  63  13.800   0.452   0.452
  485   2HG   GLU  63           HG2      GLU  63  14.347   1.513   1.513
  486    H    LYS  64           HN       LYS  64  10.597  -0.115  -0.115
  487    HA   LYS  64           HA       LYS  64  11.925  -2.300  -2.300
  488   1HB   LYS  64           HB1      LYS  64   9.222  -1.093  -1.093
  489   2HB   LYS  64           HB2      LYS  64  10.141  -2.168  -2.168
  490   1HG   LYS  64           HG1      LYS  64  12.105  -0.418  -0.418
  491   2HG   LYS  64           HG2      LYS  64  10.847   0.645   0.645
  492   1HD   LYS  64           HD1      LYS  64  10.662   1.284   1.284
  493   2HD   LYS  64           HD2      LYS  64   9.682  -0.155  -0.155
  494   1HE   LYS  64           HE1      LYS  64  12.678   0.034   0.034
  495   2HE   LYS  64           HE2      LYS  64  11.421  -0.086  -0.086
  496   1HZ   LYS  64           HZ1      LYS  64  11.107  -2.213  -2.213
  497   2HZ   LYS  64           HZ2      LYS  64  12.737  -2.141  -2.141
  498   3HZ   LYS  64           HZ3      LYS  64  11.531  -2.257  -2.257
  499    H    TYR  65           HN       TYR  65   8.637  -2.134  -2.134
  500    HA   TYR  65           HA       TYR  65   7.730  -4.743  -4.743
  501   1HB   TYR  65           HB1      TYR  65   6.075  -3.295  -3.295
  502   2HB   TYR  65           HB2      TYR  65   7.154  -2.499  -2.499
  503    HD1  TYR  65           HD1      TYR  65   6.001  -6.077  -6.077
  504    HD2  TYR  65           HD2      TYR  65   6.130  -2.532  -2.532
  505    HE1  TYR  65           HE1      TYR  65   4.916  -7.259  -7.259
  506    HE2  TYR  65           HE2      TYR  65   5.054  -3.717  -3.717
  507    HH   TYR  65           HH       TYR  65   3.421  -5.859  -5.859
  508    H    GLU  66           HN       GLU  66   9.180  -3.519  -3.519
  509    HA   GLU  66           HA       GLU  66   9.397  -5.691  -5.691
  510   1HB   GLU  66           HB1      GLU  66  11.612  -3.716  -3.716
  511   2HB   GLU  66           HB2      GLU  66  11.459  -4.754  -4.754
  512   1HG   GLU  66           HG1      GLU  66   9.060  -3.055  -3.055
  513   2HG   GLU  66           HG2      GLU  66  10.466  -2.176  -2.176
  514    H    LYS  67           HN       LYS  67  11.446  -5.090  -5.090
  515    HA   LYS  67           HA       LYS  67  13.176  -7.380  -7.380
  516   1HB   LYS  67           HB1      LYS  67  13.161  -5.825  -5.825
  517   2HB   LYS  67           HB2      LYS  67  14.453  -6.840  -6.840
  518   1HG   LYS  67           HG1      LYS  67  15.333  -5.141  -5.141
  519   2HG   LYS  67           HG2      LYS  67  13.845  -4.918  -4.918
  520   1HD   LYS  67           HD1      LYS  67  13.986  -2.886  -2.886
  521   2HD   LYS  67           HD2      LYS  67  12.985  -3.759  -3.759
  522   1HE   LYS  67           HE1      LYS  67  14.740  -2.564  -2.564
  523   2HE   LYS  67           HE2      LYS  67  14.999  -4.297  -4.297
  524   1HZ   LYS  67           HZ1      LYS  67  16.320  -3.389  -3.389
  525   2HZ   LYS  67           HZ2      LYS  67  16.728  -2.357  -2.357
  526   3HZ   LYS  67           HZ3      LYS  67  16.991  -4.031  -4.031
  527    H    ASP  68           HN       ASP  68  10.452  -6.869  -6.869
  528    HA   ASP  68           HA       ASP  68  10.775  -9.303  -9.303
  529   1HB   ASP  68           HB1      ASP  68   8.584  -7.190  -7.190
  530   2HB   ASP  68           HB2      ASP  68   8.489  -8.614  -8.614
  531    H    ILE  69           HN       ILE  69   9.370  -8.139  -8.139
  532    HA   ILE  69           HA       ILE  69   7.553 -10.457 -10.457
  533    HB   ILE  69           HB       ILE  69   6.800  -8.290  -8.290
  534   1HG1  ILE  69          HG11      ILE  69   6.178  -8.991  -8.991
  535   2HG1  ILE  69          HG12      ILE  69   7.566 -10.063 -10.063
  536   1HG2  ILE  69          HG21      ILE  69   8.982  -7.416  -7.416
  537   2HG2  ILE  69          HG22      ILE  69   9.201  -8.536  -8.536
  538   3HG2  ILE  69          HG23      ILE  69   7.942  -7.315  -7.315
  539   1HD1  ILE  69          HD11      ILE  69   5.308 -10.402 -10.402
  540   2HD1  ILE  69          HD12      ILE  69   5.508 -11.320 -11.320
  541   3HD1  ILE  69          HD13      ILE  69   6.682 -11.480 -11.480
  542    H    ALA  70           HN       ALA  70  10.473  -9.188  -9.188
  543    HA   ALA  70           HA       ALA  70  11.141 -11.309 -11.309
  544   1HB   ALA  70           HB1      ALA  70  13.045  -9.525  -9.525
  545   2HB   ALA  70           HB2      ALA  70  13.506 -10.483 -10.483
  546   3HB   ALA  70           HB3      ALA  70  12.408  -9.128  -9.128
  547    H    ALA  71           HN       ALA  71  11.451 -10.812 -10.812
  548    HA   ALA  71           HA       ALA  71  13.066 -13.166 -13.166
  549   1HB   ALA  71           HB1      ALA  71  11.437 -11.413 -11.413
  550   2HB   ALA  71           HB2      ALA  71  12.577 -12.648 -12.648
  551   3HB   ALA  71           HB3      ALA  71  13.149 -11.229 -11.229
  552    H    TYR  72           HN       TYR  72   9.676 -12.356 -12.356
  553    HA   TYR  72           HA       TYR  72   8.784 -14.831 -14.831
  554   1HB   TYR  72           HB1      TYR  72   7.318 -13.026 -13.026
  555   2HB   TYR  72           HB2      TYR  72   7.479 -12.585 -12.585
  556    HD1  TYR  72           HD1      TYR  72   6.461 -15.742 -15.742
  557    HD2  TYR  72           HD2      TYR  72   5.521 -12.809 -12.809
  558    HE1  TYR  72           HE1      TYR  72   4.404 -16.953 -16.953
  559    HE2  TYR  72           HE2      TYR  72   3.473 -14.014 -14.014
  560    HH   TYR  72           HH       TYR  72   2.844 -16.848 -16.848
  561    H    ARG  73           HN       ARG  73   8.653 -13.662 -13.662
  562    HA   ARG  73           HA       ARG  73   7.607 -15.968 -15.968
  563   1HB   ARG  73           HB1      ARG  73   9.517 -13.867 -13.867
  564   2HB   ARG  73           HB2      ARG  73   8.628 -15.031 -15.031
  565   1HG   ARG  73           HG1      ARG  73   6.700 -13.745 -13.745
  566   2HG   ARG  73           HG2      ARG  73   7.725 -12.481 -12.481
  567   1HD   ARG  73           HD1      ARG  73   6.366 -14.583 -14.583
  568   2HD   ARG  73           HD2      ARG  73   5.738 -12.961 -12.961
  569    HE   ARG  73           HE       ARG  73   7.831 -12.090 -12.090
  570   1HH1  ARG  73          HH11      ARG  73   9.748 -14.025 -14.025
  571   2HH1  ARG  73          HH12      ARG  73   9.449 -14.844 -14.844
  572   1HH2  ARG  73          HH21      ARG  73   6.144 -13.685 -13.685
  573   2HH2  ARG  73          HH22      ARG  73   7.350 -14.646 -14.646
  574    H    ALA  74           HN       ALA  74  10.720 -15.007 -15.007
  575    HA   ALA  74           HA       ALA  74  12.629 -16.525 -16.525
  576   1HB   ALA  74           HB1      ALA  74  12.968 -15.111 -15.111
  577   2HB   ALA  74           HB2      ALA  74  12.200 -16.350 -16.350
  578   3HB   ALA  74           HB3      ALA  74  13.743 -16.672 -16.672
  579    H    LYS  75           HN       LYS  75  10.324 -17.635 -17.635
  580    HA   LYS  75           HA       LYS  75   9.129 -19.770 -19.770
  581   1HB   LYS  75           HB1      LYS  75  10.988 -20.840 -20.840
  582   2HB   LYS  75           HB2      LYS  75  11.975 -20.967 -20.967
  583   1HG   LYS  75           HG1      LYS  75  10.203 -22.467 -22.467
  584   2HG   LYS  75           HG2      LYS  75   9.214 -22.227 -22.227
  585   1HD   LYS  75           HD1      LYS  75  10.360 -24.377 -24.377
  586   2HD   LYS  75           HD2      LYS  75  10.969 -23.311 -23.311
  587   1HE   LYS  75           HE1      LYS  75  12.977 -22.808 -22.808
  588   2HE   LYS  75           HE2      LYS  75  12.352 -23.849 -23.849
  589   1HZ   LYS  75           HZ1      LYS  75  12.331 -25.270 -25.270
  590   2HZ   LYS  75           HZ2      LYS  75  13.855 -24.546 -24.546
  591   3HZ   LYS  75           HZ3      LYS  75  13.254 -25.559 -25.559
  592    H    GLY  76           HN       GLY  76   9.151 -18.142 -18.142
  593   1HA   GLY  76           HA1      GLY  76  10.234 -19.365 -19.365
  594   2HA   GLY  76           HA2      GLY  76   9.862 -17.653 -17.653
  595    H    LYS  77           HN       LYS  77   7.998 -20.283 -20.283
  596    HA   LYS  77           HA       LYS  77   5.704 -19.535 -19.535
  597   1HB   LYS  77           HB1      LYS  77   4.238 -20.342 -20.342
  598   2HB   LYS  77           HB2      LYS  77   5.469 -19.345 -19.345
  599   1HG   LYS  77           HG1      LYS  77   6.636 -21.225 -21.225
  600   2HG   LYS  77           HG2      LYS  77   5.774 -22.374 -22.374
  601   1HD   LYS  77           HD1      LYS  77   4.810 -22.648 -22.648
  602   2HD   LYS  77           HD2      LYS  77   3.666 -21.683 -21.683
  603   1HE   LYS  77           HE1      LYS  77   5.691 -20.451 -20.451
  604   2HE   LYS  77           HE2      LYS  77   4.056 -20.874 -20.874
  605   1HZ   LYS  77           HZ1      LYS  77   3.914 -19.373 -19.373
  606   2HZ   LYS  77           HZ2      LYS  77   4.935 -18.559 -18.559
  607   3HZ   LYS  77           HZ3      LYS  77   3.356 -18.973 -18.973
  608    HA   PRO  78           HA       PRO  78   5.706 -24.371 -24.371
  609   1HB   PRO  78           HB1      PRO  78   8.689 -24.865 -24.865
  610   2HB   PRO  78           HB2      PRO  78   7.477 -25.846 -25.846
  611   1HG   PRO  78           HG1      PRO  78   9.090 -24.315 -24.315
  612   2HG   PRO  78           HG2      PRO  78   7.362 -24.307 -24.307
  613   1HD   PRO  78           HD1      PRO  78   8.909 -22.313 -22.313
  614   2HD   PRO  78           HD2      PRO  78   7.894 -21.985 -21.985
  615    H    ASP  79           HN       ASP  79   7.391 -22.109 -22.109
  616    HA   ASP  79           HA       ASP  79   6.462 -21.954 -21.954
  617   1HB   ASP  79           HB1      ASP  79   8.048 -23.209 -23.209
  618   2HB   ASP  79           HB2      ASP  79   7.048 -24.301 -24.301
  619    H    ALA  80           HN       ALA  80   7.306 -20.175 -20.175
  620    HA   ALA  80           HA       ALA  80  10.092 -19.432 -19.432
  621   1HB   ALA  80           HB1      ALA  80   8.186 -17.976 -17.976
  622   2HB   ALA  80           HB2      ALA  80   9.838 -17.467 -17.467
  623   3HB   ALA  80           HB3      ALA  80   9.539 -18.981 -18.981
  624    H    ALA  81           HN       ALA  81   6.832 -18.287 -18.287
  625    HA   ALA  81           HA       ALA  81   6.094 -16.208 -16.208
  626   1HB   ALA  81           HB1      ALA  81   4.784 -18.208 -18.208
  627   2HB   ALA  81           HB2      ALA  81   5.868 -18.652 -18.652
  628   3HB   ALA  81           HB3      ALA  81   4.867 -17.213 -17.213
  629   1H1   BME  16           HE1      MER  16  -8.698   8.590   8.590
  630   2H1   BME  16           HE2      MER  16  -9.438   9.943   9.943
  631   1H2   BME  16           HZ1      MER  16  -7.844  11.498  11.498
  632   2H2   BME  16           HZ2      MER  16  -7.088  10.098  10.098
  633    HO1  BME  16           HH       MER  16 -10.445  10.422  10.422

  Start of MODEL   35
    1    H    ASN   3           HN       ASN   3  -1.820 -11.884 -11.884
    2    HA   ASN   3           HA       ASN   3   1.005 -11.097 -11.097
    3   1HB   ASN   3           HB1      ASN   3  -0.305 -13.563 -13.563
    4   2HB   ASN   3           HB2      ASN   3   1.410 -13.347 -13.347
    5   1HD2  ASN   3          HD21      ASN   3  -0.810 -14.976 -14.976
    6   2HD2  ASN   3          HD22      ASN   3  -1.220 -14.907 -14.907
    7    H    ALA   4           HN       ALA   4   1.015  -9.383  -9.383
    8    HA   ALA   4           HA       ALA   4   1.814  -8.956  -8.956
    9   1HB   ALA   4           HB1      ALA   4  -1.198  -9.375  -9.375
   10   2HB   ALA   4           HB2      ALA   4  -0.092  -8.716  -8.716
   11   3HB   ALA   4           HB3      ALA   4   0.056 -10.385 -10.385
   12    HA   PRO   5           HA       PRO   5   0.466  -5.035  -5.035
   13   1HB   PRO   5           HB1      PRO   5   3.321  -4.464  -4.464
   14   2HB   PRO   5           HB2      PRO   5   2.464  -4.068  -4.068
   15   1HG   PRO   5           HG1      PRO   5   4.229  -6.096  -6.096
   16   2HG   PRO   5           HG2      PRO   5   2.663  -6.313  -6.313
   17   1HD   PRO   5           HD1      PRO   5   3.442  -7.228  -7.228
   18   2HD   PRO   5           HD2      PRO   5   2.732  -8.196  -8.196
   19    H    LYS   6           HN       LYS   6  -0.709  -4.147  -4.147
   20    HA   LYS   6           HA       LYS   6   0.081  -4.216  -4.216
   21   1HB   LYS   6           HB1      LYS   6  -2.505  -3.305  -3.305
   22   2HB   LYS   6           HB2      LYS   6  -2.264  -3.432  -3.432
   23   1HG   LYS   6           HG1      LYS   6  -1.705  -5.919  -5.919
   24   2HG   LYS   6           HG2      LYS   6  -2.314  -5.688  -5.688
   25   1HD   LYS   6           HD1      LYS   6  -3.917  -5.185  -5.185
   26   2HD   LYS   6           HD2      LYS   6  -4.049  -6.617  -6.617
   27   1HE   LYS   6           HE1      LYS   6  -5.892  -5.206  -5.206
   28   2HE   LYS   6           HE2      LYS   6  -4.746  -5.076  -5.076
   29   1HZ   LYS   6           HZ1      LYS   6  -4.146  -3.117  -3.117
   30   2HZ   LYS   6           HZ2      LYS   6  -5.804  -3.048  -3.048
   31   3HZ   LYS   6           HZ3      LYS   6  -4.673  -2.916  -2.916
   32    H    ARG   7           HN       ARG   7   1.802  -2.770  -2.770
   33    HA   ARG   7           HA       ARG   7   2.853  -0.741  -0.741
   34   1HB   ARG   7           HB1      ARG   7   0.330   0.124   0.124
   35   2HB   ARG   7           HB2      ARG   7   1.914   0.864   0.864
   36   1HG   ARG   7           HG1      ARG   7   2.878  -1.117  -1.117
   37   2HG   ARG   7           HG2      ARG   7   1.448  -2.074  -2.074
   38   1HD   ARG   7           HD1      ARG   7   0.117  -0.567  -0.567
   39   2HD   ARG   7           HD2      ARG   7   1.613   0.257   0.257
   40    HE   ARG   7           HE       ARG   7   2.449  -1.906  -1.906
   41   1HH1  ARG   7          HH11      ARG   7   0.044  -3.246  -3.246
   42   2HH1  ARG   7          HH12      ARG   7  -0.884  -3.796  -3.796
   43   1HH2  ARG   7          HH21      ARG   7   0.915  -1.829  -1.829
   44   2HH2  ARG   7          HH22      ARG   7  -0.378  -2.971  -2.971
   45    HA   PRO   8           HA       PRO   8   0.682   0.960   0.960
   46   1HB   PRO   8           HB1      PRO   8   3.098   1.785   1.785
   47   2HB   PRO   8           HB2      PRO   8   2.392   0.187   0.187
   48   1HG   PRO   8           HG1      PRO   8   4.420   1.056   1.056
   49   2HG   PRO   8           HG2      PRO   8   4.562  -0.296  -0.296
   50   1HD   PRO   8           HD1      PRO   8   3.717  -0.830  -0.830
   51   2HD   PRO   8           HD2      PRO   8   2.738  -1.519  -1.519
   52    HA   PRO   9           HA       PRO   9  -0.404   4.998   4.998
   53   1HB   PRO   9           HB1      PRO   9   2.112   6.072   6.072
   54   2HB   PRO   9           HB2      PRO   9   0.440   6.585   6.585
   55   1HG   PRO   9           HG1      PRO   9   1.808   4.647   4.647
   56   2HG   PRO   9           HG2      PRO   9   0.082   4.987   4.987
   57   1HD   PRO   9           HD1      PRO   9   1.215   2.552   2.552
   58   2HD   PRO   9           HD2      PRO   9  -0.419   3.079   3.079
   59    H    SER  10           HN       SER  10  -0.341   6.921   6.921
   60    HA   SER  10           HA       SER  10   1.134   6.816   6.816
   61   1HB   SER  10           HB1      SER  10  -0.487   8.675   8.675
   62   2HB   SER  10           HB2      SER  10  -1.289   7.195   7.195
   63    HG   SER  10           HG       SER  10  -2.013   8.309   8.309
   64    H    ALA  11           HN       ALA  11   1.050   8.777   8.777
   65    HA   ALA  11           HA       ALA  11   3.126  10.010  10.010
   66   1HB   ALA  11           HB1      ALA  11   2.581  11.328  11.328
   67   2HB   ALA  11           HB2      ALA  11   3.791  11.848  11.848
   68   3HB   ALA  11           HB3      ALA  11   3.989  10.316  10.316
   69    H    PHE  12           HN       PHE  12   0.552  10.964  10.964
   70    HA   PHE  12           HA       PHE  12  -0.387  13.347  13.347
   71   1HB   PHE  12           HB1      PHE  12  -1.233  12.670  12.670
   72   2HB   PHE  12           HB2      PHE  12  -1.560  11.017  11.017
   73    HD1  PHE  12           HD1      PHE  12  -3.082  13.422  13.422
   74    HD2  PHE  12           HD2      PHE  12  -3.490  11.477  11.477
   75    HE1  PHE  12           HE1      PHE  12  -5.502  13.815  13.815
   76    HE2  PHE  12           HE2      PHE  12  -5.901  11.881  11.881
   77    HZ   PHE  12           HZ       PHE  12  -6.912  13.052  13.052
   78    H    PHE  13           HN       PHE  13  -1.196   9.969   9.969
   79    HA   PHE  13           HA       PHE  13  -3.086   9.985   9.985
   80   1HB   PHE  13           HB1      PHE  13  -1.436   8.070   8.070
   81   2HB   PHE  13           HB2      PHE  13  -0.711   8.299   8.299
   82    HD1  PHE  13           HD1      PHE  13  -2.502   8.451   8.451
   83    HD2  PHE  13           HD2      PHE  13  -3.279   6.630   6.630
   84    HE1  PHE  13           HE1      PHE  13  -4.370   7.204   7.204
   85    HE2  PHE  13           HE2      PHE  13  -5.147   5.384   5.384
   86    HZ   PHE  13           HZ       PHE  13  -5.696   5.669   5.669
   87    H    LEU  14           HN       LEU  14   0.316  10.723  10.723
   88    HA   LEU  14           HA       LEU  14  -0.121  10.934  10.934
   89   1HB   LEU  14           HB1      LEU  14   1.964  12.354  12.354
   90   2HB   LEU  14           HB2      LEU  14   2.003  12.203  12.203
   91    HG   LEU  14           HG       LEU  14   3.508  10.636  10.636
   92   1HD1  LEU  14          HD11      LEU  14   1.929   9.410   9.410
   93   2HD1  LEU  14          HD12      LEU  14   0.980   8.927   8.927
   94   3HD1  LEU  14          HD13      LEU  14   2.613   8.330   8.330
   95   1HD2  LEU  14          HD21      LEU  14   3.301  10.767  10.767
   96   2HD2  LEU  14          HD22      LEU  14   3.395   9.085   9.085
   97   3HD2  LEU  14          HD23      LEU  14   1.851   9.769   9.769
   98    H    PHE  15           HN       PHE  15   0.286  13.570  13.570
   99    HA   PHE  15           HA       PHE  15  -0.539  15.604  15.604
  100   1HB   PHE  15           HB1      PHE  15   0.415  16.830  16.830
  101   2HB   PHE  15           HB2      PHE  15   0.557  15.343  15.343
  102    HD1  PHE  15           HD1      PHE  15  -1.641  14.722  14.722
  103    HD2  PHE  15           HD2      PHE  15  -0.559  18.666  18.666
  104    HE1  PHE  15           HE1      PHE  15  -3.034  15.629  15.629
  105    HE2  PHE  15           HE2      PHE  15  -1.971  19.584  19.584
  106    HZ   PHE  15           HZ       PHE  15  -3.208  18.058  18.058
  107    H    CYS  16           HN       MER  16  -2.311  13.541  13.541
  108    HA   CYS  16           HA       MER  16  -4.842  14.778  14.778
  109   1HB   CYS  16           HB1      MER  16  -5.649  12.783  12.783
  110   2HB   CYS  16           HB2      MER  16  -3.949  12.409  12.409
  111    H    SER  17           HN       SER  17  -3.636  12.326  12.326
  112    HA   SER  17           HA       SER  17  -5.788  12.174  12.174
  113   1HB   SER  17           HB1      SER  17  -2.804  11.987  11.987
  114   2HB   SER  17           HB2      SER  17  -4.125  11.368  11.368
  115    HG   SER  17           HG       SER  17  -4.172   9.712   9.712
  116    H    GLU  18           HN       GLU  18  -2.945  14.139  14.139
  117    HA   GLU  18           HA       GLU  18  -3.558  15.610  15.610
  118   1HB   GLU  18           HB1      GLU  18  -1.380  15.525  15.525
  119   2HB   GLU  18           HB2      GLU  18  -2.028  16.428  16.428
  120   1HG   GLU  18           HG1      GLU  18  -2.455  18.379  18.379
  121   2HG   GLU  18           HG2      GLU  18  -1.846  17.469  17.469
  122    H    TYR  19           HN       TYR  19  -4.428  16.228  16.228
  123    HA   TYR  19           HA       TYR  19  -5.698  18.790  18.790
  124   1HB   TYR  19           HB1      TYR  19  -5.531  16.817  16.817
  125   2HB   TYR  19           HB2      TYR  19  -6.698  18.160  18.160
  126    HD1  TYR  19           HD1      TYR  19  -3.247  18.181  18.181
  127    HD2  TYR  19           HD2      TYR  19  -5.813  19.537  19.537
  128    HE1  TYR  19           HE1      TYR  19  -1.512  19.721  19.721
  129    HE2  TYR  19           HE2      TYR  19  -4.080  21.081  21.081
  130    HH   TYR  19           HH       TYR  19  -1.604  22.067  22.067
  131    H    ARG  20           HN       ARG  20  -7.105  15.646  15.646
  132    HA   ARG  20           HA       ARG  20  -9.652  15.745  15.745
  133   1HB   ARG  20           HB1      ARG  20  -8.726  13.718  13.718
  134   2HB   ARG  20           HB2      ARG  20  -8.308  14.343  14.343
  135   1HG   ARG  20           HG1      ARG  20 -10.829  14.626  14.626
  136   2HG   ARG  20           HG2      ARG  20 -11.117  13.853  13.853
  137   1HD   ARG  20           HD1      ARG  20  -9.879  11.832  11.832
  138   2HD   ARG  20           HD2      ARG  20  -9.617  12.627  12.627
  139    HE   ARG  20           HE       ARG  20 -12.066  12.624  12.624
  140   1HH1  ARG  20          HH11      ARG  20 -13.940  12.097  12.097
  141   2HH1  ARG  20          HH12      ARG  20 -13.945  10.460  10.460
  142   1HH2  ARG  20          HH21      ARG  20 -10.602   9.931   9.931
  143   2HH2  ARG  20          HH22      ARG  20 -12.000   9.198   9.198
  144    HA   PRO  21           HA       PRO  21 -11.291  17.582  17.582
  145   1HB   PRO  21           HB1      PRO  21  -9.551  18.544  18.544
  146   2HB   PRO  21           HB2      PRO  21 -10.028  16.837  16.837
  147   1HG   PRO  21           HG1      PRO  21  -7.546  18.120  18.120
  148   2HG   PRO  21           HG2      PRO  21  -7.614  16.759  16.759
  149   1HD   PRO  21           HD1      PRO  21  -7.548  16.234  16.234
  150   2HD   PRO  21           HD2      PRO  21  -8.698  15.335  15.335
  151    H    LYS  22           HN       LYS  22  -8.250  19.266  19.266
  152    HA   LYS  22           HA       LYS  22  -9.131  21.896  21.896
  153   1HB   LYS  22           HB1      LYS  22  -6.754  20.559  20.559
  154   2HB   LYS  22           HB2      LYS  22  -7.100  21.637  21.637
  155   1HG   LYS  22           HG1      LYS  22  -5.735  22.860  22.860
  156   2HG   LYS  22           HG2      LYS  22  -7.351  23.525  23.525
  157   1HD   LYS  22           HD1      LYS  22  -7.757  22.104  22.104
  158   2HD   LYS  22           HD2      LYS  22  -6.140  21.440  21.440
  159   1HE   LYS  22           HE1      LYS  22  -5.186  23.747  23.747
  160   2HE   LYS  22           HE2      LYS  22  -6.820  24.369  24.369
  161   1HZ   LYS  22           HZ1      LYS  22  -6.527  22.224  22.224
  162   2HZ   LYS  22           HZ2      LYS  22  -5.145  23.195  23.195
  163   3HZ   LYS  22           HZ3      LYS  22  -6.687  23.871  23.871
  164    H    ILE  23           HN       ILE  23  -9.456  19.916  19.916
  165    HA   ILE  23           HA       ILE  23 -10.387  22.298  22.298
  166    HB   ILE  23           HB       ILE  23 -10.630  20.515  20.515
  167   1HG1  ILE  23          HG11      ILE  23  -8.641  19.010  19.010
  168   2HG1  ILE  23          HG12      ILE  23 -10.330  18.518  18.518
  169   1HG2  ILE  23          HG21      ILE  23  -8.889  22.271  22.271
  170   2HG2  ILE  23          HG22      ILE  23  -7.928  21.259  21.259
  171   3HG2  ILE  23          HG23      ILE  23  -8.173  20.792  20.792
  172   1HD1  ILE  23          HD11      ILE  23  -8.404  18.715  18.715
  173   2HD1  ILE  23          HD12      ILE  23  -8.980  17.242  17.242
  174   3HD1  ILE  23          HD13      ILE  23 -10.099  18.275  18.275
  175    H    LYS  24           HN       LYS  24 -11.468  19.504  19.504
  176    HA   LYS  24           HA       LYS  24 -14.109  19.316  19.316
  177   1HB   LYS  24           HB1      LYS  24 -12.992  17.626  17.626
  178   2HB   LYS  24           HB2      LYS  24 -12.851  18.664  18.664
  179   1HG   LYS  24           HG1      LYS  24 -15.597  18.751  18.751
  180   2HG   LYS  24           HG2      LYS  24 -15.307  17.231  17.231
  181   1HD   LYS  24           HD1      LYS  24 -15.806  16.782  16.782
  182   2HD   LYS  24           HD2      LYS  24 -14.123  16.391  16.391
  183   1HE   LYS  24           HE1      LYS  24 -13.411  18.551  18.551
  184   2HE   LYS  24           HE2      LYS  24 -15.087  19.050  19.050
  185   1HZ   LYS  24           HZ1      LYS  24 -14.822  16.570  16.570
  186   2HZ   LYS  24           HZ2      LYS  24 -13.537  17.547  17.547
  187   3HZ   LYS  24           HZ3      LYS  24 -15.139  18.078  18.078
  188    H    GLY  25           HN       GLY  25 -12.529  21.098  21.098
  189   1HA   GLY  25           HA1      GLY  25 -14.739  22.391  22.391
  190   2HA   GLY  25           HA2      GLY  25 -13.063  22.958  22.958
  191    H    GLU  26           HN       GLU  26 -12.500  23.397  23.397
  192    HA   GLU  26           HA       GLU  26 -13.609  25.943  25.943
  193   1HB   GLU  26           HB1      GLU  26 -12.050  23.996  23.996
  194   2HB   GLU  26           HB2      GLU  26 -12.336  25.668  25.668
  195   1HG   GLU  26           HG1      GLU  26 -11.075  24.918  24.918
  196   2HG   GLU  26           HG2      GLU  26 -10.092  25.072  25.072
  197    H    HIS  27           HN       HIS  27 -14.063  22.884  22.884
  198    HA   HIS  27           HA       HIS  27 -16.612  23.732  23.732
  199   1HB   HIS  27           HB1      HIS  27 -14.540  21.800  21.800
  200   2HB   HIS  27           HB2      HIS  27 -15.971  22.414  22.414
  201    HD1  HIS  27           HD1      HIS  27 -15.894  25.184  25.184
  202    HD2  HIS  27           HD2      HIS  27 -12.295  23.339  23.339
  203    HE1  HIS  27           HE1      HIS  27 -14.161  26.833  26.833
  204    HA   PRO  28           HA       PRO  28 -17.521  20.011  20.011
  205   1HB   PRO  28           HB1      PRO  28 -19.470  21.056  21.056
  206   2HB   PRO  28           HB2      PRO  28 -17.778  21.440  21.440
  207   1HG   PRO  28           HG1      PRO  28 -19.755  23.078  23.078
  208   2HG   PRO  28           HG2      PRO  28 -18.812  23.628  23.628
  209   1HD   PRO  28           HD1      PRO  28 -17.858  23.990  23.990
  210   2HD   PRO  28           HD2      PRO  28 -16.750  23.611  23.611
  211    H    GLY  29           HN       GLY  29 -18.122  20.600  20.600
  212   1HA   GLY  29           HA1      GLY  29 -20.874  19.568  19.568
  213   2HA   GLY  29           HA2      GLY  29 -20.310  20.882  20.882
  214    H    LEU  30           HN       LEU  30 -17.901  18.628  18.628
  215    HA   LEU  30           HA       LEU  30 -17.969  17.393  17.393
  216   1HB   LEU  30           HB1      LEU  30 -15.733  17.520  17.520
  217   2HB   LEU  30           HB2      LEU  30 -15.541  16.926  16.926
  218    HG   LEU  30           HG       LEU  30 -16.015  19.749  19.749
  219   1HD1  LEU  30          HD11      LEU  30 -13.702  18.957  18.957
  220   2HD1  LEU  30          HD12      LEU  30 -13.735  18.464  18.464
  221   3HD1  LEU  30          HD13      LEU  30 -13.823  20.167  20.167
  222   1HD2  LEU  30          HD21      LEU  30 -17.346  19.471  19.471
  223   2HD2  LEU  30          HD22      LEU  30 -15.959  20.505  20.505
  224   3HD2  LEU  30          HD23      LEU  30 -15.926  18.847  18.847
  225    H    SER  31           HN       SER  31 -17.217  15.226  15.226
  226    HA   SER  31           HA       SER  31 -18.120  13.437  13.437
  227   1HB   SER  31           HB1      SER  31 -19.435  13.328  13.328
  228   2HB   SER  31           HB2      SER  31 -17.932  12.733  12.733
  229    HG   SER  31           HG       SER  31 -18.339  10.897  10.897
  230    H    ILE  32           HN       ILE  32 -16.923  11.219  11.219
  231    HA   ILE  32           HA       ILE  32 -14.123  11.760  11.760
  232    HB   ILE  32           HB       ILE  32 -15.406   9.940   9.940
  233   1HG1  ILE  32          HG11      ILE  32 -13.772   8.083   8.083
  234   2HG1  ILE  32          HG12      ILE  32 -13.156   8.742   8.742
  235   1HG2  ILE  32          HG21      ILE  32 -16.893   9.290   9.290
  236   2HG2  ILE  32          HG22      ILE  32 -15.543   8.662   8.662
  237   3HG2  ILE  32          HG23      ILE  32 -16.028   7.873   7.873
  238   1HD1  ILE  32          HD11      ILE  32 -12.973  10.075  10.075
  239   2HD1  ILE  32          HD12      ILE  32 -11.651   9.302   9.302
  240   3HD1  ILE  32          HD13      ILE  32 -12.356  10.774  10.774
  241    H    GLY  33           HN       GLY  33 -15.920  11.658  11.658
  242   1HA   GLY  33           HA1      GLY  33 -13.754  10.722  10.722
  243   2HA   GLY  33           HA2      GLY  33 -15.463  10.801  10.801
  244    H    ASP  34           HN       ASP  34 -15.015  13.482  13.482
  245    HA   ASP  34           HA       ASP  34 -14.380  15.166  15.166
  246   1HB   ASP  34           HB1      ASP  34 -15.960  15.623  15.623
  247   2HB   ASP  34           HB2      ASP  34 -15.739  16.925  16.925
  248    H    VAL  35           HN       VAL  35 -14.056  14.809  14.809
  249    HA   VAL  35           HA       VAL  35 -12.096  16.822  16.822
  250    HB   VAL  35           HB       VAL  35 -12.636  14.124  14.124
  251   1HG1  VAL  35          HG11      VAL  35 -10.345  14.961  14.961
  252   2HG1  VAL  35          HG12      VAL  35 -11.049  16.498  16.498
  253   3HG1  VAL  35          HG13      VAL  35 -11.420  15.041  15.041
  254   1HG2  VAL  35          HG21      VAL  35 -13.501  16.935  16.935
  255   2HG2  VAL  35          HG22      VAL  35 -14.540  15.676  15.676
  256   3HG2  VAL  35          HG23      VAL  35 -13.812  15.479  15.479
  257    H    ALA  36           HN       ALA  36 -12.101  13.594  13.594
  258    HA   ALA  36           HA       ALA  36  -9.242  13.246  13.246
  259   1HB   ALA  36           HB1      ALA  36 -11.557  11.669  11.669
  260   2HB   ALA  36           HB2      ALA  36  -9.904  11.059  11.059
  261   3HB   ALA  36           HB3      ALA  36 -10.777  11.391  11.391
  262    H    LYS  37           HN       LYS  37 -11.759  13.665  13.665
  263    HA   LYS  37           HA       LYS  37  -9.644  13.707  13.707
  264   1HB   LYS  37           HB1      LYS  37 -12.577  14.399  14.399
  265   2HB   LYS  37           HB2      LYS  37 -11.477  14.445  14.445
  266   1HG   LYS  37           HG1      LYS  37 -10.850  12.043  12.043
  267   2HG   LYS  37           HG2      LYS  37 -12.063  12.025  12.025
  268   1HD   LYS  37           HD1      LYS  37 -13.388  11.159  11.159
  269   2HD   LYS  37           HD2      LYS  37 -13.621  12.845  12.845
  270   1HE   LYS  37           HE1      LYS  37 -11.458  11.082  11.082
  271   2HE   LYS  37           HE2      LYS  37 -12.987  11.462  11.462
  272   1HZ   LYS  37           HZ1      LYS  37 -11.809  13.865  13.865
  273   2HZ   LYS  37           HZ2      LYS  37 -10.625  12.941  12.941
  274   3HZ   LYS  37           HZ3      LYS  37 -12.098  13.289  13.289
  275    H    LYS  38           HN       LYS  38 -11.019  16.143  16.143
  276    HA   LYS  38           HA       LYS  38 -10.251  18.313  18.313
  277   1HB   LYS  38           HB1      LYS  38 -12.316  18.341  18.341
  278   2HB   LYS  38           HB2      LYS  38 -11.244  18.411  18.411
  279   1HG   LYS  38           HG1      LYS  38 -10.467  20.557  20.557
  280   2HG   LYS  38           HG2      LYS  38 -10.931  20.454  20.454
  281   1HD   LYS  38           HD1      LYS  38 -13.358  20.404  20.404
  282   2HD   LYS  38           HD2      LYS  38 -12.806  20.652  20.652
  283   1HE   LYS  38           HE1      LYS  38 -11.821  22.819  22.819
  284   2HE   LYS  38           HE2      LYS  38 -12.172  22.543  22.543
  285   1HZ   LYS  38           HZ1      LYS  38 -14.547  22.210  22.210
  286   2HZ   LYS  38           HZ2      LYS  38 -13.831  23.641  23.641
  287   3HZ   LYS  38           HZ3      LYS  38 -14.129  23.440  23.440
  288    H    LEU  39           HN       LEU  39  -9.292  17.015  17.015
  289    HA   LEU  39           HA       LEU  39  -6.975  18.792  18.792
  290   1HB   LEU  39           HB1      LEU  39  -6.926  18.159  18.159
  291   2HB   LEU  39           HB2      LEU  39  -8.444  17.375  17.375
  292    HG   LEU  39           HG       LEU  39  -6.936  15.329  15.329
  293   1HD1  LEU  39          HD11      LEU  39  -5.127  17.081  17.081
  294   2HD1  LEU  39          HD12      LEU  39  -4.748  15.437  15.437
  295   3HD1  LEU  39          HD13      LEU  39  -4.863  16.654  16.654
  296   1HD2  LEU  39          HD21      LEU  39  -8.369  15.445  15.445
  297   2HD2  LEU  39          HD22      LEU  39  -6.836  14.656  14.656
  298   3HD2  LEU  39          HD23      LEU  39  -7.059  16.333  16.333
  299    H    GLY  40           HN       GLY  40  -7.699  15.574  15.574
  300   1HA   GLY  40           HA1      GLY  40  -5.010  14.701  14.701
  301   2HA   GLY  40           HA2      GLY  40  -6.396  14.098  14.098
  302    H    GLU  41           HN       GLU  41  -7.171  16.732  16.732
  303    HA   GLU  41           HA       GLU  41  -5.443  16.812  16.812
  304   1HB   GLU  41           HB1      GLU  41  -7.563  18.614  18.614
  305   2HB   GLU  41           HB2      GLU  41  -6.732  19.015  19.015
  306   1HG   GLU  41           HG1      GLU  41  -7.494  17.075  17.075
  307   2HG   GLU  41           HG2      GLU  41  -7.992  16.262  16.262
  308    H    MET  42           HN       MET  42  -5.941  18.890  18.890
  309    HA   MET  42           HA       MET  42  -4.028  20.885  20.885
  310   1HB   MET  42           HB1      MET  42  -4.794  19.739  19.739
  311   2HB   MET  42           HB2      MET  42  -3.851  21.211  21.211
  312   1HG   MET  42           HG1      MET  42  -5.832  21.948  21.948
  313   2HG   MET  42           HG2      MET  42  -6.707  20.665  20.665
  314   1HE   MET  42           HE1      MET  42  -7.855  20.635  20.635
  315   2HE   MET  42           HE2      MET  42  -8.454  22.154  22.154
  316   3HE   MET  42           HE3      MET  42  -8.719  21.765  21.765
  317    H    TRP  43           HN       TRP  43  -3.681  17.829  17.829
  318    HA   TRP  43           HA       TRP  43  -1.068  17.827  17.827
  319   1HB   TRP  43           HB1      TRP  43  -2.480  15.891  15.891
  320   2HB   TRP  43           HB2      TRP  43  -2.665  15.645  15.645
  321    HD1  TRP  43           HD1      TRP  43  -1.118  13.998  13.998
  322    HE1  TRP  43           HE1      TRP  43   1.091  13.066  13.066
  323    HE3  TRP  43           HE3      TRP  43  -0.285  16.563  16.563
  324    HZ2  TRP  43           HZ2      TRP  43   3.096  13.288  13.288
  325    HZ3  TRP  43           HZ3      TRP  43   1.729  16.198  16.198
  326    HH2  TRP  43           HH2      TRP  43   3.440  14.557  14.557
  327    H    ASN  44           HN       ASN  44  -2.235  17.074  17.074
  328    HA   ASN  44           HA       ASN  44   0.504  16.742  16.742
  329   1HB   ASN  44           HB1      ASN  44  -0.438  16.309  16.309
  330   2HB   ASN  44           HB2      ASN  44  -1.366  15.472  15.472
  331   1HD2  ASN  44          HD21      ASN  44  -4.354  16.794  16.794
  332   2HD2  ASN  44          HD22      ASN  44  -3.517  15.544  15.544
  333    H    ASN  45           HN       ASN  45  -0.686  19.322  19.322
  334    HA   ASN  45           HA       ASN  45   0.825  21.193  21.193
  335   1HB   ASN  45           HB1      ASN  45  -1.994  21.957  21.957
  336   2HB   ASN  45           HB2      ASN  45  -0.979  22.777  22.777
  337   1HD2  ASN  45          HD21      ASN  45  -3.657  20.117  20.117
  338   2HD2  ASN  45          HD22      ASN  45  -3.593  20.802  20.802
  339    H    THR  46           HN       THR  46   1.080  19.906  19.906
  340    HA   THR  46           HA       THR  46   0.289  21.929  21.929
  341    HB   THR  46           HB       THR  46   0.496  19.457  19.457
  342    HG1  THR  46           HG1      THR  46   0.788  20.330  20.330
  343   1HG2  THR  46          HG21      THR  46   2.749  18.956  18.956
  344   2HG2  THR  46          HG22      THR  46   3.528  19.999  19.999
  345   3HG2  THR  46          HG23      THR  46   2.710  18.550  18.550
  346    H    ALA  47           HN       ALA  47   3.275  20.883  20.883
  347    HA   ALA  47           HA       ALA  47   4.502  23.391  23.391
  348   1HB   ALA  47           HB1      ALA  47   4.659  23.402  23.402
  349   2HB   ALA  47           HB2      ALA  47   5.526  21.881  21.881
  350   3HB   ALA  47           HB3      ALA  47   6.232  23.343  23.343
  351    H    ALA  48           HN       ALA  48   5.177  20.201  20.201
  352    HA   ALA  48           HA       ALA  48   6.036  18.324  18.324
  353   1HB   ALA  48           HB1      ALA  48   6.286  19.621  19.621
  354   2HB   ALA  48           HB2      ALA  48   7.744  20.374  20.374
  355   3HB   ALA  48           HB3      ALA  48   7.697  18.645  18.645
  356    H    ASP  49           HN       ASP  49   7.471  21.186  21.186
  357    HA   ASP  49           HA       ASP  49   9.876  19.942  19.942
  358   1HB   ASP  49           HB1      ASP  49   8.908  22.834  22.834
  359   2HB   ASP  49           HB2      ASP  49  10.526  22.284  22.284
  360    H    ASP  50           HN       ASP  50   6.730  20.363  20.363
  361    HA   ASP  50           HA       ASP  50   7.095  20.510  20.510
  362   1HB   ASP  50           HB1      ASP  50   5.623  22.285  22.285
  363   2HB   ASP  50           HB2      ASP  50   4.552  20.989  20.989
  364    H    LYS  51           HN       LYS  51   6.673  18.529  18.529
  365    HA   LYS  51           HA       LYS  51   4.927  16.517  16.517
  366   1HB   LYS  51           HB1      LYS  51   6.581  16.420  16.420
  367   2HB   LYS  51           HB2      LYS  51   5.600  15.097  15.097
  368   1HG   LYS  51           HG1      LYS  51   3.608  16.655  16.655
  369   2HG   LYS  51           HG2      LYS  51   4.661  17.801  17.801
  370   1HD   LYS  51           HD1      LYS  51   5.131  16.193  16.193
  371   2HD   LYS  51           HD2      LYS  51   4.272  14.922  14.922
  372   1HE   LYS  51           HE1      LYS  51   2.186  16.241  16.241
  373   2HE   LYS  51           HE2      LYS  51   3.031  17.467  17.467
  374   1HZ   LYS  51           HZ1      LYS  51   3.525  14.960  14.960
  375   2HZ   LYS  51           HZ2      LYS  51   1.854  15.106  15.106
  376   3HZ   LYS  51           HZ3      LYS  51   2.674  16.274  16.274
  377    H    GLN  52           HN       GLN  52   8.183  16.852  16.852
  378    HA   GLN  52           HA       GLN  52   9.671  14.835  14.835
  379   1HB   GLN  52           HB1      GLN  52  10.144  17.595  17.595
  380   2HB   GLN  52           HB2      GLN  52  10.826  17.145  17.145
  381   1HG   GLN  52           HG1      GLN  52  12.556  16.979  16.979
  382   2HG   GLN  52           HG2      GLN  52  12.178  15.367  15.367
  383   1HE2  GLN  52          HE21      GLN  52  10.157  15.588  15.588
  384   2HE2  GLN  52          HE22      GLN  52   9.581  16.265  16.265
  385    HA   PRO  53           HA       PRO  53   9.714  14.971  14.971
  386   1HB   PRO  53           HB1      PRO  53   7.372  16.146  16.146
  387   2HB   PRO  53           HB2      PRO  53   8.946  16.931  16.931
  388   1HG   PRO  53           HG1      PRO  53   6.742  17.021  17.021
  389   2HG   PRO  53           HG2      PRO  53   7.564  18.398  18.398
  390   1HD   PRO  53           HD1      PRO  53   8.479  17.618  17.618
  391   2HD   PRO  53           HD2      PRO  53   9.691  17.803  17.803
  392    H    TYR  54           HN       TYR  54   6.420  15.098  15.098
  393    HA   TYR  54           HA       TYR  54   5.477  12.715  12.715
  394   1HB   TYR  54           HB1      TYR  54   4.445  14.189  14.189
  395   2HB   TYR  54           HB2      TYR  54   3.556  12.916  12.916
  396    HD1  TYR  54           HD1      TYR  54   3.703  13.393  13.393
  397    HD2  TYR  54           HD2      TYR  54   3.713  16.337  16.337
  398    HE1  TYR  54           HE1      TYR  54   2.880  15.065  15.065
  399    HE2  TYR  54           HE2      TYR  54   2.896  18.006  18.006
  400    HH   TYR  54           HH       TYR  54   2.736  18.440  18.440
  401    H    GLU  55           HN       GLU  55   6.553  13.446  13.446
  402    HA   GLU  55           HA       GLU  55   6.205  10.937  10.937
  403   1HB   GLU  55           HB1      GLU  55   7.454  13.498  13.498
  404   2HB   GLU  55           HB2      GLU  55   8.578  12.272  12.272
  405   1HG   GLU  55           HG1      GLU  55   6.756  11.244  11.244
  406   2HG   GLU  55           HG2      GLU  55   5.604  12.401  12.401
  407    H    LYS  56           HN       LYS  56   9.136  12.168  12.168
  408    HA   LYS  56           HA       LYS  56  10.812   9.989   9.989
  409   1HB   LYS  56           HB1      LYS  56  11.427  12.174  12.174
  410   2HB   LYS  56           HB2      LYS  56  10.478  11.783  11.783
  411   1HG   LYS  56           HG1      LYS  56  11.982  10.004  10.004
  412   2HG   LYS  56           HG2      LYS  56  12.761  10.004  10.004
  413   1HD   LYS  56           HD1      LYS  56  14.188  11.124  11.124
  414   2HD   LYS  56           HD2      LYS  56  13.726  12.232  12.232
  415   1HE   LYS  56           HE1      LYS  56  13.538  13.310  13.310
  416   2HE   LYS  56           HE2      LYS  56  11.953  13.200  13.200
  417   1HZ   LYS  56           HZ1      LYS  56  12.432  10.852  10.852
  418   2HZ   LYS  56           HZ2      LYS  56  12.789  12.182  12.182
  419   3HZ   LYS  56           HZ3      LYS  56  11.257  12.049  12.049
  420    H    LYS  57           HN       LYS  57   8.142  10.423  10.423
  421    HA   LYS  57           HA       LYS  57   8.660   8.029   8.029
  422   1HB   LYS  57           HB1      LYS  57   6.150   9.729   9.729
  423   2HB   LYS  57           HB2      LYS  57   6.086   8.249   8.249
  424   1HG   LYS  57           HG1      LYS  57   7.996  10.498  10.498
  425   2HG   LYS  57           HG2      LYS  57   6.374  10.374  10.374
  426   1HD   LYS  57           HD1      LYS  57   7.164   7.855   7.855
  427   2HD   LYS  57           HD2      LYS  57   8.762   8.575   8.575
  428   1HE   LYS  57           HE1      LYS  57   8.194  10.229  10.229
  429   2HE   LYS  57           HE2      LYS  57   6.530   9.656   9.656
  430   1HZ   LYS  57           HZ1      LYS  57   8.229   7.467   7.467
  431   2HZ   LYS  57           HZ2      LYS  57   8.696   8.699   8.699
  432   3HZ   LYS  57           HZ3      LYS  57   7.097   8.132   8.132
  433    H    ALA  58           HN       ALA  58   6.246   8.804   8.804
  434    HA   ALA  58           HA       ALA  58   5.096   6.355   6.355
  435   1HB   ALA  58           HB1      ALA  58   4.518   8.438   8.438
  436   2HB   ALA  58           HB2      ALA  58   6.030   8.327   8.327
  437   3HB   ALA  58           HB3      ALA  58   4.799   7.096   7.096
  438    H    ALA  59           HN       ALA  59   8.061   7.557   7.557
  439    HA   ALA  59           HA       ALA  59   8.884   5.394   5.394
  440   1HB   ALA  59           HB1      ALA  59  10.043   7.585   7.585
  441   2HB   ALA  59           HB2      ALA  59  10.651   7.273   7.273
  442   3HB   ALA  59           HB3      ALA  59  11.182   6.276   6.276
  443    H    LYS  60           HN       LYS  60   9.996   6.058   6.058
  444    HA   LYS  60           HA       LYS  60  11.423   3.779   3.779
  445   1HB   LYS  60           HB1      LYS  60  10.887   5.763   5.763
  446   2HB   LYS  60           HB2      LYS  60   9.432   4.883   4.883
  447   1HG   LYS  60           HG1      LYS  60  11.177   2.845   2.845
  448   2HG   LYS  60           HG2      LYS  60  12.328   4.148   4.148
  449   1HD   LYS  60           HD1      LYS  60   9.874   3.622   3.622
  450   2HD   LYS  60           HD2      LYS  60  11.550   3.473   3.473
  451   1HE   LYS  60           HE1      LYS  60  11.813   5.974   5.974
  452   2HE   LYS  60           HE2      LYS  60  10.084   6.068   6.068
  453   1HZ   LYS  60           HZ1      LYS  60  10.492   4.574   4.574
  454   2HZ   LYS  60           HZ2      LYS  60  11.348   6.032   6.032
  455   3HZ   LYS  60           HZ3      LYS  60   9.681   6.053   6.053
  456    H    LEU  61           HN       LEU  61   7.936   4.166   4.166
  457    HA   LEU  61           HA       LEU  61   7.400   1.480   1.480
  458   1HB   LEU  61           HB1      LEU  61   5.541   3.300   3.300
  459   2HB   LEU  61           HB2      LEU  61   5.073   1.989   1.989
  460    HG   LEU  61           HG       LEU  61   6.450   4.585   4.585
  461   1HD1  LEU  61          HD11      LEU  61   3.764   3.417   3.417
  462   2HD1  LEU  61          HD12      LEU  61   4.423   4.927   4.927
  463   3HD1  LEU  61          HD13      LEU  61   4.083   4.765   4.765
  464   1HD2  LEU  61          HD21      LEU  61   5.859   2.188   2.188
  465   2HD2  LEU  61          HD22      LEU  61   7.453   2.780   2.780
  466   3HD2  LEU  61          HD23      LEU  61   6.404   3.766   3.766
  467    H    LYS  62           HN       LYS  62   7.001   2.881   2.881
  468    HA   LYS  62           HA       LYS  62   6.357   0.584   0.584
  469   1HB   LYS  62           HB1      LYS  62   8.273   2.834   2.834
  470   2HB   LYS  62           HB2      LYS  62   7.637   1.635   1.635
  471   1HG   LYS  62           HG1      LYS  62   5.364   2.332   2.332
  472   2HG   LYS  62           HG2      LYS  62   5.829   3.411   3.411
  473   1HD   LYS  62           HD1      LYS  62   7.089   4.827   4.827
  474   2HD   LYS  62           HD2      LYS  62   6.815   3.708   3.708
  475   1HE   LYS  62           HE1      LYS  62   4.622   5.204   5.204
  476   2HE   LYS  62           HE2      LYS  62   5.238   5.646   5.646
  477   1HZ   LYS  62           HZ1      LYS  62   4.561   2.935   2.935
  478   2HZ   LYS  62           HZ2      LYS  62   3.257   3.790   3.790
  479   3HZ   LYS  62           HZ3      LYS  62   3.857   4.216   4.216
  480    H    GLU  63           HN       GLU  63   9.508   1.762   1.762
  481    HA   GLU  63           HA       GLU  63  11.211  -0.186  -0.186
  482   1HB   GLU  63           HB1      GLU  63  11.255   2.029   2.029
  483   2HB   GLU  63           HB2      GLU  63  12.234   0.749   0.749
  484   1HG   GLU  63           HG1      GLU  63  13.534   0.733   0.733
  485   2HG   GLU  63           HG2      GLU  63  12.491   2.008   2.008
  486    H    LYS  64           HN       LYS  64   9.856  -0.021  -0.021
  487    HA   LYS  64           HA       LYS  64  10.779  -2.465  -2.465
  488   1HB   LYS  64           HB1      LYS  64   9.593  -0.605  -0.605
  489   2HB   LYS  64           HB2      LYS  64   8.079  -1.131  -1.131
  490   1HG   LYS  64           HG1      LYS  64   9.795  -3.041  -3.041
  491   2HG   LYS  64           HG2      LYS  64   8.698  -1.928  -1.928
  492   1HD   LYS  64           HD1      LYS  64   6.781  -2.888  -2.888
  493   2HD   LYS  64           HD2      LYS  64   7.842  -4.032  -4.032
  494   1HE   LYS  64           HE1      LYS  64   7.472  -3.870  -3.870
  495   2HE   LYS  64           HE2      LYS  64   6.705  -5.052  -5.052
  496   1HZ   LYS  64           HZ1      LYS  64   9.444  -5.046  -5.046
  497   2HZ   LYS  64           HZ2      LYS  64   9.246  -5.142  -5.142
  498   3HZ   LYS  64           HZ3      LYS  64   8.500  -6.285  -6.285
  499    H    TYR  65           HN       TYR  65   7.817  -1.760  -1.760
  500    HA   TYR  65           HA       TYR  65   6.568  -4.256  -4.256
  501   1HB   TYR  65           HB1      TYR  65   5.233  -2.522  -2.522
  502   2HB   TYR  65           HB2      TYR  65   6.585  -1.704  -1.704
  503    HD1  TYR  65           HD1      TYR  65   5.112  -5.148  -5.148
  504    HD2  TYR  65           HD2      TYR  65   5.917  -1.292  -1.292
  505    HE1  TYR  65           HE1      TYR  65   4.304  -5.880  -5.880
  506    HE2  TYR  65           HE2      TYR  65   5.111  -2.029  -2.029
  507    HH   TYR  65           HH       TYR  65   4.937  -4.815  -4.815
  508    H    GLU  66           HN       GLU  66   8.627  -2.791  -2.791
  509    HA   GLU  66           HA       GLU  66   8.871  -4.793  -4.793
  510   1HB   GLU  66           HB1      GLU  66  10.988  -2.903  -2.903
  511   2HB   GLU  66           HB2      GLU  66  11.072  -3.824  -3.824
  512   1HG   GLU  66           HG1      GLU  66   8.607  -2.155  -2.155
  513   2HG   GLU  66           HG2      GLU  66  10.050  -1.315  -1.315
  514    H    LYS  67           HN       LYS  67  10.369  -4.707  -4.707
  515    HA   LYS  67           HA       LYS  67  12.195  -6.912  -6.912
  516   1HB   LYS  67           HB1      LYS  67  11.823  -5.861  -5.861
  517   2HB   LYS  67           HB2      LYS  67  13.243  -6.592  -6.592
  518   1HG   LYS  67           HG1      LYS  67  12.253  -3.773  -3.773
  519   2HG   LYS  67           HG2      LYS  67  13.852  -4.353  -4.353
  520   1HD   LYS  67           HD1      LYS  67  13.876  -5.180  -5.180
  521   2HD   LYS  67           HD2      LYS  67  12.567  -4.032  -4.032
  522   1HE   LYS  67           HE1      LYS  67  15.331  -3.332  -3.332
  523   2HE   LYS  67           HE2      LYS  67  14.672  -2.916  -2.916
  524   1HZ   LYS  67           HZ1      LYS  67  12.881  -2.069  -2.069
  525   2HZ   LYS  67           HZ2      LYS  67  14.430  -1.521  -1.521
  526   3HZ   LYS  67           HZ3      LYS  67  13.764  -1.134  -1.134
  527    H    ASP  68           HN       ASP  68   9.200  -6.466  -6.466
  528    HA   ASP  68           HA       ASP  68   9.123  -9.109  -9.109
  529   1HB   ASP  68           HB1      ASP  68   8.305  -6.720  -6.720
  530   2HB   ASP  68           HB2      ASP  68   6.842  -7.165  -7.165
  531    H    ILE  69           HN       ILE  69   8.341  -7.485  -7.485
  532    HA   ILE  69           HA       ILE  69   6.240  -9.461  -9.461
  533    HB   ILE  69           HB       ILE  69   5.804  -7.068  -7.068
  534   1HG1  ILE  69          HG11      ILE  69   5.276  -7.467  -7.467
  535   2HG1  ILE  69          HG12      ILE  69   6.508  -8.714  -8.714
  536   1HG2  ILE  69          HG21      ILE  69   8.195  -6.499  -6.499
  537   2HG2  ILE  69          HG22      ILE  69   8.224  -7.399  -7.399
  538   3HG2  ILE  69          HG23      ILE  69   7.187  -5.994  -5.994
  539   1HD1  ILE  69          HD11      ILE  69   4.082  -8.895  -8.895
  540   2HD1  ILE  69          HD12      ILE  69   4.256  -9.672  -9.672
  541   3HD1  ILE  69          HD13      ILE  69   5.297 -10.147 -10.147
  542    H    ALA  70           HN       ALA  70   9.315  -8.209  -8.209
  543    HA   ALA  70           HA       ALA  70   9.929 -10.110 -10.110
  544   1HB   ALA  70           HB1      ALA  70  11.888  -8.754  -8.754
  545   2HB   ALA  70           HB2      ALA  70  12.342  -9.571  -9.571
  546   3HB   ALA  70           HB3      ALA  70  11.387  -8.106  -8.106
  547    H    ALA  71           HN       ALA  71  10.072 -10.181 -10.181
  548    HA   ALA  71           HA       ALA  71  11.447 -12.738 -12.738
  549   1HB   ALA  71           HB1      ALA  71   9.927 -11.173 -11.173
  550   2HB   ALA  71           HB2      ALA  71  10.917 -12.591 -12.591
  551   3HB   ALA  71           HB3      ALA  71  11.665 -11.123 -11.123
  552    H    TYR  72           HN       TYR  72   8.179 -11.598 -11.598
  553    HA   TYR  72           HA       TYR  72   6.945 -14.135 -14.135
  554   1HB   TYR  72           HB1      TYR  72   5.855 -12.133 -12.133
  555   2HB   TYR  72           HB2      TYR  72   5.997 -11.493 -11.493
  556    HD1  TYR  72           HD1      TYR  72   4.667 -14.820 -14.820
  557    HD2  TYR  72           HD2      TYR  72   3.871 -11.090 -11.090
  558    HE1  TYR  72           HE1      TYR  72   2.406 -15.579 -15.579
  559    HE2  TYR  72           HE2      TYR  72   1.623 -11.851 -11.851
  560    HH   TYR  72           HH       TYR  72   0.509 -14.178 -14.178
  561    H    ARG  73           HN       ARG  73   7.087 -12.406 -12.406
  562    HA   ARG  73           HA       ARG  73   5.710 -14.421 -14.421
  563   1HB   ARG  73           HB1      ARG  73   6.194 -12.985 -12.985
  564   2HB   ARG  73           HB2      ARG  73   5.895 -11.910 -11.910
  565   1HG   ARG  73           HG1      ARG  73   8.346 -11.588 -11.588
  566   2HG   ARG  73           HG2      ARG  73   8.670 -12.680 -12.680
  567   1HD   ARG  73           HD1      ARG  73   6.975 -10.188 -10.188
  568   2HD   ARG  73           HD2      ARG  73   8.721 -10.208 -10.208
  569    HE   ARG  73           HE       ARG  73   8.370 -11.970 -11.970
  570   1HH1  ARG  73          HH11      ARG  73   5.947 -13.089 -13.089
  571   2HH1  ARG  73          HH12      ARG  73   4.895 -12.063 -12.063
  572   1HH2  ARG  73          HH21      ARG  73   7.007  -9.280  -9.280
  573   2HH2  ARG  73          HH22      ARG  73   5.516  -9.839  -9.839
  574    H    ALA  74           HN       ALA  74   8.913 -13.642 -13.642
  575    HA   ALA  74           HA       ALA  74  10.801 -14.720 -14.720
  576   1HB   ALA  74           HB1      ALA  74  11.117 -14.294 -14.294
  577   2HB   ALA  74           HB2      ALA  74  10.247 -15.762 -15.762
  578   3HB   ALA  74           HB3      ALA  74  11.806 -15.837 -15.837
  579    H    LYS  75           HN       LYS  75   8.615 -16.792 -16.792
  580    HA   LYS  75           HA       LYS  75   8.824 -18.900 -18.900
  581   1HB   LYS  75           HB1      LYS  75   9.129 -20.628 -20.628
  582   2HB   LYS  75           HB2      LYS  75  10.516 -19.636 -19.636
  583   1HG   LYS  75           HG1      LYS  75   9.642 -18.091 -18.091
  584   2HG   LYS  75           HG2      LYS  75   8.706 -19.512 -19.512
  585   1HD   LYS  75           HD1      LYS  75  10.558 -20.820 -20.820
  586   2HD   LYS  75           HD2      LYS  75  11.642 -19.914 -19.914
  587   1HE   LYS  75           HE1      LYS  75  12.152 -19.457 -19.457
  588   2HE   LYS  75           HE2      LYS  75  11.552 -17.999 -17.999
  589   1HZ   LYS  75           HZ1      LYS  75   9.363 -19.415 -19.415
  590   2HZ   LYS  75           HZ2      LYS  75  10.531 -19.332 -19.332
  591   3HZ   LYS  75           HZ3      LYS  75   9.967 -17.906 -17.906
  592    H    GLY  76           HN       GLY  76   7.334 -18.322 -18.322
  593   1HA   GLY  76           HA1      GLY  76   4.926 -17.970 -17.970
  594   2HA   GLY  76           HA2      GLY  76   4.705 -19.086 -19.086
  595    H    LYS  77           HN       LYS  77   6.355 -18.927 -18.927
  596    HA   LYS  77           HA       LYS  77   6.741 -20.485 -20.485
  597   1HB   LYS  77           HB1      LYS  77   4.133 -21.839 -21.839
  598   2HB   LYS  77           HB2      LYS  77   4.767 -21.635 -21.635
  599   1HG   LYS  77           HG1      LYS  77   4.482 -19.092 -19.092
  600   2HG   LYS  77           HG2      LYS  77   3.492 -19.534 -19.534
  601   1HD   LYS  77           HD1      LYS  77   2.209 -21.107 -21.107
  602   2HD   LYS  77           HD2      LYS  77   3.024 -20.203 -20.203
  603   1HE   LYS  77           HE1      LYS  77   0.864 -19.155 -19.155
  604   2HE   LYS  77           HE2      LYS  77   2.072 -18.074 -18.074
  605   1HZ   LYS  77           HZ1      LYS  77   1.364 -19.882 -19.882
  606   2HZ   LYS  77           HZ2      LYS  77  -0.078 -19.315 -19.315
  607   3HZ   LYS  77           HZ3      LYS  77   1.050 -18.214 -18.214
  608    HA   PRO  78           HA       PRO  78   7.915 -24.485 -24.485
  609   1HB   PRO  78           HB1      PRO  78   6.624 -26.046 -26.046
  610   2HB   PRO  78           HB2      PRO  78   8.331 -25.967 -25.967
  611   1HG   PRO  78           HG1      PRO  78   7.503 -24.721 -24.721
  612   2HG   PRO  78           HG2      PRO  78   8.689 -23.937 -23.937
  613   1HD   PRO  78           HD1      PRO  78   5.654 -23.552 -23.552
  614   2HD   PRO  78           HD2      PRO  78   6.889 -22.286 -22.286
  615    H    ASP  79           HN       ASP  79   4.610 -24.158 -24.158
  616    HA   ASP  79           HA       ASP  79   3.821 -25.721 -25.721
  617   1HB   ASP  79           HB1      ASP  79   3.786 -27.097 -27.097
  618   2HB   ASP  79           HB2      ASP  79   2.444 -26.112 -26.112
  619    H    ALA  80           HN       ALA  80   3.465 -23.412 -23.412
  620    HA   ALA  80           HA       ALA  80   0.564 -22.876 -22.876
  621   1HB   ALA  80           HB1      ALA  80   1.553 -21.504 -21.504
  622   2HB   ALA  80           HB2      ALA  80   2.623 -20.716 -20.716
  623   3HB   ALA  80           HB3      ALA  80   0.898 -20.477 -20.477
  624    H    ALA  81           HN       ALA  81   0.897 -23.787 -23.787
  625    HA   ALA  81           HA       ALA  81   1.901 -21.814 -21.814
  626   1HB   ALA  81           HB1      ALA  81   3.048 -24.009 -24.009
  627   2HB   ALA  81           HB2      ALA  81   1.505 -24.817 -24.817
  628   3HB   ALA  81           HB3      ALA  81   2.154 -23.773 -23.773
  629   1H1   BME  16           HE1      MER  16  -7.140  10.339  10.339
  630   2H1   BME  16           HE2      MER  16  -6.329   8.776   8.776
  631   1H2   BME  16           HZ1      MER  16  -7.717   8.745   8.745
  632   2H2   BME  16           HZ2      MER  16  -6.046   8.557   8.557
  633    HO1  BME  16           HH       MER  16  -4.514   9.774   9.774

  Start of MODEL   36
    1    H    ASN   3           HN       ASN   3  -2.004  -7.272  -7.272
    2    HA   ASN   3           HA       ASN   3   0.784  -8.192  -8.192
    3   1HB   ASN   3           HB1      ASN   3  -1.355 -10.088 -10.088
    4   2HB   ASN   3           HB2      ASN   3  -0.020 -10.340 -10.340
    5   1HD2  ASN   3          HD21      ASN   3  -3.685  -9.924  -9.924
    6   2HD2  ASN   3          HD22      ASN   3  -3.325 -10.238 -10.238
    7    H    ALA   4           HN       ALA   4   1.076  -9.398  -9.398
    8    HA   ALA   4           HA       ALA   4   1.444  -8.987  -8.987
    9   1HB   ALA   4           HB1      ALA   4  -0.345 -10.654 -10.654
   10   2HB   ALA   4           HB2      ALA   4  -1.555  -9.379  -9.379
   11   3HB   ALA   4           HB3      ALA   4  -0.588  -9.606  -9.606
   12    HA   PRO   5           HA       PRO   5   0.329  -4.433  -4.433
   13   1HB   PRO   5           HB1      PRO   5   3.255  -4.359  -4.359
   14   2HB   PRO   5           HB2      PRO   5   2.342  -3.341  -3.341
   15   1HG   PRO   5           HG1      PRO   5   3.920  -5.250  -5.250
   16   2HG   PRO   5           HG2      PRO   5   2.307  -5.052  -5.052
   17   1HD   PRO   5           HD1      PRO   5   3.151  -7.105  -7.105
   18   2HD   PRO   5           HD2      PRO   5   2.304  -7.340  -7.340
   19    H    LYS   6           HN       LYS   6  -0.781  -5.573  -5.573
   20    HA   LYS   6           HA       LYS   6  -0.327  -6.012  -6.012
   21   1HB   LYS   6           HB1      LYS   6  -2.265  -3.804  -3.804
   22   2HB   LYS   6           HB2      LYS   6  -2.332  -4.712  -4.712
   23   1HG   LYS   6           HG1      LYS   6  -2.871  -6.768  -6.768
   24   2HG   LYS   6           HG2      LYS   6  -2.522  -6.056  -6.056
   25   1HD   LYS   6           HD1      LYS   6  -4.940  -6.108  -6.108
   26   2HD   LYS   6           HD2      LYS   6  -4.404  -4.444  -4.444
   27   1HE   LYS   6           HE1      LYS   6  -6.066  -4.803  -4.803
   28   2HE   LYS   6           HE2      LYS   6  -4.514  -4.456  -4.456
   29   1HZ   LYS   6           HZ1      LYS   6  -4.725  -7.222  -7.222
   30   2HZ   LYS   6           HZ2      LYS   6  -6.132  -6.684  -6.684
   31   3HZ   LYS   6           HZ3      LYS   6  -4.609  -6.384  -6.384
   32    H    ARG   7           HN       ARG   7  -0.693  -2.843  -2.843
   33    HA   ARG   7           HA       ARG   7   1.607  -1.778  -1.778
   34   1HB   ARG   7           HB1      ARG   7   0.276  -1.966  -1.966
   35   2HB   ARG   7           HB2      ARG   7  -1.177  -1.416  -1.416
   36   1HG   ARG   7           HG1      ARG   7  -0.388   0.870   0.870
   37   2HG   ARG   7           HG2      ARG   7   1.252   0.397   0.397
   38   1HD   ARG   7           HD1      ARG   7  -0.028   1.420   1.420
   39   2HD   ARG   7           HD2      ARG   7   0.577  -0.192  -0.192
   40    HE   ARG   7           HE       ARG   7  -2.263   0.316   0.316
   41   1HH1  ARG   7          HH11      ARG   7  -0.976  -2.458  -2.458
   42   2HH1  ARG   7          HH12      ARG   7  -1.549  -2.915  -2.915
   43   1HH2  ARG   7          HH21      ARG   7  -2.530   0.351   0.351
   44   2HH2  ARG   7          HH22      ARG   7  -2.454  -1.282  -1.282
   45    HA   PRO   8           HA       PRO   8   0.618   0.731   0.731
   46   1HB   PRO   8           HB1      PRO   8   2.963   2.252   2.252
   47   2HB   PRO   8           HB2      PRO   8   2.852   0.655   0.655
   48   1HG   PRO   8           HG1      PRO   8   3.653   1.377   1.377
   49   2HG   PRO   8           HG2      PRO   8   4.540   0.371   0.371
   50   1HD   PRO   8           HD1      PRO   8   3.038  -0.802  -0.802
   51   2HD   PRO   8           HD2      PRO   8   2.873  -1.413  -1.413
   52    HA   PRO   9           HA       PRO   9  -0.659   5.050   5.050
   53   1HB   PRO   9           HB1      PRO   9   1.928   6.218   6.218
   54   2HB   PRO   9           HB2      PRO   9   0.397   6.291   6.291
   55   1HG   PRO   9           HG1      PRO   9   2.646   4.288   4.288
   56   2HG   PRO   9           HG2      PRO   9   1.533   4.879   4.879
   57   1HD   PRO   9           HD1      PRO   9   1.123   2.430   2.430
   58   2HD   PRO   9           HD2      PRO   9  -0.289   3.506   3.506
   59    H    SER  10           HN       SER  10  -0.015   7.083   7.083
   60    HA   SER  10           HA       SER  10   1.185   6.533   6.533
   61   1HB   SER  10           HB1      SER  10  -1.239   6.989   6.989
   62   2HB   SER  10           HB2      SER  10  -1.002   8.516   8.516
   63    HG   SER  10           HG       SER  10   0.716   8.362   8.362
   64    H    ALA  11           HN       ALA  11   0.870   8.956   8.956
   65    HA   ALA  11           HA       ALA  11   3.068  10.130  10.130
   66   1HB   ALA  11           HB1      ALA  11   2.588  11.202  11.202
   67   2HB   ALA  11           HB2      ALA  11   3.770  11.827  11.827
   68   3HB   ALA  11           HB3      ALA  11   3.989  10.236  10.236
   69    H    PHE  12           HN       PHE  12   0.331  10.655  10.655
   70    HA   PHE  12           HA       PHE  12  -0.590  13.208  13.208
   71   1HB   PHE  12           HB1      PHE  12  -1.176  12.758  12.758
   72   2HB   PHE  12           HB2      PHE  12  -1.395  11.018  11.018
   73    HD1  PHE  12           HD1      PHE  12  -2.969  14.359  14.359
   74    HD2  PHE  12           HD2      PHE  12  -3.492  10.146  10.146
   75    HE1  PHE  12           HE1      PHE  12  -5.408  14.656  14.656
   76    HE2  PHE  12           HE2      PHE  12  -5.906  10.441  10.441
   77    HZ   PHE  12           HZ       PHE  12  -6.881  12.689  12.689
   78    H    PHE  13           HN       PHE  13  -0.399  10.230  10.230
   79    HA   PHE  13           HA       PHE  13  -3.006  10.228  10.228
   80   1HB   PHE  13           HB1      PHE  13  -1.854   8.123   8.123
   81   2HB   PHE  13           HB2      PHE  13  -0.590   8.448   8.448
   82    HD1  PHE  13           HD1      PHE  13  -1.328   8.671   8.671
   83    HD2  PHE  13           HD2      PHE  13  -3.872   7.076   7.076
   84    HE1  PHE  13           HE1      PHE  13  -2.755   7.672   7.672
   85    HE2  PHE  13           HE2      PHE  13  -5.299   6.081   6.081
   86    HZ   PHE  13           HZ       PHE  13  -4.737   6.367   6.367
   87    H    LEU  14           HN       LEU  14   0.446  10.562  10.562
   88    HA   LEU  14           HA       LEU  14   0.182  11.108  11.108
   89   1HB   LEU  14           HB1      LEU  14   2.147  12.496  12.496
   90   2HB   LEU  14           HB2      LEU  14   2.351  12.340  12.340
   91    HG   LEU  14           HG       LEU  14   3.903  10.854  10.854
   92   1HD1  LEU  14          HD11      LEU  14   2.763   9.649   9.649
   93   2HD1  LEU  14          HD12      LEU  14   1.589   8.996   8.996
   94   3HD1  LEU  14          HD13      LEU  14   3.282   8.547   8.547
   95   1HD2  LEU  14          HD21      LEU  14   3.329  10.904  10.904
   96   2HD2  LEU  14          HD22      LEU  14   3.606   9.254   9.254
   97   3HD2  LEU  14          HD23      LEU  14   1.971   9.817   9.817
   98    H    PHE  15           HN       PHE  15   0.454  13.342  13.342
   99    HA   PHE  15           HA       PHE  15  -0.215  15.776  15.776
  100   1HB   PHE  15           HB1      PHE  15   0.748  16.095  16.095
  101   2HB   PHE  15           HB2      PHE  15   0.056  14.590  14.590
  102    HD1  PHE  15           HD1      PHE  15  -2.376  14.675  14.675
  103    HD2  PHE  15           HD2      PHE  15  -0.033  18.160  18.160
  104    HE1  PHE  15           HE1      PHE  15  -3.806  15.976  15.976
  105    HE2  PHE  15           HE2      PHE  15  -1.477  19.450  19.450
  106    HZ   PHE  15           HZ       PHE  15  -3.365  18.353  18.353
  107    H    CYS  16           HN       MER  16  -2.344  13.520  13.520
  108    HA   CYS  16           HA       MER  16  -4.698  15.020  15.020
  109   1HB   CYS  16           HB1      MER  16  -4.719  12.989  12.989
  110   2HB   CYS  16           HB2      MER  16  -4.255  12.014  12.014
  111    H    SER  17           HN       SER  17  -3.431  12.602  12.602
  112    HA   SER  17           HA       SER  17  -5.491  12.755  12.755
  113   1HB   SER  17           HB1      SER  17  -2.497  12.318  12.318
  114   2HB   SER  17           HB2      SER  17  -3.765  12.029  12.029
  115    HG   SER  17           HG       SER  17  -4.408  10.964  10.964
  116    H    GLU  18           HN       GLU  18  -2.472  14.491  14.491
  117    HA   GLU  18           HA       GLU  18  -2.396  16.107  16.107
  118   1HB   GLU  18           HB1      GLU  18  -0.761  16.099  16.099
  119   2HB   GLU  18           HB2      GLU  18  -1.877  17.071  17.071
  120   1HG   GLU  18           HG1      GLU  18  -1.737  18.934  18.934
  121   2HG   GLU  18           HG2      GLU  18  -0.752  17.982  17.982
  122    H    TYR  19           HN       TYR  19  -4.327  16.956  16.956
  123    HA   TYR  19           HA       TYR  19  -5.850  18.807  18.807
  124   1HB   TYR  19           HB1      TYR  19  -5.871  20.477  20.477
  125   2HB   TYR  19           HB2      TYR  19  -4.186  19.941  19.941
  126    HD1  TYR  19           HD1      TYR  19  -5.169  17.281  17.281
  127    HD2  TYR  19           HD2      TYR  19  -4.928  21.524  21.524
  128    HE1  TYR  19           HE1      TYR  19  -5.022  17.150  17.150
  129    HE2  TYR  19           HE2      TYR  19  -4.782  21.389  21.389
  130    HH   TYR  19           HH       TYR  19  -5.599  19.674  19.674
  131    H    ARG  20           HN       ARG  20  -6.624  16.092  16.092
  132    HA   ARG  20           HA       ARG  20  -8.692  16.410  16.410
  133   1HB   ARG  20           HB1      ARG  20  -7.997  14.215  14.215
  134   2HB   ARG  20           HB2      ARG  20  -8.579  14.529  14.529
  135   1HG   ARG  20           HG1      ARG  20 -10.916  14.605  14.605
  136   2HG   ARG  20           HG2      ARG  20 -10.357  14.497  14.497
  137   1HD   ARG  20           HD1      ARG  20 -11.131  12.282  12.282
  138   2HD   ARG  20           HD2      ARG  20  -9.410  12.237  12.237
  139    HE   ARG  20           HE       ARG  20  -9.078  12.610  12.610
  140   1HH1  ARG  20          HH11      ARG  20 -11.903  12.898  12.898
  141   2HH1  ARG  20          HH12      ARG  20 -12.342  11.295  11.295
  142   1HH2  ARG  20          HH21      ARG  20  -9.572   9.844   9.844
  143   2HH2  ARG  20          HH22      ARG  20 -10.981   9.511   9.511
  144    HA   PRO  21           HA       PRO  21 -11.919  17.392  17.392
  145   1HB   PRO  21           HB1      PRO  21 -11.479  17.659  17.659
  146   2HB   PRO  21           HB2      PRO  21 -11.265  16.071  16.071
  147   1HG   PRO  21           HG1      PRO  21  -9.086  18.181  18.181
  148   2HG   PRO  21           HG2      PRO  21  -9.100  16.508  16.508
  149   1HD   PRO  21           HD1      PRO  21  -7.858  17.236  17.236
  150   2HD   PRO  21           HD2      PRO  21  -8.646  15.657  15.657
  151    H    LYS  22           HN       LYS  22  -9.249  19.241  19.241
  152    HA   LYS  22           HA       LYS  22 -10.236  21.744  21.744
  153   1HB   LYS  22           HB1      LYS  22  -7.786  20.980  20.980
  154   2HB   LYS  22           HB2      LYS  22  -7.832  21.330  21.330
  155   1HG   LYS  22           HG1      LYS  22  -7.002  23.357  23.357
  156   2HG   LYS  22           HG2      LYS  22  -8.696  23.708  23.708
  157   1HD   LYS  22           HD1      LYS  22  -8.677  24.372  24.372
  158   2HD   LYS  22           HD2      LYS  22  -8.731  22.666  22.666
  159   1HE   LYS  22           HE1      LYS  22  -6.225  24.385  24.385
  160   2HE   LYS  22           HE2      LYS  22  -6.890  23.682  23.682
  161   1HZ   LYS  22           HZ1      LYS  22  -6.483  21.618  21.618
  162   2HZ   LYS  22           HZ2      LYS  22  -5.076  22.558  22.558
  163   3HZ   LYS  22           HZ3      LYS  22  -5.708  21.886  21.886
  164    H    ILE  23           HN       ILE  23  -9.883  20.258  20.258
  165    HA   ILE  23           HA       ILE  23 -10.823  22.742  22.742
  166    HB   ILE  23           HB       ILE  23 -10.777  21.186  21.186
  167   1HG1  ILE  23          HG11      ILE  23  -9.078  19.449  19.449
  168   2HG1  ILE  23          HG12      ILE  23 -10.704  19.012  19.012
  169   1HG2  ILE  23          HG21      ILE  23  -9.099  22.931  22.931
  170   2HG2  ILE  23          HG22      ILE  23  -8.220  21.822  21.822
  171   3HG2  ILE  23          HG23      ILE  23  -8.302  21.536  21.536
  172   1HD1  ILE  23          HD11      ILE  23  -9.967  19.024  19.024
  173   2HD1  ILE  23          HD12      ILE  23  -8.330  19.412  19.412
  174   3HD1  ILE  23          HD13      ILE  23  -9.073  17.904  17.904
  175    H    LYS  24           HN       LYS  24 -11.795  19.557  19.557
  176    HA   LYS  24           HA       LYS  24 -14.338  19.424  19.424
  177   1HB   LYS  24           HB1      LYS  24 -12.980  17.625  17.625
  178   2HB   LYS  24           HB2      LYS  24 -13.312  18.342  18.342
  179   1HG   LYS  24           HG1      LYS  24 -15.846  18.085  18.085
  180   2HG   LYS  24           HG2      LYS  24 -15.434  17.270  17.270
  181   1HD   LYS  24           HD1      LYS  24 -16.027  15.614  15.614
  182   2HD   LYS  24           HD2      LYS  24 -14.316  15.470  15.470
  183   1HE   LYS  24           HE1      LYS  24 -13.700  16.496  16.496
  184   2HE   LYS  24           HE2      LYS  24 -15.312  17.117  17.117
  185   1HZ   LYS  24           HZ1      LYS  24 -15.431  14.331  14.331
  186   2HZ   LYS  24           HZ2      LYS  24 -14.214  14.689  14.689
  187   3HZ   LYS  24           HZ3      LYS  24 -15.794  15.253  15.253
  188    H    GLY  25           HN       GLY  25 -13.096  20.813  20.813
  189   1HA   GLY  25           HA1      GLY  25 -15.518  21.531  21.531
  190   2HA   GLY  25           HA2      GLY  25 -13.944  22.294  22.294
  191    H    GLU  26           HN       GLU  26 -13.376  23.332  23.332
  192    HA   GLU  26           HA       GLU  26 -14.807  25.771  25.771
  193   1HB   GLU  26           HB1      GLU  26 -12.944  24.480  24.480
  194   2HB   GLU  26           HB2      GLU  26 -13.418  26.164  26.164
  195   1HG   GLU  26           HG1      GLU  26 -12.138  24.997  24.997
  196   2HG   GLU  26           HG2      GLU  26 -11.136  25.484  25.484
  197    H    HIS  27           HN       HIS  27 -14.797  23.017  23.017
  198    HA   HIS  27           HA       HIS  27 -17.262  23.917  23.917
  199   1HB   HIS  27           HB1      HIS  27 -15.045  22.098  22.098
  200   2HB   HIS  27           HB2      HIS  27 -16.402  22.751  22.751
  201    HD1  HIS  27           HD1      HIS  27 -16.395  25.518  25.518
  202    HD2  HIS  27           HD2      HIS  27 -12.797  23.720  23.720
  203    HE1  HIS  27           HE1      HIS  27 -14.674  27.251  27.251
  204    HA   PRO  28           HA       PRO  28 -18.583  19.989  19.989
  205   1HB   PRO  28           HB1      PRO  28 -20.696  20.931  20.931
  206   2HB   PRO  28           HB2      PRO  28 -19.056  21.201  21.201
  207   1HG   PRO  28           HG1      PRO  28 -20.721  23.112  23.112
  208   2HG   PRO  28           HG2      PRO  28 -19.996  23.449  23.449
  209   1HD   PRO  28           HD1      PRO  28 -18.631  24.072  24.072
  210   2HD   PRO  28           HD2      PRO  28 -17.751  23.465  23.465
  211    H    GLY  29           HN       GLY  29 -18.695  20.773  20.773
  212   1HA   GLY  29           HA1      GLY  29 -21.442  20.222  20.222
  213   2HA   GLY  29           HA2      GLY  29 -20.368  21.343  21.343
  214    H    LEU  30           HN       LEU  30 -18.087  19.496  19.496
  215    HA   LEU  30           HA       LEU  30 -18.073  17.799  17.799
  216   1HB   LEU  30           HB1      LEU  30 -16.051  18.021  18.021
  217   2HB   LEU  30           HB2      LEU  30 -15.717  17.334  17.334
  218    HG   LEU  30           HG       LEU  30 -16.246  20.215  20.215
  219   1HD1  LEU  30          HD11      LEU  30 -13.977  19.441  19.441
  220   2HD1  LEU  30          HD12      LEU  30 -13.773  18.858  18.858
  221   3HD1  LEU  30          HD13      LEU  30 -13.927  20.579  20.579
  222   1HD2  LEU  30          HD21      LEU  30 -15.781  19.088  19.088
  223   2HD2  LEU  30          HD22      LEU  30 -17.282  19.798  19.798
  224   3HD2  LEU  30          HD23      LEU  30 -15.849  20.791  20.791
  225    H    SER  31           HN       SER  31 -17.457  15.618  15.618
  226    HA   SER  31           HA       SER  31 -18.599  14.070  14.070
  227   1HB   SER  31           HB1      SER  31 -19.682  13.778  13.778
  228   2HB   SER  31           HB2      SER  31 -18.141  13.054  13.054
  229    HG   SER  31           HG       SER  31 -20.132  11.978  11.978
  230    H    ILE  32           HN       ILE  32 -17.457  11.868  11.868
  231    HA   ILE  32           HA       ILE  32 -14.694  12.307  12.307
  232    HB   ILE  32           HB       ILE  32 -16.657  10.011  10.011
  233   1HG1  ILE  32          HG11      ILE  32 -15.897   9.564   9.564
  234   2HG1  ILE  32          HG12      ILE  32 -14.621  10.763  10.763
  235   1HG2  ILE  32          HG21      ILE  32 -13.698   9.429   9.429
  236   2HG2  ILE  32          HG22      ILE  32 -14.979   8.256   8.256
  237   3HG2  ILE  32          HG23      ILE  32 -14.864   9.009   9.009
  238   1HD1  ILE  32          HD11      ILE  32 -17.619  11.333  11.333
  239   2HD1  ILE  32          HD12      ILE  32 -16.588  11.690  11.690
  240   3HD1  ILE  32          HD13      ILE  32 -16.357  12.550  12.550
  241    H    GLY  33           HN       GLY  33 -16.321  11.744  11.744
  242   1HA   GLY  33           HA1      GLY  33 -13.882  10.874  10.874
  243   2HA   GLY  33           HA2      GLY  33 -15.521  10.853  10.853
  244    H    ASP  34           HN       ASP  34 -15.209  13.748  13.748
  245    HA   ASP  34           HA       ASP  34 -14.375  15.121  15.121
  246   1HB   ASP  34           HB1      ASP  34 -16.164  15.962  15.962
  247   2HB   ASP  34           HB2      ASP  34 -15.786  17.083  17.083
  248    H    VAL  35           HN       VAL  35 -14.300  15.120  15.120
  249    HA   VAL  35           HA       VAL  35 -12.349  17.184  17.184
  250    HB   VAL  35           HB       VAL  35 -12.972  14.630  14.630
  251   1HG1  VAL  35          HG11      VAL  35 -11.445  17.164  17.164
  252   2HG1  VAL  35          HG12      VAL  35 -11.811  15.825  15.825
  253   3HG1  VAL  35          HG13      VAL  35 -10.699  15.597  15.597
  254   1HG2  VAL  35          HG21      VAL  35 -13.894  17.496  17.496
  255   2HG2  VAL  35          HG22      VAL  35 -14.891  16.168  16.168
  256   3HG2  VAL  35          HG23      VAL  35 -14.234  16.134  16.134
  257    H    ALA  36           HN       ALA  36 -12.327  13.771  13.771
  258    HA   ALA  36           HA       ALA  36  -9.513  13.358  13.358
  259   1HB   ALA  36           HB1      ALA  36 -11.783  11.787  11.787
  260   2HB   ALA  36           HB2      ALA  36 -10.148  11.160  11.160
  261   3HB   ALA  36           HB3      ALA  36 -11.122  11.558  11.558
  262    H    LYS  37           HN       LYS  37 -11.871  13.665  13.665
  263    HA   LYS  37           HA       LYS  37  -9.655  13.662  13.662
  264   1HB   LYS  37           HB1      LYS  37 -11.253  13.756  13.756
  265   2HB   LYS  37           HB2      LYS  37 -12.260  13.165  13.165
  266   1HG   LYS  37           HG1      LYS  37 -12.921  15.612  15.612
  267   2HG   LYS  37           HG2      LYS  37 -12.020  16.036  16.036
  268   1HD   LYS  37           HD1      LYS  37 -13.483  14.403  14.403
  269   2HD   LYS  37           HD2      LYS  37 -14.501  14.285  14.285
  270   1HE   LYS  37           HE1      LYS  37 -15.413  16.012  16.012
  271   2HE   LYS  37           HE2      LYS  37 -14.805  16.790  16.790
  272   1HZ   LYS  37           HZ1      LYS  37 -12.702  16.597  16.597
  273   2HZ   LYS  37           HZ2      LYS  37 -14.042  17.226  17.226
  274   3HZ   LYS  37           HZ3      LYS  37 -13.472  17.994  17.994
  275    H    LYS  38           HN       LYS  38 -10.755  16.002  16.002
  276    HA   LYS  38           HA       LYS  38 -10.174  18.316  18.316
  277   1HB   LYS  38           HB1      LYS  38 -11.876  18.631  18.631
  278   2HB   LYS  38           HB2      LYS  38 -10.767  18.080  18.080
  279   1HG   LYS  38           HG1      LYS  38  -9.292  20.036  20.036
  280   2HG   LYS  38           HG2      LYS  38 -10.368  20.544  20.544
  281   1HD   LYS  38           HD1      LYS  38 -12.188  20.870  20.870
  282   2HD   LYS  38           HD2      LYS  38 -11.115  20.331  20.331
  283   1HE   LYS  38           HE1      LYS  38  -9.574  22.214  22.214
  284   2HE   LYS  38           HE2      LYS  38 -10.573  22.733  22.733
  285   1HZ   LYS  38           HZ1      LYS  38 -12.201  22.500  22.500
  286   2HZ   LYS  38           HZ2      LYS  38 -10.823  23.399  23.399
  287   3HZ   LYS  38           HZ3      LYS  38 -11.791  23.894  23.894
  288    H    LEU  39           HN       LEU  39  -8.837  17.005  17.005
  289    HA   LEU  39           HA       LEU  39  -6.429  18.488  18.488
  290   1HB   LEU  39           HB1      LEU  39  -5.446  17.041  17.041
  291   2HB   LEU  39           HB2      LEU  39  -6.914  17.861  17.861
  292    HG   LEU  39           HG       LEU  39  -7.580  15.254  15.254
  293   1HD1  LEU  39          HD11      LEU  39  -5.137  14.749  14.749
  294   2HD1  LEU  39          HD12      LEU  39  -5.827  15.359  15.359
  295   3HD1  LEU  39          HD13      LEU  39  -6.484  13.895  13.895
  296   1HD2  LEU  39          HD21      LEU  39  -8.770  16.800  16.800
  297   2HD2  LEU  39          HD22      LEU  39  -8.567  15.149  15.149
  298   3HD2  LEU  39          HD23      LEU  39  -7.498  16.438  16.438
  299    H    GLY  40           HN       GLY  40  -7.608  15.381  15.381
  300   1HA   GLY  40           HA1      GLY  40  -5.191  14.103  14.103
  301   2HA   GLY  40           HA2      GLY  40  -6.655  14.034  14.034
  302    H    GLU  41           HN       GLU  41  -7.053  16.599  16.599
  303    HA   GLU  41           HA       GLU  41  -5.182  16.993  16.993
  304   1HB   GLU  41           HB1      GLU  41  -7.341  18.690  18.690
  305   2HB   GLU  41           HB2      GLU  41  -6.519  19.107  19.107
  306   1HG   GLU  41           HG1      GLU  41  -8.106  16.538  16.538
  307   2HG   GLU  41           HG2      GLU  41  -8.699  17.919  17.919
  308    H    MET  42           HN       MET  42  -5.947  18.857  18.857
  309    HA   MET  42           HA       MET  42  -4.138  20.970  20.970
  310   1HB   MET  42           HB1      MET  42  -4.819  19.407  19.407
  311   2HB   MET  42           HB2      MET  42  -4.133  21.023  21.023
  312   1HG   MET  42           HG1      MET  42  -6.784  20.332  20.332
  313   2HG   MET  42           HG2      MET  42  -6.697  20.968  20.968
  314   1HE   MET  42           HE1      MET  42  -5.924  21.481  21.481
  315   2HE   MET  42           HE2      MET  42  -7.659  21.673  21.673
  316   3HE   MET  42           HE3      MET  42  -6.697  23.033  23.033
  317    H    TRP  43           HN       TRP  43  -3.538  17.826  17.826
  318    HA   TRP  43           HA       TRP  43  -0.925  17.984  17.984
  319   1HB   TRP  43           HB1      TRP  43  -2.240  16.111  16.111
  320   2HB   TRP  43           HB2      TRP  43  -2.625  15.794  15.794
  321    HD1  TRP  43           HD1      TRP  43  -1.093  14.209  14.209
  322    HE1  TRP  43           HE1      TRP  43   1.120  13.187  13.187
  323    HE3  TRP  43           HE3      TRP  43  -0.157  16.531  16.531
  324    HZ2  TRP  43           HZ2      TRP  43   3.143  13.253  13.253
  325    HZ3  TRP  43           HZ3      TRP  43   1.865  16.056  16.056
  326    HH2  TRP  43           HH2      TRP  43   3.532  14.421  14.421
  327    H    ASN  44           HN       ASN  44  -2.157  17.105  17.105
  328    HA   ASN  44           HA       ASN  44   0.363  16.660  16.660
  329   1HB   ASN  44           HB1      ASN  44  -2.187  17.719  17.719
  330   2HB   ASN  44           HB2      ASN  44  -0.816  16.988  16.988
  331   1HD2  ASN  44          HD21      ASN  44  -3.604  14.512  14.512
  332   2HD2  ASN  44          HD22      ASN  44  -3.822  16.137  16.137
  333    H    ASN  45           HN       ASN  45  -1.102  19.477  19.477
  334    HA   ASN  45           HA       ASN  45   1.012  21.225  21.225
  335   1HB   ASN  45           HB1      ASN  45  -1.764  22.300  22.300
  336   2HB   ASN  45           HB2      ASN  45  -0.575  22.895  22.895
  337   1HD2  ASN  45          HD21      ASN  45  -3.386  20.253  20.253
  338   2HD2  ASN  45          HD22      ASN  45  -3.332  21.017  21.017
  339    H    THR  46           HN       THR  46   1.107  19.964  19.964
  340    HA   THR  46           HA       THR  46   0.225  21.922  21.922
  341    HB   THR  46           HB       THR  46   0.536  19.436  19.436
  342    HG1  THR  46           HG1      THR  46   0.732  20.306  20.306
  343   1HG2  THR  46          HG21      THR  46   2.865  19.085  19.085
  344   2HG2  THR  46          HG22      THR  46   3.533  20.117  20.117
  345   3HG2  THR  46          HG23      THR  46   2.761  18.616  18.616
  346    H    ALA  47           HN       ALA  47   3.332  20.958  20.958
  347    HA   ALA  47           HA       ALA  47   4.458  23.537  23.537
  348   1HB   ALA  47           HB1      ALA  47   5.416  22.015  22.015
  349   2HB   ALA  47           HB2      ALA  47   6.148  23.483  23.483
  350   3HB   ALA  47           HB3      ALA  47   4.536  23.529  23.529
  351    H    ALA  48           HN       ALA  48   5.010  20.205  20.205
  352    HA   ALA  48           HA       ALA  48   6.212  18.495  18.495
  353   1HB   ALA  48           HB1      ALA  48   5.717  19.601  19.601
  354   2HB   ALA  48           HB2      ALA  48   7.150  20.606  20.606
  355   3HB   ALA  48           HB3      ALA  48   7.314  18.870  18.870
  356    H    ASP  49           HN       ASP  49   7.105  21.019  21.019
  357    HA   ASP  49           HA       ASP  49   9.957  20.485  20.485
  358   1HB   ASP  49           HB1      ASP  49  10.109  22.698  22.698
  359   2HB   ASP  49           HB2      ASP  49   8.389  22.962  22.962
  360    H    ASP  50           HN       ASP  50   6.772  20.666  20.666
  361    HA   ASP  50           HA       ASP  50   7.334  20.376  20.376
  362   1HB   ASP  50           HB1      ASP  50   5.697  22.235  22.235
  363   2HB   ASP  50           HB2      ASP  50   4.687  20.949  20.949
  364    H    LYS  51           HN       LYS  51   6.985  18.640  18.640
  365    HA   LYS  51           HA       LYS  51   5.188  16.540  16.540
  366   1HB   LYS  51           HB1      LYS  51   6.745  16.782  16.782
  367   2HB   LYS  51           HB2      LYS  51   5.914  15.313  15.313
  368   1HG   LYS  51           HG1      LYS  51   3.797  16.756  16.756
  369   2HG   LYS  51           HG2      LYS  51   4.717  18.010  18.010
  370   1HD   LYS  51           HD1      LYS  51   5.151  16.462  16.462
  371   2HD   LYS  51           HD2      LYS  51   4.286  15.191  15.191
  372   1HE   LYS  51           HE1      LYS  51   2.235  16.491  16.491
  373   2HE   LYS  51           HE2      LYS  51   3.044  17.798  17.798
  374   1HZ   LYS  51           HZ1      LYS  51   3.508  15.403  15.403
  375   2HZ   LYS  51           HZ2      LYS  51   1.842  15.523  15.523
  376   3HZ   LYS  51           HZ3      LYS  51   2.639  16.769  16.769
  377    H    GLN  52           HN       GLN  52   8.493  17.144  17.144
  378    HA   GLN  52           HA       GLN  52   9.898  14.935  14.935
  379   1HB   GLN  52           HB1      GLN  52  10.393  17.737  17.737
  380   2HB   GLN  52           HB2      GLN  52  11.463  16.562  16.562
  381   1HG   GLN  52           HG1      GLN  52  12.538  17.323  17.323
  382   2HG   GLN  52           HG2      GLN  52  11.939  15.723  15.723
  383   1HE2  GLN  52          HE21      GLN  52   9.413  16.961  16.961
  384   2HE2  GLN  52          HE22      GLN  52   9.753  15.681  15.681
  385    HA   PRO  53           HA       PRO  53   9.986  14.699  14.699
  386   1HB   PRO  53           HB1      PRO  53   7.728  15.838  15.838
  387   2HB   PRO  53           HB2      PRO  53   9.314  16.597  16.597
  388   1HG   PRO  53           HG1      PRO  53   6.979  16.867  16.867
  389   2HG   PRO  53           HG2      PRO  53   7.882  18.166  18.166
  390   1HD   PRO  53           HD1      PRO  53   8.620  17.507  17.507
  391   2HD   PRO  53           HD2      PRO  53   9.922  17.608  17.608
  392    H    TYR  54           HN       TYR  54   6.867  14.810  14.810
  393    HA   TYR  54           HA       TYR  54   5.824  12.417  12.417
  394   1HB   TYR  54           HB1      TYR  54   4.721  14.118  14.118
  395   2HB   TYR  54           HB2      TYR  54   3.818  12.873  12.873
  396    HD1  TYR  54           HD1      TYR  54   4.226  13.305  13.305
  397    HD2  TYR  54           HD2      TYR  54   4.084  16.269  16.269
  398    HE1  TYR  54           HE1      TYR  54   3.581  14.984  14.984
  399    HE2  TYR  54           HE2      TYR  54   3.442  17.950  17.950
  400    HH   TYR  54           HH       TYR  54   3.883  18.044  18.044
  401    H    GLU  55           HN       GLU  55   6.664  13.288  13.288
  402    HA   GLU  55           HA       GLU  55   6.127  10.796  10.796
  403   1HB   GLU  55           HB1      GLU  55   7.153  13.359  13.359
  404   2HB   GLU  55           HB2      GLU  55   8.365  12.216  12.216
  405   1HG   GLU  55           HG1      GLU  55   6.492  10.891  10.891
  406   2HG   GLU  55           HG2      GLU  55   5.390  12.166  12.166
  407    H    LYS  56           HN       LYS  56   9.226  12.047  12.047
  408    HA   LYS  56           HA       LYS  56  10.890   9.914   9.914
  409   1HB   LYS  56           HB1      LYS  56  11.556  12.138  12.138
  410   2HB   LYS  56           HB2      LYS  56  10.901  11.546  11.546
  411   1HG   LYS  56           HG1      LYS  56  13.029  10.823  10.823
  412   2HG   LYS  56           HG2      LYS  56  12.650   9.491   9.491
  413   1HD   LYS  56           HD1      LYS  56  13.539  10.840  10.840
  414   2HD   LYS  56           HD2      LYS  56  13.984  12.103  12.103
  415   1HE   LYS  56           HE1      LYS  56  15.453  10.476  10.476
  416   2HE   LYS  56           HE2      LYS  56  15.057   9.252   9.252
  417   1HZ   LYS  56           HZ1      LYS  56  15.864  11.572  11.572
  418   2HZ   LYS  56           HZ2      LYS  56  17.008  11.227  11.227
  419   3HZ   LYS  56           HZ3      LYS  56  16.620  10.053  10.053
  420    H    LYS  57           HN       LYS  57   8.591  10.296  10.296
  421    HA   LYS  57           HA       LYS  57   9.328   7.896   7.896
  422   1HB   LYS  57           HB1      LYS  57   7.814  10.017  10.017
  423   2HB   LYS  57           HB2      LYS  57   6.505   9.003   9.003
  424   1HG   LYS  57           HG1      LYS  57   7.351   7.135   7.135
  425   2HG   LYS  57           HG2      LYS  57   8.561   8.232   8.232
  426   1HD   LYS  57           HD1      LYS  57   6.607   9.784   9.784
  427   2HD   LYS  57           HD2      LYS  57   5.538   8.448   8.448
  428   1HE   LYS  57           HE1      LYS  57   7.765   8.416   8.416
  429   2HE   LYS  57           HE2      LYS  57   6.038   8.384   8.384
  430   1HZ   LYS  57           HZ1      LYS  57   6.627   6.291   6.291
  431   2HZ   LYS  57           HZ2      LYS  57   7.747   6.238   6.238
  432   3HZ   LYS  57           HZ3      LYS  57   6.084   6.208   6.208
  433    H    ALA  58           HN       ALA  58   6.565   8.679   8.679
  434    HA   ALA  58           HA       ALA  58   5.322   6.238   6.238
  435   1HB   ALA  58           HB1      ALA  58   5.978   8.154   8.154
  436   2HB   ALA  58           HB2      ALA  58   4.727   6.928   6.928
  437   3HB   ALA  58           HB3      ALA  58   4.594   8.276   8.276
  438    H    ALA  59           HN       ALA  59   8.087   7.305   7.305
  439    HA   ALA  59           HA       ALA  59   8.603   5.011   5.011
  440   1HB   ALA  59           HB1      ALA  59   9.781   7.177   7.177
  441   2HB   ALA  59           HB2      ALA  59  10.628   6.946   6.946
  442   3HB   ALA  59           HB3      ALA  59  10.946   5.872   5.872
  443    H    LYS  60           HN       LYS  60  10.193   5.883   5.883
  444    HA   LYS  60           HA       LYS  60  11.672   3.607   3.607
  445   1HB   LYS  60           HB1      LYS  60  11.759   5.712   5.712
  446   2HB   LYS  60           HB2      LYS  60  10.173   5.382   5.382
  447   1HG   LYS  60           HG1      LYS  60  12.052   3.122   3.122
  448   2HG   LYS  60           HG2      LYS  60  12.645   4.606   4.606
  449   1HD   LYS  60           HD1      LYS  60   9.866   3.483   3.483
  450   2HD   LYS  60           HD2      LYS  60  11.234   3.217   3.217
  451   1HE   LYS  60           HE1      LYS  60  11.445   5.695   5.695
  452   2HE   LYS  60           HE2      LYS  60  10.040   5.953   5.953
  453   1HZ   LYS  60           HZ1      LYS  60   9.384   4.050   4.050
  454   2HZ   LYS  60           HZ2      LYS  60  10.109   5.373   5.373
  455   3HZ   LYS  60           HZ3      LYS  60   8.755   5.613   5.613
  456    H    LEU  61           HN       LEU  61   8.268   4.191   4.191
  457    HA   LEU  61           HA       LEU  61   7.894   1.632   1.632
  458   1HB   LEU  61           HB1      LEU  61   5.852   3.401   3.401
  459   2HB   LEU  61           HB2      LEU  61   5.469   2.142   2.142
  460    HG   LEU  61           HG       LEU  61   7.199   4.614   4.614
  461   1HD1  LEU  61          HD11      LEU  61   4.849   5.154   5.154
  462   2HD1  LEU  61          HD12      LEU  61   4.399   3.934   3.934
  463   3HD1  LEU  61          HD13      LEU  61   5.337   5.344   5.344
  464   1HD2  LEU  61          HD21      LEU  61   6.282   2.420   2.420
  465   2HD2  LEU  61          HD22      LEU  61   7.929   2.680   2.680
  466   3HD2  LEU  61          HD23      LEU  61   7.138   3.888   3.888
  467    H    LYS  62           HN       LYS  62   6.957   2.613   2.613
  468    HA   LYS  62           HA       LYS  62   6.107   0.223   0.223
  469   1HB   LYS  62           HB1      LYS  62   6.466   2.349   2.349
  470   2HB   LYS  62           HB2      LYS  62   8.193   2.064   2.064
  471   1HG   LYS  62           HG1      LYS  62   7.645  -0.210  -0.210
  472   2HG   LYS  62           HG2      LYS  62   6.042   0.434   0.434
  473   1HD   LYS  62           HD1      LYS  62   8.679   1.575   1.575
  474   2HD   LYS  62           HD2      LYS  62   7.403   0.871   0.871
  475   1HE   LYS  62           HE1      LYS  62   7.242   3.500   3.500
  476   2HE   LYS  62           HE2      LYS  62   7.279   3.302   3.302
  477   1HZ   LYS  62           HZ1      LYS  62   5.196   1.734   1.734
  478   2HZ   LYS  62           HZ2      LYS  62   5.070   3.263   3.263
  479   3HZ   LYS  62           HZ3      LYS  62   5.107   3.127   3.127
  480    H    GLU  63           HN       GLU  63   9.416   1.212   1.212
  481    HA   GLU  63           HA       GLU  63  10.752  -1.110  -1.110
  482   1HB   GLU  63           HB1      GLU  63  11.806   1.154   1.154
  483   2HB   GLU  63           HB2      GLU  63  11.569   1.133   1.133
  484   1HG   GLU  63           HG1      GLU  63  13.903   0.586   0.586
  485   2HG   GLU  63           HG2      GLU  63  13.172  -0.747  -0.747
  486    H    LYS  64           HN       LYS  64  10.000  -0.066  -0.066
  487    HA   LYS  64           HA       LYS  64  11.050  -2.272  -2.272
  488   1HB   LYS  64           HB1      LYS  64   9.856   0.062   0.062
  489   2HB   LYS  64           HB2      LYS  64   8.518  -1.036  -1.036
  490   1HG   LYS  64           HG1      LYS  64  10.002  -2.470  -2.470
  491   2HG   LYS  64           HG2      LYS  64  11.354  -1.421  -1.421
  492   1HD   LYS  64           HD1      LYS  64  10.146   0.483   0.483
  493   2HD   LYS  64           HD2      LYS  64   8.840  -0.617  -0.617
  494   1HE   LYS  64           HE1      LYS  64  10.431  -0.365  -0.365
  495   2HE   LYS  64           HE2      LYS  64  10.452  -2.021  -2.021
  496   1HZ   LYS  64           HZ1      LYS  64  12.318  -0.511  -0.511
  497   2HZ   LYS  64           HZ2      LYS  64  12.579  -0.238  -0.238
  498   3HZ   LYS  64           HZ3      LYS  64  12.592  -1.822  -1.822
  499    H    TYR  65           HN       TYR  65   7.835  -1.791  -1.791
  500    HA   TYR  65           HA       TYR  65   6.473  -4.051  -4.051
  501   1HB   TYR  65           HB1      TYR  65   5.138  -2.553  -2.553
  502   2HB   TYR  65           HB2      TYR  65   6.369  -2.320  -2.320
  503    HD1  TYR  65           HD1      TYR  65   4.885  -5.598  -5.598
  504    HD2  TYR  65           HD2      TYR  65   5.090  -2.627  -2.627
  505    HE1  TYR  65           HE1      TYR  65   3.656  -7.070  -7.070
  506    HE2  TYR  65           HE2      TYR  65   3.859  -4.101  -4.101
  507    HH   TYR  65           HH       TYR  65   3.574  -6.746  -6.746
  508    H    GLU  66           HN       GLU  66   8.288  -3.806  -3.806
  509    HA   GLU  66           HA       GLU  66   8.120  -6.486  -6.486
  510   1HB   GLU  66           HB1      GLU  66  10.487  -4.654  -4.654
  511   2HB   GLU  66           HB2      GLU  66  10.213  -6.125  -6.125
  512   1HG   GLU  66           HG1      GLU  66   7.861  -4.310  -4.310
  513   2HG   GLU  66           HG2      GLU  66   9.298  -3.526  -3.526
  514    H    LYS  67           HN       LYS  67  10.168  -5.053  -5.053
  515    HA   LYS  67           HA       LYS  67  11.760  -7.499  -7.499
  516   1HB   LYS  67           HB1      LYS  67  11.886  -4.674  -4.674
  517   2HB   LYS  67           HB2      LYS  67  12.637  -5.891  -5.891
  518   1HG   LYS  67           HG1      LYS  67  14.239  -4.946  -4.946
  519   2HG   LYS  67           HG2      LYS  67  13.978  -6.646  -6.646
  520   1HD   LYS  67           HD1      LYS  67  12.511  -5.966  -5.966
  521   2HD   LYS  67           HD2      LYS  67  12.792  -4.277  -4.277
  522   1HE   LYS  67           HE1      LYS  67  15.226  -4.590  -4.590
  523   2HE   LYS  67           HE2      LYS  67  14.950  -6.294  -6.294
  524   1HZ   LYS  67           HZ1      LYS  67  13.203  -4.796  -4.796
  525   2HZ   LYS  67           HZ2      LYS  67  14.753  -4.127  -4.127
  526   3HZ   LYS  67           HZ3      LYS  67  14.501  -5.774  -5.774
  527    H    ASP  68           HN       ASP  68   9.086  -6.150  -6.150
  528    HA   ASP  68           HA       ASP  68   9.092  -7.583  -7.583
  529   1HB   ASP  68           HB1      ASP  68   7.096  -5.648  -5.648
  530   2HB   ASP  68           HB2      ASP  68   6.972  -6.358  -6.358
  531    H    ILE  69           HN       ILE  69   7.898  -7.713  -7.713
  532    HA   ILE  69           HA       ILE  69   5.804  -9.642  -9.642
  533    HB   ILE  69           HB       ILE  69   5.408  -8.042  -8.042
  534   1HG1  ILE  69          HG11      ILE  69   4.610  -9.551  -9.551
  535   2HG1  ILE  69          HG12      ILE  69   5.816 -10.772 -10.772
  536   1HG2  ILE  69          HG21      ILE  69   7.762  -7.907  -7.907
  537   2HG2  ILE  69          HG22      ILE  69   7.688  -9.512  -9.512
  538   3HG2  ILE  69          HG23      ILE  69   6.707  -8.219  -8.219
  539   1HD1  ILE  69          HD11      ILE  69   3.586  -9.883  -9.883
  540   2HD1  ILE  69          HD12      ILE  69   3.636 -11.396 -11.396
  541   3HD1  ILE  69          HD13      ILE  69   4.795 -11.110 -11.110
  542    H    ALA  70           HN       ALA  70   8.895  -9.382  -9.382
  543    HA   ALA  70           HA       ALA  70   9.321 -12.145 -12.145
  544   1HB   ALA  70           HB1      ALA  70  10.878 -10.303 -10.303
  545   2HB   ALA  70           HB2      ALA  70  11.403 -10.052 -10.052
  546   3HB   ALA  70           HB3      ALA  70  11.774 -11.560 -11.560
  547    H    ALA  71           HN       ALA  71   9.659 -10.188 -10.188
  548    HA   ALA  71           HA       ALA  71  10.820 -12.254 -12.254
  549   1HB   ALA  71           HB1      ALA  71  11.248  -9.857  -9.857
  550   2HB   ALA  71           HB2      ALA  71   9.533  -9.597  -9.597
  551   3HB   ALA  71           HB3      ALA  71  10.471 -10.606 -10.606
  552    H    TYR  72           HN       TYR  72   7.652 -11.180 -11.180
  553    HA   TYR  72           HA       TYR  72   6.275 -12.479 -12.479
  554   1HB   TYR  72           HB1      TYR  72   5.222 -10.614 -10.614
  555   2HB   TYR  72           HB2      TYR  72   5.431 -11.242 -11.242
  556    HD1  TYR  72           HD1      TYR  72   3.627 -12.075 -12.075
  557    HD2  TYR  72           HD2      TYR  72   3.701 -12.294 -12.294
  558    HE1  TYR  72           HE1      TYR  72   1.379 -13.059 -13.059
  559    HE2  TYR  72           HE2      TYR  72   1.460 -13.265 -13.265
  560    HH   TYR  72           HH       TYR  72   0.088 -14.716 -14.716
  561    H    ARG  73           HN       ARG  73   6.502 -13.151 -13.151
  562    HA   ARG  73           HA       ARG  73   5.057 -15.543 -15.543
  563   1HB   ARG  73           HB1      ARG  73   7.555 -14.707 -14.707
  564   2HB   ARG  73           HB2      ARG  73   6.495 -16.029 -16.029
  565   1HG   ARG  73           HG1      ARG  73   4.634 -14.510 -14.510
  566   2HG   ARG  73           HG2      ARG  73   5.522 -13.144 -13.144
  567   1HD   ARG  73           HD1      ARG  73   5.654 -13.111 -13.111
  568   2HD   ARG  73           HD2      ARG  73   7.253 -13.508 -13.508
  569    HE   ARG  73           HE       ARG  73   6.571 -15.956 -15.956
  570   1HH1  ARG  73          HH11      ARG  73   4.209 -13.980 -13.980
  571   2HH1  ARG  73          HH12      ARG  73   4.291 -14.634 -14.634
  572   1HH2  ARG  73          HH21      ARG  73   7.157 -16.524 -16.524
  573   2HH2  ARG  73          HH22      ARG  73   6.008 -16.117 -16.117
  574    H    ALA  74           HN       ALA  74   8.329 -14.825 -14.825
  575    HA   ALA  74           HA       ALA  74   9.718 -17.182 -17.182
  576   1HB   ALA  74           HB1      ALA  74  10.590 -14.969 -14.969
  577   2HB   ALA  74           HB2      ALA  74   9.648 -15.023 -15.023
  578   3HB   ALA  74           HB3      ALA  74  10.969 -16.154 -16.154
  579    H    LYS  75           HN       LYS  75   7.374 -16.026 -16.026
  580    HA   LYS  75           HA       LYS  75   5.659 -17.358 -17.358
  581   1HB   LYS  75           HB1      LYS  75   6.923 -19.529 -19.529
  582   2HB   LYS  75           HB2      LYS  75   7.934 -19.205 -19.205
  583   1HG   LYS  75           HG1      LYS  75   6.005 -19.279 -19.279
  584   2HG   LYS  75           HG2      LYS  75   4.874 -19.286 -19.286
  585   1HD   LYS  75           HD1      LYS  75   6.876 -21.518 -21.518
  586   2HD   LYS  75           HD2      LYS  75   5.168 -21.557 -21.557
  587   1HE   LYS  75           HE1      LYS  75   6.334 -21.444 -21.444
  588   2HE   LYS  75           HE2      LYS  75   5.548 -22.815 -22.815
  589   1HZ   LYS  75           HZ1      LYS  75   3.840 -20.619 -20.619
  590   2HZ   LYS  75           HZ2      LYS  75   4.379 -20.698 -20.698
  591   3HZ   LYS  75           HZ3      LYS  75   3.617 -22.039 -22.039
  592    H    GLY  76           HN       GLY  76   6.204 -15.177 -15.177
  593   1HA   GLY  76           HA1      GLY  76   7.306 -15.008 -15.008
  594   2HA   GLY  76           HA2      GLY  76   7.274 -13.651 -13.651
  595    H    LYS  77           HN       LYS  77   5.009 -16.087 -16.087
  596    HA   LYS  77           HA       LYS  77   2.824 -14.163 -14.163
  597   1HB   LYS  77           HB1      LYS  77   2.832 -17.202 -17.202
  598   2HB   LYS  77           HB2      LYS  77   1.406 -16.188 -16.188
  599   1HG   LYS  77           HG1      LYS  77   1.906 -15.567 -15.567
  600   2HG   LYS  77           HG2      LYS  77   3.426 -16.433 -16.433
  601   1HD   LYS  77           HD1      LYS  77   1.872 -17.869 -17.869
  602   2HD   LYS  77           HD2      LYS  77   2.148 -18.571 -18.571
  603   1HE   LYS  77           HE1      LYS  77  -0.252 -16.796 -16.796
  604   2HE   LYS  77           HE2      LYS  77  -0.290 -18.538 -18.538
  605   1HZ   LYS  77           HZ1      LYS  77   0.768 -17.998 -17.998
  606   2HZ   LYS  77           HZ2      LYS  77  -0.643 -17.070 -17.070
  607   3HZ   LYS  77           HZ3      LYS  77  -0.695 -18.753 -18.753
  608    HA   PRO  78           HA       PRO  78   3.420 -13.586 -13.586
  609   1HB   PRO  78           HB1      PRO  78   0.784 -13.793 -13.793
  610   2HB   PRO  78           HB2      PRO  78   1.444 -12.363 -12.363
  611   1HG   PRO  78           HG1      PRO  78  -0.102 -14.693 -14.693
  612   2HG   PRO  78           HG2      PRO  78  -0.457 -12.978 -12.978
  613   1HD   PRO  78           HD1      PRO  78   0.937 -14.087 -14.087
  614   2HD   PRO  78           HD2      PRO  78   1.617 -12.590 -12.590
  615    H    ASP  79           HN       ASP  79   1.312 -16.265 -16.265
  616    HA   ASP  79           HA       ASP  79   2.790 -17.941 -17.941
  617   1HB   ASP  79           HB1      ASP  79   0.442 -18.951 -18.951
  618   2HB   ASP  79           HB2      ASP  79   0.774 -17.349 -17.349
  619    H    ALA  80           HN       ALA  80   3.687 -18.104 -18.104
  620    HA   ALA  80           HA       ALA  80   3.570 -19.171 -19.171
  621   1HB   ALA  80           HB1      ALA  80   5.409 -19.953 -19.953
  622   2HB   ALA  80           HB2      ALA  80   4.392 -21.187 -21.187
  623   3HB   ALA  80           HB3      ALA  80   4.808 -21.276 -21.276
  624    H    ALA  81           HN       ALA  81   2.336 -21.665 -21.665
  625    HA   ALA  81           HA       ALA  81   1.133 -23.624 -23.624
  626   1HB   ALA  81           HB1      ALA  81  -0.156 -22.178 -22.178
  627   2HB   ALA  81           HB2      ALA  81  -0.790 -21.261 -21.261
  628   3HB   ALA  81           HB3      ALA  81  -1.251 -22.940 -22.940
  629   1H1   BME  16           HE1      MER  16  -7.201   7.645   7.645
  630   2H1   BME  16           HE2      MER  16  -7.470   7.982   7.982
  631   1H2   BME  16           HZ1      MER  16  -5.530   9.328   9.328
  632   2H2   BME  16           HZ2      MER  16  -6.873  10.319  10.319
  633    HO1  BME  16           HH       MER  16  -9.063   8.499   8.499

  Start of MODEL   37
    1    H    ASN   3           HN       ASN   3   1.444 -10.379 -10.379
    2    HA   ASN   3           HA       ASN   3   2.149 -12.352 -12.352
    3   1HB   ASN   3           HB1      ASN   3  -0.320 -12.370 -12.370
    4   2HB   ASN   3           HB2      ASN   3  -0.076 -13.464 -13.464
    5   1HD2  ASN   3          HD21      ASN   3   1.531 -14.426 -14.426
    6   2HD2  ASN   3          HD22      ASN   3   0.310 -13.262 -13.262
    7    H    ALA   4           HN       ALA   4   2.228 -10.829 -10.829
    8    HA   ALA   4           HA       ALA   4   1.463  -9.493  -9.493
    9   1HB   ALA   4           HB1      ALA   4  -0.390 -11.154 -11.154
   10   2HB   ALA   4           HB2      ALA   4  -1.337 -10.272 -10.272
   11   3HB   ALA   4           HB3      ALA   4  -0.930  -9.525  -9.525
   12    HA   PRO   5           HA       PRO   5   0.820  -5.729  -5.729
   13   1HB   PRO   5           HB1      PRO   5   3.435  -5.196  -5.196
   14   2HB   PRO   5           HB2      PRO   5   2.950  -4.827  -4.827
   15   1HG   PRO   5           HG1      PRO   5   4.656  -6.872  -6.872
   16   2HG   PRO   5           HG2      PRO   5   3.333  -7.080  -7.080
   17   1HD   PRO   5           HD1      PRO   5   3.374  -7.994  -7.994
   18   2HD   PRO   5           HD2      PRO   5   2.991  -8.929  -8.929
   19    H    LYS   6           HN       LYS   6  -0.602  -4.638  -4.638
   20    HA   LYS   6           HA       LYS   6  -0.577  -4.897  -4.897
   21   1HB   LYS   6           HB1      LYS   6  -2.308  -3.052  -3.052
   22   2HB   LYS   6           HB2      LYS   6  -2.560  -3.384  -3.384
   23   1HG   LYS   6           HG1      LYS   6  -4.117  -4.825  -4.825
   24   2HG   LYS   6           HG2      LYS   6  -2.747  -5.911  -5.911
   25   1HD   LYS   6           HD1      LYS   6  -2.302  -5.516  -5.516
   26   2HD   LYS   6           HD2      LYS   6  -3.486  -4.221  -4.221
   27   1HE   LYS   6           HE1      LYS   6  -4.113  -7.159  -7.159
   28   2HE   LYS   6           HE2      LYS   6  -4.428  -6.308  -6.308
   29   1HZ   LYS   6           HZ1      LYS   6  -5.565  -4.812  -4.812
   30   2HZ   LYS   6           HZ2      LYS   6  -6.025  -6.427  -6.427
   31   3HZ   LYS   6           HZ3      LYS   6  -6.346  -5.663  -5.663
   32    H    ARG   7           HN       ARG   7  -0.052  -3.293  -3.293
   33    HA   ARG   7           HA       ARG   7   2.087  -1.757  -1.757
   34   1HB   ARG   7           HB1      ARG   7  -0.321  -0.799  -0.799
   35   2HB   ARG   7           HB2      ARG   7   1.342  -0.328  -0.328
   36   1HG   ARG   7           HG1      ARG   7   1.855  -2.813  -2.813
   37   2HG   ARG   7           HG2      ARG   7   0.127  -3.105  -3.105
   38   1HD   ARG   7           HD1      ARG   7   1.539  -1.255  -1.255
   39   2HD   ARG   7           HD2      ARG   7   0.803  -2.809  -2.809
   40    HE   ARG   7           HE       ARG   7  -0.803  -0.483  -0.483
   41   1HH1  ARG   7          HH11      ARG   7  -2.904  -1.873  -1.873
   42   2HH1  ARG   7          HH12      ARG   7  -3.296  -2.284  -2.284
   43   1HH2  ARG   7          HH21      ARG   7  -0.078  -1.547  -1.547
   44   2HH2  ARG   7          HH22      ARG   7  -1.656  -2.095  -2.095
   45    HA   PRO   8           HA       PRO   8   0.906   1.262   1.262
   46   1HB   PRO   8           HB1      PRO   8   3.200   2.852   2.852
   47   2HB   PRO   8           HB2      PRO   8   3.119   1.334   1.334
   48   1HG   PRO   8           HG1      PRO   8   4.041   1.812   1.812
   49   2HG   PRO   8           HG2      PRO   8   4.850   0.952   0.952
   50   1HD   PRO   8           HD1      PRO   8   3.483  -0.436  -0.436
   51   2HD   PRO   8           HD2      PRO   8   3.321  -0.915  -0.915
   52    HA   PRO   9           HA       PRO   9  -0.900   5.035   5.035
   53   1HB   PRO   9           HB1      PRO   9   1.112   7.005   7.005
   54   2HB   PRO   9           HB2      PRO   9  -0.294   6.518   6.518
   55   1HG   PRO   9           HG1      PRO   9   2.519   5.382   5.382
   56   2HG   PRO   9           HG2      PRO   9   1.442   5.858   5.858
   57   1HD   PRO   9           HD1      PRO   9   1.532   3.281   3.281
   58   2HD   PRO   9           HD2      PRO   9  -0.087   4.001   4.001
   59    H    SER  10           HN       SER  10  -0.589   7.092   7.092
   60    HA   SER  10           HA       SER  10   0.477   6.381   6.381
   61   1HB   SER  10           HB1      SER  10  -1.413   8.597   8.597
   62   2HB   SER  10           HB2      SER  10  -0.992   8.206   8.206
   63    HG   SER  10           HG       SER  10  -2.357   6.638   6.638
   64    H    ALA  11           HN       ALA  11   0.685   9.019   9.019
   65    HA   ALA  11           HA       ALA  11   3.067  10.021  10.021
   66   1HB   ALA  11           HB1      ALA  11   2.175  10.996  10.996
   67   2HB   ALA  11           HB2      ALA  11   3.590  11.552  11.552
   68   3HB   ALA  11           HB3      ALA  11   3.549   9.926   9.926
   69    H    PHE  12           HN       PHE  12   0.311  10.835  10.835
   70    HA   PHE  12           HA       PHE  12  -0.390  13.396  13.396
   71   1HB   PHE  12           HB1      PHE  12  -1.233  12.733  12.733
   72   2HB   PHE  12           HB2      PHE  12  -1.695  11.123  11.123
   73    HD1  PHE  12           HD1      PHE  12  -3.286  13.271  13.271
   74    HD2  PHE  12           HD2      PHE  12  -3.392  12.071  12.071
   75    HE1  PHE  12           HE1      PHE  12  -5.672  13.838  13.838
   76    HE2  PHE  12           HE2      PHE  12  -5.769  12.649  12.649
   77    HZ   PHE  12           HZ       PHE  12  -6.915  13.528  13.528
   78    H    PHE  13           HN       PHE  13  -1.199  10.025  10.025
   79    HA   PHE  13           HA       PHE  13  -3.127  10.305  10.305
   80   1HB   PHE  13           HB1      PHE  13  -1.624   8.202   8.202
   81   2HB   PHE  13           HB2      PHE  13  -0.982   8.424   8.424
   82    HD1  PHE  13           HD1      PHE  13  -4.054   7.854   7.854
   83    HD2  PHE  13           HD2      PHE  13  -2.425   8.022   8.022
   84    HE1  PHE  13           HE1      PHE  13  -6.141   6.925   6.925
   85    HE2  PHE  13           HE2      PHE  13  -4.514   7.091   7.091
   86    HZ   PHE  13           HZ       PHE  13  -6.375   6.543   6.543
   87    H    LEU  14           HN       LEU  14   0.360  10.735  10.735
   88    HA   LEU  14           HA       LEU  14   0.157  11.041  11.041
   89   1HB   LEU  14           HB1      LEU  14   2.123  12.407  12.407
   90   2HB   LEU  14           HB2      LEU  14   2.295  12.318  12.318
   91    HG   LEU  14           HG       LEU  14   3.753  10.712  10.712
   92   1HD1  LEU  14          HD11      LEU  14   2.362   9.627   9.627
   93   2HD1  LEU  14          HD12      LEU  14   1.258   9.037   9.037
   94   3HD1  LEU  14          HD13      LEU  14   2.916   8.462   8.462
   95   1HD2  LEU  14          HD21      LEU  14   3.294  10.730  10.730
   96   2HD2  LEU  14          HD22      LEU  14   3.428   9.073   9.073
   97   3HD2  LEU  14          HD23      LEU  14   1.847   9.750   9.750
   98    H    PHE  15           HN       PHE  15   0.365  13.612  13.612
   99    HA   PHE  15           HA       PHE  15  -0.238  15.699  15.699
  100   1HB   PHE  15           HB1      PHE  15   0.622  16.851  16.851
  101   2HB   PHE  15           HB2      PHE  15   0.627  15.339  15.339
  102    HD1  PHE  15           HD1      PHE  15  -1.488  14.792  14.792
  103    HD2  PHE  15           HD2      PHE  15  -0.543  18.694  18.694
  104    HE1  PHE  15           HE1      PHE  15  -2.958  15.757  15.757
  105    HE2  PHE  15           HE2      PHE  15  -2.026  19.674  19.674
  106    HZ   PHE  15           HZ       PHE  15  -3.234  18.194  18.194
  107    H    CYS  16           HN       MER  16  -2.335  13.771  13.771
  108    HA   CYS  16           HA       MER  16  -4.731  15.221  15.221
  109   1HB   CYS  16           HB1      MER  16  -5.826  13.462  13.462
  110   2HB   CYS  16           HB2      MER  16  -4.205  13.228  13.228
  111    H    SER  17           HN       SER  17  -3.427  12.445  12.445
  112    HA   SER  17           HA       SER  17  -5.603  12.175  12.175
  113   1HB   SER  17           HB1      SER  17  -3.959  11.082  11.082
  114   2HB   SER  17           HB2      SER  17  -3.683  10.593  10.593
  115    HG   SER  17           HG       SER  17  -2.059  11.930  11.930
  116    H    GLU  18           HN       GLU  18  -2.765  14.194  14.194
  117    HA   GLU  18           HA       GLU  18  -3.448  15.442  15.442
  118   1HB   GLU  18           HB1      GLU  18  -1.156  15.178  15.178
  119   2HB   GLU  18           HB2      GLU  18  -1.555  16.328  16.328
  120   1HG   GLU  18           HG1      GLU  18  -1.838  18.136  18.136
  121   2HG   GLU  18           HG2      GLU  18  -1.708  17.022  17.022
  122    H    TYR  19           HN       TYR  19  -4.680  15.876  15.876
  123    HA   TYR  19           HA       TYR  19  -5.471  18.709  18.709
  124   1HB   TYR  19           HB1      TYR  19  -5.388  16.824  16.824
  125   2HB   TYR  19           HB2      TYR  19  -6.546  18.175  18.175
  126    HD1  TYR  19           HD1      TYR  19  -3.069  18.204  18.204
  127    HD2  TYR  19           HD2      TYR  19  -5.681  19.518  19.518
  128    HE1  TYR  19           HE1      TYR  19  -1.329  19.707  19.707
  129    HE2  TYR  19           HE2      TYR  19  -3.942  21.021  21.021
  130    HH   TYR  19           HH       TYR  19  -1.367  21.980  21.980
  131    H    ARG  20           HN       ARG  20  -6.802  15.538  15.538
  132    HA   ARG  20           HA       ARG  20  -9.311  15.320  15.320
  133   1HB   ARG  20           HB1      ARG  20  -7.736  13.786  13.786
  134   2HB   ARG  20           HB2      ARG  20  -8.551  14.472  14.472
  135   1HG   ARG  20           HG1      ARG  20  -9.945  12.696  12.696
  136   2HG   ARG  20           HG2      ARG  20 -10.761  13.863  13.863
  137   1HD   ARG  20           HD1      ARG  20 -10.477  11.727  11.727
  138   2HD   ARG  20           HD2      ARG  20  -9.506  12.982  12.982
  139    HE   ARG  20           HE       ARG  20  -7.532  12.050  12.050
  140   1HH1  ARG  20          HH11      ARG  20  -9.274  10.253  10.253
  141   2HH1  ARG  20          HH12      ARG  20  -8.970   8.704   8.704
  142   1HH2  ARG  20          HH21      ARG  20  -7.595  10.092  10.092
  143   2HH2  ARG  20          HH22      ARG  20  -7.993   8.611   8.611
  144    HA   PRO  21           HA       PRO  21 -11.454  17.038  17.038
  145   1HB   PRO  21           HB1      PRO  21  -9.902  17.626  17.626
  146   2HB   PRO  21           HB2      PRO  21 -10.710  16.097  16.097
  147   1HG   PRO  21           HG1      PRO  21  -7.919  16.390  16.390
  148   2HG   PRO  21           HG2      PRO  21  -8.732  15.092  15.092
  149   1HD   PRO  21           HD1      PRO  21  -7.742  17.756  17.756
  150   2HD   PRO  21           HD2      PRO  21  -7.466  16.140  16.140
  151    H    LYS  22           HN       LYS  22  -8.965  18.881  18.881
  152    HA   LYS  22           HA       LYS  22  -9.778  21.440  21.440
  153   1HB   LYS  22           HB1      LYS  22  -7.307  20.621  20.621
  154   2HB   LYS  22           HB2      LYS  22  -7.652  20.986  20.986
  155   1HG   LYS  22           HG1      LYS  22  -6.673  22.987  22.987
  156   2HG   LYS  22           HG2      LYS  22  -8.383  23.337  23.337
  157   1HD   LYS  22           HD1      LYS  22  -7.931  24.003  24.003
  158   2HD   LYS  22           HD2      LYS  22  -8.189  22.304  22.304
  159   1HE   LYS  22           HE1      LYS  22  -6.106  22.861  22.861
  160   2HE   LYS  22           HE2      LYS  22  -5.675  21.943  21.943
  161   1HZ   LYS  22           HZ1      LYS  22  -5.881  24.637  24.637
  162   2HZ   LYS  22           HZ2      LYS  22  -4.919  24.532  24.532
  163   3HZ   LYS  22           HZ3      LYS  22  -4.500  23.649  23.649
  164    H    ILE  23           HN       ILE  23  -9.923  19.648  19.648
  165    HA   ILE  23           HA       ILE  23 -11.094  22.055  22.055
  166    HB   ILE  23           HB       ILE  23 -11.499  19.684  19.684
  167   1HG1  ILE  23          HG11      ILE  23  -8.609  19.982  19.982
  168   2HG1  ILE  23          HG12      ILE  23  -9.647  18.589  18.589
  169   1HG2  ILE  23          HG21      ILE  23 -11.360  22.031  22.031
  170   2HG2  ILE  23          HG22      ILE  23  -9.664  22.097  22.097
  171   3HG2  ILE  23          HG23      ILE  23 -10.192  21.070  21.070
  172   1HD1  ILE  23          HD11      ILE  23  -9.869  18.314  18.314
  173   2HD1  ILE  23          HD12      ILE  23  -8.747  19.634  19.634
  174   3HD1  ILE  23          HD13      ILE  23  -8.211  18.159  18.159
  175    H    LYS  24           HN       LYS  24 -11.804  18.840  18.840
  176    HA   LYS  24           HA       LYS  24 -14.529  18.666  18.666
  177   1HB   LYS  24           HB1      LYS  24 -12.972  16.885  16.885
  178   2HB   LYS  24           HB2      LYS  24 -13.013  17.569  17.569
  179   1HG   LYS  24           HG1      LYS  24 -15.606  17.269  17.269
  180   2HG   LYS  24           HG2      LYS  24 -15.415  16.405  16.405
  181   1HD   LYS  24           HD1      LYS  24 -15.646  14.787  14.787
  182   2HD   LYS  24           HD2      LYS  24 -13.995  14.705  14.705
  183   1HE   LYS  24           HE1      LYS  24 -13.185  15.993  15.993
  184   2HE   LYS  24           HE2      LYS  24 -14.817  16.374  16.374
  185   1HZ   LYS  24           HZ1      LYS  24 -14.567  13.590  13.590
  186   2HZ   LYS  24           HZ2      LYS  24 -13.231  14.181  14.181
  187   3HZ   LYS  24           HZ3      LYS  24 -14.808  14.540  14.540
  188    H    GLY  25           HN       GLY  25 -12.797  20.148  20.148
  189   1HA   GLY  25           HA1      GLY  25 -15.006  20.692  20.692
  190   2HA   GLY  25           HA2      GLY  25 -13.433  21.497  21.497
  191    H    GLU  26           HN       GLU  26 -13.303  22.639  22.639
  192    HA   GLU  26           HA       GLU  26 -14.893  24.994  24.994
  193   1HB   GLU  26           HB1      GLU  26 -13.092  24.018  24.018
  194   2HB   GLU  26           HB2      GLU  26 -13.684  25.664  25.664
  195   1HG   GLU  26           HG1      GLU  26 -12.127  24.269  24.269
  196   2HG   GLU  26           HG2      GLU  26 -11.329  25.206  25.206
  197    H    HIS  27           HN       HIS  27 -14.894  22.399  22.399
  198    HA   HIS  27           HA       HIS  27 -17.539  23.177  23.177
  199   1HB   HIS  27           HB1      HIS  27 -15.305  21.673  21.673
  200   2HB   HIS  27           HB2      HIS  27 -16.778  22.321  22.321
  201    HD1  HIS  27           HD1      HIS  27 -16.910  25.069  25.069
  202    HD2  HIS  27           HD2      HIS  27 -13.185  23.401  23.401
  203    HE1  HIS  27           HE1      HIS  27 -15.307  26.918  26.918
  204    HA   PRO  28           HA       PRO  28 -18.166  18.970  18.970
  205   1HB   PRO  28           HB1      PRO  28 -20.215  19.557  19.557
  206   2HB   PRO  28           HB2      PRO  28 -18.551  19.924  19.924
  207   1HG   PRO  28           HG1      PRO  28 -20.564  21.820  21.820
  208   2HG   PRO  28           HG2      PRO  28 -19.694  22.084  22.084
  209   1HD   PRO  28           HD1      PRO  28 -18.700  23.048  23.048
  210   2HD   PRO  28           HD2      PRO  28 -17.585  22.426  22.426
  211    H    GLY  29           HN       GLY  29 -18.652  19.878  19.878
  212   1HA   GLY  29           HA1      GLY  29 -21.398  19.043  19.043
  213   2HA   GLY  29           HA2      GLY  29 -20.630  20.399  20.399
  214    H    LEU  30           HN       LEU  30 -18.003  18.809  18.809
  215    HA   LEU  30           HA       LEU  30 -18.135  17.404  17.404
  216   1HB   LEU  30           HB1      LEU  30 -15.826  17.675  17.675
  217   2HB   LEU  30           HB2      LEU  30 -15.662  17.210  17.210
  218    HG   LEU  30           HG       LEU  30 -16.409  19.886  19.886
  219   1HD1  LEU  30          HD11      LEU  30 -14.058  18.983  18.983
  220   2HD1  LEU  30          HD12      LEU  30 -14.346  20.638  20.638
  221   3HD1  LEU  30          HD13      LEU  30 -14.024  19.402  19.402
  222   1HD2  LEU  30          HD21      LEU  30 -17.798  19.571  19.571
  223   2HD2  LEU  30          HD22      LEU  30 -16.553  20.769  20.769
  224   3HD2  LEU  30          HD23      LEU  30 -16.361  19.154  19.154
  225    H    SER  31           HN       SER  31 -17.262  15.302  15.302
  226    HA   SER  31           HA       SER  31 -17.776  13.423  13.423
  227   1HB   SER  31           HB1      SER  31 -18.094  12.929  12.929
  228   2HB   SER  31           HB2      SER  31 -18.501  11.790  11.790
  229    HG   SER  31           HG       SER  31 -20.307  12.802  12.802
  230    H    ILE  32           HN       ILE  32 -16.536  11.286  11.286
  231    HA   ILE  32           HA       ILE  32 -13.767  11.909  11.909
  232    HB   ILE  32           HB       ILE  32 -14.866   9.891   9.891
  233   1HG1  ILE  32          HG11      ILE  32 -13.214   8.140   8.140
  234   2HG1  ILE  32          HG12      ILE  32 -12.789   8.996   8.996
  235   1HG2  ILE  32          HG21      ILE  32 -15.223   8.980   8.980
  236   2HG2  ILE  32          HG22      ILE  32 -15.532   7.975   7.975
  237   3HG2  ILE  32          HG23      ILE  32 -16.500   9.408   9.408
  238   1HD1  ILE  32          HD11      ILE  32 -12.299  10.008  10.008
  239   2HD1  ILE  32          HD12      ILE  32 -11.087   9.358   9.358
  240   3HD1  ILE  32          HD13      ILE  32 -11.870  10.880  10.880
  241    H    GLY  33           HN       GLY  33 -15.738  11.887  11.887
  242   1HA   GLY  33           HA1      GLY  33 -13.571  11.290  11.290
  243   2HA   GLY  33           HA2      GLY  33 -15.290  11.278  11.278
  244    H    ASP  34           HN       ASP  34 -14.938  13.858  13.858
  245    HA   ASP  34           HA       ASP  34 -14.528  15.733  15.733
  246   1HB   ASP  34           HB1      ASP  34 -16.066  15.950  15.950
  247   2HB   ASP  34           HB2      ASP  34 -15.941  17.308  17.308
  248    H    VAL  35           HN       VAL  35 -14.067  15.183  15.183
  249    HA   VAL  35           HA       VAL  35 -12.221  17.291  17.291
  250    HB   VAL  35           HB       VAL  35 -12.557  14.470  14.470
  251   1HG1  VAL  35          HG11      VAL  35 -10.329  15.453  15.453
  252   2HG1  VAL  35          HG12      VAL  35 -11.150  16.879  16.879
  253   3HG1  VAL  35          HG13      VAL  35 -11.372  15.329  15.329
  254   1HG2  VAL  35          HG21      VAL  35 -13.621  17.161  17.161
  255   2HG2  VAL  35          HG22      VAL  35 -14.575  15.870  15.870
  256   3HG2  VAL  35          HG23      VAL  35 -13.814  15.636  15.636
  257    H    ALA  36           HN       ALA  36 -12.049  14.125  14.125
  258    HA   ALA  36           HA       ALA  36  -9.193  13.954  13.954
  259   1HB   ALA  36           HB1      ALA  36 -11.456  12.326  12.326
  260   2HB   ALA  36           HB2      ALA  36  -9.773  11.821  11.821
  261   3HB   ALA  36           HB3      ALA  36 -10.592  11.976  11.976
  262    H    LYS  37           HN       LYS  37 -11.876  14.449  14.449
  263    HA   LYS  37           HA       LYS  37  -9.977  14.664  14.664
  264   1HB   LYS  37           HB1      LYS  37 -12.897  15.301  15.301
  265   2HB   LYS  37           HB2      LYS  37 -12.056  15.977  15.977
  266   1HG   LYS  37           HG1      LYS  37 -11.190  13.678  13.678
  267   2HG   LYS  37           HG2      LYS  37 -12.179  13.015  13.015
  268   1HD   LYS  37           HD1      LYS  37 -14.226  13.739  13.739
  269   2HD   LYS  37           HD2      LYS  37 -13.325  14.676  14.676
  270   1HE   LYS  37           HE1      LYS  37 -12.300  12.584  12.584
  271   2HE   LYS  37           HE2      LYS  37 -13.192  11.633  11.633
  272   1HZ   LYS  37           HZ1      LYS  37 -14.993  13.290  13.290
  273   2HZ   LYS  37           HZ2      LYS  37 -14.021  12.505  12.505
  274   3HZ   LYS  37           HZ3      LYS  37 -14.891  11.595  11.595
  275    H    LYS  38           HN       LYS  38 -11.171  17.057  17.057
  276    HA   LYS  38           HA       LYS  38 -10.244  19.281  19.281
  277   1HB   LYS  38           HB1      LYS  38 -12.123  19.597  19.597
  278   2HB   LYS  38           HB2      LYS  38 -11.192  19.008  19.008
  279   1HG   LYS  38           HG1      LYS  38  -9.761  20.921  20.921
  280   2HG   LYS  38           HG2      LYS  38 -10.267  21.461  21.461
  281   1HD   LYS  38           HD1      LYS  38 -12.158  21.320  21.320
  282   2HD   LYS  38           HD2      LYS  38 -11.228  22.752  22.752
  283   1HE   LYS  38           HE1      LYS  38 -12.279  22.815  22.815
  284   2HE   LYS  38           HE2      LYS  38 -13.243  21.396  21.396
  285   1HZ   LYS  38           HZ1      LYS  38 -13.554  23.278  23.278
  286   2HZ   LYS  38           HZ2      LYS  38 -13.792  24.057  24.057
  287   3HZ   LYS  38           HZ3      LYS  38 -14.711  22.685  22.685
  288    H    LEU  39           HN       LEU  39  -9.184  17.770  17.770
  289    HA   LEU  39           HA       LEU  39  -6.723  19.292  19.292
  290   1HB   LEU  39           HB1      LEU  39  -6.571  18.444  18.444
  291   2HB   LEU  39           HB2      LEU  39  -8.197  17.898  17.898
  292    HG   LEU  39           HG       LEU  39  -7.067  15.748  15.748
  293   1HD1  LEU  39          HD11      LEU  39  -4.951  17.080  17.080
  294   2HD1  LEU  39          HD12      LEU  39  -4.841  15.418  15.418
  295   3HD1  LEU  39          HD13      LEU  39  -4.819  16.661  16.661
  296   1HD2  LEU  39          HD21      LEU  39  -8.415  15.970  15.970
  297   2HD2  LEU  39          HD22      LEU  39  -7.093  14.839  14.839
  298   3HD2  LEU  39          HD23      LEU  39  -6.927  16.460  16.460
  299    H    GLY  40           HN       GLY  40  -7.707  16.238  16.238
  300   1HA   GLY  40           HA1      GLY  40  -5.090  15.231  15.231
  301   2HA   GLY  40           HA2      GLY  40  -6.504  14.817  14.817
  302    H    GLU  41           HN       GLU  41  -7.134  17.476  17.476
  303    HA   GLU  41           HA       GLU  41  -5.374  17.743  17.743
  304   1HB   GLU  41           HB1      GLU  41  -7.319  19.638  19.638
  305   2HB   GLU  41           HB2      GLU  41  -6.435  20.118  20.118
  306   1HG   GLU  41           HG1      GLU  41  -8.287  17.708  17.708
  307   2HG   GLU  41           HG2      GLU  41  -8.698  19.238  19.238
  308    H    MET  42           HN       MET  42  -5.742  19.575  19.575
  309    HA   MET  42           HA       MET  42  -3.734  21.478  21.478
  310   1HB   MET  42           HB1      MET  42  -4.399  19.866  19.866
  311   2HB   MET  42           HB2      MET  42  -3.492  21.368  21.368
  312   1HG   MET  42           HG1      MET  42  -6.296  21.119  21.119
  313   2HG   MET  42           HG2      MET  42  -6.063  21.554  21.554
  314   1HE   MET  42           HE1      MET  42  -5.480  22.465  22.465
  315   2HE   MET  42           HE2      MET  42  -7.142  22.835  22.835
  316   3HE   MET  42           HE3      MET  42  -6.044  24.120  24.120
  317    H    TRP  43           HN       TRP  43  -3.419  18.301  18.301
  318    HA   TRP  43           HA       TRP  43  -0.716  18.033  18.033
  319   1HB   TRP  43           HB1      TRP  43  -2.275  16.310  16.310
  320   2HB   TRP  43           HB2      TRP  43  -2.706  15.989  15.989
  321    HD1  TRP  43           HD1      TRP  43  -1.221  14.329  14.329
  322    HE1  TRP  43           HE1      TRP  43   0.905  13.188  13.188
  323    HE3  TRP  43           HE3      TRP  43  -0.182  16.647  16.647
  324    HZ2  TRP  43           HZ2      TRP  43   2.905  13.159  13.159
  325    HZ3  TRP  43           HZ3      TRP  43   1.810  16.070  16.070
  326    HH2  TRP  43           HH2      TRP  43   3.375  14.315  14.315
  327    H    ASN  44           HN       ASN  44  -2.425  17.228  17.228
  328    HA   ASN  44           HA       ASN  44  -0.298  16.432  16.432
  329   1HB   ASN  44           HB1      ASN  44  -1.954  16.257  16.257
  330   2HB   ASN  44           HB2      ASN  44  -3.063  16.970  16.970
  331   1HD2  ASN  44          HD21      ASN  44  -3.740  19.616  19.616
  332   2HD2  ASN  44          HD22      ASN  44  -4.244  18.610  18.610
  333    H    ASN  45           HN       ASN  45  -1.343  19.636  19.636
  334    HA   ASN  45           HA       ASN  45   1.142  20.796  20.796
  335   1HB   ASN  45           HB1      ASN  45  -0.222  22.854  22.854
  336   2HB   ASN  45           HB2      ASN  45  -0.887  21.467  21.467
  337   1HD2  ASN  45          HD21      ASN  45  -3.966  21.667  21.667
  338   2HD2  ASN  45          HD22      ASN  45  -3.096  20.988  20.988
  339    H    THR  46           HN       THR  46   1.081  19.879  19.879
  340    HA   THR  46           HA       THR  46   0.493  21.985  21.985
  341    HB   THR  46           HB       THR  46   0.827  19.667  19.667
  342    HG1  THR  46           HG1      THR  46   1.537  20.641  20.641
  343   1HG2  THR  46          HG21      THR  46   3.831  19.935  19.935
  344   2HG2  THR  46          HG22      THR  46   3.039  18.630  18.630
  345   3HG2  THR  46          HG23      THR  46   2.753  18.860  18.860
  346    H    ALA  47           HN       ALA  47   3.390  21.029  21.029
  347    HA   ALA  47           HA       ALA  47   4.545  23.583  23.583
  348   1HB   ALA  47           HB1      ALA  47   5.020  23.457  23.457
  349   2HB   ALA  47           HB2      ALA  47   5.859  21.945  21.945
  350   3HB   ALA  47           HB3      ALA  47   6.491  23.437  23.437
  351    H    ALA  48           HN       ALA  48   5.170  20.399  20.399
  352    HA   ALA  48           HA       ALA  48   5.650  18.485  18.485
  353   1HB   ALA  48           HB1      ALA  48   6.002  19.805  19.805
  354   2HB   ALA  48           HB2      ALA  48   7.550  20.361  20.361
  355   3HB   ALA  48           HB3      ALA  48   7.282  18.654  18.654
  356    H    ASP  49           HN       ASP  49   7.585  21.152  21.152
  357    HA   ASP  49           HA       ASP  49   9.800  19.539  19.539
  358   1HB   ASP  49           HB1      ASP  49   9.279  22.531  22.531
  359   2HB   ASP  49           HB2      ASP  49  10.824  21.712  21.712
  360    H    ASP  50           HN       ASP  50   6.808  19.956  19.956
  361    HA   ASP  50           HA       ASP  50   7.358  20.049  20.049
  362   1HB   ASP  50           HB1      ASP  50   4.980  21.054  21.054
  363   2HB   ASP  50           HB2      ASP  50   4.845  20.725  20.725
  364    H    LYS  51           HN       LYS  51   6.606  18.169  18.169
  365    HA   LYS  51           HA       LYS  51   4.811  16.290  16.290
  366   1HB   LYS  51           HB1      LYS  51   6.186  15.882  15.882
  367   2HB   LYS  51           HB2      LYS  51   5.044  14.790  14.790
  368   1HG   LYS  51           HG1      LYS  51   3.376  16.722  16.722
  369   2HG   LYS  51           HG2      LYS  51   4.527  17.509  17.509
  370   1HD   LYS  51           HD1      LYS  51   4.432  14.912  14.912
  371   2HD   LYS  51           HD2      LYS  51   2.812  15.105  15.105
  372   1HE   LYS  51           HE1      LYS  51   2.650  15.839  15.839
  373   2HE   LYS  51           HE2      LYS  51   2.766  17.333  17.333
  374   1HZ   LYS  51           HZ1      LYS  51   5.357  16.515  16.515
  375   2HZ   LYS  51           HZ2      LYS  51   4.488  16.391  16.391
  376   3HZ   LYS  51           HZ3      LYS  51   4.536  17.868  17.868
  377    H    GLN  52           HN       GLN  52   7.936  16.431  16.431
  378    HA   GLN  52           HA       GLN  52   9.281  14.232  14.232
  379   1HB   GLN  52           HB1      GLN  52  10.026  16.886  16.886
  380   2HB   GLN  52           HB2      GLN  52  10.781  16.552  16.552
  381   1HG   GLN  52           HG1      GLN  52  12.383  16.027  16.027
  382   2HG   GLN  52           HG2      GLN  52  11.871  14.517  14.517
  383   1HE2  GLN  52          HE21      GLN  52   9.661  14.588  14.588
  384   2HE2  GLN  52          HE22      GLN  52   9.230  15.359  15.359
  385    HA   PRO  53           HA       PRO  53  10.112  14.778  14.778
  386   1HB   PRO  53           HB1      PRO  53   7.984  16.139  16.139
  387   2HB   PRO  53           HB2      PRO  53   9.572  16.823  16.823
  388   1HG   PRO  53           HG1      PRO  53   7.076  16.893  16.893
  389   2HG   PRO  53           HG2      PRO  53   8.083  18.259  18.259
  390   1HD   PRO  53           HD1      PRO  53   8.581  17.244  17.244
  391   2HD   PRO  53           HD2      PRO  53   9.984  17.435  17.435
  392    H    TYR  54           HN       TYR  54   6.710  14.861  14.861
  393    HA   TYR  54           HA       TYR  54   5.881  12.702  12.702
  394   1HB   TYR  54           HB1      TYR  54   4.595  13.936  13.936
  395   2HB   TYR  54           HB2      TYR  54   3.806  12.727  12.727
  396    HD1  TYR  54           HD1      TYR  54   4.097  13.422  13.422
  397    HD2  TYR  54           HD2      TYR  54   3.928  16.115  16.115
  398    HE1  TYR  54           HE1      TYR  54   3.336  15.202  15.202
  399    HE2  TYR  54           HE2      TYR  54   3.167  17.896  17.896
  400    HH   TYR  54           HH       TYR  54   3.545  18.133  18.133
  401    H    GLU  55           HN       GLU  55   6.458  13.013  13.013
  402    HA   GLU  55           HA       GLU  55   5.957  10.408  10.408
  403   1HB   GLU  55           HB1      GLU  55   7.143  12.808  12.808
  404   2HB   GLU  55           HB2      GLU  55   8.298  11.554  11.554
  405   1HG   GLU  55           HG1      GLU  55   6.420  10.210  10.210
  406   2HG   GLU  55           HG2      GLU  55   5.328  11.534  11.534
  407    H    LYS  56           HN       LYS  56   9.128  11.648  11.648
  408    HA   LYS  56           HA       LYS  56  10.594   9.297   9.297
  409   1HB   LYS  56           HB1      LYS  56  10.809  11.718  11.718
  410   2HB   LYS  56           HB2      LYS  56  11.993  10.435  10.435
  411   1HG   LYS  56           HG1      LYS  56  11.339  11.970  11.970
  412   2HG   LYS  56           HG2      LYS  56  12.660  12.379  12.379
  413   1HD   LYS  56           HD1      LYS  56  13.569  10.024  10.024
  414   2HD   LYS  56           HD2      LYS  56  12.322   9.758   9.758
  415   1HE   LYS  56           HE1      LYS  56  13.194  11.609  11.609
  416   2HE   LYS  56           HE2      LYS  56  14.419  11.961  11.961
  417   1HZ   LYS  56           HZ1      LYS  56  14.531   9.235   9.235
  418   2HZ   LYS  56           HZ2      LYS  56  14.551  10.130  10.130
  419   3HZ   LYS  56           HZ3      LYS  56  15.706  10.432  10.432
  420    H    LYS  57           HN       LYS  57   8.364  10.387  10.387
  421    HA   LYS  57           HA       LYS  57   9.096   8.466   8.466
  422   1HB   LYS  57           HB1      LYS  57   7.536  10.584  10.584
  423   2HB   LYS  57           HB2      LYS  57   6.272   9.578   9.578
  424   1HG   LYS  57           HG1      LYS  57   6.017   9.346   9.346
  425   2HG   LYS  57           HG2      LYS  57   6.723   7.852   7.852
  426   1HD   LYS  57           HD1      LYS  57   8.175   8.199   8.199
  427   2HD   LYS  57           HD2      LYS  57   9.032   9.190   9.190
  428   1HE   LYS  57           HE1      LYS  57   6.967  10.244  10.244
  429   2HE   LYS  57           HE2      LYS  57   8.705  10.380  10.380
  430   1HZ   LYS  57           HZ1      LYS  57   8.046  11.383  11.383
  431   2HZ   LYS  57           HZ2      LYS  57   6.985  12.071  12.071
  432   3HZ   LYS  57           HZ3      LYS  57   8.664  12.206  12.206
  433    H    ALA  58           HN       ALA  58   6.436   8.621   8.621
  434    HA   ALA  58           HA       ALA  58   5.295   6.105   6.105
  435   1HB   ALA  58           HB1      ALA  58   4.496   7.815   7.815
  436   2HB   ALA  58           HB2      ALA  58   5.899   7.499   7.499
  437   3HB   ALA  58           HB3      ALA  58   4.698   6.247   6.247
  438    H    ALA  59           HN       ALA  59   8.026   6.947   6.947
  439    HA   ALA  59           HA       ALA  59   8.743   4.443   4.443
  440   1HB   ALA  59           HB1      ALA  59   9.862   6.564   6.564
  441   2HB   ALA  59           HB2      ALA  59  10.652   6.663   6.663
  442   3HB   ALA  59           HB3      ALA  59  11.053   5.360   5.360
  443    H    LYS  60           HN       LYS  60  10.265   5.916   5.916
  444    HA   LYS  60           HA       LYS  60  11.787   3.909   3.909
  445   1HB   LYS  60           HB1      LYS  60  11.498   6.241   6.241
  446   2HB   LYS  60           HB2      LYS  60   9.987   5.751   5.751
  447   1HG   LYS  60           HG1      LYS  60  11.738   5.705   5.705
  448   2HG   LYS  60           HG2      LYS  60  11.194   4.068   4.068
  449   1HD   LYS  60           HD1      LYS  60  13.146   3.575   3.575
  450   2HD   LYS  60           HD2      LYS  60  13.648   5.254   5.254
  451   1HE   LYS  60           HE1      LYS  60  13.494   3.510   3.510
  452   2HE   LYS  60           HE2      LYS  60  14.969   3.862   3.862
  453   1HZ   LYS  60           HZ1      LYS  60  13.672   6.279   6.279
  454   2HZ   LYS  60           HZ2      LYS  60  13.731   5.397   5.397
  455   3HZ   LYS  60           HZ3      LYS  60  15.162   5.724   5.724
  456    H    LEU  61           HN       LEU  61   8.326   4.230   4.230
  457    HA   LEU  61           HA       LEU  61   8.084   1.857   1.857
  458   1HB   LEU  61           HB1      LEU  61   5.935   3.360   3.360
  459   2HB   LEU  61           HB2      LEU  61   5.670   2.311   2.311
  460    HG   LEU  61           HG       LEU  61   7.362   4.874   4.874
  461   1HD1  LEU  61          HD11      LEU  61   4.571   4.353   4.353
  462   2HD1  LEU  61          HD12      LEU  61   5.503   5.831   5.831
  463   3HD1  LEU  61          HD13      LEU  61   5.009   5.346   5.346
  464   1HD2  LEU  61          HD21      LEU  61   6.467   3.043   3.043
  465   2HD2  LEU  61          HD22      LEU  61   8.109   3.189   3.189
  466   3HD2  LEU  61          HD23      LEU  61   7.348   4.554   4.554
  467    H    LYS  62           HN       LYS  62   7.122   2.541   2.541
  468    HA   LYS  62           HA       LYS  62   6.224   0.055   0.055
  469   1HB   LYS  62           HB1      LYS  62   6.474   2.202   2.202
  470   2HB   LYS  62           HB2      LYS  62   8.177   1.826   1.826
  471   1HG   LYS  62           HG1      LYS  62   7.654  -0.279  -0.279
  472   2HG   LYS  62           HG2      LYS  62   5.934  -0.073  -0.073
  473   1HD   LYS  62           HD1      LYS  62   6.038   2.085   2.085
  474   2HD   LYS  62           HD2      LYS  62   7.715   1.717   1.717
  475   1HE   LYS  62           HE1      LYS  62   7.052  -0.354  -0.354
  476   2HE   LYS  62           HE2      LYS  62   5.372  -0.117  -0.117
  477   1HZ   LYS  62           HZ1      LYS  62   6.267   2.214   2.214
  478   2HZ   LYS  62           HZ2      LYS  62   6.696   0.897   0.897
  479   3HZ   LYS  62           HZ3      LYS  62   5.079   1.117   1.117
  480    H    GLU  63           HN       GLU  63   9.506   1.205   1.205
  481    HA   GLU  63           HA       GLU  63  10.992  -1.002  -1.002
  482   1HB   GLU  63           HB1      GLU  63  11.960   1.231   1.231
  483   2HB   GLU  63           HB2      GLU  63  11.529   1.138   1.138
  484   1HG   GLU  63           HG1      GLU  63  13.144  -0.780  -0.780
  485   2HG   GLU  63           HG2      GLU  63  13.615  -0.589  -0.589
  486    H    LYS  64           HN       LYS  64   9.935  -0.160  -0.160
  487    HA   LYS  64           HA       LYS  64  10.941  -2.428  -2.428
  488   1HB   LYS  64           HB1      LYS  64   8.287  -0.963  -0.963
  489   2HB   LYS  64           HB2      LYS  64   8.934  -2.152  -2.152
  490   1HG   LYS  64           HG1      LYS  64  10.483   0.333   0.333
  491   2HG   LYS  64           HG2      LYS  64   9.417   0.284   0.284
  492   1HD   LYS  64           HD1      LYS  64  10.773  -1.615  -1.615
  493   2HD   LYS  64           HD2      LYS  64  11.856  -1.516  -1.516
  494   1HE   LYS  64           HE1      LYS  64  12.800  -0.274  -0.274
  495   2HE   LYS  64           HE2      LYS  64  12.412   0.834   0.834
  496   1HZ   LYS  64           HZ1      LYS  64  10.141   0.562   0.562
  497   2HZ   LYS  64           HZ2      LYS  64  11.459   0.843   0.843
  498   3HZ   LYS  64           HZ3      LYS  64  11.115   1.934   1.934
  499    H    TYR  65           HN       TYR  65   7.782  -2.032  -2.032
  500    HA   TYR  65           HA       TYR  65   6.680  -4.580  -4.580
  501   1HB   TYR  65           HB1      TYR  65   5.225  -2.919  -2.919
  502   2HB   TYR  65           HB2      TYR  65   6.396  -2.313  -2.313
  503    HD1  TYR  65           HD1      TYR  65   5.033  -5.810  -5.810
  504    HD2  TYR  65           HD2      TYR  65   5.216  -2.257  -2.257
  505    HE1  TYR  65           HE1      TYR  65   3.842  -6.935  -6.935
  506    HE2  TYR  65           HE2      TYR  65   4.027  -3.386  -3.386
  507    HH   TYR  65           HH       TYR  65   2.296  -5.498  -5.498
  508    H    GLU  66           HN       GLU  66   8.345  -3.413  -3.413
  509    HA   GLU  66           HA       GLU  66   8.456  -5.577  -5.577
  510   1HB   GLU  66           HB1      GLU  66  10.713  -3.673  -3.673
  511   2HB   GLU  66           HB2      GLU  66  10.617  -4.713  -4.713
  512   1HG   GLU  66           HG1      GLU  66   8.229  -2.957  -2.957
  513   2HG   GLU  66           HG2      GLU  66   9.670  -2.144  -2.144
  514    H    LYS  67           HN       LYS  67  10.392  -5.193  -5.193
  515    HA   LYS  67           HA       LYS  67  12.071  -7.510  -7.510
  516   1HB   LYS  67           HB1      LYS  67  11.970  -5.972  -5.972
  517   2HB   LYS  67           HB2      LYS  67  13.282  -7.007  -7.007
  518   1HG   LYS  67           HG1      LYS  67  14.223  -5.377  -5.377
  519   2HG   LYS  67           HG2      LYS  67  12.711  -4.932  -4.932
  520   1HD   LYS  67           HD1      LYS  67  13.132  -3.011  -3.011
  521   2HD   LYS  67           HD2      LYS  67  12.148  -3.874  -3.874
  522   1HE   LYS  67           HE1      LYS  67  15.205  -3.884  -3.884
  523   2HE   LYS  67           HE2      LYS  67  14.220  -2.901  -2.901
  524   1HZ   LYS  67           HZ1      LYS  67  13.351  -5.554  -5.554
  525   2HZ   LYS  67           HZ2      LYS  67  15.041  -5.532  -5.532
  526   3HZ   LYS  67           HZ3      LYS  67  14.086  -4.583  -4.583
  527    H    ASP  68           HN       ASP  68   9.341  -6.823  -6.823
  528    HA   ASP  68           HA       ASP  68   9.431  -9.296  -9.296
  529   1HB   ASP  68           HB1      ASP  68   7.468  -7.012  -7.012
  530   2HB   ASP  68           HB2      ASP  68   7.192  -8.439  -8.439
  531    H    ILE  69           HN       ILE  69   8.231  -8.026  -8.026
  532    HA   ILE  69           HA       ILE  69   6.176 -10.145 -10.145
  533    HB   ILE  69           HB       ILE  69   5.656  -7.900  -7.900
  534   1HG1  ILE  69          HG11      ILE  69   4.835  -8.485  -8.485
  535   2HG1  ILE  69          HG12      ILE  69   6.064  -9.729  -9.729
  536   1HG2  ILE  69          HG21      ILE  69   7.918  -7.287  -7.287
  537   2HG2  ILE  69          HG22      ILE  69   7.891  -8.392  -8.392
  538   3HG2  ILE  69          HG23      ILE  69   6.803  -7.011  -7.011
  539   1HD1  ILE  69          HD11      ILE  69   3.907  -9.771  -9.771
  540   2HD1  ILE  69          HD12      ILE  69   3.875 -10.715 -10.715
  541   3HD1  ILE  69          HD13      ILE  69   5.099 -11.030 -11.030
  542    H    ALA  70           HN       ALA  70   9.143  -9.133  -9.133
  543    HA   ALA  70           HA       ALA  70   9.592 -11.222 -11.222
  544   1HB   ALA  70           HB1      ALA  70  11.672  -9.720  -9.720
  545   2HB   ALA  70           HB2      ALA  70  12.042 -10.641 -10.641
  546   3HB   ALA  70           HB3      ALA  70  11.079  -9.184  -9.184
  547    H    ALA  71           HN       ALA  71   9.942 -10.960 -10.960
  548    HA   ALA  71           HA       ALA  71  11.233 -13.555 -13.555
  549   1HB   ALA  71           HB1      ALA  71  10.051 -11.625 -11.625
  550   2HB   ALA  71           HB2      ALA  71  11.015 -13.039 -13.039
  551   3HB   ALA  71           HB3      ALA  71  11.738 -11.698 -11.698
  552    H    TYR  72           HN       TYR  72   8.076 -12.098 -12.098
  553    HA   TYR  72           HA       TYR  72   6.659 -14.204 -14.204
  554   1HB   TYR  72           HB1      TYR  72   5.727 -11.998 -11.998
  555   2HB   TYR  72           HB2      TYR  72   5.754 -12.155 -12.155
  556    HD1  TYR  72           HD1      TYR  72   4.625 -14.915 -14.915
  557    HD2  TYR  72           HD2      TYR  72   3.460 -11.703 -11.703
  558    HE1  TYR  72           HE1      TYR  72   2.323 -15.750 -15.750
  559    HE2  TYR  72           HE2      TYR  72   1.161 -12.532 -12.532
  560    HH   TYR  72           HH       TYR  72  -0.040 -14.645 -14.645
  561    H    ARG  73           HN       ARG  73   7.059 -13.485 -13.485
  562    HA   ARG  73           HA       ARG  73   5.615 -15.775 -15.775
  563   1HB   ARG  73           HB1      ARG  73   7.609 -13.918 -13.918
  564   2HB   ARG  73           HB2      ARG  73   6.612 -15.088 -15.088
  565   1HG   ARG  73           HG1      ARG  73   4.580 -13.912 -13.912
  566   2HG   ARG  73           HG2      ARG  73   5.691 -12.651 -12.651
  567   1HD   ARG  73           HD1      ARG  73   6.334 -12.338 -12.338
  568   2HD   ARG  73           HD2      ARG  73   5.098 -13.517 -13.517
  569    HE   ARG  73           HE       ARG  73   4.569 -10.870 -10.870
  570   1HH1  ARG  73          HH11      ARG  73   2.429 -12.663 -12.663
  571   2HH1  ARG  73          HH12      ARG  73   1.330 -12.547 -12.547
  572   1HH2  ARG  73          HH21      ARG  73   3.742 -11.116 -11.116
  573   2HH2  ARG  73          HH22      ARG  73   2.096 -11.647 -11.647
  574    H    ALA  74           HN       ALA  74   8.875 -14.960 -14.960
  575    HA   ALA  74           HA       ALA  74  10.224 -17.169 -17.169
  576   1HB   ALA  74           HB1      ALA  74  10.870 -15.684 -15.684
  577   2HB   ALA  74           HB2      ALA  74  11.989 -16.737 -16.737
  578   3HB   ALA  74           HB3      ALA  74  11.419 -15.273 -15.273
  579    H    LYS  75           HN       LYS  75   8.491 -16.838 -16.838
  580    HA   LYS  75           HA       LYS  75   7.120 -18.489 -18.489
  581   1HB   LYS  75           HB1      LYS  75   7.615 -20.800 -20.800
  582   2HB   LYS  75           HB2      LYS  75   8.271 -20.398 -20.398
  583   1HG   LYS  75           HG1      LYS  75  10.598 -20.260 -20.260
  584   2HG   LYS  75           HG2      LYS  75   9.721 -21.074 -21.074
  585   1HD   LYS  75           HD1      LYS  75   9.969 -22.216 -22.216
  586   2HD   LYS  75           HD2      LYS  75  10.904 -22.702 -22.702
  587   1HE   LYS  75           HE1      LYS  75   8.776 -23.338 -23.338
  588   2HE   LYS  75           HE2      LYS  75   7.871 -22.938 -22.938
  589   1HZ   LYS  75           HZ1      LYS  75   9.989 -24.639 -24.639
  590   2HZ   LYS  75           HZ2      LYS  75   9.148 -25.318 -25.318
  591   3HZ   LYS  75           HZ3      LYS  75   8.316 -24.909 -24.909
  592    H    GLY  76           HN       GLY  76   7.762 -16.647 -16.647
  593   1HA   GLY  76           HA1      GLY  76  10.018 -17.008 -17.008
  594   2HA   GLY  76           HA2      GLY  76   9.057 -15.546 -15.546
  595    H    LYS  77           HN       LYS  77   6.611 -16.023 -16.023
  596    HA   LYS  77           HA       LYS  77   5.074 -16.303 -16.303
  597   1HB   LYS  77           HB1      LYS  77   6.446 -19.042 -19.042
  598   2HB   LYS  77           HB2      LYS  77   4.925 -18.814 -18.814
  599   1HG   LYS  77           HG1      LYS  77   3.984 -17.819 -17.819
  600   2HG   LYS  77           HG2      LYS  77   5.444 -18.349 -18.349
  601   1HD   LYS  77           HD1      LYS  77   3.682 -20.304 -20.304
  602   2HD   LYS  77           HD2      LYS  77   3.363 -19.885 -19.885
  603   1HE   LYS  77           HE1      LYS  77   4.660 -21.930 -21.930
  604   2HE   LYS  77           HE2      LYS  77   5.692 -20.655 -20.655
  605   1HZ   LYS  77           HZ1      LYS  77   5.968 -20.781 -20.781
  606   2HZ   LYS  77           HZ2      LYS  77   6.145 -22.340 -22.340
  607   3HZ   LYS  77           HZ3      LYS  77   7.127 -21.073 -21.073
  608    HA   PRO  78           HA       PRO  78   7.336 -16.339 -16.339
  609   1HB   PRO  78           HB1      PRO  78   5.530 -18.281 -18.281
  610   2HB   PRO  78           HB2      PRO  78   5.759 -16.565 -16.565
  611   1HG   PRO  78           HG1      PRO  78   3.450 -17.453 -17.453
  612   2HG   PRO  78           HG2      PRO  78   4.145 -15.907 -15.907
  613   1HD   PRO  78           HD1      PRO  78   4.540 -18.645 -18.645
  614   2HD   PRO  78           HD2      PRO  78   3.980 -17.135 -17.135
  615    H    ASP  79           HN       ASP  79   8.222 -18.161 -18.161
  616    HA   ASP  79           HA       ASP  79   9.947 -19.591 -19.591
  617   1HB   ASP  79           HB1      ASP  79  10.599 -19.201 -19.201
  618   2HB   ASP  79           HB2      ASP  79   9.559 -20.547 -20.547
  619    H    ALA  80           HN       ALA  80  10.027 -21.685 -21.685
  620    HA   ALA  80           HA       ALA  80   7.410 -23.160 -23.160
  621   1HB   ALA  80           HB1      ALA  80   8.436 -22.623 -22.623
  622   2HB   ALA  80           HB2      ALA  80   9.874 -23.516 -23.516
  623   3HB   ALA  80           HB3      ALA  80   8.344 -24.356 -24.356
  624    H    ALA  81           HN       ALA  81  10.849 -24.046 -24.046
  625    HA   ALA  81           HA       ALA  81  10.449 -25.911 -25.911
  626   1HB   ALA  81           HB1      ALA  81  11.945 -26.505 -26.505
  627   2HB   ALA  81           HB2      ALA  81  11.853 -27.577 -27.577
  628   3HB   ALA  81           HB3      ALA  81  10.401 -27.192 -27.192
  629   1H1   BME  16           HE1      MER  16  -8.969   9.755   9.755
  630   2H1   BME  16           HE2      MER  16  -7.628   8.595   8.595
  631   1H2   BME  16           HZ1      MER  16  -6.021  10.403  10.403
  632   2H2   BME  16           HZ2      MER  16  -7.285  11.606  11.606
  633    HO1  BME  16           HH       MER  16  -7.565   8.745   8.745

  Start of MODEL   38
    1    H    ASN   3           HN       ASN   3  -5.105 -11.316 -11.316
    2    HA   ASN   3           HA       ASN   3  -2.415 -12.534 -12.534
    3   1HB   ASN   3           HB1      ASN   3  -3.379 -14.102 -14.102
    4   2HB   ASN   3           HB2      ASN   3  -4.085 -14.359 -14.359
    5   1HD2  ASN   3          HD21      ASN   3  -4.847 -13.958 -13.958
    6   2HD2  ASN   3          HD22      ASN   3  -6.467 -13.472 -13.472
    7    H    ALA   4           HN       ALA   4  -1.621 -12.503 -12.503
    8    HA   ALA   4           HA       ALA   4  -0.983 -11.438 -11.438
    9   1HB   ALA   4           HB1      ALA   4  -3.878 -10.493 -10.493
   10   2HB   ALA   4           HB2      ALA   4  -2.791 -10.313 -10.313
   11   3HB   ALA   4           HB3      ALA   4  -3.205 -11.924 -11.924
   12    HA   PRO   5           HA       PRO   5   0.765  -7.618  -7.618
   13   1HB   PRO   5           HB1      PRO   5   0.407  -6.774  -6.774
   14   2HB   PRO   5           HB2      PRO   5   1.734  -7.762  -7.762
   15   1HG   PRO   5           HG1      PRO   5  -0.876  -8.544  -8.544
   16   2HG   PRO   5           HG2      PRO   5   0.736  -9.205  -9.205
   17   1HD   PRO   5           HD1      PRO   5  -0.931 -10.586 -10.586
   18   2HD   PRO   5           HD2      PRO   5   0.675 -10.502 -10.502
   19    H    LYS   6           HN       LYS   6   0.078  -6.047  -6.047
   20    HA   LYS   6           HA       LYS   6  -2.585  -4.798  -4.798
   21   1HB   LYS   6           HB1      LYS   6  -2.075  -5.793  -5.793
   22   2HB   LYS   6           HB2      LYS   6  -0.783  -4.635  -4.635
   23   1HG   LYS   6           HG1      LYS   6  -3.494  -3.500  -3.500
   24   2HG   LYS   6           HG2      LYS   6  -3.318  -4.259  -4.259
   25   1HD   LYS   6           HD1      LYS   6  -1.296  -2.771  -2.771
   26   2HD   LYS   6           HD2      LYS   6  -1.657  -1.938  -1.938
   27   1HE   LYS   6           HE1      LYS   6  -3.879  -1.281  -1.281
   28   2HE   LYS   6           HE2      LYS   6  -3.606  -2.186  -2.186
   29   1HZ   LYS   6           HZ1      LYS   6  -1.443  -0.460  -0.460
   30   2HZ   LYS   6           HZ2      LYS   6  -2.871   0.434   0.434
   31   3HZ   LYS   6           HZ3      LYS   6  -2.619  -0.436  -0.436
   32    H    ARG   7           HN       ARG   7  -2.304  -3.384  -3.384
   33    HA   ARG   7           HA       ARG   7  -0.155  -1.631  -1.631
   34   1HB   ARG   7           HB1      ARG   7  -1.765  -2.239  -2.239
   35   2HB   ARG   7           HB2      ARG   7  -3.085  -1.575  -1.575
   36   1HG   ARG   7           HG1      ARG   7  -2.814   0.472   0.472
   37   2HG   ARG   7           HG2      ARG   7  -1.133   0.540   0.540
   38   1HD   ARG   7           HD1      ARG   7  -1.387   0.738   0.738
   39   2HD   ARG   7           HD2      ARG   7  -0.465  -0.699  -0.699
   40    HE   ARG   7           HE       ARG   7  -2.598  -2.005  -2.005
   41   1HH1  ARG   7          HH11      ARG   7  -1.693   0.658   0.658
   42   2HH1  ARG   7          HH12      ARG   7  -3.080   0.543   0.543
   43   1HH2  ARG   7          HH21      ARG   7  -4.585  -1.964  -1.964
   44   2HH2  ARG   7          HH22      ARG   7  -4.737  -0.959  -0.959
   45    HA   PRO   8           HA       PRO   8  -1.168   1.167   1.167
   46   1HB   PRO   8           HB1      PRO   8   1.240   2.356   2.356
   47   2HB   PRO   8           HB2      PRO   8   1.037   0.644   0.644
   48   1HG   PRO   8           HG1      PRO   8   1.996   1.879   1.879
   49   2HG   PRO   8           HG2      PRO   8   2.819   0.676   0.676
   50   1HD   PRO   8           HD1      PRO   8   1.256  -0.095  -0.095
   51   2HD   PRO   8           HD2      PRO   8   1.317  -1.059  -1.059
   52    HA   PRO   9           HA       PRO   9  -1.784   5.617   5.617
   53   1HB   PRO   9           HB1      PRO   9   0.797   6.447   6.447
   54   2HB   PRO   9           HB2      PRO   9  -0.821   6.724   6.724
   55   1HG   PRO   9           HG1      PRO   9   1.087   4.471   4.471
   56   2HG   PRO   9           HG2      PRO   9  -0.107   5.243   5.243
   57   1HD   PRO   9           HD1      PRO   9  -0.685   2.835   2.835
   58   2HD   PRO   9           HD2      PRO   9  -1.945   4.075   4.075
   59    H    SER  10           HN       SER  10  -0.602   7.526   7.526
   60    HA   SER  10           HA       SER  10   0.798   6.630   6.630
   61   1HB   SER  10           HB1      SER  10  -0.249   8.676   8.676
   62   2HB   SER  10           HB2      SER  10  -1.418   7.487   7.487
   63    HG   SER  10           HG       SER  10  -1.012  10.015  10.015
   64    H    ALA  11           HN       ALA  11   0.510   9.704   9.704
   65    HA   ALA  11           HA       ALA  11   3.106  10.254  10.254
   66   1HB   ALA  11           HB1      ALA  11   2.462  11.431  11.431
   67   2HB   ALA  11           HB2      ALA  11   3.852  11.820  11.820
   68   3HB   ALA  11           HB3      ALA  11   3.718  10.229  10.229
   69    H    PHE  12           HN       PHE  12   0.189  11.407  11.407
   70    HA   PHE  12           HA       PHE  12   0.237  13.905  13.905
   71   1HB   PHE  12           HB1      PHE  12  -1.291  14.659  14.659
   72   2HB   PHE  12           HB2      PHE  12  -0.672  13.306  13.306
   73    HD1  PHE  12           HD1      PHE  12  -3.452  14.040  14.040
   74    HD2  PHE  12           HD2      PHE  12  -2.160  12.097  12.097
   75    HE1  PHE  12           HE1      PHE  12  -5.757  13.369  13.369
   76    HE2  PHE  12           HE2      PHE  12  -4.472  11.435  11.435
   77    HZ   PHE  12           HZ       PHE  12  -6.280  12.055  12.055
   78    H    PHE  13           HN       PHE  13  -0.580  10.723  10.723
   79    HA   PHE  13           HA       PHE  13  -3.014  11.009  11.009
   80   1HB   PHE  13           HB1      PHE  13  -1.902   8.836   8.836
   81   2HB   PHE  13           HB2      PHE  13  -0.894   8.952   8.952
   82    HD1  PHE  13           HD1      PHE  13  -2.133   9.164   9.164
   83    HD2  PHE  13           HD2      PHE  13  -4.105   8.027   8.027
   84    HE1  PHE  13           HE1      PHE  13  -4.022   8.288   8.288
   85    HE2  PHE  13           HE2      PHE  13  -5.988   7.154   7.154
   86    HZ   PHE  13           HZ       PHE  13  -5.953   7.284   7.284
   87    H    LEU  14           HN       LEU  14   0.434  11.257  11.257
   88    HA   LEU  14           HA       LEU  14   0.181  11.548  11.548
   89   1HB   LEU  14           HB1      LEU  14   2.223  12.847  12.847
   90   2HB   LEU  14           HB2      LEU  14   2.383  12.780  12.780
   91    HG   LEU  14           HG       LEU  14   3.840  11.115  11.115
   92   1HD1  LEU  14          HD11      LEU  14   2.505  10.169  10.169
   93   2HD1  LEU  14          HD12      LEU  14   1.331   9.536   9.536
   94   3HD1  LEU  14          HD13      LEU  14   2.977   8.928   8.928
   95   1HD2  LEU  14          HD21      LEU  14   3.221  11.060  11.060
   96   2HD2  LEU  14          HD22      LEU  14   3.373   9.429   9.429
   97   3HD2  LEU  14          HD23      LEU  14   1.783  10.111  10.111
   98    H    PHE  15           HN       PHE  15   0.587  13.943  13.943
   99    HA   PHE  15           HA       PHE  15   0.058  16.366  16.366
  100   1HB   PHE  15           HB1      PHE  15   0.839  16.325  16.325
  101   2HB   PHE  15           HB2      PHE  15  -0.376  15.120  15.120
  102    HD1  PHE  15           HD1      PHE  15   0.128  18.752  18.752
  103    HD2  PHE  15           HD2      PHE  15  -2.324  15.731  15.731
  104    HE1  PHE  15           HE1      PHE  15  -1.173  20.474  20.474
  105    HE2  PHE  15           HE2      PHE  15  -3.616  17.454  17.454
  106    HZ   PHE  15           HZ       PHE  15  -3.045  19.825  19.825
  107    H    CYS  16           HN       MER  16  -2.306  14.327  14.327
  108    HA   CYS  16           HA       MER  16  -4.692  15.551  15.551
  109   1HB   CYS  16           HB1      MER  16  -4.413  13.568  13.568
  110   2HB   CYS  16           HB2      MER  16  -4.087  12.581  12.581
  111    H    SER  17           HN       SER  17  -3.116  13.151  13.151
  112    HA   SER  17           HA       SER  17  -5.129  13.123  13.123
  113   1HB   SER  17           HB1      SER  17  -3.428  12.200  12.200
  114   2HB   SER  17           HB2      SER  17  -3.087  11.577  11.577
  115    HG   SER  17           HG       SER  17  -1.243  12.522  12.522
  116    H    GLU  18           HN       GLU  18  -2.378  15.211  15.211
  117    HA   GLU  18           HA       GLU  18  -2.805  16.805  16.805
  118   1HB   GLU  18           HB1      GLU  18  -0.627  16.448  16.448
  119   2HB   GLU  18           HB2      GLU  18  -1.215  17.436  17.436
  120   1HG   GLU  18           HG1      GLU  18  -1.400  19.405  19.405
  121   2HG   GLU  18           HG2      GLU  18  -0.925  18.439  18.439
  122    H    TYR  19           HN       TYR  19  -4.423  16.672  16.672
  123    HA   TYR  19           HA       TYR  19  -5.299  19.503  19.503
  124   1HB   TYR  19           HB1      TYR  19  -5.120  17.319  17.319
  125   2HB   TYR  19           HB2      TYR  19  -6.598  18.307  18.307
  126    HD1  TYR  19           HD1      TYR  19  -2.900  18.601  18.601
  127    HD2  TYR  19           HD2      TYR  19  -6.498  20.392  20.392
  128    HE1  TYR  19           HE1      TYR  19  -1.602  20.394  20.394
  129    HE2  TYR  19           HE2      TYR  19  -5.209  22.185  22.185
  130    HH   TYR  19           HH       TYR  19  -3.191  22.933  22.933
  131    H    ARG  20           HN       ARG  20  -6.450  16.295  16.295
  132    HA   ARG  20           HA       ARG  20  -9.049  16.077  16.077
  133   1HB   ARG  20           HB1      ARG  20  -7.565  14.473  14.473
  134   2HB   ARG  20           HB2      ARG  20  -7.534  15.470  15.470
  135   1HG   ARG  20           HG1      ARG  20  -9.950  15.209  15.209
  136   2HG   ARG  20           HG2      ARG  20 -10.083  14.351  14.351
  137   1HD   ARG  20           HD1      ARG  20 -10.056  12.724  12.724
  138   2HD   ARG  20           HD2      ARG  20  -8.579  12.542  12.542
  139    HE   ARG  20           HE       ARG  20  -7.467  13.952  13.952
  140   1HH1  ARG  20          HH11      ARG  20  -9.533  14.802  14.802
  141   2HH1  ARG  20          HH12      ARG  20  -9.705  13.546  13.546
  142   1HH2  ARG  20          HH21      ARG  20  -8.006  11.194  11.194
  143   2HH2  ARG  20          HH22      ARG  20  -8.816  11.445  11.445
  144    HA   PRO  21           HA       PRO  21 -10.363  18.313  18.313
  145   1HB   PRO  21           HB1      PRO  21  -8.127  20.221  20.221
  146   2HB   PRO  21           HB2      PRO  21  -9.065  19.173  19.173
  147   1HG   PRO  21           HG1      PRO  21  -6.567  18.430  18.430
  148   2HG   PRO  21           HG2      PRO  21  -7.830  17.192  17.192
  149   1HD   PRO  21           HD1      PRO  21  -6.788  18.972  18.972
  150   2HD   PRO  21           HD2      PRO  21  -6.770  17.209  17.209
  151    H    LYS  22           HN       LYS  22  -8.373  20.366  20.366
  152    HA   LYS  22           HA       LYS  22 -10.039  22.688  22.688
  153   1HB   LYS  22           HB1      LYS  22  -7.924  21.762  21.762
  154   2HB   LYS  22           HB2      LYS  22  -8.725  23.311  23.311
  155   1HG   LYS  22           HG1      LYS  22  -7.100  24.137  24.137
  156   2HG   LYS  22           HG2      LYS  22  -7.910  23.334  23.334
  157   1HD   LYS  22           HD1      LYS  22  -6.482  21.344  21.344
  158   2HD   LYS  22           HD2      LYS  22  -5.737  22.031  22.031
  159   1HE   LYS  22           HE1      LYS  22  -4.266  22.407  22.407
  160   2HE   LYS  22           HE2      LYS  22  -4.877  23.942  23.942
  161   1HZ   LYS  22           HZ1      LYS  22  -6.693  22.941  22.941
  162   2HZ   LYS  22           HZ2      LYS  22  -5.137  22.844  22.844
  163   3HZ   LYS  22           HZ3      LYS  22  -5.724  24.332  24.332
  164    H    ILE  23           HN       ILE  23 -10.125  19.873  19.873
  165    HA   ILE  23           HA       ILE  23 -12.177  21.340  21.340
  166    HB   ILE  23           HB       ILE  23 -12.013  18.960  18.960
  167   1HG1  ILE  23          HG11      ILE  23  -9.132  19.342  19.342
  168   2HG1  ILE  23          HG12      ILE  23 -10.153  18.195  18.195
  169   1HG2  ILE  23          HG21      ILE  23 -11.729  21.193  21.193
  170   2HG2  ILE  23          HG22      ILE  23 -10.117  21.309  21.309
  171   3HG2  ILE  23          HG23      ILE  23 -10.448  20.148  20.148
  172   1HD1  ILE  23          HD11      ILE  23 -10.679  17.115  17.115
  173   2HD1  ILE  23          HD12      ILE  23  -9.580  18.218  18.218
  174   3HD1  ILE  23          HD13      ILE  23  -8.959  17.070  17.070
  175    H    LYS  24           HN       LYS  24 -11.786  18.994  18.994
  176    HA   LYS  24           HA       LYS  24 -14.353  17.689  17.689
  177   1HB   LYS  24           HB1      LYS  24 -12.197  16.699  16.699
  178   2HB   LYS  24           HB2      LYS  24 -12.275  17.707  17.707
  179   1HG   LYS  24           HG1      LYS  24 -13.112  15.502  15.502
  180   2HG   LYS  24           HG2      LYS  24 -14.488  16.576  16.576
  181   1HD   LYS  24           HD1      LYS  24 -15.133  14.496  14.496
  182   2HD   LYS  24           HD2      LYS  24 -15.039  15.713  15.713
  183   1HE   LYS  24           HE1      LYS  24 -12.727  14.895  14.895
  184   2HE   LYS  24           HE2      LYS  24 -12.866  13.677  13.677
  185   1HZ   LYS  24           HZ1      LYS  24 -15.143  13.511  13.511
  186   2HZ   LYS  24           HZ2      LYS  24 -13.801  13.593  13.593
  187   3HZ   LYS  24           HZ3      LYS  24 -13.877  12.387  12.387
  188    H    GLY  25           HN       GLY  25 -13.071  20.467  20.467
  189   1HA   GLY  25           HA1      GLY  25 -15.231  20.805  20.805
  190   2HA   GLY  25           HA2      GLY  25 -13.813  21.840  21.840
  191    H    GLU  26           HN       GLU  26 -13.929  22.236  22.236
  192    HA   GLU  26           HA       GLU  26 -15.977  24.284  24.284
  193   1HB   GLU  26           HB1      GLU  26 -13.844  23.326  23.326
  194   2HB   GLU  26           HB2      GLU  26 -14.868  24.718  24.718
  195   1HG   GLU  26           HG1      GLU  26 -13.059  24.423  24.423
  196   2HG   GLU  26           HG2      GLU  26 -12.586  25.271  25.271
  197    H    HIS  27           HN       HIS  27 -15.195  21.234  21.234
  198    HA   HIS  27           HA       HIS  27 -17.929  21.108  21.108
  199   1HB   HIS  27           HB1      HIS  27 -15.391  20.073  20.073
  200   2HB   HIS  27           HB2      HIS  27 -17.005  20.203  20.203
  201    HD1  HIS  27           HD1      HIS  27 -17.879  22.839  22.839
  202    HD2  HIS  27           HD2      HIS  27 -13.836  22.268  22.268
  203    HE1  HIS  27           HE1      HIS  27 -16.861  24.990  24.990
  204    HA   PRO  28           HA       PRO  28 -17.411  17.187  17.187
  205   1HB   PRO  28           HB1      PRO  28 -19.422  17.509  17.509
  206   2HB   PRO  28           HB2      PRO  28 -17.872  18.293  18.293
  207   1HG   PRO  28           HG1      PRO  28 -20.366  19.497  19.497
  208   2HG   PRO  28           HG2      PRO  28 -19.426  20.159  20.159
  209   1HD   PRO  28           HD1      PRO  28 -18.972  20.954  20.954
  210   2HD   PRO  28           HD2      PRO  28 -17.627  20.860  20.860
  211    H    GLY  29           HN       GLY  29 -18.346  17.746  17.746
  212   1HA   GLY  29           HA1      GLY  29 -20.764  16.079  16.079
  213   2HA   GLY  29           HA2      GLY  29 -20.670  17.592  17.592
  214    H    LEU  30           HN       LEU  30 -17.558  16.305  16.305
  215    HA   LEU  30           HA       LEU  30 -17.724  15.380  15.380
  216   1HB   LEU  30           HB1      LEU  30 -15.354  15.658  15.658
  217   2HB   LEU  30           HB2      LEU  30 -15.216  15.385  15.385
  218    HG   LEU  30           HG       LEU  30 -16.103  17.825  17.825
  219   1HD1  LEU  30          HD11      LEU  30 -13.707  17.580  17.580
  220   2HD1  LEU  30          HD12      LEU  30 -13.912  17.354  17.354
  221   3HD1  LEU  30          HD13      LEU  30 -14.277  18.908  18.908
  222   1HD2  LEU  30          HD21      LEU  30 -16.402  17.416  17.416
  223   2HD2  LEU  30          HD22      LEU  30 -17.718  17.640  17.640
  224   3HD2  LEU  30          HD23      LEU  30 -16.591  18.944  18.944
  225    H    SER  31           HN       SER  31 -16.631  13.445  13.445
  226    HA   SER  31           HA       SER  31 -16.918  11.184  11.184
  227   1HB   SER  31           HB1      SER  31 -18.424  11.254  11.254
  228   2HB   SER  31           HB2      SER  31 -16.937  11.019  11.019
  229    HG   SER  31           HG       SER  31 -17.006   9.329   9.329
  230    H    ILE  32           HN       ILE  32 -15.449   9.303   9.303
  231    HA   ILE  32           HA       ILE  32 -12.736  10.286  10.286
  232    HB   ILE  32           HB       ILE  32 -13.624   8.194   8.194
  233   1HG1  ILE  32          HG11      ILE  32 -11.770   6.687   6.687
  234   2HG1  ILE  32          HG12      ILE  32 -11.403   7.537   7.537
  235   1HG2  ILE  32          HG21      ILE  32 -15.145   7.501   7.501
  236   2HG2  ILE  32          HG22      ILE  32 -13.788   7.218   7.218
  237   3HG2  ILE  32          HG23      ILE  32 -14.017   6.201   6.201
  238   1HD1  ILE  32          HD11      ILE  32 -11.148   8.684   8.684
  239   2HD1  ILE  32          HD12      ILE  32  -9.818   8.183   8.183
  240   3HD1  ILE  32          HD13      ILE  32 -10.788   9.573   9.573
  241    H    GLY  33           HN       GLY  33 -14.686  10.526  10.526
  242   1HA   GLY  33           HA1      GLY  33 -12.796  10.083  10.083
  243   2HA   GLY  33           HA2      GLY  33 -14.559  10.111  10.111
  244    H    ASP  34           HN       ASP  34 -14.428  12.346  12.346
  245    HA   ASP  34           HA       ASP  34 -14.145  14.559  14.559
  246   1HB   ASP  34           HB1      ASP  34 -15.396  14.273  14.273
  247   2HB   ASP  34           HB2      ASP  34 -15.402  15.820  15.820
  248    H    VAL  35           HN       VAL  35 -13.337  13.644  13.644
  249    HA   VAL  35           HA       VAL  35 -11.474  15.735  15.735
  250    HB   VAL  35           HB       VAL  35 -11.868  12.902  12.902
  251   1HG1  VAL  35          HG11      VAL  35 -10.189  15.126  15.126
  252   2HG1  VAL  35          HG12      VAL  35 -10.552  13.589  13.589
  253   3HG1  VAL  35          HG13      VAL  35  -9.556  13.639  13.639
  254   1HG2  VAL  35          HG21      VAL  35 -12.765  15.567  15.567
  255   2HG2  VAL  35          HG22      VAL  35 -13.777  14.324  14.324
  256   3HG2  VAL  35          HG23      VAL  35 -12.952  14.012  14.012
  257    H    ALA  36           HN       ALA  36 -11.376  12.815  12.815
  258    HA   ALA  36           HA       ALA  36  -8.491  12.575  12.575
  259   1HB   ALA  36           HB1      ALA  36 -10.750  11.135  11.135
  260   2HB   ALA  36           HB2      ALA  36  -9.068  10.617  10.617
  261   3HB   ALA  36           HB3      ALA  36  -9.915  10.607  10.607
  262    H    LYS  37           HN       LYS  37 -11.115  13.644  13.644
  263    HA   LYS  37           HA       LYS  37  -9.361  14.049  14.049
  264   1HB   LYS  37           HB1      LYS  37 -11.626  13.637  13.637
  265   2HB   LYS  37           HB2      LYS  37 -12.213  14.742  14.742
  266   1HG   LYS  37           HG1      LYS  37 -11.746  16.636  16.636
  267   2HG   LYS  37           HG2      LYS  37 -10.549  15.838  15.838
  268   1HD   LYS  37           HD1      LYS  37 -13.332  14.748  14.748
  269   2HD   LYS  37           HD2      LYS  37 -13.133  16.381  16.381
  270   1HE   LYS  37           HE1      LYS  37 -11.263  15.617  15.617
  271   2HE   LYS  37           HE2      LYS  37 -11.426  13.981  13.981
  272   1HZ   LYS  37           HZ1      LYS  37 -13.935  14.833  14.833
  273   2HZ   LYS  37           HZ2      LYS  37 -12.808  15.193  15.193
  274   3HZ   LYS  37           HZ3      LYS  37 -12.949  13.605  13.605
  275    H    LYS  38           HN       LYS  38 -10.734  16.113  16.113
  276    HA   LYS  38           HA       LYS  38  -9.879  18.618  18.618
  277   1HB   LYS  38           HB1      LYS  38 -11.527  18.052  18.052
  278   2HB   LYS  38           HB2      LYS  38 -10.157  17.597  17.597
  279   1HG   LYS  38           HG1      LYS  38 -10.835  19.836  19.836
  280   2HG   LYS  38           HG2      LYS  38  -9.278  19.945  19.945
  281   1HD   LYS  38           HD1      LYS  38 -10.283  20.687  20.687
  282   2HD   LYS  38           HD2      LYS  38 -11.900  20.309  20.309
  283   1HE   LYS  38           HE1      LYS  38 -10.081  22.422  22.422
  284   2HE   LYS  38           HE2      LYS  38 -11.386  22.758  22.758
  285   1HZ   LYS  38           HZ1      LYS  38 -12.392  21.149  21.149
  286   2HZ   LYS  38           HZ2      LYS  38 -11.531  22.428  22.428
  287   3HZ   LYS  38           HZ3      LYS  38 -12.792  22.754  22.754
  288    H    LEU  39           HN       LEU  39  -8.421  16.410  16.410
  289    HA   LEU  39           HA       LEU  39  -5.961  17.903  17.903
  290   1HB   LEU  39           HB1      LEU  39  -6.754  15.105  15.105
  291   2HB   LEU  39           HB2      LEU  39  -5.148  15.743  15.743
  292    HG   LEU  39           HG       LEU  39  -7.725  17.065  17.065
  293   1HD1  LEU  39          HD11      LEU  39  -5.922  15.266  15.266
  294   2HD1  LEU  39          HD12      LEU  39  -7.268  16.129  16.129
  295   3HD1  LEU  39          HD13      LEU  39  -7.552  14.853  14.853
  296   1HD2  LEU  39          HD21      LEU  39  -5.662  18.570  18.570
  297   2HD2  LEU  39          HD22      LEU  39  -6.310  18.298  18.298
  298   3HD2  LEU  39          HD23      LEU  39  -4.906  17.397  17.397
  299    H    GLY  40           HN       GLY  40  -7.098  15.128  15.128
  300   1HA   GLY  40           HA1      GLY  40  -4.730  14.250  14.250
  301   2HA   GLY  40           HA2      GLY  40  -6.303  14.055  14.055
  302    H    GLU  41           HN       GLU  41  -6.343  17.206  17.206
  303    HA   GLU  41           HA       GLU  41  -5.017  17.781  17.781
  304   1HB   GLU  41           HB1      GLU  41  -7.215  19.070  19.070
  305   2HB   GLU  41           HB2      GLU  41  -6.489  19.890  19.890
  306   1HG   GLU  41           HG1      GLU  41  -7.906  17.183  17.183
  307   2HG   GLU  41           HG2      GLU  41  -8.608  18.711  18.711
  308    H    MET  42           HN       MET  42  -5.776  19.337  19.337
  309    HA   MET  42           HA       MET  42  -4.026  21.462  21.462
  310   1HB   MET  42           HB1      MET  42  -4.761  19.575  19.575
  311   2HB   MET  42           HB2      MET  42  -3.892  21.082  21.082
  312   1HG   MET  42           HG1      MET  42  -6.633  20.853  20.853
  313   2HG   MET  42           HG2      MET  42  -6.376  21.351  21.351
  314   1HE   MET  42           HE1      MET  42  -5.778  22.167  22.167
  315   2HE   MET  42           HE2      MET  42  -7.437  22.600  22.600
  316   3HE   MET  42           HE3      MET  42  -6.280  23.839  23.839
  317    H    TRP  43           HN       TRP  43  -3.327  18.185  18.185
  318    HA   TRP  43           HA       TRP  43  -0.718  18.305  18.305
  319   1HB   TRP  43           HB1      TRP  43  -2.055  16.360  16.360
  320   2HB   TRP  43           HB2      TRP  43  -2.317  16.256  16.256
  321    HD1  TRP  43           HD1      TRP  43  -0.803  14.725  14.725
  322    HE1  TRP  43           HE1      TRP  43   1.430  13.727  13.727
  323    HE3  TRP  43           HE3      TRP  43   0.136  16.965  16.965
  324    HZ2  TRP  43           HZ2      TRP  43   3.466  13.757  13.757
  325    HZ3  TRP  43           HZ3      TRP  43   2.155  16.479  16.479
  326    HH2  TRP  43           HH2      TRP  43   3.846  14.878  14.878
  327    H    ASN  44           HN       ASN  44  -1.911  17.805  17.805
  328    HA   ASN  44           HA       ASN  44   0.678  17.647  17.647
  329   1HB   ASN  44           HB1      ASN  44  -1.985  18.397  18.397
  330   2HB   ASN  44           HB2      ASN  44  -0.495  18.048  18.048
  331   1HD2  ASN  44          HD21      ASN  44  -2.727  14.973  14.973
  332   2HD2  ASN  44          HD22      ASN  44  -3.270  16.561  16.561
  333    H    ASN  45           HN       ASN  45  -0.876  20.287  20.287
  334    HA   ASN  45           HA       ASN  45   1.055  22.161  22.161
  335   1HB   ASN  45           HB1      ASN  45  -0.774  23.875  23.875
  336   2HB   ASN  45           HB2      ASN  45  -1.159  22.468  22.468
  337   1HD2  ASN  45          HD21      ASN  45  -4.120  21.800  21.800
  338   2HD2  ASN  45          HD22      ASN  45  -3.166  21.496  21.496
  339    H    THR  46           HN       THR  46   1.283  20.823  20.823
  340    HA   THR  46           HA       THR  46   0.493  22.678  22.678
  341    HB   THR  46           HB       THR  46   0.660  20.207  20.207
  342    HG1  THR  46           HG1      THR  46   1.250  20.952  20.952
  343   1HG2  THR  46          HG21      THR  46   2.731  19.611  19.611
  344   2HG2  THR  46          HG22      THR  46   3.715  20.517  20.517
  345   3HG2  THR  46          HG23      THR  46   2.852  19.094  19.094
  346    H    ALA  47           HN       ALA  47   3.331  21.755  21.755
  347    HA   ALA  47           HA       ALA  47   4.673  24.201  24.201
  348   1HB   ALA  47           HB1      ALA  47   5.764  22.520  22.520
  349   2HB   ALA  47           HB2      ALA  47   6.519  23.958  23.958
  350   3HB   ALA  47           HB3      ALA  47   5.004  24.085  24.085
  351    H    ALA  48           HN       ALA  48   5.256  20.921  20.921
  352    HA   ALA  48           HA       ALA  48   5.935  19.110  19.110
  353   1HB   ALA  48           HB1      ALA  48   6.334  20.598  20.598
  354   2HB   ALA  48           HB2      ALA  48   7.836  21.146  21.146
  355   3HB   ALA  48           HB3      ALA  48   7.630  19.458  19.458
  356    H    ASP  49           HN       ASP  49   7.785  21.836  21.836
  357    HA   ASP  49           HA       ASP  49  10.029  20.352  20.352
  358   1HB   ASP  49           HB1      ASP  49  10.140  22.684  22.684
  359   2HB   ASP  49           HB2      ASP  49   9.193  23.275  23.275
  360    H    ASP  50           HN       ASP  50   6.910  20.818  20.818
  361    HA   ASP  50           HA       ASP  50   7.353  20.582  20.582
  362   1HB   ASP  50           HB1      ASP  50   5.892  22.513  22.513
  363   2HB   ASP  50           HB2      ASP  50   4.828  21.378  21.378
  364    H    LYS  51           HN       LYS  51   6.800  18.871  18.871
  365    HA   LYS  51           HA       LYS  51   4.972  16.845  16.845
  366   1HB   LYS  51           HB1      LYS  51   6.550  16.857  16.857
  367   2HB   LYS  51           HB2      LYS  51   5.517  15.551  15.551
  368   1HG   LYS  51           HG1      LYS  51   3.551  17.084  17.084
  369   2HG   LYS  51           HG2      LYS  51   4.616  18.374  18.374
  370   1HD   LYS  51           HD1      LYS  51   5.297  17.029  17.029
  371   2HD   LYS  51           HD2      LYS  51   4.310  15.686  15.686
  372   1HE   LYS  51           HE1      LYS  51   2.284  16.955  16.955
  373   2HE   LYS  51           HE2      LYS  51   3.188  18.423  18.423
  374   1HZ   LYS  51           HZ1      LYS  51   4.062  16.354  16.354
  375   2HZ   LYS  51           HZ2      LYS  51   2.365  16.383  16.383
  376   3HZ   LYS  51           HZ3      LYS  51   3.247  17.780  17.780
  377    H    GLN  52           HN       GLN  52   8.210  17.184  17.184
  378    HA   GLN  52           HA       GLN  52   9.586  14.986  14.986
  379   1HB   GLN  52           HB1      GLN  52  10.333  17.635  17.635
  380   2HB   GLN  52           HB2      GLN  52  10.831  17.200  17.200
  381   1HG   GLN  52           HG1      GLN  52  12.713  16.840  16.840
  382   2HG   GLN  52           HG2      GLN  52  12.133  15.267  15.267
  383   1HE2  GLN  52          HE21      GLN  52  10.558  15.665  15.665
  384   2HE2  GLN  52          HE22      GLN  52   9.899  16.402  16.402
  385    HA   PRO  53           HA       PRO  53  10.017  14.913  14.913
  386   1HB   PRO  53           HB1      PRO  53   7.823  16.109  16.109
  387   2HB   PRO  53           HB2      PRO  53   9.403  16.852  16.852
  388   1HG   PRO  53           HG1      PRO  53   6.980  17.088  17.088
  389   2HG   PRO  53           HG2      PRO  53   7.941  18.400  18.400
  390   1HD   PRO  53           HD1      PRO  53   8.565  17.671  17.671
  391   2HD   PRO  53           HD2      PRO  53   9.907  17.761  17.761
  392    H    TYR  54           HN       TYR  54   6.766  15.073  15.073
  393    HA   TYR  54           HA       TYR  54   5.803  12.723  12.723
  394   1HB   TYR  54           HB1      TYR  54   4.603  14.292  14.292
  395   2HB   TYR  54           HB2      TYR  54   3.745  13.108  13.108
  396    HD1  TYR  54           HD1      TYR  54   4.323  13.686  13.686
  397    HD2  TYR  54           HD2      TYR  54   3.996  16.490  16.490
  398    HE1  TYR  54           HE1      TYR  54   3.778  15.448  15.448
  399    HE2  TYR  54           HE2      TYR  54   3.449  18.253  18.253
  400    HH   TYR  54           HH       TYR  54   2.385  18.289  18.289
  401    H    GLU  55           HN       GLU  55   6.524  13.500  13.500
  402    HA   GLU  55           HA       GLU  55   5.979  11.045  11.045
  403   1HB   GLU  55           HB1      GLU  55   7.409  13.513  13.513
  404   2HB   GLU  55           HB2      GLU  55   8.378  12.204  12.204
  405   1HG   GLU  55           HG1      GLU  55   6.414  11.395  11.395
  406   2HG   GLU  55           HG2      GLU  55   5.396  12.613  12.613
  407    H    LYS  56           HN       LYS  56   9.113  12.053  12.053
  408    HA   LYS  56           HA       LYS  56  10.585   9.726   9.726
  409   1HB   LYS  56           HB1      LYS  56  11.478  11.970  11.970
  410   2HB   LYS  56           HB2      LYS  56  10.714  11.758  11.758
  411   1HG   LYS  56           HG1      LYS  56  12.694  10.901  10.901
  412   2HG   LYS  56           HG2      LYS  56  12.267   9.445   9.445
  413   1HD   LYS  56           HD1      LYS  56  13.887  11.749  11.749
  414   2HD   LYS  56           HD2      LYS  56  14.539  10.227  10.227
  415   1HE   LYS  56           HE1      LYS  56  13.242   9.011   9.011
  416   2HE   LYS  56           HE2      LYS  56  12.614  10.545  10.545
  417   1HZ   LYS  56           HZ1      LYS  56  15.387  10.759  10.759
  418   2HZ   LYS  56           HZ2      LYS  56  15.031   9.321   9.321
  419   3HZ   LYS  56           HZ3      LYS  56  14.422  10.801  10.801
  420    H    LYS  57           HN       LYS  57   8.278  10.534  10.534
  421    HA   LYS  57           HA       LYS  57   8.896   8.350   8.350
  422   1HB   LYS  57           HB1      LYS  57   7.657  10.598  10.598
  423   2HB   LYS  57           HB2      LYS  57   6.238   9.809   9.809
  424   1HG   LYS  57           HG1      LYS  57   6.023   8.325   8.325
  425   2HG   LYS  57           HG2      LYS  57   7.744   8.289   8.289
  426   1HD   LYS  57           HD1      LYS  57   7.556  10.684  10.684
  427   2HD   LYS  57           HD2      LYS  57   5.818  10.578  10.578
  428   1HE   LYS  57           HE1      LYS  57   5.645   8.825   8.825
  429   2HE   LYS  57           HE2      LYS  57   7.394   8.640   8.640
  430   1HZ   LYS  57           HZ1      LYS  57   6.781  11.322  11.322
  431   2HZ   LYS  57           HZ2      LYS  57   5.781  10.376  10.376
  432   3HZ   LYS  57           HZ3      LYS  57   7.468  10.186  10.186
  433    H    ALA  58           HN       ALA  58   6.269   8.923   8.923
  434    HA   ALA  58           HA       ALA  58   4.902   6.511   6.511
  435   1HB   ALA  58           HB1      ALA  58   5.621   7.994   7.994
  436   2HB   ALA  58           HB2      ALA  58   4.338   6.806   6.806
  437   3HB   ALA  58           HB3      ALA  58   4.222   8.336   8.336
  438    H    ALA  59           HN       ALA  59   7.757   7.170   7.170
  439    HA   ALA  59           HA       ALA  59   8.156   4.632   4.632
  440   1HB   ALA  59           HB1      ALA  59   9.604   6.611   6.611
  441   2HB   ALA  59           HB2      ALA  59  10.317   6.485   6.485
  442   3HB   ALA  59           HB3      ALA  59  10.579   5.211   5.211
  443    H    LYS  60           HN       LYS  60   9.790   5.721   5.721
  444    HA   LYS  60           HA       LYS  60  11.034   3.603   3.603
  445   1HB   LYS  60           HB1      LYS  60  10.745   5.879   5.879
  446   2HB   LYS  60           HB2      LYS  60   9.189   5.357   5.357
  447   1HG   LYS  60           HG1      LYS  60  10.326   3.483   3.483
  448   2HG   LYS  60           HG2      LYS  60  11.876   4.088   4.088
  449   1HD   LYS  60           HD1      LYS  60  11.386   6.293   6.293
  450   2HD   LYS  60           HD2      LYS  60   9.874   5.632   5.632
  451   1HE   LYS  60           HE1      LYS  60  11.138   3.866   3.866
  452   2HE   LYS  60           HE2      LYS  60  12.646   4.572   4.572
  453   1HZ   LYS  60           HZ1      LYS  60  11.125   6.625   6.625
  454   2HZ   LYS  60           HZ2      LYS  60  11.097   5.331   5.331
  455   3HZ   LYS  60           HZ3      LYS  60  12.579   5.968   5.968
  456    H    LEU  61           HN       LEU  61   7.582   4.087   4.087
  457    HA   LEU  61           HA       LEU  61   7.363   1.457   1.457
  458   1HB   LEU  61           HB1      LEU  61   4.936   2.076   2.076
  459   2HB   LEU  61           HB2      LEU  61   6.052   3.240   3.240
  460    HG   LEU  61           HG       LEU  61   5.830   4.312   4.312
  461   1HD1  LEU  61          HD11      LEU  61   4.207   2.556   2.556
  462   2HD1  LEU  61          HD12      LEU  61   3.133   2.988   2.988
  463   3HD1  LEU  61          HD13      LEU  61   3.491   4.149   4.149
  464   1HD2  LEU  61          HD21      LEU  61   3.890   4.732   4.732
  465   2HD2  LEU  61          HD22      LEU  61   5.473   5.471   5.471
  466   3HD2  LEU  61          HD23      LEU  61   4.191   5.856   5.856
  467    H    LYS  62           HN       LYS  62   6.259   2.812   2.812
  468    HA   LYS  62           HA       LYS  62   4.797   0.681   0.681
  469   1HB   LYS  62           HB1      LYS  62   5.351   2.884   2.884
  470   2HB   LYS  62           HB2      LYS  62   6.956   2.260   2.260
  471   1HG   LYS  62           HG1      LYS  62   5.713   0.240   0.240
  472   2HG   LYS  62           HG2      LYS  62   4.295   1.263   1.263
  473   1HD   LYS  62           HD1      LYS  62   5.287   1.653   1.653
  474   2HD   LYS  62           HD2      LYS  62   5.663   3.068   3.068
  475   1HE   LYS  62           HE1      LYS  62   7.950   2.171   2.171
  476   2HE   LYS  62           HE2      LYS  62   7.551   0.722   0.722
  477   1HZ   LYS  62           HZ1      LYS  62   6.965   2.892   2.892
  478   2HZ   LYS  62           HZ2      LYS  62   8.508   3.161   3.161
  479   3HZ   LYS  62           HZ3      LYS  62   8.186   1.730   1.730
  480    H    GLU  63           HN       GLU  63   8.212   1.243   1.243
  481    HA   GLU  63           HA       GLU  63   9.246  -1.061  -1.061
  482   1HB   GLU  63           HB1      GLU  63  10.545   1.046   1.046
  483   2HB   GLU  63           HB2      GLU  63  10.365   0.743   0.743
  484   1HG   GLU  63           HG1      GLU  63  11.791  -1.348  -1.348
  485   2HG   GLU  63           HG2      GLU  63  12.622   0.142   0.142
  486    H    LYS  64           HN       LYS  64   8.477  -0.372  -0.372
  487    HA   LYS  64           HA       LYS  64   9.333  -2.803  -2.803
  488   1HB   LYS  64           HB1      LYS  64   8.115  -0.530  -0.530
  489   2HB   LYS  64           HB2      LYS  64   6.770  -1.645  -1.645
  490   1HG   LYS  64           HG1      LYS  64   7.878  -1.808  -1.808
  491   2HG   LYS  64           HG2      LYS  64   8.347  -3.256  -3.256
  492   1HD   LYS  64           HD1      LYS  64  10.491  -2.118  -2.118
  493   2HD   LYS  64           HD2      LYS  64   9.998  -0.688  -0.688
  494   1HE   LYS  64           HE1      LYS  64  10.479  -3.415  -3.415
  495   2HE   LYS  64           HE2      LYS  64  11.592  -2.057  -2.057
  496   1HZ   LYS  64           HZ1      LYS  64   9.051  -1.208  -1.208
  497   2HZ   LYS  64           HZ2      LYS  64   9.473  -2.610  -2.610
  498   3HZ   LYS  64           HZ3      LYS  64  10.502  -1.258  -1.258
  499    H    TYR  65           HN       TYR  65   6.196  -1.978  -1.978
  500    HA   TYR  65           HA       TYR  65   4.735  -4.338  -4.338
  501   1HB   TYR  65           HB1      TYR  65   3.471  -2.516  -2.516
  502   2HB   TYR  65           HB2      TYR  65   4.710  -1.968  -1.968
  503    HD1  TYR  65           HD1      TYR  65   2.667  -5.138  -5.138
  504    HD2  TYR  65           HD2      TYR  65   3.749  -1.662  -1.662
  505    HE1  TYR  65           HE1      TYR  65   1.333  -5.876  -5.876
  506    HE2  TYR  65           HE2      TYR  65   2.401  -2.430  -2.430
  507    HH   TYR  65           HH       TYR  65   0.102  -4.458  -4.458
  508    H    GLU  66           HN       GLU  66   6.510  -3.432  -3.432
  509    HA   GLU  66           HA       GLU  66   6.190  -5.826  -5.826
  510   1HB   GLU  66           HB1      GLU  66   8.672  -4.123  -4.123
  511   2HB   GLU  66           HB2      GLU  66   8.126  -5.180  -5.180
  512   1HG   GLU  66           HG1      GLU  66   5.921  -3.711  -3.711
  513   2HG   GLU  66           HG2      GLU  66   6.879  -2.589  -2.589
  514    H    LYS  67           HN       LYS  67   8.260  -5.209  -5.209
  515    HA   LYS  67           HA       LYS  67   9.900  -7.608  -7.608
  516   1HB   LYS  67           HB1      LYS  67  10.024  -5.228  -5.228
  517   2HB   LYS  67           HB2      LYS  67  10.674  -6.706  -6.706
  518   1HG   LYS  67           HG1      LYS  67  12.438  -5.597  -5.597
  519   2HG   LYS  67           HG2      LYS  67  12.046  -6.984  -6.984
  520   1HD   LYS  67           HD1      LYS  67  10.799  -5.487  -5.487
  521   2HD   LYS  67           HD2      LYS  67  11.219  -4.104  -4.104
  522   1HE   LYS  67           HE1      LYS  67  13.214  -5.923  -5.923
  523   2HE   LYS  67           HE2      LYS  67  12.786  -4.292  -4.292
  524   1HZ   LYS  67           HZ1      LYS  67  13.515  -4.212  -4.212
  525   2HZ   LYS  67           HZ2      LYS  67  14.704  -5.092  -5.092
  526   3HZ   LYS  67           HZ3      LYS  67  14.306  -3.517  -3.517
  527    H    ASP  68           HN       ASP  68   7.169  -6.755  -6.755
  528    HA   ASP  68           HA       ASP  68   7.149  -8.836  -8.836
  529   1HB   ASP  68           HB1      ASP  68   6.264  -6.459  -6.459
  530   2HB   ASP  68           HB2      ASP  68   4.885  -6.978  -6.978
  531    H    ILE  69           HN       ILE  69   6.068  -8.103  -8.103
  532    HA   ILE  69           HA       ILE  69   4.190 -10.365 -10.365
  533    HB   ILE  69           HB       ILE  69   3.559  -8.424  -8.424
  534   1HG1  ILE  69          HG11      ILE  69   3.177  -9.397  -9.397
  535   2HG1  ILE  69          HG12      ILE  69   4.591 -10.431 -10.431
  536   1HG2  ILE  69          HG21      ILE  69   5.758  -7.507  -7.507
  537   2HG2  ILE  69          HG22      ILE  69   6.169  -8.753  -8.753
  538   3HG2  ILE  69          HG23      ILE  69   4.895  -7.596  -7.596
  539   1HD1  ILE  69          HD11      ILE  69   2.208 -10.612 -10.612
  540   2HD1  ILE  69          HD12      ILE  69   2.445 -11.660 -11.660
  541   3HD1  ILE  69          HD13      ILE  69   3.546 -11.727 -11.727
  542    H    ALA  70           HN       ALA  70   7.255  -9.364  -9.364
  543    HA   ALA  70           HA       ALA  70   7.972 -11.720 -11.720
  544   1HB   ALA  70           HB1      ALA  70   9.811  -9.913  -9.913
  545   2HB   ALA  70           HB2      ALA  70  10.356 -11.022 -11.022
  546   3HB   ALA  70           HB3      ALA  70   9.382  -9.625  -9.625
  547    H    ALA  71           HN       ALA  71   8.018 -10.837 -10.837
  548    HA   ALA  71           HA       ALA  71   9.288 -13.260 -13.260
  549   1HB   ALA  71           HB1      ALA  71   7.647 -11.164 -11.164
  550   2HB   ALA  71           HB2      ALA  71   8.626 -12.411 -12.411
  551   3HB   ALA  71           HB3      ALA  71   9.397 -11.153 -11.153
  552    H    TYR  72           HN       TYR  72   5.992 -12.009 -12.009
  553    HA   TYR  72           HA       TYR  72   4.519 -14.025 -14.025
  554   1HB   TYR  72           HB1      TYR  72   3.483 -11.992 -11.992
  555   2HB   TYR  72           HB2      TYR  72   3.922 -12.283 -12.283
  556    HD1  TYR  72           HD1      TYR  72   2.667 -13.988 -13.988
  557    HD2  TYR  72           HD2      TYR  72   1.546 -12.990 -12.990
  558    HE1  TYR  72           HE1      TYR  72   0.487 -15.058 -15.058
  559    HE2  TYR  72           HE2      TYR  72  -0.629 -14.058 -14.058
  560    HH   TYR  72           HH       TYR  72  -2.063 -14.827 -14.827
  561    H    ARG  73           HN       ARG  73   5.525 -13.852 -13.852
  562    HA   ARG  73           HA       ARG  73   4.365 -16.297 -16.297
  563   1HB   ARG  73           HB1      ARG  73   6.785 -14.747 -14.747
  564   2HB   ARG  73           HB2      ARG  73   6.068 -16.093 -16.093
  565   1HG   ARG  73           HG1      ARG  73   3.901 -14.826 -14.826
  566   2HG   ARG  73           HG2      ARG  73   4.685 -13.466 -13.466
  567   1HD   ARG  73           HD1      ARG  73   6.337 -13.339 -13.339
  568   2HD   ARG  73           HD2      ARG  73   5.545 -14.699 -14.699
  569    HE   ARG  73           HE       ARG  73   4.210 -12.063 -12.063
  570   1HH1  ARG  73          HH11      ARG  73   2.133 -13.767 -13.767
  571   2HH1  ARG  73          HH12      ARG  73   2.122 -13.921 -13.921
  572   1HH2  ARG  73          HH21      ARG  73   5.410 -12.740 -12.740
  573   2HH2  ARG  73          HH22      ARG  73   4.034 -13.322 -13.322
  574    H    ALA  74           HN       ALA  74   7.278 -15.314 -15.314
  575    HA   ALA  74           HA       ALA  74   8.402 -18.054 -18.054
  576   1HB   ALA  74           HB1      ALA  74   9.776 -16.187 -16.187
  577   2HB   ALA  74           HB2      ALA  74   9.555 -15.360 -15.360
  578   3HB   ALA  74           HB3      ALA  74  10.479 -16.858 -16.858
  579    H    LYS  75           HN       LYS  75   6.115 -17.409 -17.409
  580    HA   LYS  75           HA       LYS  75   5.299 -17.790 -17.790
  581   1HB   LYS  75           HB1      LYS  75   6.740 -19.836 -19.836
  582   2HB   LYS  75           HB2      LYS  75   8.104 -18.989 -18.989
  583   1HG   LYS  75           HG1      LYS  75   6.852 -18.603 -18.603
  584   2HG   LYS  75           HG2      LYS  75   5.444 -19.388 -19.388
  585   1HD   LYS  75           HD1      LYS  75   8.061 -20.906 -20.906
  586   2HD   LYS  75           HD2      LYS  75   7.118 -20.717 -20.717
  587   1HE   LYS  75           HE1      LYS  75   6.479 -22.827 -22.827
  588   2HE   LYS  75           HE2      LYS  75   5.132 -21.730 -21.730
  589   1HZ   LYS  75           HZ1      LYS  75   6.875 -21.503 -21.503
  590   2HZ   LYS  75           HZ2      LYS  75   6.515 -23.135 -23.135
  591   3HZ   LYS  75           HZ3      LYS  75   5.256 -22.020 -22.020
  592    H    GLY  76           HN       GLY  76   5.417 -15.505 -15.505
  593   1HA   GLY  76           HA1      GLY  76   7.414 -14.102 -14.102
  594   2HA   GLY  76           HA2      GLY  76   6.228 -13.342 -13.342
  595    H    LYS  77           HN       LYS  77   6.271 -15.546 -15.546
  596    HA   LYS  77           HA       LYS  77   3.884 -14.278 -14.278
  597   1HB   LYS  77           HB1      LYS  77   5.396 -16.790 -16.790
  598   2HB   LYS  77           HB2      LYS  77   3.855 -16.289 -16.289
  599   1HG   LYS  77           HG1      LYS  77   4.412 -17.182 -17.182
  600   2HG   LYS  77           HG2      LYS  77   3.523 -18.066 -18.066
  601   1HD   LYS  77           HD1      LYS  77   2.182 -15.566 -15.566
  602   2HD   LYS  77           HD2      LYS  77   2.605 -15.906 -15.906
  603   1HE   LYS  77           HE1      LYS  77   0.411 -16.868 -16.868
  604   2HE   LYS  77           HE2      LYS  77   1.545 -18.195 -18.195
  605   1HZ   LYS  77           HZ1      LYS  77   1.565 -17.400 -17.400
  606   2HZ   LYS  77           HZ2      LYS  77  -0.047 -17.613 -17.613
  607   3HZ   LYS  77           HZ3      LYS  77   1.068 -18.883 -18.883
  608    HA   PRO  78           HA       PRO  78   6.061 -12.177 -12.177
  609   1HB   PRO  78           HB1      PRO  78   4.322 -13.628 -13.628
  610   2HB   PRO  78           HB2      PRO  78   4.610 -11.889 -11.889
  611   1HG   PRO  78           HG1      PRO  78   2.296 -12.833 -12.833
  612   2HG   PRO  78           HG2      PRO  78   3.226 -11.754 -11.754
  613   1HD   PRO  78           HD1      PRO  78   3.231 -14.810 -14.810
  614   2HD   PRO  78           HD2      PRO  78   2.913 -13.723 -13.723
  615    H    ASP  79           HN       ASP  79   5.905 -15.532 -15.532
  616    HA   ASP  79           HA       ASP  79   8.409 -15.740 -15.740
  617   1HB   ASP  79           HB1      ASP  79   6.189 -17.831 -17.831
  618   2HB   ASP  79           HB2      ASP  79   7.593 -17.977 -17.977
  619    H    ALA  80           HN       ALA  80   8.880 -15.053 -15.053
  620    HA   ALA  80           HA       ALA  80   8.978 -16.467 -16.467
  621   1HB   ALA  80           HB1      ALA  80  11.378 -15.097 -15.097
  622   2HB   ALA  80           HB2      ALA  80  11.240 -15.500 -15.500
  623   3HB   ALA  80           HB3      ALA  80  10.135 -14.342 -14.342
  624    H    ALA  81           HN       ALA  81  10.979 -17.341 -17.341
  625    HA   ALA  81           HA       ALA  81  12.096 -19.683 -19.683
  626   1HB   ALA  81           HB1      ALA  81  13.714 -18.168 -18.168
  627   2HB   ALA  81           HB2      ALA  81  12.914 -18.403 -18.403
  628   3HB   ALA  81           HB3      ALA  81  13.754 -19.742 -19.742
  629   1H1   BME  16           HE1      MER  16  -7.939  10.752  10.752
  630   2H1   BME  16           HE2      MER  16  -8.106   9.618   9.618
  631   1H2   BME  16           HZ1      MER  16  -6.475  12.185  12.185
  632   2H2   BME  16           HZ2      MER  16  -5.765  10.617  10.617
  633    HO1  BME  16           HH       MER  16  -9.345  11.955  11.955

  Start of MODEL   39
    1    H    ASN   3           HN       ASN   3   0.658 -12.488 -12.488
    2    HA   ASN   3           HA       ASN   3   2.406 -13.054 -13.054
    3   1HB   ASN   3           HB1      ASN   3  -0.567 -13.606 -13.606
    4   2HB   ASN   3           HB2      ASN   3   0.364 -14.284 -14.284
    5   1HD2  ASN   3          HD21      ASN   3   1.363 -16.996 -16.996
    6   2HD2  ASN   3          HD22      ASN   3   0.971 -16.404 -16.404
    7    H    ALA   4           HN       ALA   4   1.868 -12.380 -12.380
    8    HA   ALA   4           HA       ALA   4   1.783 -10.472 -10.472
    9   1HB   ALA   4           HB1      ALA   4  -0.117 -11.930 -11.930
   10   2HB   ALA   4           HB2      ALA   4  -1.094 -11.103 -11.103
   11   3HB   ALA   4           HB3      ALA   4  -0.563 -10.246 -10.246
   12    HA   PRO   5           HA       PRO   5   1.409  -7.071  -7.071
   13   1HB   PRO   5           HB1      PRO   5   3.827  -6.353  -6.353
   14   2HB   PRO   5           HB2      PRO   5   3.566  -6.187  -6.187
   15   1HG   PRO   5           HG1      PRO   5   5.096  -8.214  -8.214
   16   2HG   PRO   5           HG2      PRO   5   3.862  -8.541  -8.541
   17   1HD   PRO   5           HD1      PRO   5   3.648  -9.018  -9.018
   18   2HD   PRO   5           HD2      PRO   5   3.283 -10.144 -10.144
   19    H    LYS   6           HN       LYS   6  -0.266  -6.015  -6.015
   20    HA   LYS   6           HA       LYS   6  -0.949  -5.411  -5.411
   21   1HB   LYS   6           HB1      LYS   6  -2.096  -3.465  -3.465
   22   2HB   LYS   6           HB2      LYS   6  -2.910  -4.584  -4.584
   23   1HG   LYS   6           HG1      LYS   6  -3.576  -5.329  -5.329
   24   2HG   LYS   6           HG2      LYS   6  -2.254  -6.420  -6.420
   25   1HD   LYS   6           HD1      LYS   6  -0.700  -4.862  -4.862
   26   2HD   LYS   6           HD2      LYS   6  -2.099  -3.889  -3.889
   27   1HE   LYS   6           HE1      LYS   6  -1.825  -6.835  -6.835
   28   2HE   LYS   6           HE2      LYS   6  -1.549  -5.497  -5.497
   29   1HZ   LYS   6           HZ1      LYS   6  -4.034  -5.097  -5.097
   30   2HZ   LYS   6           HZ2      LYS   6  -3.972  -6.714  -6.714
   31   3HZ   LYS   6           HZ3      LYS   6  -3.688  -5.462  -5.462
   32    H    ARG   7           HN       ARG   7  -1.511  -2.824  -2.824
   33    HA   ARG   7           HA       ARG   7   1.189  -1.633  -1.633
   34   1HB   ARG   7           HB1      ARG   7  -0.147   0.036   0.036
   35   2HB   ARG   7           HB2      ARG   7   0.695  -1.408  -1.408
   36   1HG   ARG   7           HG1      ARG   7  -1.419  -1.461  -1.461
   37   2HG   ARG   7           HG2      ARG   7  -1.463  -2.699  -2.699
   38   1HD   ARG   7           HD1      ARG   7  -3.594  -1.516  -1.516
   39   2HD   ARG   7           HD2      ARG   7  -2.800  -1.148  -1.148
   40    HE   ARG   7           HE       ARG   7  -2.345   0.755   0.755
   41   1HH1  ARG   7          HH11      ARG   7  -1.832   1.748   1.748
   42   2HH1  ARG   7          HH12      ARG   7  -3.304   2.543   2.543
   43   1HH2  ARG   7          HH21      ARG   7  -5.168   0.929   0.929
   44   2HH2  ARG   7          HH22      ARG   7  -5.243   2.066   2.066
   45    HA   PRO   8           HA       PRO   8  -0.207   1.101   1.101
   46   1HB   PRO   8           HB1      PRO   8   2.101   2.509   2.509
   47   2HB   PRO   8           HB2      PRO   8   2.059   0.763   0.763
   48   1HG   PRO   8           HG1      PRO   8   2.848   2.233   2.233
   49   2HG   PRO   8           HG2      PRO   8   3.835   1.097   1.097
   50   1HD   PRO   8           HD1      PRO   8   2.362   0.203   0.203
   51   2HD   PRO   8           HD2      PRO   8   2.481  -0.776  -0.776
   52    HA   PRO   9           HA       PRO   9  -1.222   5.515   5.515
   53   1HB   PRO   9           HB1      PRO   9   1.385   6.514   6.514
   54   2HB   PRO   9           HB2      PRO   9  -0.211   6.736   6.736
   55   1HG   PRO   9           HG1      PRO   9   1.829   4.610   4.610
   56   2HG   PRO   9           HG2      PRO   9   0.607   5.306   5.306
   57   1HD   PRO   9           HD1      PRO   9   0.200   2.851   2.851
   58   2HD   PRO   9           HD2      PRO   9  -1.165   3.985   3.985
   59    H    SER  10           HN       SER  10  -0.341   7.472   7.472
   60    HA   SER  10           HA       SER  10   0.942   6.643   6.643
   61   1HB   SER  10           HB1      SER  10  -1.367   7.465   7.465
   62   2HB   SER  10           HB2      SER  10  -0.908   8.989   8.989
   63    HG   SER  10           HG       SER  10  -0.128   9.590   9.590
   64    H    ALA  11           HN       ALA  11   0.778   9.387   9.387
   65    HA   ALA  11           HA       ALA  11   3.261  10.174  10.174
   66   1HB   ALA  11           HB1      ALA  11   2.629  11.329  11.329
   67   2HB   ALA  11           HB2      ALA  11   3.966  11.796  11.796
   68   3HB   ALA  11           HB3      ALA  11   3.950  10.208  10.208
   69    H    PHE  12           HN       PHE  12   0.504  11.149  11.149
   70    HA   PHE  12           HA       PHE  12   0.050  13.724  13.724
   71   1HB   PHE  12           HB1      PHE  12  -1.104  13.723  13.723
   72   2HB   PHE  12           HB2      PHE  12  -1.039  11.944  11.944
   73    HD1  PHE  12           HD1      PHE  12  -3.138  13.722  13.722
   74    HD2  PHE  12           HD2      PHE  12  -2.917  11.728  11.728
   75    HE1  PHE  12           HE1      PHE  12  -5.579  13.588  13.588
   76    HE2  PHE  12           HE2      PHE  12  -5.358  11.607  11.607
   77    HZ   PHE  12           HZ       PHE  12  -6.702  12.532  12.532
   78    H    PHE  13           HN       PHE  13  -0.905  10.415  10.415
   79    HA   PHE  13           HA       PHE  13  -2.974  10.632  10.632
   80   1HB   PHE  13           HB1      PHE  13  -1.727   8.525   8.525
   81   2HB   PHE  13           HB2      PHE  13  -0.578   8.870   8.870
   82    HD1  PHE  13           HD1      PHE  13  -1.564   9.150   9.150
   83    HD2  PHE  13           HD2      PHE  13  -3.793   7.501   7.501
   84    HE1  PHE  13           HE1      PHE  13  -3.177   8.199   8.199
   85    HE2  PHE  13           HE2      PHE  13  -5.400   6.550   6.550
   86    HZ   PHE  13           HZ       PHE  13  -5.094   6.896   6.896
   87    H    LEU  14           HN       LEU  14   0.465  11.051  11.051
   88    HA   LEU  14           HA       LEU  14   0.137  11.586  11.586
   89   1HB   LEU  14           HB1      LEU  14   2.222  12.791  12.791
   90   2HB   LEU  14           HB2      LEU  14   2.374  12.718  12.718
   91    HG   LEU  14           HG       LEU  14   3.830  11.098  11.098
   92   1HD1  LEU  14          HD11      LEU  14   2.502   9.970   9.970
   93   2HD1  LEU  14          HD12      LEU  14   1.368   9.390   9.390
   94   3HD1  LEU  14          HD13      LEU  14   3.032   8.834   8.834
   95   1HD2  LEU  14          HD21      LEU  14   1.963  10.092  10.092
   96   2HD2  LEU  14          HD22      LEU  14   3.439  11.026  11.026
   97   3HD2  LEU  14          HD23      LEU  14   3.513   9.392   9.392
   98    H    PHE  15           HN       PHE  15   0.653  13.870  13.870
   99    HA   PHE  15           HA       PHE  15   0.094  16.298  16.298
  100   1HB   PHE  15           HB1      PHE  15   1.050  16.491  16.491
  101   2HB   PHE  15           HB2      PHE  15   0.120  15.117  15.117
  102    HD1  PHE  15           HD1      PHE  15   0.043  18.814  18.814
  103    HD2  PHE  15           HD2      PHE  15  -1.827  15.383  15.383
  104    HE1  PHE  15           HE1      PHE  15  -1.380  20.262  20.262
  105    HE2  PHE  15           HE2      PHE  15  -3.230  16.836  16.836
  106    HZ   PHE  15           HZ       PHE  15  -3.002  19.267  19.267
  107    H    CYS  16           HN       MER  16  -2.251  14.234  14.234
  108    HA   CYS  16           HA       MER  16  -4.599  15.679  15.679
  109   1HB   CYS  16           HB1      MER  16  -4.742  13.515  13.515
  110   2HB   CYS  16           HB2      MER  16  -4.220  12.651  12.651
  111    H    SER  17           HN       SER  17  -3.366  13.240  13.240
  112    HA   SER  17           HA       SER  17  -5.159  13.474  13.474
  113   1HB   SER  17           HB1      SER  17  -2.134  13.049  13.049
  114   2HB   SER  17           HB2      SER  17  -3.333  12.725  12.725
  115    HG   SER  17           HG       SER  17  -2.731  11.309  11.309
  116    H    GLU  18           HN       GLU  18  -2.167  15.200  15.200
  117    HA   GLU  18           HA       GLU  18  -1.958  16.831  16.831
  118   1HB   GLU  18           HB1      GLU  18  -0.492  16.743  16.743
  119   2HB   GLU  18           HB2      GLU  18  -1.636  17.814  17.814
  120   1HG   GLU  18           HG1      GLU  18  -1.287  19.558  19.558
  121   2HG   GLU  18           HG2      GLU  18  -0.136  18.534  18.534
  122    H    TYR  19           HN       TYR  19  -4.019  17.622  17.622
  123    HA   TYR  19           HA       TYR  19  -5.591  19.382  19.382
  124   1HB   TYR  19           HB1      TYR  19  -5.559  21.197  21.197
  125   2HB   TYR  19           HB2      TYR  19  -3.873  20.643  20.643
  126    HD1  TYR  19           HD1      TYR  19  -3.542  18.494  18.494
  127    HD2  TYR  19           HD2      TYR  19  -6.000  21.945  21.945
  128    HE1  TYR  19           HE1      TYR  19  -3.479  18.348  18.348
  129    HE2  TYR  19           HE2      TYR  19  -5.942  21.812  21.812
  130    HH   TYR  19           HH       TYR  19  -4.285  20.824  20.824
  131    H    ARG  20           HN       ARG  20  -6.328  16.840  16.840
  132    HA   ARG  20           HA       ARG  20  -8.219  16.878  16.878
  133   1HB   ARG  20           HB1      ARG  20  -7.508  14.722  14.722
  134   2HB   ARG  20           HB2      ARG  20  -7.610  14.976  14.976
  135   1HG   ARG  20           HG1      ARG  20 -10.135  14.978  14.978
  136   2HG   ARG  20           HG2      ARG  20  -9.956  14.699  14.699
  137   1HD   ARG  20           HD1      ARG  20  -8.859  12.540  12.540
  138   2HD   ARG  20           HD2      ARG  20  -8.855  12.869  12.869
  139    HE   ARG  20           HE       ARG  20 -11.318  12.747  12.747
  140   1HH1  ARG  20          HH11      ARG  20 -12.826  12.829  12.829
  141   2HH1  ARG  20          HH12      ARG  20 -12.757  11.369  11.369
  142   1HH2  ARG  20          HH21      ARG  20  -9.741  10.351  10.351
  143   2HH2  ARG  20          HH22      ARG  20 -10.965   9.931   9.931
  144    HA   PRO  21           HA       PRO  21 -11.448  17.584  17.584
  145   1HB   PRO  21           HB1      PRO  21  -9.717  18.984  18.984
  146   2HB   PRO  21           HB2      PRO  21 -11.047  17.848  17.848
  147   1HG   PRO  21           HG1      PRO  21  -8.557  16.925  16.925
  148   2HG   PRO  21           HG2      PRO  21  -9.683  15.942  15.942
  149   1HD   PRO  21           HD1      PRO  21  -7.653  17.977  17.977
  150   2HD   PRO  21           HD2      PRO  21  -7.838  16.268  16.268
  151    H    LYS  22           HN       LYS  22  -8.838  19.877  19.877
  152    HA   LYS  22           HA       LYS  22 -10.329  22.279  22.279
  153   1HB   LYS  22           HB1      LYS  22  -7.737  21.873  21.873
  154   2HB   LYS  22           HB2      LYS  22  -7.933  21.988  21.988
  155   1HG   LYS  22           HG1      LYS  22  -9.066  24.227  24.227
  156   2HG   LYS  22           HG2      LYS  22  -8.835  24.083  24.083
  157   1HD   LYS  22           HD1      LYS  22  -7.065  25.487  25.487
  158   2HD   LYS  22           HD2      LYS  22  -6.324  23.930  23.930
  159   1HE   LYS  22           HE1      LYS  22  -6.450  23.378  23.378
  160   2HE   LYS  22           HE2      LYS  22  -7.201  24.933  24.933
  161   1HZ   LYS  22           HZ1      LYS  22  -4.864  25.339  25.339
  162   2HZ   LYS  22           HZ2      LYS  22  -4.504  24.330  24.330
  163   3HZ   LYS  22           HZ3      LYS  22  -5.226  25.847  25.847
  164    H    ILE  23           HN       ILE  23  -9.874  20.169  20.169
  165    HA   ILE  23           HA       ILE  23 -11.105  22.232  22.232
  166    HB   ILE  23           HB       ILE  23 -11.061  20.286  20.286
  167   1HG1  ILE  23          HG11      ILE  23  -9.142  19.022  19.022
  168   2HG1  ILE  23          HG12      ILE  23 -10.778  18.432  18.432
  169   1HG2  ILE  23          HG21      ILE  23  -9.492  22.168  22.168
  170   2HG2  ILE  23          HG22      ILE  23  -8.475  21.358  21.358
  171   3HG2  ILE  23          HG23      ILE  23  -8.642  20.701  20.701
  172   1HD1  ILE  23          HD11      ILE  23 -10.263  18.054  18.054
  173   2HD1  ILE  23          HD12      ILE  23  -8.607  18.572  18.572
  174   3HD1  ILE  23          HD13      ILE  23  -9.230  17.129  17.129
  175    H    LYS  24           HN       LYS  24 -11.791  19.228  19.228
  176    HA   LYS  24           HA       LYS  24 -14.332  18.630  18.630
  177   1HB   LYS  24           HB1      LYS  24 -12.765  17.277  17.277
  178   2HB   LYS  24           HB2      LYS  24 -13.065  18.278  18.278
  179   1HG   LYS  24           HG1      LYS  24 -15.522  17.700  17.700
  180   2HG   LYS  24           HG2      LYS  24 -15.243  16.655  16.655
  181   1HD   LYS  24           HD1      LYS  24 -14.039  16.306  16.306
  182   2HD   LYS  24           HD2      LYS  24 -15.403  15.402  15.402
  183   1HE   LYS  24           HE1      LYS  24 -13.921  14.521  14.521
  184   2HE   LYS  24           HE2      LYS  24 -12.549  15.341  15.341
  185   1HZ   LYS  24           HZ1      LYS  24 -13.926  13.881  13.881
  186   2HZ   LYS  24           HZ2      LYS  24 -13.593  12.859  12.859
  187   3HZ   LYS  24           HZ3      LYS  24 -12.328  13.696  13.696
  188    H    GLY  25           HN       GLY  25 -13.204  20.742  20.742
  189   1HA   GLY  25           HA1      GLY  25 -15.622  21.526  21.526
  190   2HA   GLY  25           HA2      GLY  25 -14.106  22.434  22.434
  191    H    GLU  26           HN       GLU  26 -13.703  23.000  23.000
  192    HA   GLU  26           HA       GLU  26 -15.391  25.233  25.233
  193   1HB   GLU  26           HB1      GLU  26 -13.402  23.801  23.801
  194   2HB   GLU  26           HB2      GLU  26 -14.050  25.396  25.396
  195   1HG   GLU  26           HG1      GLU  26 -12.649  24.806  24.806
  196   2HG   GLU  26           HG2      GLU  26 -11.706  25.152  25.152
  197    H    HIS  27           HN       HIS  27 -15.080  22.141  22.141
  198    HA   HIS  27           HA       HIS  27 -17.692  22.469  22.469
  199   1HB   HIS  27           HB1      HIS  27 -15.284  20.878  20.878
  200   2HB   HIS  27           HB2      HIS  27 -16.745  21.266  21.266
  201    HD1  HIS  27           HD1      HIS  27 -17.049  24.031  24.031
  202    HD2  HIS  27           HD2      HIS  27 -13.257  22.676  22.676
  203    HE1  HIS  27           HE1      HIS  27 -15.527  25.879  25.879
  204    HA   PRO  28           HA       PRO  28 -18.140  18.646  18.646
  205   1HB   PRO  28           HB1      PRO  28 -20.159  19.414  19.414
  206   2HB   PRO  28           HB2      PRO  28 -18.516  19.980  19.980
  207   1HG   PRO  28           HG1      PRO  28 -20.709  21.438  21.438
  208   2HG   PRO  28           HG2      PRO  28 -19.788  22.054  22.054
  209   1HD   PRO  28           HD1      PRO  28 -18.978  22.571  22.571
  210   2HD   PRO  28           HD2      PRO  28 -17.790  22.330  22.330
  211    H    GLY  29           HN       GLY  29 -18.756  19.130  19.130
  212   1HA   GLY  29           HA1      GLY  29 -21.461  18.016  18.016
  213   2HA   GLY  29           HA2      GLY  29 -20.811  19.257  19.257
  214    H    LEU  30           HN       LEU  30 -18.088  17.985  17.985
  215    HA   LEU  30           HA       LEU  30 -17.985  16.347  16.347
  216   1HB   LEU  30           HB1      LEU  30 -15.998  16.606  16.606
  217   2HB   LEU  30           HB2      LEU  30 -15.582  16.051  16.051
  218    HG   LEU  30           HG       LEU  30 -16.412  18.805  18.805
  219   1HD1  LEU  30          HD11      LEU  30 -13.849  17.773  17.773
  220   2HD1  LEU  30          HD12      LEU  30 -14.164  19.454  19.454
  221   3HD1  LEU  30          HD13      LEU  30 -14.067  18.262  18.262
  222   1HD2  LEU  30          HD21      LEU  30 -17.453  18.445  18.445
  223   2HD2  LEU  30          HD22      LEU  30 -16.137  19.599  19.599
  224   3HD2  LEU  30          HD23      LEU  30 -15.896  17.956  17.956
  225    H    SER  31           HN       SER  31 -17.089  14.189  14.189
  226    HA   SER  31           HA       SER  31 -18.065  12.353  12.353
  227   1HB   SER  31           HB1      SER  31 -17.775  11.801  11.801
  228   2HB   SER  31           HB2      SER  31 -18.513  10.731  10.731
  229    HG   SER  31           HG       SER  31 -20.267  11.805  11.805
  230    H    ILE  32           HN       ILE  32 -16.719  10.199  10.199
  231    HA   ILE  32           HA       ILE  32 -13.995  10.894  10.894
  232    HB   ILE  32           HB       ILE  32 -15.222   8.861   8.861
  233   1HG1  ILE  32          HG11      ILE  32 -13.431   7.155   7.155
  234   2HG1  ILE  32          HG12      ILE  32 -12.781   7.974   7.974
  235   1HG2  ILE  32          HG21      ILE  32 -15.035   7.852   7.852
  236   2HG2  ILE  32          HG22      ILE  32 -15.570   6.877   6.877
  237   3HG2  ILE  32          HG23      ILE  32 -16.507   8.272   8.272
  238   1HD1  ILE  32          HD11      ILE  32 -12.888   9.121   9.121
  239   2HD1  ILE  32          HD12      ILE  32 -11.453   8.482   8.482
  240   3HD1  ILE  32          HD13      ILE  32 -12.204   9.945   9.945
  241    H    GLY  33           HN       GLY  33 -15.586  10.693  10.693
  242   1HA   GLY  33           HA1      GLY  33 -13.160  10.066  10.066
  243   2HA   GLY  33           HA2      GLY  33 -14.807  10.037  10.037
  244    H    ASP  34           HN       ASP  34 -14.771  12.716  12.716
  245    HA   ASP  34           HA       ASP  34 -13.980  14.478  14.478
  246   1HB   ASP  34           HB1      ASP  34 -15.888  14.925  14.925
  247   2HB   ASP  34           HB2      ASP  34 -15.628  16.119  16.119
  248    H    VAL  35           HN       VAL  35 -14.014  14.011  14.011
  249    HA   VAL  35           HA       VAL  35 -12.290  16.173  16.173
  250    HB   VAL  35           HB       VAL  35 -12.787  13.448  13.448
  251   1HG1  VAL  35          HG11      VAL  35 -11.538  15.971  15.971
  252   2HG1  VAL  35          HG12      VAL  35 -11.928  14.518  14.518
  253   3HG1  VAL  35          HG13      VAL  35 -10.677  14.480  14.480
  254   1HG2  VAL  35          HG21      VAL  35 -14.013  16.150  16.150
  255   2HG2  VAL  35          HG22      VAL  35 -14.838  14.782  14.782
  256   3HG2  VAL  35          HG23      VAL  35 -14.271  14.680  14.680
  257    H    ALA  36           HN       ALA  36 -11.887  13.050  13.050
  258    HA   ALA  36           HA       ALA  36  -9.003  12.982  12.982
  259   1HB   ALA  36           HB1      ALA  36 -10.369  10.969  10.969
  260   2HB   ALA  36           HB2      ALA  36 -10.944  11.121  11.121
  261   3HB   ALA  36           HB3      ALA  36  -9.258  10.708  10.708
  262    H    LYS  37           HN       LYS  37 -11.342  13.139  13.139
  263    HA   LYS  37           HA       LYS  37  -9.267  13.294  13.294
  264   1HB   LYS  37           HB1      LYS  37 -11.458  12.457  12.457
  265   2HB   LYS  37           HB2      LYS  37 -12.213  13.960  13.960
  266   1HG   LYS  37           HG1      LYS  37 -11.267  15.195  15.195
  267   2HG   LYS  37           HG2      LYS  37 -10.131  13.910  13.910
  268   1HD   LYS  37           HD1      LYS  37 -12.024  12.502  12.502
  269   2HD   LYS  37           HD2      LYS  37 -13.172  13.747  13.747
  270   1HE   LYS  37           HE1      LYS  37 -12.670  13.846  13.846
  271   2HE   LYS  37           HE2      LYS  37 -12.158  15.317  15.317
  272   1HZ   LYS  37           HZ1      LYS  37 -10.048  13.483  13.483
  273   2HZ   LYS  37           HZ2      LYS  37 -10.626  13.536  13.536
  274   3HZ   LYS  37           HZ3      LYS  37 -10.128  14.966  14.966
  275    H    LYS  38           HN       LYS  38 -10.725  15.702  15.702
  276    HA   LYS  38           HA       LYS  38  -9.925  17.907  17.907
  277   1HB   LYS  38           HB1      LYS  38 -12.044  17.902  17.902
  278   2HB   LYS  38           HB2      LYS  38 -10.980  18.068  18.068
  279   1HG   LYS  38           HG1      LYS  38 -10.026  20.151  20.151
  280   2HG   LYS  38           HG2      LYS  38 -11.149  19.969  19.969
  281   1HD   LYS  38           HD1      LYS  38 -13.036  19.984  19.984
  282   2HD   LYS  38           HD2      LYS  38 -11.818  20.489  20.489
  283   1HE   LYS  38           HE1      LYS  38 -12.566  21.960  21.960
  284   2HE   LYS  38           HE2      LYS  38 -12.959  22.475  22.475
  285   1HZ   LYS  38           HZ1      LYS  38 -10.195  22.045  22.045
  286   2HZ   LYS  38           HZ2      LYS  38 -10.660  23.006  23.006
  287   3HZ   LYS  38           HZ3      LYS  38 -11.037  23.495  23.495
  288    H    LEU  39           HN       LEU  39  -9.168  16.690  16.690
  289    HA   LEU  39           HA       LEU  39  -6.920  18.441  18.441
  290   1HB   LEU  39           HB1      LEU  39  -7.750  17.694  17.694
  291   2HB   LEU  39           HB2      LEU  39  -8.286  16.211  16.211
  292    HG   LEU  39           HG       LEU  39  -6.008  15.452  15.452
  293   1HD1  LEU  39          HD11      LEU  39  -4.946  17.685  17.685
  294   2HD1  LEU  39          HD12      LEU  39  -5.760  17.732  17.732
  295   3HD1  LEU  39          HD13      LEU  39  -4.501  16.541  16.541
  296   1HD2  LEU  39          HD21      LEU  39  -7.399  16.102  16.102
  297   2HD2  LEU  39          HD22      LEU  39  -7.728  14.691  14.691
  298   3HD2  LEU  39          HD23      LEU  39  -6.186  14.886  14.886
  299    H    GLY  40           HN       GLY  40  -7.412  15.312  15.312
  300   1HA   GLY  40           HA1      GLY  40  -4.711  14.522  14.522
  301   2HA   GLY  40           HA2      GLY  40  -6.040  13.943  13.943
  302    H    GLU  41           HN       GLU  41  -6.782  16.570  16.570
  303    HA   GLU  41           HA       GLU  41  -4.784  16.671  16.671
  304   1HB   GLU  41           HB1      GLU  41  -6.296  18.005  18.005
  305   2HB   GLU  41           HB2      GLU  41  -7.344  17.250  17.250
  306   1HG   GLU  41           HG1      GLU  41  -7.073  19.367  19.367
  307   2HG   GLU  41           HG2      GLU  41  -6.201  20.068  20.068
  308    H    MET  42           HN       MET  42  -5.692  18.737  18.737
  309    HA   MET  42           HA       MET  42  -3.883  20.858  20.858
  310   1HB   MET  42           HB1      MET  42  -4.718  19.624  19.624
  311   2HB   MET  42           HB2      MET  42  -3.896  21.174  21.174
  312   1HG   MET  42           HG1      MET  42  -5.844  21.754  21.754
  313   2HG   MET  42           HG2      MET  42  -6.671  20.420  20.420
  314   1HE   MET  42           HE1      MET  42  -8.129  20.493  20.493
  315   2HE   MET  42           HE2      MET  42  -6.687  20.387  20.387
  316   3HE   MET  42           HE3      MET  42  -7.956  21.549  21.549
  317    H    TRP  43           HN       TRP  43  -3.420  17.739  17.739
  318    HA   TRP  43           HA       TRP  43  -0.791  17.970  17.970
  319   1HB   TRP  43           HB1      TRP  43  -2.012  15.964  15.964
  320   2HB   TRP  43           HB2      TRP  43  -2.321  15.705  15.705
  321    HD1  TRP  43           HD1      TRP  43  -0.797  14.114  14.114
  322    HE1  TRP  43           HE1      TRP  43   1.446  13.207  13.207
  323    HE3  TRP  43           HE3      TRP  43   0.172  16.747  16.747
  324    HZ2  TRP  43           HZ2      TRP  43   3.537  13.458  13.458
  325    HZ3  TRP  43           HZ3      TRP  43   2.218  16.425  16.425
  326    HH2  TRP  43           HH2      TRP  43   3.927  14.779  14.779
  327    H    ASN  44           HN       ASN  44  -2.003  17.212  17.212
  328    HA   ASN  44           HA       ASN  44   0.664  16.995  16.995
  329   1HB   ASN  44           HB1      ASN  44  -2.055  17.188  17.188
  330   2HB   ASN  44           HB2      ASN  44  -0.545  16.732  16.732
  331   1HD2  ASN  44          HD21      ASN  44  -2.642  13.868  13.868
  332   2HD2  ASN  44          HD22      ASN  44  -3.281  15.364  15.364
  333    H    ASN  45           HN       ASN  45  -0.555  19.475  19.475
  334    HA   ASN  45           HA       ASN  45   0.739  21.504  21.504
  335   1HB   ASN  45           HB1      ASN  45  -2.138  21.977  21.977
  336   2HB   ASN  45           HB2      ASN  45  -1.180  22.994  22.994
  337   1HD2  ASN  45          HD21      ASN  45  -3.576  20.207  20.207
  338   2HD2  ASN  45          HD22      ASN  45  -3.582  20.692  20.692
  339    H    THR  46           HN       THR  46   1.296  20.298  20.298
  340    HA   THR  46           HA       THR  46   0.359  22.348  22.348
  341    HB   THR  46           HB       THR  46   0.538  19.959  19.959
  342    HG1  THR  46           HG1      THR  46   2.492  20.994  20.994
  343   1HG2  THR  46          HG21      THR  46   2.673  19.255  19.255
  344   2HG2  THR  46          HG22      THR  46   3.590  20.294  20.294
  345   3HG2  THR  46          HG23      THR  46   2.700  18.936  18.936
  346    H    ALA  47           HN       ALA  47   3.430  21.196  21.196
  347    HA   ALA  47           HA       ALA  47   4.510  23.836  23.836
  348   1HB   ALA  47           HB1      ALA  47   4.821  23.594  23.594
  349   2HB   ALA  47           HB2      ALA  47   5.701  22.102  22.102
  350   3HB   ALA  47           HB3      ALA  47   6.360  23.633  23.633
  351    H    ALA  48           HN       ALA  48   5.393  20.602  20.602
  352    HA   ALA  48           HA       ALA  48   6.185  18.903  18.903
  353   1HB   ALA  48           HB1      ALA  48   6.384  20.489  20.489
  354   2HB   ALA  48           HB2      ALA  48   7.829  21.178  21.178
  355   3HB   ALA  48           HB3      ALA  48   7.815  19.493  19.493
  356    H    ASP  49           HN       ASP  49   7.648  21.673  21.673
  357    HA   ASP  49           HA       ASP  49  10.022  20.325  20.325
  358   1HB   ASP  49           HB1      ASP  49   9.217  23.072  23.072
  359   2HB   ASP  49           HB2      ASP  49   9.904  23.042  23.042
  360    H    ASP  50           HN       ASP  50   6.958  20.331  20.331
  361    HA   ASP  50           HA       ASP  50   7.403  20.386  20.386
  362   1HB   ASP  50           HB1      ASP  50   5.898  22.285  22.285
  363   2HB   ASP  50           HB2      ASP  50   4.861  21.125  21.125
  364    H    LYS  51           HN       LYS  51   6.831  18.642  18.642
  365    HA   LYS  51           HA       LYS  51   5.036  16.630  16.630
  366   1HB   LYS  51           HB1      LYS  51   6.595  16.606  16.606
  367   2HB   LYS  51           HB2      LYS  51   5.347  15.467  15.467
  368   1HG   LYS  51           HG1      LYS  51   3.700  17.318  17.318
  369   2HG   LYS  51           HG2      LYS  51   4.948  18.473  18.473
  370   1HD   LYS  51           HD1      LYS  51   3.831  17.970  17.970
  371   2HD   LYS  51           HD2      LYS  51   5.311  17.022  17.022
  372   1HE   LYS  51           HE1      LYS  51   4.088  15.044  15.044
  373   2HE   LYS  51           HE2      LYS  51   2.613  16.014  16.014
  374   1HZ   LYS  51           HZ1      LYS  51   3.793  16.274  16.274
  375   2HZ   LYS  51           HZ2      LYS  51   3.809  14.621  14.621
  376   3HZ   LYS  51           HZ3      LYS  51   2.341  15.481  15.481
  377    H    GLN  52           HN       GLN  52   8.264  16.809  16.809
  378    HA   GLN  52           HA       GLN  52   9.564  14.607  14.607
  379   1HB   GLN  52           HB1      GLN  52  10.268  17.387  17.387
  380   2HB   GLN  52           HB2      GLN  52  11.127  16.660  16.660
  381   1HG   GLN  52           HG1      GLN  52  12.522  16.593  16.593
  382   2HG   GLN  52           HG2      GLN  52  12.098  14.962  14.962
  383   1HE2  GLN  52          HE21      GLN  52   9.570  15.633  15.633
  384   2HE2  GLN  52          HE22      GLN  52   9.275  16.143  16.143
  385    HA   PRO  53           HA       PRO  53  10.145  14.811  14.811
  386   1HB   PRO  53           HB1      PRO  53   8.002  16.149  16.149
  387   2HB   PRO  53           HB2      PRO  53   9.611  16.814  16.814
  388   1HG   PRO  53           HG1      PRO  53   7.186  17.042  17.042
  389   2HG   PRO  53           HG2      PRO  53   8.204  18.356  18.356
  390   1HD   PRO  53           HD1      PRO  53   8.757  17.463  17.463
  391   2HD   PRO  53           HD2      PRO  53  10.134  17.561  17.561
  392    H    TYR  54           HN       TYR  54   6.810  15.033  15.033
  393    HA   TYR  54           HA       TYR  54   5.888  12.748  12.748
  394   1HB   TYR  54           HB1      TYR  54   4.603  14.209  14.209
  395   2HB   TYR  54           HB2      TYR  54   3.785  13.070  13.070
  396    HD1  TYR  54           HD1      TYR  54   4.317  13.748  13.748
  397    HD2  TYR  54           HD2      TYR  54   4.142  16.430  16.430
  398    HE1  TYR  54           HE1      TYR  54   3.831  15.600  15.600
  399    HE2  TYR  54           HE2      TYR  54   3.657  18.281  18.281
  400    HH   TYR  54           HH       TYR  54   4.261  18.601  18.601
  401    H    GLU  55           HN       GLU  55   6.477  13.405  13.405
  402    HA   GLU  55           HA       GLU  55   5.845  10.966  10.966
  403   1HB   GLU  55           HB1      GLU  55   7.065  13.403  13.403
  404   2HB   GLU  55           HB2      GLU  55   8.290  12.215  12.215
  405   1HG   GLU  55           HG1      GLU  55   6.600  10.935  10.935
  406   2HG   GLU  55           HG2      GLU  55   5.394  12.139  12.139
  407    H    LYS  56           HN       LYS  56   9.069  11.881  11.881
  408    HA   LYS  56           HA       LYS  56  10.483   9.595   9.595
  409   1HB   LYS  56           HB1      LYS  56  11.350  11.768  11.768
  410   2HB   LYS  56           HB2      LYS  56  10.713  11.339  11.339
  411   1HG   LYS  56           HG1      LYS  56  12.205   9.375   9.375
  412   2HG   LYS  56           HG2      LYS  56  12.761   9.675   9.675
  413   1HD   LYS  56           HD1      LYS  56  13.655  11.907  11.907
  414   2HD   LYS  56           HD2      LYS  56  13.150  11.555  11.555
  415   1HE   LYS  56           HE1      LYS  56  15.138   9.881   9.881
  416   2HE   LYS  56           HE2      LYS  56  15.567  11.045  11.045
  417   1HZ   LYS  56           HZ1      LYS  56  13.661   9.328   9.328
  418   2HZ   LYS  56           HZ2      LYS  56  14.827   8.369   8.369
  419   3HZ   LYS  56           HZ3      LYS  56  15.299   9.477   9.477
  420    H    LYS  57           HN       LYS  57   8.239  10.181  10.181
  421    HA   LYS  57           HA       LYS  57   8.891   7.808   7.808
  422   1HB   LYS  57           HB1      LYS  57   6.268   9.399   9.399
  423   2HB   LYS  57           HB2      LYS  57   6.691   8.210   8.210
  424   1HG   LYS  57           HG1      LYS  57   8.359  10.706  10.706
  425   2HG   LYS  57           HG2      LYS  57   7.037  10.633  10.633
  426   1HD   LYS  57           HD1      LYS  57   8.192   8.647   8.647
  427   2HD   LYS  57           HD2      LYS  57   9.566   8.933   8.933
  428   1HE   LYS  57           HE1      LYS  57   9.870  11.193  11.193
  429   2HE   LYS  57           HE2      LYS  57   8.419  11.015  11.015
  430   1HZ   LYS  57           HZ1      LYS  57  10.101   8.836   8.836
  431   2HZ   LYS  57           HZ2      LYS  57  11.012  10.266  10.266
  432   3HZ   LYS  57           HZ3      LYS  57   9.605  10.067  10.067
  433    H    ALA  58           HN       ALA  58   6.105   8.623   8.623
  434    HA   ALA  58           HA       ALA  58   4.856   6.154   6.154
  435   1HB   ALA  58           HB1      ALA  58   5.203   8.148   8.148
  436   2HB   ALA  58           HB2      ALA  58   3.990   6.876   6.876
  437   3HB   ALA  58           HB3      ALA  58   3.943   8.181   8.181
  438    H    ALA  59           HN       ALA  59   7.483   7.310   7.310
  439    HA   ALA  59           HA       ALA  59   7.831   5.138   5.138
  440   1HB   ALA  59           HB1      ALA  59   8.999   7.335   7.335
  441   2HB   ALA  59           HB2      ALA  59   9.965   7.004   7.004
  442   3HB   ALA  59           HB3      ALA  59  10.162   6.023   6.023
  443    H    LYS  60           HN       LYS  60   9.683   5.867   5.867
  444    HA   LYS  60           HA       LYS  60  11.197   3.655   3.655
  445   1HB   LYS  60           HB1      LYS  60  10.276   5.842   5.842
  446   2HB   LYS  60           HB2      LYS  60   9.848   4.481   4.481
  447   1HG   LYS  60           HG1      LYS  60  12.607   5.277   5.277
  448   2HG   LYS  60           HG2      LYS  60  12.079   5.328   5.328
  449   1HD   LYS  60           HD1      LYS  60  11.925   2.843   2.843
  450   2HD   LYS  60           HD2      LYS  60  12.469   2.767   2.767
  451   1HE   LYS  60           HE1      LYS  60  14.580   3.991   3.991
  452   2HE   LYS  60           HE2      LYS  60  14.042   3.894   3.894
  453   1HZ   LYS  60           HZ1      LYS  60  13.863   1.342   1.342
  454   2HZ   LYS  60           HZ2      LYS  60  15.386   1.976   1.976
  455   3HZ   LYS  60           HZ3      LYS  60  14.899   1.895   1.895
  456    H    LEU  61           HN       LEU  61   7.859   3.993   3.993
  457    HA   LEU  61           HA       LEU  61   7.593   1.316   1.316
  458   1HB   LEU  61           HB1      LEU  61   5.464   3.202   3.202
  459   2HB   LEU  61           HB2      LEU  61   5.177   1.857   1.857
  460    HG   LEU  61           HG       LEU  61   6.993   4.259   4.259
  461   1HD1  LEU  61          HD11      LEU  61   4.239   3.562   3.562
  462   2HD1  LEU  61          HD12      LEU  61   5.235   4.910   4.910
  463   3HD1  LEU  61          HD13      LEU  61   4.661   4.869   4.869
  464   1HD2  LEU  61          HD21      LEU  61   6.148   1.934   1.934
  465   2HD2  LEU  61          HD22      LEU  61   7.772   2.225   2.225
  466   3HD2  LEU  61          HD23      LEU  61   7.060   3.345   3.345
  467    H    LYS  62           HN       LYS  62   6.272   2.606   2.606
  468    HA   LYS  62           HA       LYS  62   5.365   0.305   0.305
  469   1HB   LYS  62           HB1      LYS  62   5.412   2.585   2.585
  470   2HB   LYS  62           HB2      LYS  62   7.131   2.396   2.396
  471   1HG   LYS  62           HG1      LYS  62   6.565   0.271   0.271
  472   2HG   LYS  62           HG2      LYS  62   4.871   0.686   0.686
  473   1HD   LYS  62           HD1      LYS  62   7.008   2.374   2.374
  474   2HD   LYS  62           HD2      LYS  62   5.766   1.442   1.442
  475   1HE   LYS  62           HE1      LYS  62   3.998   2.851   2.851
  476   2HE   LYS  62           HE2      LYS  62   5.265   3.824   3.824
  477   1HZ   LYS  62           HZ1      LYS  62   5.809   3.646   3.646
  478   2HZ   LYS  62           HZ2      LYS  62   4.175   4.071   4.071
  479   3HZ   LYS  62           HZ3      LYS  62   5.383   5.009   5.009
  480    H    GLU  63           HN       GLU  63   8.642   1.451   1.451
  481    HA   GLU  63           HA       GLU  63  10.041  -0.504  -0.504
  482   1HB   GLU  63           HB1      GLU  63  10.723   1.874   1.874
  483   2HB   GLU  63           HB2      GLU  63  11.339   0.803   0.803
  484   1HG   GLU  63           HG1      GLU  63  12.172   0.961   0.961
  485   2HG   GLU  63           HG2      GLU  63  13.134   1.277   1.277
  486    H    LYS  64           HN       LYS  64   9.416  -0.325  -0.325
  487    HA   LYS  64           HA       LYS  64  10.712  -2.755  -2.755
  488   1HB   LYS  64           HB1      LYS  64   9.926  -1.108  -1.108
  489   2HB   LYS  64           HB2      LYS  64   8.264  -1.369  -1.369
  490   1HG   LYS  64           HG1      LYS  64   9.782  -3.813  -3.813
  491   2HG   LYS  64           HG2      LYS  64   9.475  -2.642  -2.642
  492   1HD   LYS  64           HD1      LYS  64   7.281  -3.805  -3.805
  493   2HD   LYS  64           HD2      LYS  64   7.691  -4.425  -4.425
  494   1HE   LYS  64           HE1      LYS  64   7.211  -2.134  -2.134
  495   2HE   LYS  64           HE2      LYS  64   6.683  -1.602  -1.602
  496   1HZ   LYS  64           HZ1      LYS  64   5.376  -3.990  -3.990
  497   2HZ   LYS  64           HZ2      LYS  64   5.231  -2.970  -2.970
  498   3HZ   LYS  64           HZ3      LYS  64   4.723  -2.432  -2.432
  499    H    TYR  65           HN       TYR  65   7.367  -2.124  -2.124
  500    HA   TYR  65           HA       TYR  65   6.284  -4.700  -4.700
  501   1HB   TYR  65           HB1      TYR  65   4.692  -3.050  -3.050
  502   2HB   TYR  65           HB2      TYR  65   5.723  -2.163  -2.163
  503    HD1  TYR  65           HD1      TYR  65   4.662  -5.739  -5.739
  504    HD2  TYR  65           HD2      TYR  65   4.240  -1.810  -1.810
  505    HE1  TYR  65           HE1      TYR  65   3.344  -6.625  -6.625
  506    HE2  TYR  65           HE2      TYR  65   2.919  -2.700  -2.700
  507    HH   TYR  65           HH       TYR  65   2.860  -5.800  -5.800
  508    H    GLU  66           HN       GLU  66   7.420  -3.250  -3.250
  509    HA   GLU  66           HA       GLU  66   7.179  -5.546  -5.546
  510   1HB   GLU  66           HB1      GLU  66   8.873  -4.519  -4.519
  511   2HB   GLU  66           HB2      GLU  66   7.468  -3.572  -3.572
  512   1HG   GLU  66           HG1      GLU  66   8.818  -2.380  -2.380
  513   2HG   GLU  66           HG2      GLU  66  10.189  -3.374  -3.374
  514    H    LYS  67           HN       LYS  67   9.560  -4.960  -4.960
  515    HA   LYS  67           HA       LYS  67  11.390  -7.004  -7.004
  516   1HB   LYS  67           HB1      LYS  67  11.530  -4.838  -4.838
  517   2HB   LYS  67           HB2      LYS  67  12.420  -6.277  -6.277
  518   1HG   LYS  67           HG1      LYS  67  13.844  -4.746  -4.746
  519   2HG   LYS  67           HG2      LYS  67  13.612  -6.243  -6.243
  520   1HD   LYS  67           HD1      LYS  67  11.904  -5.095  -5.095
  521   2HD   LYS  67           HD2      LYS  67  12.152  -3.622  -3.622
  522   1HE   LYS  67           HE1      LYS  67  14.538  -3.582  -3.582
  523   2HE   LYS  67           HE2      LYS  67  14.313  -5.111  -5.111
  524   1HZ   LYS  67           HZ1      LYS  67  12.334  -3.332  -3.332
  525   2HZ   LYS  67           HZ2      LYS  67  13.836  -2.548  -2.548
  526   3HZ   LYS  67           HZ3      LYS  67  13.593  -4.027  -4.027
  527    H    ASP  68           HN       ASP  68   9.075  -6.554  -6.554
  528    HA   ASP  68           HA       ASP  68   9.578  -9.029  -9.029
  529   1HB   ASP  68           HB1      ASP  68   7.561  -6.788  -6.788
  530   2HB   ASP  68           HB2      ASP  68   7.423  -8.265  -8.265
  531    H    ILE  69           HN       ILE  69   7.777  -7.895  -7.895
  532    HA   ILE  69           HA       ILE  69   5.836 -10.120 -10.120
  533    HB   ILE  69           HB       ILE  69   5.402  -7.684  -7.684
  534   1HG1  ILE  69          HG11      ILE  69   3.594  -9.090  -9.090
  535   2HG1  ILE  69          HG12      ILE  69   3.910  -8.478  -8.478
  536   1HG2  ILE  69          HG21      ILE  69   7.295  -7.479  -7.479
  537   2HG2  ILE  69          HG22      ILE  69   6.707  -8.693  -8.693
  538   3HG2  ILE  69          HG23      ILE  69   5.833  -7.182  -7.182
  539   1HD1  ILE  69          HD11      ILE  69   5.125 -10.586 -10.586
  540   2HD1  ILE  69          HD12      ILE  69   4.761 -11.184 -11.184
  541   3HD1  ILE  69          HD13      ILE  69   3.459 -10.885 -10.885
  542    H    ALA  70           HN       ALA  70   8.644  -8.899  -8.899
  543    HA   ALA  70           HA       ALA  70   8.980 -10.980 -10.980
  544   1HB   ALA  70           HB1      ALA  70  11.121  -9.277  -9.277
  545   2HB   ALA  70           HB2      ALA  70  11.373 -10.222 -10.222
  546   3HB   ALA  70           HB3      ALA  70  10.281  -8.850  -8.850
  547    H    ALA  71           HN       ALA  71   9.566 -10.687 -10.687
  548    HA   ALA  71           HA       ALA  71  11.179 -13.131 -13.131
  549   1HB   ALA  71           HB1      ALA  71  10.041 -11.280 -11.280
  550   2HB   ALA  71           HB2      ALA  71  11.181 -12.587 -12.587
  551   3HB   ALA  71           HB3      ALA  71  11.670 -11.187 -11.187
  552    H    TYR  72           HN       TYR  72   7.962 -11.893 -11.893
  553    HA   TYR  72           HA       TYR  72   6.842 -14.080 -14.080
  554   1HB   TYR  72           HB1      TYR  72   5.590 -12.061 -12.061
  555   2HB   TYR  72           HB2      TYR  72   5.611 -12.124 -12.124
  556    HD1  TYR  72           HD1      TYR  72   4.813 -14.659 -14.659
  557    HD2  TYR  72           HD2      TYR  72   3.420 -12.522 -12.522
  558    HE1  TYR  72           HE1      TYR  72   2.719 -15.930 -15.930
  559    HE2  TYR  72           HE2      TYR  72   1.328 -13.791 -13.791
  560    HH   TYR  72           HH       TYR  72   0.235 -15.405 -15.405
  561    H    ARG  73           HN       ARG  73   6.998 -13.406 -13.406
  562    HA   ARG  73           HA       ARG  73   5.734 -15.830 -15.830
  563   1HB   ARG  73           HB1      ARG  73   6.169 -14.872 -14.872
  564   2HB   ARG  73           HB2      ARG  73   5.672 -13.565 -13.565
  565   1HG   ARG  73           HG1      ARG  73   7.503 -12.478 -12.478
  566   2HG   ARG  73           HG2      ARG  73   8.384 -13.488 -13.488
  567   1HD   ARG  73           HD1      ARG  73   9.578 -13.860 -13.860
  568   2HD   ARG  73           HD2      ARG  73   8.427 -15.190 -15.190
  569    HE   ARG  73           HE       ARG  73   6.985 -13.765 -13.765
  570   1HH1  ARG  73          HH11      ARG  73   9.441 -11.753 -11.753
  571   2HH1  ARG  73          HH12      ARG  73   9.955 -11.331 -11.331
  572   1HH2  ARG  73          HH21      ARG  73   7.956 -13.775 -13.775
  573   2HH2  ARG  73          HH22      ARG  73   9.093 -12.503 -12.503
  574    H    ALA  74           HN       ALA  74   8.935 -14.719 -14.719
  575    HA   ALA  74           HA       ALA  74  10.490 -16.577 -16.577
  576   1HB   ALA  74           HB1      ALA  74  11.423 -14.788 -14.788
  577   2HB   ALA  74           HB2      ALA  74  10.923 -15.695 -15.695
  578   3HB   ALA  74           HB3      ALA  74  12.159 -16.339 -16.339
  579    H    LYS  75           HN       LYS  75   8.886 -16.887 -16.887
  580    HA   LYS  75           HA       LYS  75   7.600 -18.760 -18.760
  581   1HB   LYS  75           HB1      LYS  75   8.419 -20.304 -20.304
  582   2HB   LYS  75           HB2      LYS  75   9.884 -20.578 -20.578
  583   1HG   LYS  75           HG1      LYS  75   8.631 -22.381 -22.381
  584   2HG   LYS  75           HG2      LYS  75   8.115 -21.167 -21.167
  585   1HD   LYS  75           HD1      LYS  75   6.113 -20.640 -20.640
  586   2HD   LYS  75           HD2      LYS  75   6.602 -21.815 -21.815
  587   1HE   LYS  75           HE1      LYS  75   6.476 -23.622 -23.622
  588   2HE   LYS  75           HE2      LYS  75   5.853 -22.421 -22.421
  589   1HZ   LYS  75           HZ1      LYS  75   4.360 -22.253 -22.253
  590   2HZ   LYS  75           HZ2      LYS  75   4.454 -23.887 -23.887
  591   3HZ   LYS  75           HZ3      LYS  75   3.856 -22.751 -22.751
  592    H    GLY  76           HN       GLY  76   8.876 -17.027 -17.027
  593   1HA   GLY  76           HA1      GLY  76  10.972 -18.339 -18.339
  594   2HA   GLY  76           HA2      GLY  76  10.644 -16.616 -16.616
  595    H    LYS  77           HN       LYS  77   9.047 -15.776 -15.776
  596    HA   LYS  77           HA       LYS  77   7.687 -15.599 -15.599
  597   1HB   LYS  77           HB1      LYS  77   6.799 -18.462 -18.462
  598   2HB   LYS  77           HB2      LYS  77   5.867 -17.264 -17.264
  599   1HG   LYS  77           HG1      LYS  77   5.108 -16.290 -16.290
  600   2HG   LYS  77           HG2      LYS  77   6.705 -16.100 -16.100
  601   1HD   LYS  77           HD1      LYS  77   5.970 -17.569 -17.569
  602   2HD   LYS  77           HD2      LYS  77   6.409 -18.784 -18.784
  603   1HE   LYS  77           HE1      LYS  77   3.631 -17.616 -17.616
  604   2HE   LYS  77           HE2      LYS  77   4.149 -19.243 -19.243
  605   1HZ   LYS  77           HZ1      LYS  77   4.704 -18.788 -18.788
  606   2HZ   LYS  77           HZ2      LYS  77   3.106 -18.294 -18.294
  607   3HZ   LYS  77           HZ3      LYS  77   3.597 -19.872 -19.872
  608    HA   PRO  78           HA       PRO  78   9.651 -18.015 -18.015
  609   1HB   PRO  78           HB1      PRO  78   7.094 -18.445 -18.445
  610   2HB   PRO  78           HB2      PRO  78   8.515 -17.504 -17.504
  611   1HG   PRO  78           HG1      PRO  78   6.240 -16.220 -16.220
  612   2HG   PRO  78           HG2      PRO  78   7.802 -15.583 -15.583
  613   1HD   PRO  78           HD1      PRO  78   5.954 -17.451 -17.451
  614   2HD   PRO  78           HD2      PRO  78   6.599 -15.864 -15.864
  615    H    ASP  79           HN       ASP  79   9.574 -19.617 -19.617
  616    HA   ASP  79           HA       ASP  79   9.309 -21.737 -21.737
  617   1HB   ASP  79           HB1      ASP  79   9.765 -22.397 -22.397
  618   2HB   ASP  79           HB2      ASP  79  10.113 -23.466 -23.466
  619    H    ALA  80           HN       ALA  80   6.997 -20.876 -20.876
  620    HA   ALA  80           HA       ALA  80   4.715 -21.288 -21.288
  621   1HB   ALA  80           HB1      ALA  80   5.007 -20.929 -20.929
  622   2HB   ALA  80           HB2      ALA  80   5.404 -22.618 -22.618
  623   3HB   ALA  80           HB3      ALA  80   3.779 -22.163 -22.163
  624    H    ALA  81           HN       ALA  81   5.239 -22.741 -22.741
  625    HA   ALA  81           HA       ALA  81   4.470 -24.485 -24.485
  626   1HB   ALA  81           HB1      ALA  81   2.417 -24.605 -24.605
  627   2HB   ALA  81           HB2      ALA  81   3.233 -25.665 -25.665
  628   3HB   ALA  81           HB3      ALA  81   2.941 -26.206 -26.206
  629   1H1   BME  16           HE1      MER  16  -8.761  11.655  11.655
  630   2H1   BME  16           HE2      MER  16  -8.581  10.053  10.053
  631   1H2   BME  16           HZ1      MER  16  -8.116   9.874   9.874
  632   2H2   BME  16           HZ2      MER  16  -6.627   9.604   9.604
  633    HO1  BME  16           HH       MER  16  -7.198  12.282  12.282

  Start of MODEL   40
    1    H    ASN   3           HN       ASN   3   2.584 -11.148 -11.148
    2    HA   ASN   3           HA       ASN   3   1.878 -12.564 -12.564
    3   1HB   ASN   3           HB1      ASN   3  -0.616 -12.531 -12.531
    4   2HB   ASN   3           HB2      ASN   3   0.440 -12.607 -12.607
    5   1HD2  ASN   3          HD21      ASN   3  -2.076  -9.497  -9.497
    6   2HD2  ASN   3          HD22      ASN   3  -2.122 -10.837 -10.837
    7    H    ALA   4           HN       ALA   4   2.764 -11.064 -11.064
    8    HA   ALA   4           HA       ALA   4   2.476 -10.702 -10.702
    9   1HB   ALA   4           HB1      ALA   4   0.182 -11.692 -11.692
   10   2HB   ALA   4           HB2      ALA   4  -0.490 -10.162 -10.162
   11   3HB   ALA   4           HB3      ALA   4   0.305 -10.242 -10.242
   12    HA   PRO   5           HA       PRO   5   2.806  -6.311  -6.311
   13   1HB   PRO   5           HB1      PRO   5   4.889  -5.635  -5.635
   14   2HB   PRO   5           HB2      PRO   5   5.145  -6.608  -6.608
   15   1HG   PRO   5           HG1      PRO   5   4.762  -7.613  -7.613
   16   2HG   PRO   5           HG2      PRO   5   6.082  -8.015  -8.015
   17   1HD   PRO   5           HD1      PRO   5   3.896  -9.625  -9.625
   18   2HD   PRO   5           HD2      PRO   5   4.632  -9.451  -9.451
   19    H    LYS   6           HN       LYS   6   0.831  -5.726  -5.726
   20    HA   LYS   6           HA       LYS   6   0.028  -5.857  -5.857
   21   1HB   LYS   6           HB1      LYS   6  -1.376  -5.656  -5.656
   22   2HB   LYS   6           HB2      LYS   6  -1.060  -3.940  -3.940
   23   1HG   LYS   6           HG1      LYS   6  -2.223  -3.727  -3.727
   24   2HG   LYS   6           HG2      LYS   6  -2.306  -5.462  -5.462
   25   1HD   LYS   6           HD1      LYS   6  -3.728  -3.890  -3.890
   26   2HD   LYS   6           HD2      LYS   6  -4.481  -4.441  -4.441
   27   1HE   LYS   6           HE1      LYS   6  -3.940  -6.824  -6.824
   28   2HE   LYS   6           HE2      LYS   6  -3.323  -6.232  -6.232
   29   1HZ   LYS   6           HZ1      LYS   6  -5.833  -5.099  -5.099
   30   2HZ   LYS   6           HZ2      LYS   6  -5.963  -6.762  -6.762
   31   3HZ   LYS   6           HZ3      LYS   6  -5.347  -6.224  -6.224
   32    H    ARG   7           HN       ARG   7  -0.717  -3.570  -3.570
   33    HA   ARG   7           HA       ARG   7   1.826  -2.093  -2.093
   34   1HB   ARG   7           HB1      ARG   7   0.902  -1.154  -1.154
   35   2HB   ARG   7           HB2      ARG   7   0.989  -2.903  -2.903
   36   1HG   ARG   7           HG1      ARG   7  -1.439  -3.039  -3.039
   37   2HG   ARG   7           HG2      ARG   7  -1.550  -1.289  -1.289
   38   1HD   ARG   7           HD1      ARG   7  -0.742  -2.950  -2.950
   39   2HD   ARG   7           HD2      ARG   7  -2.317  -2.212  -2.212
   40    HE   ARG   7           HE       ARG   7   0.239  -0.664  -0.664
   41   1HH1  ARG   7          HH11      ARG   7  -3.205   0.376   0.376
   42   2HH1  ARG   7          HH12      ARG   7  -2.912  -1.270  -1.270
   43   1HH2  ARG   7          HH21      ARG   7  -0.239   1.545   1.545
   44   2HH2  ARG   7          HH22      ARG   7  -1.675   1.988   1.988
   45    HA   PRO   8           HA       PRO   8   0.345   1.204   1.204
   46   1HB   PRO   8           HB1      PRO   8   2.508   2.817   2.817
   47   2HB   PRO   8           HB2      PRO   8   2.667   1.142   1.142
   48   1HG   PRO   8           HG1      PRO   8   3.062   2.234   2.234
   49   2HG   PRO   8           HG2      PRO   8   4.244   1.362   1.362
   50   1HD   PRO   8           HD1      PRO   8   2.658   0.008   0.008
   51   2HD   PRO   8           HD2      PRO   8   3.090  -0.691  -0.691
   52    HA   PRO   9           HA       PRO   9  -1.125   5.356   5.356
   53   1HB   PRO   9           HB1      PRO   9   1.430   6.671   6.671
   54   2HB   PRO   9           HB2      PRO   9  -0.089   6.803   6.803
   55   1HG   PRO   9           HG1      PRO   9   2.223   4.921   4.921
   56   2HG   PRO   9           HG2      PRO   9   1.145   5.676   5.676
   57   1HD   PRO   9           HD1      PRO   9   0.709   3.112   3.112
   58   2HD   PRO   9           HD2      PRO   9  -0.691   4.191   4.191
   59    H    SER  10           HN       SER  10  -0.250   7.326   7.326
   60    HA   SER  10           HA       SER  10   0.678   6.394   6.394
   61   1HB   SER  10           HB1      SER  10  -1.168   8.704   8.704
   62   2HB   SER  10           HB2      SER  10  -0.711   8.198   8.198
   63    HG   SER  10           HG       SER  10  -2.517   7.119   7.119
   64    H    ALA  11           HN       ALA  11   0.478   9.395   9.395
   65    HA   ALA  11           HA       ALA  11   2.983  10.272  10.272
   66   1HB   ALA  11           HB1      ALA  11   2.270  11.080  11.080
   67   2HB   ALA  11           HB2      ALA  11   3.621  11.678  11.678
   68   3HB   ALA  11           HB3      ALA  11   3.607  10.018  10.018
   69    H    PHE  12           HN       PHE  12  -0.008  10.922  10.922
   70    HA   PHE  12           HA       PHE  12  -0.353  13.592  13.592
   71   1HB   PHE  12           HB1      PHE  12  -1.411  13.920  13.920
   72   2HB   PHE  12           HB2      PHE  12  -1.164  12.206  12.206
   73    HD1  PHE  12           HD1      PHE  12  -3.559  14.403  14.403
   74    HD2  PHE  12           HD2      PHE  12  -2.987  10.953  10.953
   75    HE1  PHE  12           HE1      PHE  12  -5.990  14.153  14.153
   76    HE2  PHE  12           HE2      PHE  12  -5.419  10.712  10.712
   77    HZ   PHE  12           HZ       PHE  12  -6.926  12.299  12.299
   78    H    PHE  13           HN       PHE  13  -0.562  10.575  10.575
   79    HA   PHE  13           HA       PHE  13  -3.196  10.711  10.711
   80   1HB   PHE  13           HB1      PHE  13  -1.868   8.550   8.550
   81   2HB   PHE  13           HB2      PHE  13  -1.099   8.737   8.737
   82    HD1  PHE  13           HD1      PHE  13  -2.849   9.295   9.295
   83    HD2  PHE  13           HD2      PHE  13  -3.886   7.360   7.360
   84    HE1  PHE  13           HE1      PHE  13  -4.883   8.403   8.403
   85    HE2  PHE  13           HE2      PHE  13  -5.915   6.467   6.467
   86    HZ   PHE  13           HZ       PHE  13  -6.420   6.990   6.990
   87    H    LEU  14           HN       LEU  14   0.317  10.903  10.903
   88    HA   LEU  14           HA       LEU  14   0.148  11.467  11.467
   89   1HB   LEU  14           HB1      LEU  14   2.187  12.695  12.695
   90   2HB   LEU  14           HB2      LEU  14   2.386  12.550  12.550
   91    HG   LEU  14           HG       LEU  14   3.838  11.021  11.021
   92   1HD1  LEU  14          HD11      LEU  14   2.700   9.911   9.911
   93   2HD1  LEU  14          HD12      LEU  14   1.462   9.284   9.284
   94   3HD1  LEU  14          HD13      LEU  14   3.127   8.746   8.746
   95   1HD2  LEU  14          HD21      LEU  14   3.217  10.933  10.933
   96   2HD2  LEU  14          HD22      LEU  14   3.425   9.304   9.304
   97   3HD2  LEU  14          HD23      LEU  14   1.811   9.929   9.929
   98    H    PHE  15           HN       PHE  15   0.561  13.638  13.638
   99    HA   PHE  15           HA       PHE  15   0.075  16.135  16.135
  100   1HB   PHE  15           HB1      PHE  15   1.012  16.210  16.210
  101   2HB   PHE  15           HB2      PHE  15   0.040  14.835  14.835
  102    HD1  PHE  15           HD1      PHE  15  -2.352  15.272  15.272
  103    HD2  PHE  15           HD2      PHE  15   0.510  18.405  18.405
  104    HE1  PHE  15           HE1      PHE  15  -3.724  16.719  16.719
  105    HE2  PHE  15           HE2      PHE  15  -0.875  19.851  19.851
  106    HZ   PHE  15           HZ       PHE  15  -2.987  19.006  19.006
  107    H    CYS  16           HN       MER  16  -2.282  14.053  14.053
  108    HA   CYS  16           HA       MER  16  -4.529  15.655  15.655
  109   1HB   CYS  16           HB1      MER  16  -4.928  13.662  13.662
  110   2HB   CYS  16           HB2      MER  16  -4.278  12.613  12.613
  111    H    SER  17           HN       SER  17  -3.418  13.070  13.070
  112    HA   SER  17           HA       SER  17  -5.295  13.320  13.320
  113   1HB   SER  17           HB1      SER  17  -2.311  12.727  12.727
  114   2HB   SER  17           HB2      SER  17  -3.544  12.466  12.466
  115    HG   SER  17           HG       SER  17  -4.367  11.506  11.506
  116    H    GLU  18           HN       GLU  18  -2.195  14.901  14.901
  117    HA   GLU  18           HA       GLU  18  -1.970  16.424  16.424
  118   1HB   GLU  18           HB1      GLU  18  -0.408  16.416  16.416
  119   2HB   GLU  18           HB2      GLU  18  -1.515  17.443  17.443
  120   1HG   GLU  18           HG1      GLU  18   0.271  18.803  18.803
  121   2HG   GLU  18           HG2      GLU  18  -1.305  19.241  19.241
  122    H    TYR  19           HN       TYR  19  -3.958  17.448  17.448
  123    HA   TYR  19           HA       TYR  19  -5.492  19.133  19.133
  124   1HB   TYR  19           HB1      TYR  19  -5.329  21.072  21.072
  125   2HB   TYR  19           HB2      TYR  19  -3.677  20.456  20.456
  126    HD1  TYR  19           HD1      TYR  19  -3.006  18.601  18.601
  127    HD2  TYR  19           HD2      TYR  19  -5.802  21.789  21.789
  128    HE1  TYR  19           HE1      TYR  19  -2.737  18.598  18.598
  129    HE2  TYR  19           HE2      TYR  19  -5.536  21.792  21.792
  130    HH   TYR  19           HH       TYR  19  -3.124  20.614  20.614
  131    H    ARG  20           HN       ARG  20  -6.440  16.810  16.810
  132    HA   ARG  20           HA       ARG  20  -8.277  17.180  17.180
  133   1HB   ARG  20           HB1      ARG  20  -7.543  14.956  14.956
  134   2HB   ARG  20           HB2      ARG  20  -7.601  14.855  14.855
  135   1HG   ARG  20           HG1      ARG  20 -10.106  14.771  14.771
  136   2HG   ARG  20           HG2      ARG  20 -10.034  15.038  15.038
  137   1HD   ARG  20           HD1      ARG  20 -10.350  12.612  12.612
  138   2HD   ARG  20           HD2      ARG  20  -8.857  12.884  12.884
  139    HE   ARG  20           HE       ARG  20  -7.704  12.839  12.839
  140   1HH1  ARG  20          HH11      ARG  20  -9.658  12.666  12.666
  141   2HH1  ARG  20          HH12      ARG  20 -10.003  10.980  10.980
  142   1HH2  ARG  20          HH21      ARG  20  -8.582  10.135  10.135
  143   2HH2  ARG  20          HH22      ARG  20  -9.377   9.508   9.508
  144    HA   PRO  21           HA       PRO  21 -11.392  17.189  17.189
  145   1HB   PRO  21           HB1      PRO  21  -9.478  18.349  18.349
  146   2HB   PRO  21           HB2      PRO  21 -10.882  17.301  17.301
  147   1HG   PRO  21           HG1      PRO  21  -8.488  16.139  16.139
  148   2HG   PRO  21           HG2      PRO  21  -9.734  15.371  15.371
  149   1HD   PRO  21           HD1      PRO  21  -7.555  17.313  17.313
  150   2HD   PRO  21           HD2      PRO  21  -7.952  15.706  15.706
  151    H    LYS  22           HN       LYS  22  -8.826  19.535  19.535
  152    HA   LYS  22           HA       LYS  22 -10.247  21.907  21.907
  153   1HB   LYS  22           HB1      LYS  22  -7.749  21.651  21.651
  154   2HB   LYS  22           HB2      LYS  22  -7.901  21.521  21.521
  155   1HG   LYS  22           HG1      LYS  22  -8.909  23.786  23.786
  156   2HG   LYS  22           HG2      LYS  22  -8.869  23.911  23.911
  157   1HD   LYS  22           HD1      LYS  22  -6.350  23.617  23.617
  158   2HD   LYS  22           HD2      LYS  22  -6.471  23.703  23.703
  159   1HE   LYS  22           HE1      LYS  22  -7.365  25.878  25.878
  160   2HE   LYS  22           HE2      LYS  22  -5.905  25.923  25.923
  161   1HZ   LYS  22           HZ1      LYS  22  -8.055  25.428  25.428
  162   2HZ   LYS  22           HZ2      LYS  22  -8.481  26.726  26.726
  163   3HZ   LYS  22           HZ3      LYS  22  -7.059  26.799  26.799
  164    H    ILE  23           HN       ILE  23  -9.919  20.176  20.176
  165    HA   ILE  23           HA       ILE  23 -11.428  22.387  22.387
  166    HB   ILE  23           HB       ILE  23 -11.226  20.846  20.846
  167   1HG1  ILE  23          HG11      ILE  23  -9.059  19.476  19.476
  168   2HG1  ILE  23          HG12      ILE  23 -10.628  18.741  18.741
  169   1HG2  ILE  23          HG21      ILE  23  -9.880  22.873  22.873
  170   2HG2  ILE  23          HG22      ILE  23  -8.733  21.976  21.976
  171   3HG2  ILE  23          HG23      ILE  23  -8.882  21.640  21.640
  172   1HD1  ILE  23          HD11      ILE  23 -10.266  18.845  18.845
  173   2HD1  ILE  23          HD12      ILE  23  -8.673  19.542  19.542
  174   3HD1  ILE  23          HD13      ILE  23  -9.021  17.913  17.913
  175    H    LYS  24           HN       LYS  24 -11.744  19.132  19.132
  176    HA   LYS  24           HA       LYS  24 -14.272  18.484  18.484
  177   1HB   LYS  24           HB1      LYS  24 -12.406  17.067  17.067
  178   2HB   LYS  24           HB2      LYS  24 -12.773  17.569  17.569
  179   1HG   LYS  24           HG1      LYS  24 -15.057  16.504  16.504
  180   2HG   LYS  24           HG2      LYS  24 -14.761  16.107  16.107
  181   1HD   LYS  24           HD1      LYS  24 -14.316  14.084  14.084
  182   2HD   LYS  24           HD2      LYS  24 -12.746  14.727  14.727
  183   1HE   LYS  24           HE1      LYS  24 -12.567  14.090  14.090
  184   2HE   LYS  24           HE2      LYS  24 -12.731  15.832  15.832
  185   1HZ   LYS  24           HZ1      LYS  24 -15.298  14.753  14.753
  186   2HZ   LYS  24           HZ2      LYS  24 -14.376  13.943  13.943
  187   3HZ   LYS  24           HZ3      LYS  24 -14.504  15.635  15.635
  188    H    GLY  25           HN       GLY  25 -13.198  20.374  20.374
  189   1HA   GLY  25           HA1      GLY  25 -15.688  20.398  20.398
  190   2HA   GLY  25           HA2      GLY  25 -14.235  21.361  21.361
  191    H    GLU  26           HN       GLU  26 -13.867  22.556  22.556
  192    HA   GLU  26           HA       GLU  26 -15.701  24.743  24.743
  193   1HB   GLU  26           HB1      GLU  26 -13.698  23.935  23.935
  194   2HB   GLU  26           HB2      GLU  26 -14.519  25.482  25.482
  195   1HG   GLU  26           HG1      GLU  26 -12.857  24.534  24.534
  196   2HG   GLU  26           HG2      GLU  26 -12.122  25.356  25.356
  197    H    HIS  27           HN       HIS  27 -15.302  22.109  22.109
  198    HA   HIS  27           HA       HIS  27 -18.004  22.588  22.588
  199   1HB   HIS  27           HB1      HIS  27 -15.581  21.517  21.517
  200   2HB   HIS  27           HB2      HIS  27 -17.103  22.089  22.089
  201    HD1  HIS  27           HD1      HIS  27 -17.488  24.770  24.770
  202    HD2  HIS  27           HD2      HIS  27 -13.623  23.433  23.433
  203    HE1  HIS  27           HE1      HIS  27 -16.060  26.776  26.776
  204    HA   PRO  28           HA       PRO  28 -18.032  18.259  18.259
  205   1HB   PRO  28           HB1      PRO  28 -20.039  18.398  18.398
  206   2HB   PRO  28           HB2      PRO  28 -18.441  19.000  19.000
  207   1HG   PRO  28           HG1      PRO  28 -20.804  20.629  20.629
  208   2HG   PRO  28           HG2      PRO  28 -19.867  20.932  20.932
  209   1HD   PRO  28           HD1      PRO  28 -19.214  22.180  22.180
  210   2HD   PRO  28           HD2      PRO  28 -17.964  21.743  21.743
  211    H    GLY  29           HN       GLY  29 -18.947  19.729  19.729
  212   1HA   GLY  29           HA1      GLY  29 -21.366  18.205  18.205
  213   2HA   GLY  29           HA2      GLY  29 -21.270  19.925  19.925
  214    H    LEU  30           HN       LEU  30 -18.617  17.667  17.667
  215    HA   LEU  30           HA       LEU  30 -18.223  18.057  18.057
  216   1HB   LEU  30           HB1      LEU  30 -16.389  17.372  17.372
  217   2HB   LEU  30           HB2      LEU  30 -15.819  17.129  17.129
  218    HG   LEU  30           HG       LEU  30 -16.778  19.729  19.729
  219   1HD1  LEU  30          HD11      LEU  30 -13.959  18.771  18.771
  220   2HD1  LEU  30          HD12      LEU  30 -14.355  20.400  20.400
  221   3HD1  LEU  30          HD13      LEU  30 -14.651  19.046  19.046
  222   1HD2  LEU  30          HD21      LEU  30 -15.453  19.255  19.255
  223   2HD2  LEU  30          HD22      LEU  30 -17.125  19.736  19.736
  224   3HD2  LEU  30          HD23      LEU  30 -15.831  20.830  20.830
  225    H    SER  31           HN       SER  31 -17.064  15.570  15.570
  226    HA   SER  31           HA       SER  31 -18.317  13.330  13.330
  227   1HB   SER  31           HB1      SER  31 -17.913  13.532  13.532
  228   2HB   SER  31           HB2      SER  31 -18.176  11.996  11.996
  229    HG   SER  31           HG       SER  31 -20.183  12.472  12.472
  230    H    ILE  32           HN       ILE  32 -16.985  11.267  11.267
  231    HA   ILE  32           HA       ILE  32 -14.227  11.901  11.901
  232    HB   ILE  32           HB       ILE  32 -15.627  10.062  10.062
  233   1HG1  ILE  32          HG11      ILE  32 -13.889   8.284   8.284
  234   2HG1  ILE  32          HG12      ILE  32 -13.083   9.009   9.009
  235   1HG2  ILE  32          HG21      ILE  32 -16.801   9.303   9.303
  236   2HG2  ILE  32          HG22      ILE  32 -15.294   8.732   8.732
  237   3HG2  ILE  32          HG23      ILE  32 -15.961   7.946   7.946
  238   1HD1  ILE  32          HD11      ILE  32 -13.436  10.314  10.314
  239   2HD1  ILE  32          HD12      ILE  32 -11.944   9.627   9.627
  240   3HD1  ILE  32          HD13      ILE  32 -12.620  11.062  11.062
  241    H    GLY  33           HN       GLY  33 -15.846  11.863  11.863
  242   1HA   GLY  33           HA1      GLY  33 -13.664  10.936  10.936
  243   2HA   GLY  33           HA2      GLY  33 -15.369  11.100  11.100
  244    H    ASP  34           HN       ASP  34 -15.075  13.678  13.678
  245    HA   ASP  34           HA       ASP  34 -14.215  15.446  15.446
  246   1HB   ASP  34           HB1      ASP  34 -16.278  15.546  15.546
  247   2HB   ASP  34           HB2      ASP  34 -15.717  17.082  17.082
  248    H    VAL  35           HN       VAL  35 -14.173  14.985  14.985
  249    HA   VAL  35           HA       VAL  35 -12.242  16.982  16.982
  250    HB   VAL  35           HB       VAL  35 -13.001  14.336  14.336
  251   1HG1  VAL  35          HG11      VAL  35 -11.310  16.605  16.605
  252   2HG1  VAL  35          HG12      VAL  35 -11.903  15.226  15.226
  253   3HG1  VAL  35          HG13      VAL  35 -10.727  14.991  14.991
  254   1HG2  VAL  35          HG21      VAL  35 -13.737  17.200  17.200
  255   2HG2  VAL  35          HG22      VAL  35 -14.819  16.015  16.015
  256   3HG2  VAL  35          HG23      VAL  35 -14.223  15.786  15.786
  257    H    ALA  36           HN       ALA  36 -12.140  13.879  13.879
  258    HA   ALA  36           HA       ALA  36  -9.272  13.474  13.474
  259   1HB   ALA  36           HB1      ALA  36 -10.825  11.636  11.636
  260   2HB   ALA  36           HB2      ALA  36 -11.454  11.854  11.854
  261   3HB   ALA  36           HB3      ALA  36  -9.802  11.284  11.284
  262    H    LYS  37           HN       LYS  37 -11.655  14.085  14.085
  263    HA   LYS  37           HA       LYS  37  -9.682  14.003  14.003
  264   1HB   LYS  37           HB1      LYS  37 -11.966  13.451  13.451
  265   2HB   LYS  37           HB2      LYS  37 -12.550  14.947  14.947
  266   1HG   LYS  37           HG1      LYS  37 -11.486  16.258  16.258
  267   2HG   LYS  37           HG2      LYS  37 -10.793  14.813  14.813
  268   1HD   LYS  37           HD1      LYS  37 -13.082  14.014  14.014
  269   2HD   LYS  37           HD2      LYS  37 -13.782  15.366  15.366
  270   1HE   LYS  37           HE1      LYS  37 -11.974  15.661  15.661
  271   2HE   LYS  37           HE2      LYS  37 -13.726  15.795  15.795
  272   1HZ   LYS  37           HZ1      LYS  37 -12.752  17.442  17.442
  273   2HZ   LYS  37           HZ2      LYS  37 -11.857  17.764  17.764
  274   3HZ   LYS  37           HZ3      LYS  37 -13.552  17.887  17.887
  275    H    LYS  38           HN       LYS  38 -10.654  16.415  16.415
  276    HA   LYS  38           HA       LYS  38  -9.778  18.646  18.646
  277   1HB   LYS  38           HB1      LYS  38 -11.778  18.688  18.688
  278   2HB   LYS  38           HB2      LYS  38 -10.533  18.737  18.737
  279   1HG   LYS  38           HG1      LYS  38 -11.100  21.009  21.009
  280   2HG   LYS  38           HG2      LYS  38  -9.578  20.792  20.792
  281   1HD   LYS  38           HD1      LYS  38 -10.599  21.499  21.499
  282   2HD   LYS  38           HD2      LYS  38 -11.534  20.022  20.022
  283   1HE   LYS  38           HE1      LYS  38 -12.352  22.629  22.629
  284   2HE   LYS  38           HE2      LYS  38 -13.056  21.929  21.929
  285   1HZ   LYS  38           HZ1      LYS  38 -13.138  20.005  20.005
  286   2HZ   LYS  38           HZ2      LYS  38 -13.751  21.462  21.462
  287   3HZ   LYS  38           HZ3      LYS  38 -14.429  20.782  20.782
  288    H    LEU  39           HN       LEU  39  -9.149  17.131  17.131
  289    HA   LEU  39           HA       LEU  39  -6.642  18.345  18.345
  290   1HB   LEU  39           HB1      LEU  39  -8.245  17.318  17.318
  291   2HB   LEU  39           HB2      LEU  39  -7.909  15.781  15.781
  292    HG   LEU  39           HG       LEU  39  -5.705  15.966  15.966
  293   1HD1  LEU  39          HD11      LEU  39  -6.486  18.285  18.285
  294   2HD1  LEU  39          HD12      LEU  39  -4.936  17.460  17.460
  295   3HD1  LEU  39          HD13      LEU  39  -5.362  18.367  18.367
  296   1HD2  LEU  39          HD21      LEU  39  -7.780  16.024  16.024
  297   2HD2  LEU  39          HD22      LEU  39  -7.249  14.609  14.609
  298   3HD2  LEU  39          HD23      LEU  39  -6.193  15.384  15.384
  299    H    GLY  40           HN       GLY  40  -7.524  15.562  15.562
  300   1HA   GLY  40           HA1      GLY  40  -4.853  14.444  14.444
  301   2HA   GLY  40           HA2      GLY  40  -6.244  14.007  14.007
  302    H    GLU  41           HN       GLU  41  -6.898  16.628  16.628
  303    HA   GLU  41           HA       GLU  41  -5.148  16.872  16.872
  304   1HB   GLU  41           HB1      GLU  41  -7.483  17.407  17.407
  305   2HB   GLU  41           HB2      GLU  41  -7.254  18.714  18.714
  306   1HG   GLU  41           HG1      GLU  41  -5.701  19.794  19.794
  307   2HG   GLU  41           HG2      GLU  41  -6.078  18.504  18.504
  308    H    MET  42           HN       MET  42  -5.755  18.947  18.947
  309    HA   MET  42           HA       MET  42  -3.833  20.928  20.928
  310   1HB   MET  42           HB1      MET  42  -4.704  19.695  19.695
  311   2HB   MET  42           HB2      MET  42  -3.789  21.196  21.196
  312   1HG   MET  42           HG1      MET  42  -5.769  21.908  21.908
  313   2HG   MET  42           HG2      MET  42  -6.637  20.644  20.644
  314   1HE   MET  42           HE1      MET  42  -7.827  20.589  20.589
  315   2HE   MET  42           HE2      MET  42  -6.334  20.604  20.604
  316   3HE   MET  42           HE3      MET  42  -7.651  21.712  21.712
  317    H    TRP  43           HN       TRP  43  -3.532  17.755  17.755
  318    HA   TRP  43           HA       TRP  43  -0.861  17.928  17.928
  319   1HB   TRP  43           HB1      TRP  43  -2.113  16.022  16.022
  320   2HB   TRP  43           HB2      TRP  43  -2.583  15.679  15.679
  321    HD1  TRP  43           HD1      TRP  43  -1.057  14.081  14.081
  322    HE1  TRP  43           HE1      TRP  43   1.168  13.100  13.100
  323    HE3  TRP  43           HE3      TRP  43   0.021  16.586  16.586
  324    HZ2  TRP  43           HZ2      TRP  43   3.287  13.256  13.256
  325    HZ3  TRP  43           HZ3      TRP  43   2.100  16.194  16.194
  326    HH2  TRP  43           HH2      TRP  43   3.753  14.529  14.529
  327    H    ASN  44           HN       ASN  44  -2.206  17.003  17.003
  328    HA   ASN  44           HA       ASN  44   0.356  16.556  16.556
  329   1HB   ASN  44           HB1      ASN  44  -2.311  17.223  17.223
  330   2HB   ASN  44           HB2      ASN  44  -0.886  16.600  16.600
  331   1HD2  ASN  44          HD21      ASN  44  -3.336  13.942  13.942
  332   2HD2  ASN  44          HD22      ASN  44  -3.767  15.519  15.519
  333    H    ASN  45           HN       ASN  45  -0.919  19.318  19.318
  334    HA   ASN  45           HA       ASN  45   0.838  21.050  21.050
  335   1HB   ASN  45           HB1      ASN  45  -1.916  21.953  21.953
  336   2HB   ASN  45           HB2      ASN  45  -0.877  22.725  22.725
  337   1HD2  ASN  45          HD21      ASN  45  -3.597  20.054  20.054
  338   2HD2  ASN  45          HD22      ASN  45  -3.528  20.778  20.778
  339    H    THR  46           HN       THR  46   1.228  19.895  19.895
  340    HA   THR  46           HA       THR  46   0.724  22.078  22.078
  341    HB   THR  46           HB       THR  46   0.832  19.663  19.663
  342    HG1  THR  46           HG1      THR  46   1.428  20.650  20.650
  343   1HG2  THR  46          HG21      THR  46   2.879  18.895  18.895
  344   2HG2  THR  46          HG22      THR  46   3.878  19.935  19.935
  345   3HG2  THR  46          HG23      THR  46   3.014  18.599  18.599
  346    H    ALA  47           HN       ALA  47   3.501  20.713  20.713
  347    HA   ALA  47           HA       ALA  47   4.856  23.138  23.138
  348   1HB   ALA  47           HB1      ALA  47   5.982  21.582  21.582
  349   2HB   ALA  47           HB2      ALA  47   6.768  22.950  22.950
  350   3HB   ALA  47           HB3      ALA  47   5.281  23.183  23.183
  351    H    ALA  48           HN       ALA  48   5.468  19.931  19.931
  352    HA   ALA  48           HA       ALA  48   6.101  17.981  17.981
  353   1HB   ALA  48           HB1      ALA  48   5.896  19.102  19.102
  354   2HB   ALA  48           HB2      ALA  48   7.480  19.835  19.835
  355   3HB   ALA  48           HB3      ALA  48   7.328  18.095  18.095
  356    H    ASP  49           HN       ASP  49   7.520  20.577  20.577
  357    HA   ASP  49           HA       ASP  49  10.193  19.437  19.437
  358   1HB   ASP  49           HB1      ASP  49   9.256  22.332  22.332
  359   2HB   ASP  49           HB2      ASP  49  10.910  21.762  21.762
  360    H    ASP  50           HN       ASP  50   7.167  20.155  20.155
  361    HA   ASP  50           HA       ASP  50   7.849  20.108  20.108
  362   1HB   ASP  50           HB1      ASP  50   6.458  22.074  22.074
  363   2HB   ASP  50           HB2      ASP  50   5.197  20.891  20.891
  364    H    LYS  51           HN       LYS  51   7.147  18.201  18.201
  365    HA   LYS  51           HA       LYS  51   5.182  16.428  16.428
  366   1HB   LYS  51           HB1      LYS  51   6.665  16.233  16.233
  367   2HB   LYS  51           HB2      LYS  51   5.663  14.941  14.941
  368   1HG   LYS  51           HG1      LYS  51   3.729  16.568  16.568
  369   2HG   LYS  51           HG2      LYS  51   4.770  17.719  17.719
  370   1HD   LYS  51           HD1      LYS  51   5.134  16.072  16.072
  371   2HD   LYS  51           HD2      LYS  51   4.133  14.908  14.908
  372   1HE   LYS  51           HE1      LYS  51   2.196  16.232  16.232
  373   2HE   LYS  51           HE2      LYS  51   3.078  17.606  17.606
  374   1HZ   LYS  51           HZ1      LYS  51   3.601  15.294  15.294
  375   2HZ   LYS  51           HZ2      LYS  51   1.922  15.464  15.464
  376   3HZ   LYS  51           HZ3      LYS  51   2.835  16.731  16.731
  377    H    GLN  52           HN       GLN  52   8.468  16.509  16.509
  378    HA   GLN  52           HA       GLN  52   9.639  14.207  14.207
  379   1HB   GLN  52           HB1      GLN  52  10.520  17.022  17.022
  380   2HB   GLN  52           HB2      GLN  52  11.495  15.847  15.847
  381   1HG   GLN  52           HG1      GLN  52  12.526  16.086  16.086
  382   2HG   GLN  52           HG2      GLN  52  11.630  14.589  14.589
  383   1HE2  GLN  52          HE21      GLN  52   9.283  15.934  15.934
  384   2HE2  GLN  52          HE22      GLN  52   9.524  14.691  14.691
  385    HA   PRO  53           HA       PRO  53  10.050  14.691  14.691
  386   1HB   PRO  53           HB1      PRO  53   7.842  16.109  16.109
  387   2HB   PRO  53           HB2      PRO  53   9.479  16.726  16.726
  388   1HG   PRO  53           HG1      PRO  53   7.188  16.919  16.919
  389   2HG   PRO  53           HG2      PRO  53   8.202  18.234  18.234
  390   1HD   PRO  53           HD1      PRO  53   8.872  17.207  17.207
  391   2HD   PRO  53           HD2      PRO  53  10.184  17.316  17.316
  392    H    TYR  54           HN       TYR  54   6.848  14.767  14.767
  393    HA   TYR  54           HA       TYR  54   5.829  12.579  12.579
  394   1HB   TYR  54           HB1      TYR  54   4.594  14.009  14.009
  395   2HB   TYR  54           HB2      TYR  54   3.747  12.913  12.913
  396    HD1  TYR  54           HD1      TYR  54   4.139  13.647  13.647
  397    HD2  TYR  54           HD2      TYR  54   4.265  16.256  16.256
  398    HE1  TYR  54           HE1      TYR  54   3.645  15.553  15.553
  399    HE2  TYR  54           HE2      TYR  54   3.774  18.162  18.162
  400    HH   TYR  54           HH       TYR  54   4.086  18.108  18.108
  401    H    GLU  55           HN       GLU  55   6.413  13.106  13.106
  402    HA   GLU  55           HA       GLU  55   5.726  10.594  10.594
  403   1HB   GLU  55           HB1      GLU  55   6.933  13.002  13.002
  404   2HB   GLU  55           HB2      GLU  55   8.089  11.752  11.752
  405   1HG   GLU  55           HG1      GLU  55   6.253  10.467  10.467
  406   2HG   GLU  55           HG2      GLU  55   5.144  11.772  11.772
  407    H    LYS  56           HN       LYS  56   8.946  11.675  11.675
  408    HA   LYS  56           HA       LYS  56  10.428   9.372   9.372
  409   1HB   LYS  56           HB1      LYS  56  11.234  11.714  11.714
  410   2HB   LYS  56           HB2      LYS  56  10.730  11.342  11.342
  411   1HG   LYS  56           HG1      LYS  56  13.066  10.922  10.922
  412   2HG   LYS  56           HG2      LYS  56  12.346   9.327   9.327
  413   1HD   LYS  56           HD1      LYS  56  12.649   9.292   9.292
  414   2HD   LYS  56           HD2      LYS  56  13.311  10.916  10.916
  415   1HE   LYS  56           HE1      LYS  56  15.151  10.066  10.066
  416   2HE   LYS  56           HE2      LYS  56  14.524   8.436   8.436
  417   1HZ   LYS  56           HZ1      LYS  56  14.804   9.648   9.648
  418   2HZ   LYS  56           HZ2      LYS  56  16.254   9.822   9.822
  419   3HZ   LYS  56           HZ3      LYS  56  15.591   8.278   8.278
  420    H    LYS  57           HN       LYS  57   8.323  10.224  10.224
  421    HA   LYS  57           HA       LYS  57   9.105   8.105   8.105
  422   1HB   LYS  57           HB1      LYS  57   7.620  10.330  10.330
  423   2HB   LYS  57           HB2      LYS  57   6.289   9.271   9.271
  424   1HG   LYS  57           HG1      LYS  57   6.425   9.097   9.097
  425   2HG   LYS  57           HG2      LYS  57   7.226   7.641   7.641
  426   1HD   LYS  57           HD1      LYS  57   9.457   8.894   8.894
  427   2HD   LYS  57           HD2      LYS  57   8.571  10.241  10.241
  428   1HE   LYS  57           HE1      LYS  57   9.502   8.916   8.916
  429   2HE   LYS  57           HE2      LYS  57   7.754   8.714   8.714
  430   1HZ   LYS  57           HZ1      LYS  57   8.862   6.782   6.782
  431   2HZ   LYS  57           HZ2      LYS  57   9.718   6.760   6.760
  432   3HZ   LYS  57           HZ3      LYS  57   8.032   6.555   6.555
  433    H    ALA  58           HN       ALA  58   6.191   8.545   8.545
  434    HA   ALA  58           HA       ALA  58   5.050   6.031   6.031
  435   1HB   ALA  58           HB1      ALA  58   4.016   7.913   7.913
  436   2HB   ALA  58           HB2      ALA  58   5.231   7.753   7.753
  437   3HB   ALA  58           HB3      ALA  58   4.061   6.471   6.471
  438    H    ALA  59           HN       ALA  59   7.432   7.061   7.061
  439    HA   ALA  59           HA       ALA  59   7.837   4.700   4.700
  440   1HB   ALA  59           HB1      ALA  59   8.841   6.920   6.920
  441   2HB   ALA  59           HB2      ALA  59   9.914   6.821   6.821
  442   3HB   ALA  59           HB3      ALA  59  10.085   5.684   5.684
  443    H    LYS  60           HN       LYS  60   9.856   5.834   5.834
  444    HA   LYS  60           HA       LYS  60  11.488   3.661   3.661
  445   1HB   LYS  60           HB1      LYS  60  11.350   5.896   5.896
  446   2HB   LYS  60           HB2      LYS  60  10.216   5.052   5.052
  447   1HG   LYS  60           HG1      LYS  60  12.062   3.150   3.150
  448   2HG   LYS  60           HG2      LYS  60  13.121   4.357   4.357
  449   1HD   LYS  60           HD1      LYS  60  13.549   4.501   4.501
  450   2HD   LYS  60           HD2      LYS  60  12.471   5.850   5.850
  451   1HE   LYS  60           HE1      LYS  60  10.547   4.592   4.592
  452   2HE   LYS  60           HE2      LYS  60  11.507   3.122   3.122
  453   1HZ   LYS  60           HZ1      LYS  60  12.821   5.144   5.144
  454   2HZ   LYS  60           HZ2      LYS  60  11.195   5.124   5.124
  455   3HZ   LYS  60           HZ3      LYS  60  12.133   3.710   3.710
  456    H    LEU  61           HN       LEU  61   8.240   4.096   4.096
  457    HA   LEU  61           HA       LEU  61   8.251   1.541   1.541
  458   1HB   LEU  61           HB1      LEU  61   5.838   3.067   3.067
  459   2HB   LEU  61           HB2      LEU  61   5.828   1.877   1.877
  460    HG   LEU  61           HG       LEU  61   7.209   4.597   4.597
  461   1HD1  LEU  61          HD11      LEU  61   4.994   3.445   3.445
  462   2HD1  LEU  61          HD12      LEU  61   5.723   5.039   5.039
  463   3HD1  LEU  61          HD13      LEU  61   4.847   4.652   4.652
  464   1HD2  LEU  61          HD21      LEU  61   7.433   2.422   2.422
  465   2HD2  LEU  61          HD22      LEU  61   8.743   3.005   3.005
  466   3HD2  LEU  61          HD23      LEU  61   8.016   4.076   4.076
  467    H    LYS  62           HN       LYS  62   6.553   2.356   2.356
  468    HA   LYS  62           HA       LYS  62   5.743  -0.184  -0.184
  469   1HB   LYS  62           HB1      LYS  62   5.280   1.787   1.787
  470   2HB   LYS  62           HB2      LYS  62   6.982   1.985   1.985
  471   1HG   LYS  62           HG1      LYS  62   7.059  -0.081  -0.081
  472   2HG   LYS  62           HG2      LYS  62   5.486  -0.599  -0.599
  473   1HD   LYS  62           HD1      LYS  62   5.921   1.901   1.901
  474   2HD   LYS  62           HD2      LYS  62   5.573   0.333   0.333
  475   1HE   LYS  62           HE1      LYS  62   3.455   0.202   0.202
  476   2HE   LYS  62           HE2      LYS  62   3.775   1.771   1.771
  477   1HZ   LYS  62           HZ1      LYS  62   4.014   2.005   2.005
  478   2HZ   LYS  62           HZ2      LYS  62   2.548   1.222   1.222
  479   3HZ   LYS  62           HZ3      LYS  62   2.890   2.738   2.738
  480    H    GLU  63           HN       GLU  63   8.936   1.212   1.212
  481    HA   GLU  63           HA       GLU  63  10.184  -0.923  -0.923
  482   1HB   GLU  63           HB1      GLU  63  11.195   1.320   1.320
  483   2HB   GLU  63           HB2      GLU  63  11.289   1.247   1.247
  484   1HG   GLU  63           HG1      GLU  63  13.007  -0.499  -0.499
  485   2HG   GLU  63           HG2      GLU  63  12.857  -0.611  -0.611
  486    H    LYS  64           HN       LYS  64  10.232  -0.159  -0.159
  487    HA   LYS  64           HA       LYS  64  11.749  -2.406  -2.406
  488   1HB   LYS  64           HB1      LYS  64  10.833  -0.352  -0.352
  489   2HB   LYS  64           HB2      LYS  64   9.415  -1.348  -1.348
  490   1HG   LYS  64           HG1      LYS  64  10.808  -3.113  -3.113
  491   2HG   LYS  64           HG2      LYS  64  12.274  -2.239  -2.239
  492   1HD   LYS  64           HD1      LYS  64  11.344  -0.300  -0.300
  493   2HD   LYS  64           HD2      LYS  64  10.140  -1.442  -1.442
  494   1HE   LYS  64           HE1      LYS  64  11.955  -2.968  -2.968
  495   2HE   LYS  64           HE2      LYS  64  13.157  -1.835  -1.835
  496   1HZ   LYS  64           HZ1      LYS  64  11.382  -0.440  -0.440
  497   2HZ   LYS  64           HZ2      LYS  64  11.889  -1.840  -1.840
  498   3HZ   LYS  64           HZ3      LYS  64  13.037  -0.738  -0.738
  499    H    TYR  65           HN       TYR  65   8.297  -2.022  -2.022
  500    HA   TYR  65           HA       TYR  65   7.345  -4.548  -4.548
  501   1HB   TYR  65           HB1      TYR  65   5.662  -2.991  -2.991
  502   2HB   TYR  65           HB2      TYR  65   6.494  -2.282  -2.282
  503    HD1  TYR  65           HD1      TYR  65   5.490  -5.868  -5.868
  504    HD2  TYR  65           HD2      TYR  65   4.742  -2.173  -2.173
  505    HE1  TYR  65           HE1      TYR  65   3.952  -6.987  -6.987
  506    HE2  TYR  65           HE2      TYR  65   3.211  -3.301  -3.301
  507    HH   TYR  65           HH       TYR  65   3.142  -6.431  -6.431
  508    H    GLU  66           HN       GLU  66   7.916  -3.497  -3.497
  509    HA   GLU  66           HA       GLU  66   7.673  -5.740  -5.740
  510   1HB   GLU  66           HB1      GLU  66   9.956  -3.812  -3.812
  511   2HB   GLU  66           HB2      GLU  66   9.425  -4.925  -4.925
  512   1HG   GLU  66           HG1      GLU  66   7.107  -3.419  -3.419
  513   2HG   GLU  66           HG2      GLU  66   8.389  -2.290  -2.290
  514    H    LYS  67           HN       LYS  67  10.440  -5.138  -5.138
  515    HA   LYS  67           HA       LYS  67  11.890  -7.462  -7.462
  516   1HB   LYS  67           HB1      LYS  67  12.434  -5.338  -5.338
  517   2HB   LYS  67           HB2      LYS  67  13.392  -6.796  -6.796
  518   1HG   LYS  67           HG1      LYS  67  14.474  -5.057  -5.057
  519   2HG   LYS  67           HG2      LYS  67  14.143  -6.469  -6.469
  520   1HD   LYS  67           HD1      LYS  67  12.186  -5.323  -5.323
  521   2HD   LYS  67           HD2      LYS  67  12.437  -3.945  -3.945
  522   1HE   LYS  67           HE1      LYS  67  14.446  -4.927  -4.927
  523   2HE   LYS  67           HE2      LYS  67  13.369  -3.557  -3.557
  524   1HZ   LYS  67           HZ1      LYS  67  14.675  -3.269  -3.269
  525   2HZ   LYS  67           HZ2      LYS  67  15.844  -3.601  -3.601
  526   3HZ   LYS  67           HZ3      LYS  67  14.780  -2.288  -2.288
  527    H    ASP  68           HN       ASP  68   9.930  -6.799  -6.799
  528    HA   ASP  68           HA       ASP  68  10.551  -9.250  -9.250
  529   1HB   ASP  68           HB1      ASP  68   8.572  -6.991  -6.991
  530   2HB   ASP  68           HB2      ASP  68   8.698  -8.425  -8.425
  531    H    ILE  69           HN       ILE  69   8.368  -8.033  -8.033
  532    HA   ILE  69           HA       ILE  69   6.393 -10.123 -10.123
  533    HB   ILE  69           HB       ILE  69   5.569  -8.025  -8.025
  534   1HG1  ILE  69          HG11      ILE  69   4.280  -8.799  -8.799
  535   2HG1  ILE  69          HG12      ILE  69   5.458 -10.060 -10.060
  536   1HG2  ILE  69          HG21      ILE  69   7.552  -7.386  -7.386
  537   2HG2  ILE  69          HG22      ILE  69   7.244  -8.578  -8.578
  538   3HG2  ILE  69          HG23      ILE  69   6.124  -7.236  -7.236
  539   1HD1  ILE  69          HD11      ILE  69   3.781  -9.881  -9.881
  540   2HD1  ILE  69          HD12      ILE  69   3.504 -10.989 -10.989
  541   3HD1  ILE  69          HD13      ILE  69   4.933 -11.160 -11.160
  542    H    ALA  70           HN       ALA  70   8.875  -9.347  -9.347
  543    HA   ALA  70           HA       ALA  70   8.685 -11.625 -11.625
  544   1HB   ALA  70           HB1      ALA  70  11.159  -9.975  -9.975
  545   2HB   ALA  70           HB2      ALA  70  11.050 -11.037 -11.037
  546   3HB   ALA  70           HB3      ALA  70  10.062  -9.588  -9.588
  547    H    ALA  71           HN       ALA  71  10.117 -10.956 -10.956
  548    HA   ALA  71           HA       ALA  71  11.520 -13.497 -13.497
  549   1HB   ALA  71           HB1      ALA  71  12.403 -11.454 -11.454
  550   2HB   ALA  71           HB2      ALA  71  10.941 -11.332 -11.332
  551   3HB   ALA  71           HB3      ALA  71  12.039 -12.683 -12.683
  552    H    TYR  72           HN       TYR  72   8.422 -12.154 -12.154
  553    HA   TYR  72           HA       TYR  72   7.608 -14.108 -14.108
  554   1HB   TYR  72           HB1      TYR  72   6.483 -11.782 -11.782
  555   2HB   TYR  72           HB2      TYR  72   5.318 -13.125 -13.125
  556    HD1  TYR  72           HD1      TYR  72   7.508 -11.436 -11.436
  557    HD2  TYR  72           HD2      TYR  72   3.884 -13.507 -13.507
  558    HE1  TYR  72           HE1      TYR  72   6.774 -11.061 -11.061
  559    HE2  TYR  72           HE2      TYR  72   3.155 -13.140 -13.140
  560    HH   TYR  72           HH       TYR  72   4.632 -12.692 -12.692
  561    H    ARG  73           HN       ARG  73   6.686 -13.569 -13.569
  562    HA   ARG  73           HA       ARG  73   5.167 -15.870 -15.870
  563   1HB   ARG  73           HB1      ARG  73   6.937 -14.242 -14.242
  564   2HB   ARG  73           HB2      ARG  73   5.719 -15.376 -15.376
  565   1HG   ARG  73           HG1      ARG  73   5.119 -12.950 -12.950
  566   2HG   ARG  73           HG2      ARG  73   4.961 -12.946 -12.946
  567   1HD   ARG  73           HD1      ARG  73   3.521 -15.203 -15.203
  568   2HD   ARG  73           HD2      ARG  73   2.933 -13.608 -13.608
  569    HE   ARG  73           HE       ARG  73   3.198 -14.497 -14.497
  570   1HH1  ARG  73          HH11      ARG  73   2.471 -11.661 -11.661
  571   2HH1  ARG  73          HH12      ARG  73   0.742 -11.698 -11.698
  572   1HH2  ARG  73          HH21      ARG  73   0.613 -15.198 -15.198
  573   2HH2  ARG  73          HH22      ARG  73  -0.339 -13.755 -13.755
  574    H    ALA  74           HN       ALA  74   8.477 -15.240 -15.240
  575    HA   ALA  74           HA       ALA  74   9.940 -17.034 -17.034
  576   1HB   ALA  74           HB1      ALA  74  10.755 -15.614 -15.614
  577   2HB   ALA  74           HB2      ALA  74  10.016 -16.690 -16.690
  578   3HB   ALA  74           HB3      ALA  74  11.372 -17.249 -17.249
  579    H    LYS  75           HN       LYS  75   8.221 -18.048 -18.048
  580    HA   LYS  75           HA       LYS  75   7.401 -20.592 -20.592
  581   1HB   LYS  75           HB1      LYS  75   9.963 -20.962 -20.962
  582   2HB   LYS  75           HB2      LYS  75   9.760 -20.782 -20.782
  583   1HG   LYS  75           HG1      LYS  75   8.556 -22.810 -22.810
  584   2HG   LYS  75           HG2      LYS  75   8.033 -22.805 -22.805
  585   1HD   LYS  75           HD1      LYS  75   9.756 -24.519 -24.519
  586   2HD   LYS  75           HD2      LYS  75  10.419 -23.244 -23.244
  587   1HE   LYS  75           HE1      LYS  75  12.095 -23.876 -23.876
  588   2HE   LYS  75           HE2      LYS  75  11.519 -22.275 -22.275
  589   1HZ   LYS  75           HZ1      LYS  75   9.859 -24.162 -24.162
  590   2HZ   LYS  75           HZ2      LYS  75  11.471 -24.595 -24.595
  591   3HZ   LYS  75           HZ3      LYS  75  10.914 -23.048 -23.048
  592    H    GLY  76           HN       GLY  76   6.537 -18.271 -18.271
  593   1HA   GLY  76           HA1      GLY  76   6.125 -19.426 -19.426
  594   2HA   GLY  76           HA2      GLY  76   5.470 -17.896 -17.896
  595    H    LYS  77           HN       LYS  77   3.835 -18.101 -18.101
  596    HA   LYS  77           HA       LYS  77   1.667 -18.748 -18.748
  597   1HB   LYS  77           HB1      LYS  77   2.844 -21.575 -21.575
  598   2HB   LYS  77           HB2      LYS  77   1.612 -21.058 -21.058
  599   1HG   LYS  77           HG1      LYS  77   3.270 -19.441 -19.441
  600   2HG   LYS  77           HG2      LYS  77   4.514 -20.203 -20.203
  601   1HD   LYS  77           HD1      LYS  77   3.937 -22.420 -22.420
  602   2HD   LYS  77           HD2      LYS  77   2.798 -21.592 -21.592
  603   1HE   LYS  77           HE1      LYS  77   5.806 -21.089 -21.089
  604   2HE   LYS  77           HE2      LYS  77   4.946 -21.894 -21.894
  605   1HZ   LYS  77           HZ1      LYS  77   3.738 -19.414 -19.414
  606   2HZ   LYS  77           HZ2      LYS  77   5.413 -19.174 -19.174
  607   3HZ   LYS  77           HZ3      LYS  77   4.579 -19.953 -19.953
  608    HA   PRO  78           HA       PRO  78  -0.301 -20.460 -20.460
  609   1HB   PRO  78           HB1      PRO  78  -2.071 -22.520 -22.520
  610   2HB   PRO  78           HB2      PRO  78  -2.454 -20.848 -20.848
  611   1HG   PRO  78           HG1      PRO  78  -2.387 -21.880 -21.880
  612   2HG   PRO  78           HG2      PRO  78  -2.263 -20.164 -20.164
  613   1HD   PRO  78           HD1      PRO  78  -0.017 -22.148 -22.148
  614   2HD   PRO  78           HD2      PRO  78  -0.222 -20.464 -20.464
  615    H    ASP  79           HN       ASP  79   2.124 -21.398 -21.398
  616    HA   ASP  79           HA       ASP  79   3.608 -22.991 -22.991
  617   1HB   ASP  79           HB1      ASP  79   2.050 -23.045 -23.045
  618   2HB   ASP  79           HB2      ASP  79   1.044 -24.245 -24.245
  619    H    ALA  80           HN       ALA  80   3.456 -23.222 -23.222
  620    HA   ALA  80           HA       ALA  80   3.012 -26.092 -26.092
  621   1HB   ALA  80           HB1      ALA  80   2.644 -23.613 -23.613
  622   2HB   ALA  80           HB2      ALA  80   2.455 -25.273 -25.273
  623   3HB   ALA  80           HB3      ALA  80   1.355 -24.611 -24.611
  624    H    ALA  81           HN       ALA  81   5.078 -26.628 -26.628
  625    HA   ALA  81           HA       ALA  81   7.392 -25.232 -25.232
  626   1HB   ALA  81           HB1      ALA  81   7.468 -26.267 -26.267
  627   2HB   ALA  81           HB2      ALA  81   7.239 -27.848 -27.848
  628   3HB   ALA  81           HB3      ALA  81   8.705 -26.933 -26.933
  629   1H1   BME  16           HE1      MER  16  -8.177   8.451   8.451
  630   2H1   BME  16           HE2      MER  16  -7.745   9.408   9.408
  631   1H2   BME  16           HZ1      MER  16  -7.936  10.428  10.428
  632   2H2   BME  16           HZ2      MER  16  -6.431  10.139  10.139
  633    HO1  BME  16           HH       MER  16 -10.092   9.249   9.249

  Start of MODEL   41
    1    H    ASN   3           HN       ASN   3   0.984  -6.775  -6.775
    2    HA   ASN   3           HA       ASN   3   2.741  -9.010  -9.010
    3   1HB   ASN   3           HB1      ASN   3  -0.125  -9.315  -9.315
    4   2HB   ASN   3           HB2      ASN   3   1.118 -10.552 -10.552
    5   1HD2  ASN   3          HD21      ASN   3   0.698  -8.504  -8.504
    6   2HD2  ASN   3          HD22      ASN   3  -0.447  -8.535  -8.535
    7    H    ALA   4           HN       ALA   4   2.684  -9.438  -9.438
    8    HA   ALA   4           HA       ALA   4   2.071  -9.686  -9.686
    9   1HB   ALA   4           HB1      ALA   4  -0.778  -9.714  -9.714
   10   2HB   ALA   4           HB2      ALA   4  -0.371 -10.182 -10.182
   11   3HB   ALA   4           HB3      ALA   4   0.264 -11.102 -11.102
   12    HA   PRO   5           HA       PRO   5   1.793  -6.024  -6.024
   13   1HB   PRO   5           HB1      PRO   5  -0.099  -6.916  -6.916
   14   2HB   PRO   5           HB2      PRO   5   1.661  -6.981  -6.981
   15   1HG   PRO   5           HG1      PRO   5  -0.264  -9.096  -9.096
   16   2HG   PRO   5           HG2      PRO   5   1.180  -9.287  -9.287
   17   1HD   PRO   5           HD1      PRO   5   1.270  -9.899  -9.899
   18   2HD   PRO   5           HD2      PRO   5   2.652  -8.949  -8.949
   19    H    LYS   6           HN       LYS   6   0.915  -4.650  -4.650
   20    HA   LYS   6           HA       LYS   6  -1.969  -3.986  -3.986
   21   1HB   LYS   6           HB1      LYS   6  -1.636  -4.956  -4.956
   22   2HB   LYS   6           HB2      LYS   6  -0.281  -3.888  -3.888
   23   1HG   LYS   6           HG1      LYS   6  -1.739  -1.913  -1.913
   24   2HG   LYS   6           HG2      LYS   6  -3.098  -2.838  -2.838
   25   1HD   LYS   6           HD1      LYS   6  -1.748  -3.491  -3.491
   26   2HD   LYS   6           HD2      LYS   6  -2.991  -2.263  -2.263
   27   1HE   LYS   6           HE1      LYS   6  -4.541  -3.968  -3.968
   28   2HE   LYS   6           HE2      LYS   6  -3.310  -5.202  -5.202
   29   1HZ   LYS   6           HZ1      LYS   6  -3.677  -3.814  -3.814
   30   2HZ   LYS   6           HZ2      LYS   6  -5.198  -4.273  -4.273
   31   3HZ   LYS   6           HZ3      LYS   6  -3.997  -5.444  -5.444
   32    H    ARG   7           HN       ARG   7  -1.487  -2.568  -2.568
   33    HA   ARG   7           HA       ARG   7   0.063  -0.635  -0.635
   34   1HB   ARG   7           HB1      ARG   7  -2.199  -0.866  -0.866
   35   2HB   ARG   7           HB2      ARG   7  -2.878  -0.124  -0.124
   36   1HG   ARG   7           HG1      ARG   7  -2.810   1.588   1.588
   37   2HG   ARG   7           HG2      ARG   7  -1.547   1.997   1.997
   38   1HD   ARG   7           HD1      ARG   7   0.105   0.807   0.807
   39   2HD   ARG   7           HD2      ARG   7  -1.223   0.697   0.697
   40    HE   ARG   7           HE       ARG   7  -0.086   3.260   3.260
   41   1HH1  ARG   7          HH11      ARG   7  -2.616   3.958   3.958
   42   2HH1  ARG   7          HH12      ARG   7  -2.456   4.148   4.148
   43   1HH2  ARG   7          HH21      ARG   7   0.547   2.350   2.350
   44   2HH2  ARG   7          HH22      ARG   7  -0.623   3.215   3.215
   45    HA   PRO   8           HA       PRO   8   0.775   1.905   1.905
   46   1HB   PRO   8           HB1      PRO   8   3.362   2.467   2.467
   47   2HB   PRO   8           HB2      PRO   8   3.093   1.881   1.881
   48   1HG   PRO   8           HG1      PRO   8   4.044   0.184   0.184
   49   2HG   PRO   8           HG2      PRO   8   2.828  -0.396  -0.396
   50   1HD   PRO   8           HD1      PRO   8   2.346   0.699   0.699
   51   2HD   PRO   8           HD2      PRO   8   1.800  -0.850  -0.850
   52    HA   PRO   9           HA       PRO   9  -0.007   6.066   6.066
   53   1HB   PRO   9           HB1      PRO   9   2.928   6.574   6.574
   54   2HB   PRO   9           HB2      PRO   9   1.570   7.688   7.688
   55   1HG   PRO   9           HG1      PRO   9   2.268   6.310   6.310
   56   2HG   PRO   9           HG2      PRO   9   0.554   6.259   6.259
   57   1HD   PRO   9           HD1      PRO   9   2.703   4.166   4.166
   58   2HD   PRO   9           HD2      PRO   9   1.040   3.913   3.913
   59    H    SER  10           HN       SER  10   0.353   7.567   7.567
   60    HA   SER  10           HA       SER  10   1.561   6.404   6.404
   61   1HB   SER  10           HB1      SER  10  -0.184   7.844   7.844
   62   2HB   SER  10           HB2      SER  10  -0.878   6.619   6.619
   63    HG   SER  10           HG       SER  10  -1.086   9.237   9.237
   64    H    ALA  11           HN       ALA  11   1.695   9.061   9.061
   65    HA   ALA  11           HA       ALA  11   3.752  10.487  10.487
   66   1HB   ALA  11           HB1      ALA  11   4.240  10.141  10.141
   67   2HB   ALA  11           HB2      ALA  11   2.801  11.102  11.102
   68   3HB   ALA  11           HB3      ALA  11   4.174  11.819  11.819
   69    H    PHE  12           HN       PHE  12   0.849  10.693  10.693
   70    HA   PHE  12           HA       PHE  12  -0.054  13.317  13.317
   71   1HB   PHE  12           HB1      PHE  12  -0.809  12.462  12.462
   72   2HB   PHE  12           HB2      PHE  12  -1.155  10.861  10.861
   73    HD1  PHE  12           HD1      PHE  12  -2.309  14.311  14.311
   74    HD2  PHE  12           HD2      PHE  12  -3.311  10.399  10.399
   75    HE1  PHE  12           HE1      PHE  12  -4.640  15.000  15.000
   76    HE2  PHE  12           HE2      PHE  12  -5.659  11.092  11.092
   77    HZ   PHE  12           HZ       PHE  12  -6.325  13.384  13.384
   78    H    PHE  13           HN       PHE  13  -0.317  10.071  10.071
   79    HA   PHE  13           HA       PHE  13  -2.514  10.299  10.299
   80   1HB   PHE  13           HB1      PHE  13  -0.432   8.438   8.438
   81   2HB   PHE  13           HB2      PHE  13  -0.405   8.801   8.801
   82    HD1  PHE  13           HD1      PHE  13  -2.719   8.766   8.766
   83    HD2  PHE  13           HD2      PHE  13  -2.021   6.911   6.911
   84    HE1  PHE  13           HE1      PHE  13  -4.708   7.364   7.364
   85    HE2  PHE  13           HE2      PHE  13  -4.011   5.511   5.511
   86    HZ   PHE  13           HZ       PHE  13  -5.359   5.735   5.735
   87    H    LEU  14           HN       LEU  14   0.884  10.964  10.964
   88    HA   LEU  14           HA       LEU  14   0.680  11.706  11.706
   89   1HB   LEU  14           HB1      LEU  14   2.453  12.999  12.999
   90   2HB   LEU  14           HB2      LEU  14   2.725  13.121  13.121
   91    HG   LEU  14           HG       LEU  14   4.289  11.547  11.547
   92   1HD1  LEU  14          HD11      LEU  14   3.121  10.568  10.568
   93   2HD1  LEU  14          HD12      LEU  14   1.986   9.751   9.751
   94   3HD1  LEU  14          HD13      LEU  14   3.684   9.315   9.315
   95   1HD2  LEU  14          HD21      LEU  14   3.727  11.261  11.261
   96   2HD2  LEU  14          HD22      LEU  14   4.049   9.704   9.704
   97   3HD2  LEU  14          HD23      LEU  14   2.399  10.177  10.177
   98    H    PHE  15           HN       PHE  15   0.595  14.010  14.010
   99    HA   PHE  15           HA       PHE  15  -0.257  16.155  16.155
  100   1HB   PHE  15           HB1      PHE  15   0.675  17.259  17.259
  101   2HB   PHE  15           HB2      PHE  15   0.805  15.715  15.715
  102    HD1  PHE  15           HD1      PHE  15  -1.333  14.988  14.988
  103    HD2  PHE  15           HD2      PHE  15  -0.446  19.003  19.003
  104    HE1  PHE  15           HE1      PHE  15  -2.792  15.814  15.814
  105    HE2  PHE  15           HE2      PHE  15  -1.925  19.828  19.828
  106    HZ   PHE  15           HZ       PHE  15  -3.094  18.220  18.220
  107    H    CYS  16           HN       MER  16  -2.115  14.041  14.041
  108    HA   CYS  16           HA       MER  16  -4.618  15.295  15.295
  109   1HB   CYS  16           HB1      MER  16  -4.743  13.491  13.491
  110   2HB   CYS  16           HB2      MER  16  -3.851  12.416  12.416
  111    H    SER  17           HN       SER  17  -3.049  12.948  12.948
  112    HA   SER  17           HA       SER  17  -5.135  12.515  12.515
  113   1HB   SER  17           HB1      SER  17  -2.952  11.273  11.273
  114   2HB   SER  17           HB2      SER  17  -2.140  12.707  12.707
  115    HG   SER  17           HG       SER  17  -3.578  10.893  10.893
  116    H    GLU  18           HN       GLU  18  -2.562  14.885  14.885
  117    HA   GLU  18           HA       GLU  18  -3.531  16.307  16.307
  118   1HB   GLU  18           HB1      GLU  18  -1.188  16.250  16.250
  119   2HB   GLU  18           HB2      GLU  18  -1.658  17.178  17.178
  120   1HG   GLU  18           HG1      GLU  18  -2.267  19.107  19.107
  121   2HG   GLU  18           HG2      GLU  18  -2.102  18.198  18.198
  122    H    TYR  19           HN       TYR  19  -4.795  16.218  16.218
  123    HA   TYR  19           HA       TYR  19  -5.821  19.005  19.005
  124   1HB   TYR  19           HB1      TYR  19  -5.420  16.910  16.910
  125   2HB   TYR  19           HB2      TYR  19  -6.861  17.939  17.939
  126    HD1  TYR  19           HD1      TYR  19  -3.277  18.462  18.462
  127    HD2  TYR  19           HD2      TYR  19  -6.549  19.726  19.726
  128    HE1  TYR  19           HE1      TYR  19  -1.901  20.258  20.258
  129    HE2  TYR  19           HE2      TYR  19  -5.179  21.523  21.523
  130    HH   TYR  19           HH       TYR  19  -2.830  22.817  22.817
  131    H    ARG  20           HN       ARG  20  -7.034  15.748  15.748
  132    HA   ARG  20           HA       ARG  20  -9.615  15.646  15.646
  133   1HB   ARG  20           HB1      ARG  20  -7.979  14.547  14.547
  134   2HB   ARG  20           HB2      ARG  20  -9.719  14.440  14.440
  135   1HG   ARG  20           HG1      ARG  20  -9.934  13.223  13.223
  136   2HG   ARG  20           HG2      ARG  20  -8.225  13.441  13.441
  137   1HD   ARG  20           HD1      ARG  20  -8.800  11.167  11.167
  138   2HD   ARG  20           HD2      ARG  20  -7.601  12.056  12.056
  139    HE   ARG  20           HE       ARG  20  -9.474  12.736  12.736
  140   1HH1  ARG  20          HH11      ARG  20  -9.102   9.613   9.613
  141   2HH1  ARG  20          HH12      ARG  20 -10.616   9.028   9.028
  142   1HH2  ARG  20          HH21      ARG  20 -11.716  12.208  12.208
  143   2HH2  ARG  20          HH22      ARG  20 -12.128  10.528  10.528
  144    HA   PRO  21           HA       PRO  21 -11.538  17.374  17.374
  145   1HB   PRO  21           HB1      PRO  21 -10.150  18.299  18.299
  146   2HB   PRO  21           HB2      PRO  21 -10.181  16.560  16.560
  147   1HG   PRO  21           HG1      PRO  21  -8.081  18.584  18.584
  148   2HG   PRO  21           HG2      PRO  21  -7.795  17.169  17.169
  149   1HD   PRO  21           HD1      PRO  21  -7.532  16.900  16.900
  150   2HD   PRO  21           HD2      PRO  21  -8.416  15.655  15.655
  151    H    LYS  22           HN       LYS  22  -9.051  19.162  19.162
  152    HA   LYS  22           HA       LYS  22 -10.099  21.818  21.818
  153   1HB   LYS  22           HB1      LYS  22  -7.643  21.301  21.301
  154   2HB   LYS  22           HB2      LYS  22  -7.750  20.968  20.968
  155   1HG   LYS  22           HG1      LYS  22  -8.409  23.295  23.295
  156   2HG   LYS  22           HG2      LYS  22  -8.476  23.627  23.627
  157   1HD   LYS  22           HD1      LYS  22  -6.034  23.071  23.071
  158   2HD   LYS  22           HD2      LYS  22  -5.996  22.819  22.819
  159   1HE   LYS  22           HE1      LYS  22  -6.513  25.142  25.142
  160   2HE   LYS  22           HE2      LYS  22  -6.873  25.452  25.452
  161   1HZ   LYS  22           HZ1      LYS  22  -4.314  24.350  24.350
  162   2HZ   LYS  22           HZ2      LYS  22  -4.413  25.607  25.607
  163   3HZ   LYS  22           HZ3      LYS  22  -4.769  25.908  25.908
  164    H    ILE  23           HN       ILE  23 -10.190  19.529  19.529
  165    HA   ILE  23           HA       ILE  23 -11.141  21.588  21.588
  166    HB   ILE  23           HB       ILE  23 -11.298  18.534  18.534
  167   1HG1  ILE  23          HG11      ILE  23  -9.123  20.378  20.378
  168   2HG1  ILE  23          HG12      ILE  23  -8.905  19.351  19.351
  169   1HG2  ILE  23          HG21      ILE  23 -12.760  19.927  19.927
  170   2HG2  ILE  23          HG22      ILE  23 -11.342  20.816  20.816
  171   3HG2  ILE  23          HG23      ILE  23 -11.521  19.118  19.118
  172   1HD1  ILE  23          HD11      ILE  23  -9.670  18.354  18.354
  173   2HD1  ILE  23          HD12      ILE  23  -8.090  18.215  18.215
  174   3HD1  ILE  23          HD13      ILE  23  -9.450  17.354  17.354
  175    H    LYS  24           HN       LYS  24 -12.143  18.816  18.816
  176    HA   LYS  24           HA       LYS  24 -14.883  18.692  18.692
  177   1HB   LYS  24           HB1      LYS  24 -13.350  17.072  17.072
  178   2HB   LYS  24           HB2      LYS  24 -13.262  18.156  18.156
  179   1HG   LYS  24           HG1      LYS  24 -16.076  17.826  17.826
  180   2HG   LYS  24           HG2      LYS  24 -15.414  16.221  16.221
  181   1HD   LYS  24           HD1      LYS  24 -14.756  18.007  18.007
  182   2HD   LYS  24           HD2      LYS  24 -16.048  16.834  16.834
  183   1HE   LYS  24           HE1      LYS  24 -13.394  15.742  15.742
  184   2HE   LYS  24           HE2      LYS  24 -13.490  16.273  16.273
  185   1HZ   LYS  24           HZ1      LYS  24 -15.817  14.839  14.839
  186   2HZ   LYS  24           HZ2      LYS  24 -14.472  13.924  13.924
  187   3HZ   LYS  24           HZ3      LYS  24 -14.591  14.462  14.462
  188    H    GLY  25           HN       GLY  25 -12.975  20.571  20.571
  189   1HA   GLY  25           HA1      GLY  25 -14.963  21.712  21.712
  190   2HA   GLY  25           HA2      GLY  25 -13.369  22.397  22.397
  191    H    GLU  26           HN       GLU  26 -13.399  22.945  22.945
  192    HA   GLU  26           HA       GLU  26 -14.892  25.373  25.373
  193   1HB   GLU  26           HB1      GLU  26 -13.277  23.856  23.856
  194   2HB   GLU  26           HB2      GLU  26 -13.762  25.531  25.531
  195   1HG   GLU  26           HG1      GLU  26 -12.155  24.588  24.588
  196   2HG   GLU  26           HG2      GLU  26 -11.341  24.950  24.950
  197    H    HIS  27           HN       HIS  27 -15.044  22.348  22.348
  198    HA   HIS  27           HA       HIS  27 -17.762  22.970  22.970
  199   1HB   HIS  27           HB1      HIS  27 -15.782  21.210  21.210
  200   2HB   HIS  27           HB2      HIS  27 -17.210  22.058  22.058
  201    HD1  HIS  27           HD1      HIS  27 -16.901  24.768  24.768
  202    HD2  HIS  27           HD2      HIS  27 -13.427  22.611  22.611
  203    HE1  HIS  27           HE1      HIS  27 -15.084  26.334  26.334
  204    HA   PRO  28           HA       PRO  28 -18.311  18.954  18.954
  205   1HB   PRO  28           HB1      PRO  28 -20.159  19.702  19.702
  206   2HB   PRO  28           HB2      PRO  28 -18.455  20.058  20.058
  207   1HG   PRO  28           HG1      PRO  28 -20.558  21.911  21.911
  208   2HG   PRO  28           HG2      PRO  28 -19.508  22.254  22.254
  209   1HD   PRO  28           HD1      PRO  28 -18.807  23.023  23.023
  210   2HD   PRO  28           HD2      PRO  28 -17.562  22.535  22.535
  211    H    GLY  29           HN       GLY  29 -18.949  19.694  19.694
  212   1HA   GLY  29           HA1      GLY  29 -21.822  19.105  19.105
  213   2HA   GLY  29           HA2      GLY  29 -20.987  20.274  20.274
  214    H    LEU  30           HN       LEU  30 -18.522  18.491  18.491
  215    HA   LEU  30           HA       LEU  30 -19.392  16.772  16.772
  216   1HB   LEU  30           HB1      LEU  30 -16.581  16.519  16.519
  217   2HB   LEU  30           HB2      LEU  30 -17.426  17.330  17.330
  218    HG   LEU  30           HG       LEU  30 -16.681  18.701  18.701
  219   1HD1  LEU  30          HD11      LEU  30 -14.644  17.837  17.837
  220   2HD1  LEU  30          HD12      LEU  30 -15.161  18.636  18.636
  221   3HD1  LEU  30          HD13      LEU  30 -14.719  19.582  19.582
  222   1HD2  LEU  30          HD21      LEU  30 -17.361  19.731  19.731
  223   2HD2  LEU  30          HD22      LEU  30 -18.440  19.843  19.843
  224   3HD2  LEU  30          HD23      LEU  30 -16.929  20.730  20.730
  225    H    SER  31           HN       SER  31 -17.858  14.802  14.802
  226    HA   SER  31           HA       SER  31 -18.058  13.117  13.117
  227   1HB   SER  31           HB1      SER  31 -18.448  12.354  12.354
  228   2HB   SER  31           HB2      SER  31 -18.524  11.226  11.226
  229    HG   SER  31           HG       SER  31 -20.388  12.918  12.918
  230    H    ILE  32           HN       ILE  32 -16.655  11.140  11.140
  231    HA   ILE  32           HA       ILE  32 -13.955  11.926  11.926
  232    HB   ILE  32           HB       ILE  32 -15.540   9.373   9.373
  233   1HG1  ILE  32          HG11      ILE  32 -14.212   8.894   8.894
  234   2HG1  ILE  32          HG12      ILE  32 -13.154  10.257  10.257
  235   1HG2  ILE  32          HG21      ILE  32 -12.602   9.219   9.219
  236   2HG2  ILE  32          HG22      ILE  32 -13.611   7.854   7.854
  237   3HG2  ILE  32          HG23      ILE  32 -13.958   8.722   8.722
  238   1HD1  ILE  32          HD11      ILE  32 -16.146  10.442  10.442
  239   2HD1  ILE  32          HD12      ILE  32 -14.851  10.844  10.844
  240   3HD1  ILE  32          HD13      ILE  32 -15.096  11.817  11.817
  241    H    GLY  33           HN       GLY  33 -15.868  11.116  11.116
  242   1HA   GLY  33           HA1      GLY  33 -13.597  10.634  10.634
  243   2HA   GLY  33           HA2      GLY  33 -15.295  10.630  10.630
  244    H    ASP  34           HN       ASP  34 -15.117  13.365  13.365
  245    HA   ASP  34           HA       ASP  34 -14.533  15.011  15.011
  246   1HB   ASP  34           HB1      ASP  34 -16.201  15.397  15.397
  247   2HB   ASP  34           HB2      ASP  34 -16.059  16.678  16.678
  248    H    VAL  35           HN       VAL  35 -14.148  14.676  14.676
  249    HA   VAL  35           HA       VAL  35 -12.369  16.888  16.888
  250    HB   VAL  35           HB       VAL  35 -12.887  14.264  14.264
  251   1HG1  VAL  35          HG11      VAL  35 -11.545  16.799  16.799
  252   2HG1  VAL  35          HG12      VAL  35 -11.923  15.393  15.393
  253   3HG1  VAL  35          HG13      VAL  35 -10.728  15.276  15.276
  254   1HG2  VAL  35          HG21      VAL  35 -14.920  15.696  15.696
  255   2HG2  VAL  35          HG22      VAL  35 -14.331  15.602  15.602
  256   3HG2  VAL  35          HG23      VAL  35 -14.031  17.041  17.041
  257    H    ALA  36           HN       ALA  36 -12.069  13.693  13.693
  258    HA   ALA  36           HA       ALA  36  -9.157  13.621  13.621
  259   1HB   ALA  36           HB1      ALA  36 -10.481  11.590  11.590
  260   2HB   ALA  36           HB2      ALA  36 -11.135  11.673  11.673
  261   3HB   ALA  36           HB3      ALA  36  -9.427  11.341  11.341
  262    H    LYS  37           HN       LYS  37 -11.769  13.697  13.697
  263    HA   LYS  37           HA       LYS  37 -10.014  13.680  13.680
  264   1HB   LYS  37           HB1      LYS  37 -12.392  13.259  13.259
  265   2HB   LYS  37           HB2      LYS  37 -12.768  14.889  14.889
  266   1HG   LYS  37           HG1      LYS  37 -13.012  14.649  14.649
  267   2HG   LYS  37           HG2      LYS  37 -11.747  15.794  15.794
  268   1HD   LYS  37           HD1      LYS  37 -11.050  14.263  14.263
  269   2HD   LYS  37           HD2      LYS  37 -10.002  14.092  14.092
  270   1HE   LYS  37           HE1      LYS  37 -10.629  11.878  11.878
  271   2HE   LYS  37           HE2      LYS  37 -11.221  12.020  12.020
  272   1HZ   LYS  37           HZ1      LYS  37 -13.153  13.049  13.049
  273   2HZ   LYS  37           HZ2      LYS  37 -12.668  11.522  11.522
  274   3HZ   LYS  37           HZ3      LYS  37 -13.255  11.696  11.696
  275    H    LYS  38           HN       LYS  38 -11.202  16.432  16.432
  276    HA   LYS  38           HA       LYS  38  -9.996  18.349  18.349
  277   1HB   LYS  38           HB1      LYS  38 -11.775  18.423  18.423
  278   2HB   LYS  38           HB2      LYS  38 -10.417  19.497  19.497
  279   1HG   LYS  38           HG1      LYS  38 -10.796  20.721  20.721
  280   2HG   LYS  38           HG2      LYS  38 -11.962  19.552  19.552
  281   1HD   LYS  38           HD1      LYS  38 -13.114  21.551  21.551
  282   2HD   LYS  38           HD2      LYS  38 -13.522  20.189  20.189
  283   1HE   LYS  38           HE1      LYS  38 -11.336  22.183  22.183
  284   2HE   LYS  38           HE2      LYS  38 -13.012  22.384  22.384
  285   1HZ   LYS  38           HZ1      LYS  38 -12.243  19.778  19.778
  286   2HZ   LYS  38           HZ2      LYS  38 -11.037  20.830  20.830
  287   3HZ   LYS  38           HZ3      LYS  38 -12.651  21.046  21.046
  288    H    LEU  39           HN       LEU  39  -9.124  17.216  17.216
  289    HA   LEU  39           HA       LEU  39  -6.722  18.763  18.763
  290   1HB   LEU  39           HB1      LEU  39  -6.806  18.048  18.048
  291   2HB   LEU  39           HB2      LEU  39  -8.261  17.200  17.200
  292    HG   LEU  39           HG       LEU  39  -6.713  15.311  15.311
  293   1HD1  LEU  39          HD11      LEU  39  -4.670  16.668  16.668
  294   2HD1  LEU  39          HD12      LEU  39  -4.984  16.914  16.914
  295   3HD1  LEU  39          HD13      LEU  39  -4.599  15.307  15.307
  296   1HD2  LEU  39          HD21      LEU  39  -8.218  15.203  15.203
  297   2HD2  LEU  39          HD22      LEU  39  -6.673  14.444  14.444
  298   3HD2  LEU  39          HD23      LEU  39  -6.980  16.060  16.060
  299    H    GLY  40           HN       GLY  40  -7.525  15.596  15.596
  300   1HA   GLY  40           HA1      GLY  40  -5.002  14.462  14.462
  301   2HA   GLY  40           HA2      GLY  40  -6.393  14.274  14.274
  302    H    GLU  41           HN       GLU  41  -6.883  16.696  16.696
  303    HA   GLU  41           HA       GLU  41  -5.034  17.073  17.073
  304   1HB   GLU  41           HB1      GLU  41  -7.145  18.780  18.780
  305   2HB   GLU  41           HB2      GLU  41  -6.330  19.229  19.229
  306   1HG   GLU  41           HG1      GLU  41  -7.140  17.162  17.162
  307   2HG   GLU  41           HG2      GLU  41  -7.846  16.594  16.594
  308    H    MET  42           HN       MET  42  -5.650  19.018  19.018
  309    HA   MET  42           HA       MET  42  -3.772  21.045  21.045
  310   1HB   MET  42           HB1      MET  42  -4.430  19.587  19.587
  311   2HB   MET  42           HB2      MET  42  -3.635  21.155  21.155
  312   1HG   MET  42           HG1      MET  42  -5.715  21.859  21.859
  313   2HG   MET  42           HG2      MET  42  -6.430  20.412  20.412
  314   1HE   MET  42           HE1      MET  42  -8.260  20.536  20.536
  315   2HE   MET  42           HE2      MET  42  -8.716  22.017  22.017
  316   3HE   MET  42           HE3      MET  42  -8.511  22.037  22.037
  317    H    TRP  43           HN       TRP  43  -3.296  17.946  17.946
  318    HA   TRP  43           HA       TRP  43  -0.597  18.015  18.015
  319   1HB   TRP  43           HB1      TRP  43  -1.996  16.266  16.266
  320   2HB   TRP  43           HB2      TRP  43  -2.416  15.820  15.820
  321    HD1  TRP  43           HD1      TRP  43  -0.946  14.061  14.061
  322    HE1  TRP  43           HE1      TRP  43   1.216  13.021  13.021
  323    HE3  TRP  43           HE3      TRP  43   0.143  16.749  16.749
  324    HZ2  TRP  43           HZ2      TRP  43   3.265  13.210  13.210
  325    HZ3  TRP  43           HZ3      TRP  43   2.170  16.320  16.320
  326    HH2  TRP  43           HH2      TRP  43   3.754  14.544  14.544
  327    H    ASN  44           HN       ASN  44  -2.051  16.960  16.960
  328    HA   ASN  44           HA       ASN  44   0.347  16.359  16.359
  329   1HB   ASN  44           HB1      ASN  44  -2.321  17.324  17.324
  330   2HB   ASN  44           HB2      ASN  44  -1.023  16.582  16.582
  331   1HD2  ASN  44          HD21      ASN  44  -3.598  14.120  14.120
  332   2HD2  ASN  44          HD22      ASN  44  -3.915  15.721  15.721
  333    H    ASN  45           HN       ASN  45  -0.914  19.323  19.323
  334    HA   ASN  45           HA       ASN  45   1.124  20.830  20.830
  335   1HB   ASN  45           HB1      ASN  45  -1.495  22.129  22.129
  336   2HB   ASN  45           HB2      ASN  45  -0.421  22.554  22.554
  337   1HD2  ASN  45          HD21      ASN  45  -3.537  20.148  20.148
  338   2HD2  ASN  45          HD22      ASN  45  -3.286  21.083  21.083
  339    H    THR  46           HN       THR  46   1.342  19.786  19.786
  340    HA   THR  46           HA       THR  46   0.893  21.997  21.997
  341    HB   THR  46           HB       THR  46   1.141  19.574  19.574
  342    HG1  THR  46           HG1      THR  46   1.620  20.641  20.641
  343   1HG2  THR  46          HG21      THR  46   4.167  20.053  20.053
  344   2HG2  THR  46          HG22      THR  46   3.400  18.670  18.670
  345   3HG2  THR  46          HG23      THR  46   3.258  18.927  18.927
  346    H    ALA  47           HN       ALA  47   3.624  20.751  20.751
  347    HA   ALA  47           HA       ALA  47   4.921  23.152  23.152
  348   1HB   ALA  47           HB1      ALA  47   5.460  23.344  23.344
  349   2HB   ALA  47           HB2      ALA  47   6.200  21.756  21.756
  350   3HB   ALA  47           HB3      ALA  47   6.903  23.097  23.097
  351    H    ALA  48           HN       ALA  48   5.515  19.999  19.999
  352    HA   ALA  48           HA       ALA  48   6.056  17.980  17.980
  353   1HB   ALA  48           HB1      ALA  48   6.042  19.077  19.077
  354   2HB   ALA  48           HB2      ALA  48   7.644  19.735  19.735
  355   3HB   ALA  48           HB3      ALA  48   7.403  18.004  18.004
  356    H    ASP  49           HN       ASP  49   7.818  20.772  20.772
  357    HA   ASP  49           HA       ASP  49  10.300  19.422  19.422
  358   1HB   ASP  49           HB1      ASP  49   9.573  22.392  22.392
  359   2HB   ASP  49           HB2      ASP  49  11.185  21.718  21.718
  360    H    ASP  50           HN       ASP  50   7.330  20.184  20.184
  361    HA   ASP  50           HA       ASP  50   8.152  20.460  20.460
  362   1HB   ASP  50           HB1      ASP  50   6.680  22.316  22.316
  363   2HB   ASP  50           HB2      ASP  50   5.474  21.106  21.106
  364    H    LYS  51           HN       LYS  51   7.353  18.278  18.278
  365    HA   LYS  51           HA       LYS  51   5.537  16.599  16.599
  366   1HB   LYS  51           HB1      LYS  51   6.851  16.111  16.111
  367   2HB   LYS  51           HB2      LYS  51   5.858  14.932  14.932
  368   1HG   LYS  51           HG1      LYS  51   3.967  16.598  16.598
  369   2HG   LYS  51           HG2      LYS  51   4.993  17.617  17.617
  370   1HD   LYS  51           HD1      LYS  51   5.216  15.806  15.806
  371   2HD   LYS  51           HD2      LYS  51   4.258  14.729  14.729
  372   1HE   LYS  51           HE1      LYS  51   2.332  16.213  16.213
  373   2HE   LYS  51           HE2      LYS  51   3.251  17.343  17.343
  374   1HZ   LYS  51           HZ1      LYS  51   3.471  14.755  14.755
  375   2HZ   LYS  51           HZ2      LYS  51   1.828  15.104  15.104
  376   3HZ   LYS  51           HZ3      LYS  51   2.776  16.143  16.143
  377    H    GLN  52           HN       GLN  52   8.669  16.632  16.632
  378    HA   GLN  52           HA       GLN  52  10.047  14.503  14.503
  379   1HB   GLN  52           HB1      GLN  52  10.730  17.229  17.229
  380   2HB   GLN  52           HB2      GLN  52  11.519  16.786  16.786
  381   1HG   GLN  52           HG1      GLN  52  13.063  16.409  16.409
  382   2HG   GLN  52           HG2      GLN  52  12.614  14.858  14.858
  383   1HE2  GLN  52          HE21      GLN  52  10.300  15.074  15.074
  384   2HE2  GLN  52          HE22      GLN  52   9.905  15.814  15.814
  385    HA   PRO  53           HA       PRO  53  10.574  15.010  15.010
  386   1HB   PRO  53           HB1      PRO  53   8.405  16.425  16.425
  387   2HB   PRO  53           HB2      PRO  53  10.029  17.070  17.070
  388   1HG   PRO  53           HG1      PRO  53   7.650  17.226  17.226
  389   2HG   PRO  53           HG2      PRO  53   8.674  18.551  18.551
  390   1HD   PRO  53           HD1      PRO  53   9.266  17.512  17.512
  391   2HD   PRO  53           HD2      PRO  53  10.614  17.689  17.689
  392    H    TYR  54           HN       TYR  54   7.204  15.230  15.230
  393    HA   TYR  54           HA       TYR  54   6.225  13.061  13.061
  394   1HB   TYR  54           HB1      TYR  54   5.091  14.365  14.365
  395   2HB   TYR  54           HB2      TYR  54   4.200  13.236  13.236
  396    HD1  TYR  54           HD1      TYR  54   4.822  14.100  14.100
  397    HD2  TYR  54           HD2      TYR  54   4.195  16.482  16.482
  398    HE1  TYR  54           HE1      TYR  54   4.138  15.985  15.985
  399    HE2  TYR  54           HE2      TYR  54   3.513  18.363  18.363
  400    HH   TYR  54           HH       TYR  54   2.467  18.536  18.536
  401    H    GLU  55           HN       GLU  55   7.012  13.399  13.399
  402    HA   GLU  55           HA       GLU  55   6.426  10.844  10.844
  403   1HB   GLU  55           HB1      GLU  55   7.715  13.239  13.239
  404   2HB   GLU  55           HB2      GLU  55   8.857  11.965  11.965
  405   1HG   GLU  55           HG1      GLU  55   7.056  10.718  10.718
  406   2HG   GLU  55           HG2      GLU  55   5.924  12.000  12.000
  407    H    LYS  56           HN       LYS  56   9.598  11.952  11.952
  408    HA   LYS  56           HA       LYS  56  11.111   9.717   9.717
  409   1HB   LYS  56           HB1      LYS  56  11.871  11.938  11.938
  410   2HB   LYS  56           HB2      LYS  56  10.972  11.707  11.707
  411   1HG   LYS  56           HG1      LYS  56  13.315  11.300  11.300
  412   2HG   LYS  56           HG2      LYS  56  12.474   9.769   9.769
  413   1HD   LYS  56           HD1      LYS  56  13.236   9.118   9.118
  414   2HD   LYS  56           HD2      LYS  56  13.948  10.704  10.704
  415   1HE   LYS  56           HE1      LYS  56  15.523  10.301  10.301
  416   2HE   LYS  56           HE2      LYS  56  14.800   8.721   8.721
  417   1HZ   LYS  56           HZ1      LYS  56  15.479   8.921   8.921
  418   2HZ   LYS  56           HZ2      LYS  56  16.819   9.414   9.414
  419   3HZ   LYS  56           HZ3      LYS  56  16.123   7.888   7.888
  420    H    LYS  57           HN       LYS  57   8.763  10.386  10.386
  421    HA   LYS  57           HA       LYS  57   9.301   8.027   8.027
  422   1HB   LYS  57           HB1      LYS  57   7.183  10.163  10.163
  423   2HB   LYS  57           HB2      LYS  57   6.706   8.671   8.671
  424   1HG   LYS  57           HG1      LYS  57   9.245  10.158  10.158
  425   2HG   LYS  57           HG2      LYS  57   7.694  10.521  10.521
  426   1HD   LYS  57           HD1      LYS  57   7.508   8.029   8.029
  427   2HD   LYS  57           HD2      LYS  57   9.168   7.843   7.843
  428   1HE   LYS  57           HE1      LYS  57   8.284   9.765   9.765
  429   2HE   LYS  57           HE2      LYS  57   8.997   8.189   8.189
  430   1HZ   LYS  57           HZ1      LYS  57  10.628   9.588   9.588
  431   2HZ   LYS  57           HZ2      LYS  57  10.292  10.597  10.597
  432   3HZ   LYS  57           HZ3      LYS  57  10.978   9.064   9.064
  433    H    ALA  58           HN       ALA  58   6.559   8.874   8.874
  434    HA   ALA  58           HA       ALA  58   5.227   6.470   6.470
  435   1HB   ALA  58           HB1      ALA  58   5.757   8.372   8.372
  436   2HB   ALA  58           HB2      ALA  58   4.476   7.168   7.168
  437   3HB   ALA  58           HB3      ALA  58   4.460   8.512   8.512
  438    H    ALA  59           HN       ALA  59   7.972   7.400   7.400
  439    HA   ALA  59           HA       ALA  59   8.196   5.112   5.112
  440   1HB   ALA  59           HB1      ALA  59   9.439   7.208   7.208
  441   2HB   ALA  59           HB2      ALA  59  10.392   6.941   6.941
  442   3HB   ALA  59           HB3      ALA  59  10.558   5.855   5.855
  443    H    LYS  60           HN       LYS  60  10.123   5.804   5.804
  444    HA   LYS  60           HA       LYS  60  11.448   3.397   3.397
  445   1HB   LYS  60           HB1      LYS  60  11.557   5.586   5.586
  446   2HB   LYS  60           HB2      LYS  60  10.304   4.856   4.856
  447   1HG   LYS  60           HG1      LYS  60  12.179   2.764   2.764
  448   2HG   LYS  60           HG2      LYS  60  13.186   4.193   4.193
  449   1HD   LYS  60           HD1      LYS  60  12.102   4.874   4.874
  450   2HD   LYS  60           HD2      LYS  60  11.145   3.399   3.399
  451   1HE   LYS  60           HE1      LYS  60  13.345   2.099   2.099
  452   2HE   LYS  60           HE2      LYS  60  14.195   3.608   3.608
  453   1HZ   LYS  60           HZ1      LYS  60  12.129   3.302   3.302
  454   2HZ   LYS  60           HZ2      LYS  60  13.112   1.920   1.920
  455   3HZ   LYS  60           HZ3      LYS  60  13.805   3.450   3.450
  456    H    LEU  61           HN       LEU  61   8.182   4.194   4.194
  457    HA   LEU  61           HA       LEU  61   7.780   1.592   1.592
  458   1HB   LEU  61           HB1      LEU  61   5.747   3.673   3.673
  459   2HB   LEU  61           HB2      LEU  61   5.438   2.394   2.394
  460    HG   LEU  61           HG       LEU  61   7.494   4.651   4.651
  461   1HD1  LEU  61          HD11      LEU  61   5.197   5.409   5.409
  462   2HD1  LEU  61          HD12      LEU  61   4.875   4.144   4.144
  463   3HD1  LEU  61          HD13      LEU  61   6.026   5.427   5.427
  464   1HD2  LEU  61          HD21      LEU  61   6.787   2.394   2.394
  465   2HD2  LEU  61          HD22      LEU  61   8.317   2.574   2.574
  466   3HD2  LEU  61          HD23      LEU  61   7.847   3.750   3.750
  467    H    LYS  62           HN       LYS  62   6.721   2.943   2.943
  468    HA   LYS  62           HA       LYS  62   5.341   0.756   0.756
  469   1HB   LYS  62           HB1      LYS  62   5.880   3.059   3.059
  470   2HB   LYS  62           HB2      LYS  62   7.390   2.318   2.318
  471   1HG   LYS  62           HG1      LYS  62   6.068   0.453   0.453
  472   2HG   LYS  62           HG2      LYS  62   4.587   1.295   1.295
  473   1HD   LYS  62           HD1      LYS  62   5.468   3.314   3.314
  474   2HD   LYS  62           HD2      LYS  62   6.796   2.294   2.294
  475   1HE   LYS  62           HE1      LYS  62   5.140   0.681   0.681
  476   2HE   LYS  62           HE2      LYS  62   3.840   1.761   1.761
  477   1HZ   LYS  62           HZ1      LYS  62   5.719   3.279   3.279
  478   2HZ   LYS  62           HZ2      LYS  62   5.409   1.885   1.885
  479   3HZ   LYS  62           HZ3      LYS  62   4.129   2.896   2.896
  480    H    GLU  63           HN       GLU  63   8.790   1.415   1.415
  481    HA   GLU  63           HA       GLU  63   9.812  -0.848  -0.848
  482   1HB   GLU  63           HB1      GLU  63  11.075   1.289   1.289
  483   2HB   GLU  63           HB2      GLU  63  11.066   0.626   0.626
  484   1HG   GLU  63           HG1      GLU  63  12.344  -1.403  -1.403
  485   2HG   GLU  63           HG2      GLU  63  12.454  -0.611  -0.611
  486    H    LYS  64           HN       LYS  64   9.322  -0.330  -0.330
  487    HA   LYS  64           HA       LYS  64   9.984  -2.925  -2.925
  488   1HB   LYS  64           HB1      LYS  64   7.921  -0.969  -0.969
  489   2HB   LYS  64           HB2      LYS  64   8.168  -2.530  -2.530
  490   1HG   LYS  64           HG1      LYS  64  10.637  -1.984  -1.984
  491   2HG   LYS  64           HG2      LYS  64  10.262  -0.368  -0.368
  492   1HD   LYS  64           HD1      LYS  64   8.782   0.025   0.025
  493   2HD   LYS  64           HD2      LYS  64   8.974  -1.635  -1.635
  494   1HE   LYS  64           HE1      LYS  64  10.447  -0.154  -0.154
  495   2HE   LYS  64           HE2      LYS  64  11.411  -1.244  -1.244
  496   1HZ   LYS  64           HZ1      LYS  64  10.878   1.029   1.029
  497   2HZ   LYS  64           HZ2      LYS  64  11.408   1.540   1.540
  498   3HZ   LYS  64           HZ3      LYS  64  12.366   0.483   0.483
  499    H    TYR  65           HN       TYR  65   6.755  -1.827  -1.827
  500    HA   TYR  65           HA       TYR  65   5.214  -4.104  -4.104
  501   1HB   TYR  65           HB1      TYR  65   4.291  -1.992  -1.992
  502   2HB   TYR  65           HB2      TYR  65   5.241  -2.056  -2.056
  503    HD1  TYR  65           HD1      TYR  65   4.639  -3.889  -3.889
  504    HD2  TYR  65           HD2      TYR  65   2.050  -2.780  -2.780
  505    HE1  TYR  65           HE1      TYR  65   2.744  -4.843  -4.843
  506    HE2  TYR  65           HE2      TYR  65   0.158  -3.721  -3.721
  507    HH   TYR  65           HH       TYR  65  -0.246  -4.146  -4.146
  508    H    GLU  66           HN       GLU  66   6.950  -3.282  -3.282
  509    HA   GLU  66           HA       GLU  66   6.496  -5.730  -5.730
  510   1HB   GLU  66           HB1      GLU  66   8.903  -3.938  -3.938
  511   2HB   GLU  66           HB2      GLU  66   8.430  -5.141  -5.141
  512   1HG   GLU  66           HG1      GLU  66   6.119  -3.463  -3.463
  513   2HG   GLU  66           HG2      GLU  66   7.487  -2.394  -2.394
  514    H    LYS  67           HN       LYS  67   8.804  -4.921  -4.921
  515    HA   LYS  67           HA       LYS  67  10.464  -7.265  -7.265
  516   1HB   LYS  67           HB1      LYS  67  10.589  -4.868  -4.868
  517   2HB   LYS  67           HB2      LYS  67  11.265  -6.306  -6.306
  518   1HG   LYS  67           HG1      LYS  67  13.026  -5.221  -5.221
  519   2HG   LYS  67           HG2      LYS  67  12.618  -6.633  -6.633
  520   1HD   LYS  67           HD1      LYS  67  11.314  -5.177  -5.177
  521   2HD   LYS  67           HD2      LYS  67  11.765  -3.769  -3.769
  522   1HE   LYS  67           HE1      LYS  67  14.173  -4.242  -4.242
  523   2HE   LYS  67           HE2      LYS  67  13.713  -5.624  -5.624
  524   1HZ   LYS  67           HZ1      LYS  67  12.265  -3.392  -3.392
  525   2HZ   LYS  67           HZ2      LYS  67  13.901  -2.956  -2.956
  526   3HZ   LYS  67           HZ3      LYS  67  13.442  -4.287  -4.287
  527    H    ASP  68           HN       ASP  68   7.860  -6.523  -6.523
  528    HA   ASP  68           HA       ASP  68   8.174  -8.732  -8.732
  529   1HB   ASP  68           HB1      ASP  68   5.906  -6.759  -6.759
  530   2HB   ASP  68           HB2      ASP  68   5.918  -7.999  -7.999
  531    H    ILE  69           HN       ILE  69   6.606  -7.911  -7.911
  532    HA   ILE  69           HA       ILE  69   4.896 -10.302 -10.302
  533    HB   ILE  69           HB       ILE  69   3.996  -8.337  -8.337
  534   1HG1  ILE  69          HG11      ILE  69   3.312  -9.314  -9.314
  535   2HG1  ILE  69          HG12      ILE  69   4.770 -10.289 -10.289
  536   1HG2  ILE  69          HG21      ILE  69   6.115  -7.372  -7.372
  537   2HG2  ILE  69          HG22      ILE  69   6.326  -8.576  -8.576
  538   3HG2  ILE  69          HG23      ILE  69   4.992  -7.441  -7.441
  539   1HD1  ILE  69          HD11      ILE  69   2.650 -10.625 -10.625
  540   2HD1  ILE  69          HD12      ILE  69   2.823 -11.665 -11.665
  541   3HD1  ILE  69          HD13      ILE  69   4.064 -11.621 -11.621
  542    H    ALA  70           HN       ALA  70   7.647  -9.095  -9.095
  543    HA   ALA  70           HA       ALA  70   8.314 -11.352 -11.352
  544   1HB   ALA  70           HB1      ALA  70  10.206  -9.300  -9.300
  545   2HB   ALA  70           HB2      ALA  70  10.638 -10.399 -10.399
  546   3HB   ALA  70           HB3      ALA  70   9.438  -9.154  -9.154
  547    H    ALA  71           HN       ALA  71   8.715 -10.657 -10.657
  548    HA   ALA  71           HA       ALA  71  10.509 -12.926 -12.926
  549   1HB   ALA  71           HB1      ALA  71   9.215 -10.962 -10.962
  550   2HB   ALA  71           HB2      ALA  71  10.411 -12.167 -12.167
  551   3HB   ALA  71           HB3      ALA  71  10.851 -10.850 -10.850
  552    H    TYR  72           HN       TYR  72   7.171 -12.006 -12.006
  553    HA   TYR  72           HA       TYR  72   6.357 -14.234 -14.234
  554   1HB   TYR  72           HB1      TYR  72   5.045 -12.094 -12.094
  555   2HB   TYR  72           HB2      TYR  72   4.076 -13.555 -13.555
  556    HD1  TYR  72           HD1      TYR  72   6.640 -11.978 -11.978
  557    HD2  TYR  72           HD2      TYR  72   2.517 -12.802 -12.802
  558    HE1  TYR  72           HE1      TYR  72   6.119 -11.187 -11.187
  559    HE2  TYR  72           HE2      TYR  72   2.001 -12.012 -12.012
  560    HH   TYR  72           HH       TYR  72   3.705 -11.876 -11.876
  561    H    ARG  73           HN       ARG  73   6.531 -13.754 -13.754
  562    HA   ARG  73           HA       ARG  73   5.343 -16.375 -16.375
  563   1HB   ARG  73           HB1      ARG  73   6.516 -14.206 -14.206
  564   2HB   ARG  73           HB2      ARG  73   5.909 -15.718 -15.718
  565   1HG   ARG  73           HG1      ARG  73   3.852 -14.551 -14.551
  566   2HG   ARG  73           HG2      ARG  73   4.463 -13.294 -13.294
  567   1HD   ARG  73           HD1      ARG  73   3.391 -16.016 -16.016
  568   2HD   ARG  73           HD2      ARG  73   2.626 -14.452 -14.452
  569    HE   ARG  73           HE       ARG  73   5.272 -15.173 -15.173
  570   1HH1  ARG  73          HH11      ARG  73   3.912 -12.449 -12.449
  571   2HH1  ARG  73          HH12      ARG  73   4.952 -12.518 -12.518
  572   1HH2  ARG  73          HH21      ARG  73   2.712 -15.706 -15.706
  573   2HH2  ARG  73          HH22      ARG  73   2.607 -14.306 -14.306
  574    H    ALA  74           HN       ALA  74   8.394 -14.870 -14.870
  575    HA   ALA  74           HA       ALA  74   9.761 -17.178 -17.178
  576   1HB   ALA  74           HB1      ALA  74  10.596 -14.904 -14.904
  577   2HB   ALA  74           HB2      ALA  74  10.917 -14.705 -14.705
  578   3HB   ALA  74           HB3      ALA  74  11.822 -15.881 -15.881
  579    H    LYS  75           HN       LYS  75   8.764 -16.193 -16.193
  580    HA   LYS  75           HA       LYS  75  10.038 -18.550 -18.550
  581   1HB   LYS  75           HB1      LYS  75  11.740 -16.453 -16.453
  582   2HB   LYS  75           HB2      LYS  75  10.958 -16.004 -16.004
  583   1HG   LYS  75           HG1      LYS  75  11.495 -18.285 -18.285
  584   2HG   LYS  75           HG2      LYS  75  12.293 -18.678 -18.678
  585   1HD   LYS  75           HD1      LYS  75  13.734 -16.542 -16.542
  586   2HD   LYS  75           HD2      LYS  75  13.089 -16.577 -16.577
  587   1HE   LYS  75           HE1      LYS  75  13.951 -18.916 -18.916
  588   2HE   LYS  75           HE2      LYS  75  14.650 -18.816 -18.816
  589   1HZ   LYS  75           HZ1      LYS  75  15.450 -16.565 -16.565
  590   2HZ   LYS  75           HZ2      LYS  75  15.737 -17.944 -17.944
  591   3HZ   LYS  75           HZ3      LYS  75  16.401 -17.832 -17.832
  592    H    GLY  76           HN       GLY  76   7.407 -18.137 -18.137
  593   1HA   GLY  76           HA1      GLY  76   6.748 -17.379 -17.379
  594   2HA   GLY  76           HA2      GLY  76   5.614 -17.210 -17.210
  595    H    LYS  77           HN       LYS  77   4.699 -19.049 -19.049
  596    HA   LYS  77           HA       LYS  77   3.587 -21.113 -21.113
  597   1HB   LYS  77           HB1      LYS  77   6.354 -22.294 -22.294
  598   2HB   LYS  77           HB2      LYS  77   5.124 -22.883 -22.883
  599   1HG   LYS  77           HG1      LYS  77   5.472 -20.701 -20.701
  600   2HG   LYS  77           HG2      LYS  77   6.921 -20.470 -20.470
  601   1HD   LYS  77           HD1      LYS  77   7.674 -21.484 -21.484
  602   2HD   LYS  77           HD2      LYS  77   7.675 -22.792 -22.792
  603   1HE   LYS  77           HE1      LYS  77   5.507 -23.605 -23.605
  604   2HE   LYS  77           HE2      LYS  77   5.371 -22.210 -22.210
  605   1HZ   LYS  77           HZ1      LYS  77   7.833 -23.485 -23.485
  606   2HZ   LYS  77           HZ2      LYS  77   6.584 -24.639 -24.639
  607   3HZ   LYS  77           HZ3      LYS  77   6.529 -23.258 -23.258
  608    HA   PRO  78           HA       PRO  78   3.354 -22.549 -22.549
  609   1HB   PRO  78           HB1      PRO  78   4.264 -25.361 -25.361
  610   2HB   PRO  78           HB2      PRO  78   2.704 -24.784 -24.784
  611   1HG   PRO  78           HG1      PRO  78   2.906 -25.762 -25.762
  612   2HG   PRO  78           HG2      PRO  78   1.913 -24.330 -24.330
  613   1HD   PRO  78           HD1      PRO  78   4.839 -24.396 -24.396
  614   2HD   PRO  78           HD2      PRO  78   3.445 -23.577 -23.577
  615    H    ASP  79           HN       ASP  79   5.983 -21.500 -21.500
  616    HA   ASP  79           HA       ASP  79   7.638 -22.428 -22.428
  617   1HB   ASP  79           HB1      ASP  79   8.549 -22.001 -22.001
  618   2HB   ASP  79           HB2      ASP  79   9.603 -22.436 -22.436
  619    H    ALA  80           HN       ALA  80   9.618 -20.857 -20.857
  620    HA   ALA  80           HA       ALA  80   8.778 -18.027 -18.027
  621   1HB   ALA  80           HB1      ALA  80  10.092 -19.102 -19.102
  622   2HB   ALA  80           HB2      ALA  80   9.746 -17.412 -17.412
  623   3HB   ALA  80           HB3      ALA  80   8.428 -18.555 -18.555
  624    H    ALA  81           HN       ALA  81  11.406 -20.000 -20.000
  625    HA   ALA  81           HA       ALA  81  13.314 -18.773 -18.773
  626   1HB   ALA  81           HB1      ALA  81  13.845 -19.671 -19.671
  627   2HB   ALA  81           HB2      ALA  81  15.057 -19.039 -19.039
  628   3HB   ALA  81           HB3      ALA  81  13.750 -18.006 -18.006
  629   1H1   BME  16           HE1      MER  16  -8.105   8.833   8.833
  630   2H1   BME  16           HE2      MER  16  -8.430   8.914   8.914
  631   1H2   BME  16           HZ1      MER  16  -6.154   9.715   9.715
  632   2H2   BME  16           HZ2      MER  16  -5.742   9.624   9.624
  633    HO1  BME  16           HH       MER  16  -7.133   7.029   7.029

  Start of MODEL   42
    1    H    ASN   3           HN       ASN   3  -0.246 -11.612 -11.612
    2    HA   ASN   3           HA       ASN   3  -1.400 -13.148 -13.148
    3   1HB   ASN   3           HB1      ASN   3  -3.697 -12.257 -12.257
    4   2HB   ASN   3           HB2      ASN   3  -2.988 -13.409 -13.409
    5   1HD2  ASN   3          HD21      ASN   3  -3.136 -11.144 -11.144
    6   2HD2  ASN   3          HD22      ASN   3  -3.120 -12.752 -12.752
    7    H    ALA   4           HN       ALA   4   0.547 -11.258 -11.258
    8    HA   ALA   4           HA       ALA   4   1.052  -9.640  -9.640
    9   1HB   ALA   4           HB1      ALA   4  -1.133  -9.970  -9.970
   10   2HB   ALA   4           HB2      ALA   4  -1.926  -8.858  -8.858
   11   3HB   ALA   4           HB3      ALA   4  -0.667  -8.282  -8.282
   12    HA   PRO   5           HA       PRO   5   1.608  -6.642  -6.642
   13   1HB   PRO   5           HB1      PRO   5   3.722  -6.127  -6.127
   14   2HB   PRO   5           HB2      PRO   5   3.843  -5.934  -5.934
   15   1HG   PRO   5           HG1      PRO   5   4.776  -8.175  -8.175
   16   2HG   PRO   5           HG2      PRO   5   3.701  -8.355  -8.355
   17   1HD   PRO   5           HD1      PRO   5   3.009  -8.619  -8.619
   18   2HD   PRO   5           HD2      PRO   5   2.564  -9.702  -9.702
   19    H    LYS   6           HN       LYS   6   0.511  -6.381  -6.381
   20    HA   LYS   6           HA       LYS   6  -0.807  -4.898  -4.898
   21   1HB   LYS   6           HB1      LYS   6  -1.433  -4.516  -4.516
   22   2HB   LYS   6           HB2      LYS   6  -1.198  -2.894  -2.894
   23   1HG   LYS   6           HG1      LYS   6  -2.988  -4.935  -4.935
   24   2HG   LYS   6           HG2      LYS   6  -3.586  -3.886  -3.886
   25   1HD   LYS   6           HD1      LYS   6  -2.340  -2.892  -2.892
   26   2HD   LYS   6           HD2      LYS   6  -4.049  -3.082  -3.082
   27   1HE   LYS   6           HE1      LYS   6  -2.291  -1.234  -1.234
   28   2HE   LYS   6           HE2      LYS   6  -3.306  -0.720  -0.720
   29   1HZ   LYS   6           HZ1      LYS   6  -4.833  -2.299  -2.299
   30   2HZ   LYS   6           HZ2      LYS   6  -4.030  -1.108  -1.108
   31   3HZ   LYS   6           HZ3      LYS   6  -5.023  -0.659  -0.659
   32    H    ARG   7           HN       ARG   7  -0.755  -3.087  -3.087
   33    HA   ARG   7           HA       ARG   7   1.816  -1.850  -1.850
   34   1HB   ARG   7           HB1      ARG   7   0.587  -0.531  -0.531
   35   2HB   ARG   7           HB2      ARG   7   0.675  -2.270  -2.270
   36   1HG   ARG   7           HG1      ARG   7  -1.624  -2.556  -2.556
   37   2HG   ARG   7           HG2      ARG   7  -1.780  -0.863  -0.863
   38   1HD   ARG   7           HD1      ARG   7  -1.393  -2.005  -2.005
   39   2HD   ARG   7           HD2      ARG   7  -2.889  -1.354  -1.354
   40    HE   ARG   7           HE       ARG   7  -1.672   0.860   0.860
   41   1HH1  ARG   7          HH11      ARG   7   1.036   0.305   0.305
   42   2HH1  ARG   7          HH12      ARG   7   1.132   0.523   0.523
   43   1HH2  ARG   7          HH21      ARG   7  -2.339   0.316   0.316
   44   2HH2  ARG   7          HH22      ARG   7  -0.825   0.533   0.533
   45    HA   PRO   8           HA       PRO   8   0.701   1.153   1.153
   46   1HB   PRO   8           HB1      PRO   8   3.058   2.634   2.634
   47   2HB   PRO   8           HB2      PRO   8   2.918   1.056   1.056
   48   1HG   PRO   8           HG1      PRO   8   3.852   1.669   1.669
   49   2HG   PRO   8           HG2      PRO   8   4.688   0.729   0.729
   50   1HD   PRO   8           HD1      PRO   8   3.246  -0.561  -0.561
   51   2HD   PRO   8           HD2      PRO   8   3.082  -1.073  -1.073
   52    HA   PRO   9           HA       PRO   9  -0.860   5.050   5.050
   53   1HB   PRO   9           HB1      PRO   9   1.014   6.889   6.889
   54   2HB   PRO   9           HB2      PRO   9  -0.502   6.298   6.298
   55   1HG   PRO   9           HG1      PRO   9   2.278   5.131   5.131
   56   2HG   PRO   9           HG2      PRO   9   1.057   5.507   5.507
   57   1HD   PRO   9           HD1      PRO   9   1.206   3.001   3.001
   58   2HD   PRO   9           HD2      PRO   9  -0.414   3.727   3.727
   59    H    SER  10           HN       SER  10  -0.166   7.254   7.254
   60    HA   SER  10           HA       SER  10   1.446   6.626   6.626
   61   1HB   SER  10           HB1      SER  10  -0.596   8.820   8.820
   62   2HB   SER  10           HB2      SER  10   0.195   8.414   8.414
   63    HG   SER  10           HG       SER  10  -1.880   7.206   7.206
   64    H    ALA  11           HN       ALA  11   0.907   9.278   9.278
   65    HA   ALA  11           HA       ALA  11   3.293  10.259  10.259
   66   1HB   ALA  11           HB1      ALA  11   2.625  11.465  11.465
   67   2HB   ALA  11           HB2      ALA  11   3.900  12.025  12.025
   68   3HB   ALA  11           HB3      ALA  11   4.041  10.469  10.469
   69    H    PHE  12           HN       PHE  12   0.721  11.119  11.119
   70    HA   PHE  12           HA       PHE  12  -0.309  13.498  13.498
   71   1HB   PHE  12           HB1      PHE  12  -1.003  12.811  12.811
   72   2HB   PHE  12           HB2      PHE  12  -1.317  11.146  11.146
   73    HD1  PHE  12           HD1      PHE  12  -3.225  13.085  13.085
   74    HD2  PHE  12           HD2      PHE  12  -3.023  11.934  11.934
   75    HE1  PHE  12           HE1      PHE  12  -5.648  13.411  13.411
   76    HE2  PHE  12           HE2      PHE  12  -5.439  12.268  12.268
   77    HZ   PHE  12           HZ       PHE  12  -6.758  13.002  13.002
   78    H    PHE  13           HN       PHE  13  -0.999  10.086  10.086
   79    HA   PHE  13           HA       PHE  13  -3.003  10.180  10.180
   80   1HB   PHE  13           HB1      PHE  13  -1.540   8.194   8.194
   81   2HB   PHE  13           HB2      PHE  13  -0.688   8.373   8.373
   82    HD1  PHE  13           HD1      PHE  13  -2.180   8.430   8.430
   83    HD2  PHE  13           HD2      PHE  13  -3.618   7.089   7.089
   84    HE1  PHE  13           HE1      PHE  13  -4.066   7.311   7.311
   85    HE2  PHE  13           HE2      PHE  13  -5.499   5.972   5.972
   86    HZ   PHE  13           HZ       PHE  13  -5.728   6.084   6.084
   87    H    LEU  14           HN       LEU  14   0.437  10.725  10.725
   88    HA   LEU  14           HA       LEU  14   0.069  10.905  10.905
   89   1HB   LEU  14           HB1      LEU  14   2.086  12.396  12.396
   90   2HB   LEU  14           HB2      LEU  14   2.165  12.259  12.259
   91    HG   LEU  14           HG       LEU  14   3.704  10.704  10.704
   92   1HD1  LEU  14          HD11      LEU  14   2.207   9.478   9.478
   93   2HD1  LEU  14          HD12      LEU  14   1.229   8.947   8.947
   94   3HD1  LEU  14          HD13      LEU  14   2.890   8.409   8.409
   95   1HD2  LEU  14          HD21      LEU  14   3.413  10.853  10.853
   96   2HD2  LEU  14          HD22      LEU  14   3.569   9.172   9.172
   97   3HD2  LEU  14          HD23      LEU  14   1.991   9.816   9.816
   98    H    PHE  15           HN       PHE  15   0.259  13.585  13.585
   99    HA   PHE  15           HA       PHE  15  -0.476  15.573  15.573
  100   1HB   PHE  15           HB1      PHE  15   0.333  16.846  16.846
  101   2HB   PHE  15           HB2      PHE  15   0.466  15.366  15.366
  102    HD1  PHE  15           HD1      PHE  15  -1.479  14.738  14.738
  103    HD2  PHE  15           HD2      PHE  15  -0.999  18.632  18.632
  104    HE1  PHE  15           HE1      PHE  15  -2.956  15.625  15.625
  105    HE2  PHE  15           HE2      PHE  15  -2.492  19.536  19.536
  106    HZ   PHE  15           HZ       PHE  15  -3.465  18.024  18.024
  107    H    CYS  16           HN       MER  16  -2.389  13.667  13.667
  108    HA   CYS  16           HA       MER  16  -4.914  14.861  14.861
  109   1HB   CYS  16           HB1      MER  16  -5.741  13.020  13.020
  110   2HB   CYS  16           HB2      MER  16  -4.053  12.795  12.795
  111    H    SER  17           HN       SER  17  -3.442  12.246  12.246
  112    HA   SER  17           HA       SER  17  -5.604  11.979  11.979
  113   1HB   SER  17           HB1      SER  17  -3.967  10.702  10.702
  114   2HB   SER  17           HB2      SER  17  -3.733  10.314  10.314
  115    HG   SER  17           HG       SER  17  -1.820  11.112  11.112
  116    H    GLU  18           HN       GLU  18  -3.056  14.235  14.235
  117    HA   GLU  18           HA       GLU  18  -3.604  15.368  15.368
  118   1HB   GLU  18           HB1      GLU  18  -1.241  14.976  14.976
  119   2HB   GLU  18           HB2      GLU  18  -1.597  16.282  16.282
  120   1HG   GLU  18           HG1      GLU  18  -0.543  17.472  17.472
  121   2HG   GLU  18           HG2      GLU  18  -2.205  17.638  17.638
  122    H    TYR  19           HN       TYR  19  -5.061  15.536  15.536
  123    HA   TYR  19           HA       TYR  19  -5.520  18.488  18.488
  124   1HB   TYR  19           HB1      TYR  19  -5.241  16.497  16.497
  125   2HB   TYR  19           HB2      TYR  19  -6.648  17.572  17.572
  126    HD1  TYR  19           HD1      TYR  19  -3.176  18.000  18.000
  127    HD2  TYR  19           HD2      TYR  19  -6.138  19.369  19.369
  128    HE1  TYR  19           HE1      TYR  19  -1.674  19.792  19.792
  129    HE2  TYR  19           HE2      TYR  19  -4.639  21.155  21.155
  130    HH   TYR  19           HH       TYR  19  -2.371  21.760  21.760
  131    H    ARG  20           HN       ARG  20  -6.996  15.404  15.404
  132    HA   ARG  20           HA       ARG  20  -9.584  15.423  15.423
  133   1HB   ARG  20           HB1      ARG  20  -9.153  14.776  14.776
  134   2HB   ARG  20           HB2      ARG  20 -10.074  13.953  13.953
  135   1HG   ARG  20           HG1      ARG  20  -7.868  13.217  13.217
  136   2HG   ARG  20           HG2      ARG  20  -7.106  13.900  13.900
  137   1HD   ARG  20           HD1      ARG  20  -9.046  11.551  11.551
  138   2HD   ARG  20           HD2      ARG  20  -7.471  11.605  11.605
  139    HE   ARG  20           HE       ARG  20  -9.779  13.181  13.181
  140   1HH1  ARG  20          HH11      ARG  20  -6.743  12.625  12.625
  141   2HH1  ARG  20          HH12      ARG  20  -7.125  11.799  11.799
  142   1HH2  ARG  20          HH21      ARG  20 -10.502  11.417  11.417
  143   2HH2  ARG  20          HH22      ARG  20  -9.320  11.092  11.092
  144    HA   PRO  21           HA       PRO  21 -11.433  17.560  17.560
  145   1HB   PRO  21           HB1      PRO  21 -10.201  18.031  18.031
  146   2HB   PRO  21           HB2      PRO  21 -10.382  16.381  16.381
  147   1HG   PRO  21           HG1      PRO  21  -7.905  18.111  18.111
  148   2HG   PRO  21           HG2      PRO  21  -8.040  16.360  16.360
  149   1HD   PRO  21           HD1      PRO  21  -7.518  17.894  17.894
  150   2HD   PRO  21           HD2      PRO  21  -7.684  16.138  16.138
  151    H    LYS  22           HN       LYS  22  -8.838  19.157  19.157
  152    HA   LYS  22           HA       LYS  22  -9.453  21.864  21.864
  153   1HB   LYS  22           HB1      LYS  22  -7.059  21.047  21.047
  154   2HB   LYS  22           HB2      LYS  22  -7.388  20.919  20.919
  155   1HG   LYS  22           HG1      LYS  22  -8.076  23.456  23.456
  156   2HG   LYS  22           HG2      LYS  22  -7.364  23.433  23.433
  157   1HD   LYS  22           HD1      LYS  22  -5.659  24.249  24.249
  158   2HD   LYS  22           HD2      LYS  22  -5.201  22.623  22.623
  159   1HE   LYS  22           HE1      LYS  22  -4.912  22.962  22.962
  160   2HE   LYS  22           HE2      LYS  22  -6.145  21.746  21.746
  161   1HZ   LYS  22           HZ1      LYS  22  -7.319  24.310  24.310
  162   2HZ   LYS  22           HZ2      LYS  22  -6.376  24.110  24.110
  163   3HZ   LYS  22           HZ3      LYS  22  -7.610  22.999  22.999
  164    H    ILE  23           HN       ILE  23  -9.808  19.748  19.748
  165    HA   ILE  23           HA       ILE  23 -10.847  21.997  21.997
  166    HB   ILE  23           HB       ILE  23 -11.521  19.517  19.517
  167   1HG1  ILE  23          HG11      ILE  23  -8.663  19.426  19.426
  168   2HG1  ILE  23          HG12      ILE  23  -9.942  18.294  18.294
  169   1HG2  ILE  23          HG21      ILE  23 -10.931  21.652  21.652
  170   2HG2  ILE  23          HG22      ILE  23  -9.269  21.492  21.492
  171   3HG2  ILE  23          HG23      ILE  23  -9.924  20.381  20.381
  172   1HD1  ILE  23          HD11      ILE  23 -10.158  17.754  17.754
  173   2HD1  ILE  23          HD12      ILE  23  -8.752  18.734  18.734
  174   3HD1  ILE  23          HD13      ILE  23  -8.607  17.301  17.301
  175    H    LYS  24           HN       LYS  24 -11.744  19.182  19.182
  176    HA   LYS  24           HA       LYS  24 -14.489  19.039  19.039
  177   1HB   LYS  24           HB1      LYS  24 -13.073  17.390  17.390
  178   2HB   LYS  24           HB2      LYS  24 -12.957  18.523  18.523
  179   1HG   LYS  24           HG1      LYS  24 -15.610  18.415  18.415
  180   2HG   LYS  24           HG2      LYS  24 -15.451  17.014  17.014
  181   1HD   LYS  24           HD1      LYS  24 -15.664  16.240  16.240
  182   2HD   LYS  24           HD2      LYS  24 -14.008  15.940  15.940
  183   1HE   LYS  24           HE1      LYS  24 -13.224  17.917  17.917
  184   2HE   LYS  24           HE2      LYS  24 -14.869  18.433  18.433
  185   1HZ   LYS  24           HZ1      LYS  24 -14.550  15.799  15.799
  186   2HZ   LYS  24           HZ2      LYS  24 -13.263  16.738  16.738
  187   3HZ   LYS  24           HZ3      LYS  24 -14.870  17.203  17.203
  188    H    GLY  25           HN       GLY  25 -12.649  20.963  20.963
  189   1HA   GLY  25           HA1      GLY  25 -14.864  22.099  22.099
  190   2HA   GLY  25           HA2      GLY  25 -13.203  22.685  22.685
  191    H    GLU  26           HN       GLU  26 -12.868  23.246  23.246
  192    HA   GLU  26           HA       GLU  26 -14.119  25.816  25.816
  193   1HB   GLU  26           HB1      GLU  26 -12.278  24.260  24.260
  194   2HB   GLU  26           HB2      GLU  26 -12.657  25.961  25.961
  195   1HG   GLU  26           HG1      GLU  26 -11.474  24.808  24.808
  196   2HG   GLU  26           HG2      GLU  26 -10.471  25.426  25.426
  197    H    HIS  27           HN       HIS  27 -14.332  22.832  22.832
  198    HA   HIS  27           HA       HIS  27 -16.752  23.728  23.728
  199   1HB   HIS  27           HB1      HIS  27 -14.570  21.855  21.855
  200   2HB   HIS  27           HB2      HIS  27 -15.918  22.519  22.519
  201    HD1  HIS  27           HD1      HIS  27 -15.809  25.310  25.310
  202    HD2  HIS  27           HD2      HIS  27 -12.291  23.357  23.357
  203    HE1  HIS  27           HE1      HIS  27 -14.012  26.951  26.951
  204    HA   PRO  28           HA       PRO  28 -17.837  19.854  19.854
  205   1HB   PRO  28           HB1      PRO  28 -19.865  20.811  20.811
  206   2HB   PRO  28           HB2      PRO  28 -18.194  21.100  21.100
  207   1HG   PRO  28           HG1      PRO  28 -20.007  22.967  22.967
  208   2HG   PRO  28           HG2      PRO  28 -19.147  23.352  23.352
  209   1HD   PRO  28           HD1      PRO  28 -18.039  23.914  23.914
  210   2HD   PRO  28           HD2      PRO  28 -16.994  23.403  23.403
  211    H    GLY  29           HN       GLY  29 -18.159  20.553  20.553
  212   1HA   GLY  29           HA1      GLY  29 -20.953  19.880  19.880
  213   2HA   GLY  29           HA2      GLY  29 -20.074  21.101  21.101
  214    H    LEU  30           HN       LEU  30 -17.667  19.061  19.061
  215    HA   LEU  30           HA       LEU  30 -17.841  17.677  17.677
  216   1HB   LEU  30           HB1      LEU  30 -15.656  17.658  17.658
  217   2HB   LEU  30           HB2      LEU  30 -15.458  17.108  17.108
  218    HG   LEU  30           HG       LEU  30 -15.838  19.915  19.915
  219   1HD1  LEU  30          HD11      LEU  30 -13.606  18.599  18.599
  220   2HD1  LEU  30          HD12      LEU  30 -13.648  20.294  20.294
  221   3HD1  LEU  30          HD13      LEU  30 -13.551  19.065  19.065
  222   1HD2  LEU  30          HD21      LEU  30 -17.193  19.735  19.735
  223   2HD2  LEU  30          HD22      LEU  30 -15.771  20.725  20.725
  224   3HD2  LEU  30          HD23      LEU  30 -15.800  19.077  19.077
  225    H    SER  31           HN       SER  31 -17.170  15.494  15.494
  226    HA   SER  31           HA       SER  31 -18.174  13.668  13.668
  227   1HB   SER  31           HB1      SER  31 -19.538  13.741  13.741
  228   2HB   SER  31           HB2      SER  31 -18.085  13.102  13.102
  229    HG   SER  31           HG       SER  31 -19.894  11.805  11.805
  230    H    ILE  32           HN       ILE  32 -17.136  11.428  11.428
  231    HA   ILE  32           HA       ILE  32 -14.314  11.705  11.705
  232    HB   ILE  32           HB       ILE  32 -15.683   9.884   9.884
  233   1HG1  ILE  32          HG11      ILE  32 -13.172   9.438   9.438
  234   2HG1  ILE  32          HG12      ILE  32 -14.147   8.135   8.135
  235   1HG2  ILE  32          HG21      ILE  32 -16.222   9.002   9.002
  236   2HG2  ILE  32          HG22      ILE  32 -16.640   8.053   8.053
  237   3HG2  ILE  32          HG23      ILE  32 -17.393   9.611   9.611
  238   1HD1  ILE  32          HD11      ILE  32 -13.681   8.636   8.636
  239   2HD1  ILE  32          HD12      ILE  32 -12.910   7.407   7.407
  240   3HD1  ILE  32          HD13      ILE  32 -14.633   7.342   7.342
  241    H    GLY  33           HN       GLY  33 -16.202  11.737  11.737
  242   1HA   GLY  33           HA1      GLY  33 -14.014  10.936  10.936
  243   2HA   GLY  33           HA2      GLY  33 -15.703  11.136  11.136
  244    H    ASP  34           HN       ASP  34 -15.241  13.702  13.702
  245    HA   ASP  34           HA       ASP  34 -14.417  15.429  15.429
  246   1HB   ASP  34           HB1      ASP  34 -15.991  16.030  16.030
  247   2HB   ASP  34           HB2      ASP  34 -15.725  17.236  17.236
  248    H    VAL  35           HN       VAL  35 -14.157  14.930  14.930
  249    HA   VAL  35           HA       VAL  35 -12.193  16.853  16.853
  250    HB   VAL  35           HB       VAL  35 -12.892  14.067  14.067
  251   1HG1  VAL  35          HG11      VAL  35 -10.536  14.539  14.539
  252   2HG1  VAL  35          HG12      VAL  35 -11.040  16.065  16.065
  253   3HG1  VAL  35          HG13      VAL  35 -11.597  14.564  14.564
  254   1HG2  VAL  35          HG21      VAL  35 -13.442  16.865  16.865
  255   2HG2  VAL  35          HG22      VAL  35 -14.612  15.806  15.806
  256   3HG2  VAL  35          HG23      VAL  35 -13.914  15.362  15.362
  257    H    ALA  36           HN       ALA  36 -12.146  13.696  13.696
  258    HA   ALA  36           HA       ALA  36  -9.305  13.357  13.357
  259   1HB   ALA  36           HB1      ALA  36 -10.868  11.490  11.490
  260   2HB   ALA  36           HB2      ALA  36 -11.629  11.892  11.892
  261   3HB   ALA  36           HB3      ALA  36  -9.988  11.256  11.256
  262    H    LYS  37           HN       LYS  37 -11.829  13.879  13.879
  263    HA   LYS  37           HA       LYS  37  -9.776  14.096  14.096
  264   1HB   LYS  37           HB1      LYS  37 -12.696  14.927  14.927
  265   2HB   LYS  37           HB2      LYS  37 -11.644  14.992  14.992
  266   1HG   LYS  37           HG1      LYS  37 -11.209  12.575  12.575
  267   2HG   LYS  37           HG2      LYS  37 -12.166  12.443  12.443
  268   1HD   LYS  37           HD1      LYS  37 -13.616  11.726  11.726
  269   2HD   LYS  37           HD2      LYS  37 -14.166  13.333  13.333
  270   1HE   LYS  37           HE1      LYS  37 -14.002  13.080  13.080
  271   2HE   LYS  37           HE2      LYS  37 -12.862  14.298  14.298
  272   1HZ   LYS  37           HZ1      LYS  37 -11.661  11.750  11.750
  273   2HZ   LYS  37           HZ2      LYS  37 -12.332  12.001  12.001
  274   3HZ   LYS  37           HZ3      LYS  37 -11.210  13.110  13.110
  275    H    LYS  38           HN       LYS  38 -10.915  16.310  16.310
  276    HA   LYS  38           HA       LYS  38 -10.206  18.678  18.678
  277   1HB   LYS  38           HB1      LYS  38 -12.186  18.640  18.640
  278   2HB   LYS  38           HB2      LYS  38 -11.116  18.376  18.376
  279   1HG   LYS  38           HG1      LYS  38 -10.910  20.805  20.805
  280   2HG   LYS  38           HG2      LYS  38 -11.961  20.760  20.760
  281   1HD   LYS  38           HD1      LYS  38  -9.934  20.272  20.272
  282   2HD   LYS  38           HD2      LYS  38  -8.919  20.503  20.503
  283   1HE   LYS  38           HE1      LYS  38 -10.839  22.596  22.596
  284   2HE   LYS  38           HE2      LYS  38  -9.100  22.606  22.606
  285   1HZ   LYS  38           HZ1      LYS  38  -9.594  22.239  22.239
  286   2HZ   LYS  38           HZ2      LYS  38 -10.511  23.564  23.564
  287   3HZ   LYS  38           HZ3      LYS  38  -8.830  23.537  23.537
  288    H    LEU  39           HN       LEU  39  -9.216  17.213  17.213
  289    HA   LEU  39           HA       LEU  39  -6.812  18.801  18.801
  290   1HB   LEU  39           HB1      LEU  39  -6.633  17.938  17.938
  291   2HB   LEU  39           HB2      LEU  39  -8.256  17.391  17.391
  292    HG   LEU  39           HG       LEU  39  -7.112  15.244  15.244
  293   1HD1  LEU  39          HD11      LEU  39  -5.038  16.580  16.580
  294   2HD1  LEU  39          HD12      LEU  39  -4.916  14.910  14.910
  295   3HD1  LEU  39          HD13      LEU  39  -4.865  16.137  16.137
  296   1HD2  LEU  39          HD21      LEU  39  -8.517  15.494  15.494
  297   2HD2  LEU  39          HD22      LEU  39  -7.195  14.366  14.366
  298   3HD2  LEU  39          HD23      LEU  39  -7.051  16.005  16.005
  299    H    GLY  40           HN       GLY  40  -7.688  15.794  15.794
  300   1HA   GLY  40           HA1      GLY  40  -4.979  14.901  14.901
  301   2HA   GLY  40           HA2      GLY  40  -6.343  14.395  14.395
  302    H    GLU  41           HN       GLU  41  -7.186  16.914  16.914
  303    HA   GLU  41           HA       GLU  41  -5.314  17.358  17.358
  304   1HB   GLU  41           HB1      GLU  41  -7.452  19.112  19.112
  305   2HB   GLU  41           HB2      GLU  41  -6.605  19.556  19.556
  306   1HG   GLU  41           HG1      GLU  41  -8.066  16.906  16.906
  307   2HG   GLU  41           HG2      GLU  41  -8.888  18.344  18.344
  308    H    MET  42           HN       MET  42  -5.914  19.062  19.062
  309    HA   MET  42           HA       MET  42  -4.048  21.150  21.150
  310   1HB   MET  42           HB1      MET  42  -4.793  19.560  19.560
  311   2HB   MET  42           HB2      MET  42  -3.959  21.107  21.107
  312   1HG   MET  42           HG1      MET  42  -6.630  20.711  20.711
  313   2HG   MET  42           HG2      MET  42  -6.569  21.151  21.151
  314   1HE   MET  42           HE1      MET  42  -7.409  22.270  22.270
  315   2HE   MET  42           HE2      MET  42  -6.466  23.691  23.691
  316   3HE   MET  42           HE3      MET  42  -5.683  22.125  22.125
  317    H    TRP  43           HN       TRP  43  -3.578  17.951  17.951
  318    HA   TRP  43           HA       TRP  43  -0.903  17.947  17.947
  319   1HB   TRP  43           HB1      TRP  43  -2.274  16.015  16.015
  320   2HB   TRP  43           HB2      TRP  43  -2.584  15.752  15.752
  321    HD1  TRP  43           HD1      TRP  43  -0.953  14.275  14.275
  322    HE1  TRP  43           HE1      TRP  43   1.273  13.351  13.351
  323    HE3  TRP  43           HE3      TRP  43  -0.216  16.588  16.588
  324    HZ2  TRP  43           HZ2      TRP  43   3.274  13.497  13.497
  325    HZ3  TRP  43           HZ3      TRP  43   1.801  16.218  16.218
  326    HH2  TRP  43           HH2      TRP  43   3.570  14.667  14.667
  327    H    ASN  44           HN       ASN  44  -2.295  17.315  17.315
  328    HA   ASN  44           HA       ASN  44   0.133  16.864  16.864
  329   1HB   ASN  44           HB1      ASN  44  -2.486  17.912  17.912
  330   2HB   ASN  44           HB2      ASN  44  -1.161  17.142  17.142
  331   1HD2  ASN  44          HD21      ASN  44  -3.930  14.742  14.742
  332   2HD2  ASN  44          HD22      ASN  44  -4.142  16.357  16.357
  333    H    ASN  45           HN       ASN  45  -0.908  19.652  19.652
  334    HA   ASN  45           HA       ASN  45   1.124  21.319  21.319
  335   1HB   ASN  45           HB1      ASN  45  -0.525  23.152  23.152
  336   2HB   ASN  45           HB2      ASN  45  -0.902  21.709  21.709
  337   1HD2  ASN  45          HD21      ASN  45  -4.138  21.488  21.488
  338   2HD2  ASN  45          HD22      ASN  45  -3.077  21.028  21.028
  339    H    THR  46           HN       THR  46   0.989  20.267  20.267
  340    HA   THR  46           HA       THR  46  -0.114  22.255  22.255
  341    HB   THR  46           HB       THR  46   0.202  19.930  19.930
  342    HG1  THR  46           HG1      THR  46   0.635  20.859  20.859
  343   1HG2  THR  46          HG21      THR  46   2.348  19.278  19.278
  344   2HG2  THR  46          HG22      THR  46   3.241  20.339  20.339
  345   3HG2  THR  46          HG23      THR  46   2.390  18.961  18.961
  346    H    ALA  47           HN       ALA  47   3.162  21.418  21.418
  347    HA   ALA  47           HA       ALA  47   4.028  24.169  24.169
  348   1HB   ALA  47           HB1      ALA  47   4.244  23.712  23.712
  349   2HB   ALA  47           HB2      ALA  47   5.351  22.410  22.410
  350   3HB   ALA  47           HB3      ALA  47   5.770  24.068  24.068
  351    H    ALA  48           HN       ALA  48   4.932  20.938  20.938
  352    HA   ALA  48           HA       ALA  48   5.775  19.326  19.326
  353   1HB   ALA  48           HB1      ALA  48   6.117  21.011  21.011
  354   2HB   ALA  48           HB2      ALA  48   7.529  21.629  21.629
  355   3HB   ALA  48           HB3      ALA  48   7.507  19.976  19.976
  356    H    ASP  49           HN       ASP  49   7.312  22.045  22.045
  357    HA   ASP  49           HA       ASP  49   9.572  20.542  20.542
  358   1HB   ASP  49           HB1      ASP  49   8.810  23.480  23.480
  359   2HB   ASP  49           HB2      ASP  49  10.365  22.777  22.777
  360    H    ASP  50           HN       ASP  50   6.605  20.372  20.372
  361    HA   ASP  50           HA       ASP  50   6.869  20.489  20.489
  362   1HB   ASP  50           HB1      ASP  50   5.292  22.284  22.284
  363   2HB   ASP  50           HB2      ASP  50   4.396  21.109  21.109
  364    H    LYS  51           HN       LYS  51   6.379  18.805  18.805
  365    HA   LYS  51           HA       LYS  51   4.767  16.618  16.618
  366   1HB   LYS  51           HB1      LYS  51   6.298  16.755  16.755
  367   2HB   LYS  51           HB2      LYS  51   5.090  15.565  15.565
  368   1HG   LYS  51           HG1      LYS  51   3.352  17.277  17.277
  369   2HG   LYS  51           HG2      LYS  51   4.543  18.541  18.541
  370   1HD   LYS  51           HD1      LYS  51   3.523  18.081  18.081
  371   2HD   LYS  51           HD2      LYS  51   5.133  17.385  17.385
  372   1HE   LYS  51           HE1      LYS  51   4.213  15.158  15.158
  373   2HE   LYS  51           HE2      LYS  51   2.600  15.875  15.875
  374   1HZ   LYS  51           HZ1      LYS  51   3.842  16.587  16.587
  375   2HZ   LYS  51           HZ2      LYS  51   4.105  14.922  14.922
  376   3HZ   LYS  51           HZ3      LYS  51   2.519  15.539  15.539
  377    H    GLN  52           HN       GLN  52   7.973  17.163  17.163
  378    HA   GLN  52           HA       GLN  52   9.428  15.014  15.014
  379   1HB   GLN  52           HB1      GLN  52  10.041  17.720  17.720
  380   2HB   GLN  52           HB2      GLN  52  10.671  17.238  17.238
  381   1HG   GLN  52           HG1      GLN  52  12.454  17.024  17.024
  382   2HG   GLN  52           HG2      GLN  52  11.986  15.410  15.410
  383   1HE2  GLN  52          HE21      GLN  52  10.099  15.797  15.797
  384   2HE2  GLN  52          HE22      GLN  52   9.494  16.409  16.409
  385    HA   PRO  53           HA       PRO  53   9.895  14.835  14.835
  386   1HB   PRO  53           HB1      PRO  53   7.715  15.967  15.967
  387   2HB   PRO  53           HB2      PRO  53   9.281  16.750  16.750
  388   1HG   PRO  53           HG1      PRO  53   6.824  16.953  16.953
  389   2HG   PRO  53           HG2      PRO  53   7.732  18.286  18.286
  390   1HD   PRO  53           HD1      PRO  53   8.372  17.645  17.645
  391   2HD   PRO  53           HD2      PRO  53   9.721  17.758  17.758
  392    H    TYR  54           HN       TYR  54   6.542  15.041  15.041
  393    HA   TYR  54           HA       TYR  54   5.637  12.653  12.653
  394   1HB   TYR  54           HB1      TYR  54   4.503  14.192  14.192
  395   2HB   TYR  54           HB2      TYR  54   3.640  12.908  12.908
  396    HD1  TYR  54           HD1      TYR  54   4.004  13.393  13.393
  397    HD2  TYR  54           HD2      TYR  54   3.688  16.296  16.296
  398    HE1  TYR  54           HE1      TYR  54   3.226  15.043  15.043
  399    HE2  TYR  54           HE2      TYR  54   2.910  17.950  17.950
  400    HH   TYR  54           HH       TYR  54   3.314  17.760  17.760
  401    H    GLU  55           HN       GLU  55   6.453  13.413  13.413
  402    HA   GLU  55           HA       GLU  55   6.091  10.909  10.909
  403   1HB   GLU  55           HB1      GLU  55   7.298  13.467  13.467
  404   2HB   GLU  55           HB2      GLU  55   8.435  12.260  12.260
  405   1HG   GLU  55           HG1      GLU  55   6.540  11.148  11.148
  406   2HG   GLU  55           HG2      GLU  55   5.471  12.433  12.433
  407    H    LYS  56           HN       LYS  56   9.099  12.144  12.144
  408    HA   LYS  56           HA       LYS  56  10.782   9.977   9.977
  409   1HB   LYS  56           HB1      LYS  56  11.470  12.197  12.197
  410   2HB   LYS  56           HB2      LYS  56  10.572  11.899  11.899
  411   1HG   LYS  56           HG1      LYS  56  12.093   9.922   9.922
  412   2HG   LYS  56           HG2      LYS  56  13.005  10.339  10.339
  413   1HD   LYS  56           HD1      LYS  56  13.508  12.583  12.583
  414   2HD   LYS  56           HD2      LYS  56  12.581  12.171  12.171
  415   1HE   LYS  56           HE1      LYS  56  14.142  10.278  10.278
  416   2HE   LYS  56           HE2      LYS  56  15.086  10.725  10.725
  417   1HZ   LYS  56           HZ1      LYS  56  14.715  13.005  13.005
  418   2HZ   LYS  56           HZ2      LYS  56  15.272  11.744  11.744
  419   3HZ   LYS  56           HZ3      LYS  56  16.158  12.198  12.198
  420    H    LYS  57           HN       LYS  57   8.325  10.569  10.569
  421    HA   LYS  57           HA       LYS  57   8.860   8.381   8.381
  422   1HB   LYS  57           HB1      LYS  57   7.186  10.451  10.451
  423   2HB   LYS  57           HB2      LYS  57   6.024   9.386   9.386
  424   1HG   LYS  57           HG1      LYS  57   5.625   8.929   8.929
  425   2HG   LYS  57           HG2      LYS  57   6.666   7.616   7.616
  426   1HD   LYS  57           HD1      LYS  57   7.955   8.204   8.204
  427   2HD   LYS  57           HD2      LYS  57   8.556   9.489   9.489
  428   1HE   LYS  57           HE1      LYS  57   6.213   9.734   9.734
  429   2HE   LYS  57           HE2      LYS  57   7.817  10.395  10.395
  430   1HZ   LYS  57           HZ1      LYS  57   6.862  11.290  11.290
  431   2HZ   LYS  57           HZ2      LYS  57   5.669  11.564  11.564
  432   3HZ   LYS  57           HZ3      LYS  57   7.230  12.191  12.191
  433    H    ALA  58           HN       ALA  58   6.400   8.764   8.764
  434    HA   ALA  58           HA       ALA  58   5.292   6.276   6.276
  435   1HB   ALA  58           HB1      ALA  58   4.689   8.149   8.149
  436   2HB   ALA  58           HB2      ALA  58   6.207   7.963   7.963
  437   3HB   ALA  58           HB3      ALA  58   5.008   6.693   6.693
  438    H    ALA  59           HN       ALA  59   8.198   7.226   7.226
  439    HA   ALA  59           HA       ALA  59   8.957   4.812   4.812
  440   1HB   ALA  59           HB1      ALA  59  10.162   6.971   6.971
  441   2HB   ALA  59           HB2      ALA  59  10.822   6.856   6.856
  442   3HB   ALA  59           HB3      ALA  59  11.290   5.687   5.687
  443    H    LYS  60           HN       LYS  60  10.255   5.945   5.945
  444    HA   LYS  60           HA       LYS  60  11.653   3.820   3.820
  445   1HB   LYS  60           HB1      LYS  60  11.119   6.171   6.171
  446   2HB   LYS  60           HB2      LYS  60   9.767   5.384   5.384
  447   1HG   LYS  60           HG1      LYS  60  11.356   3.751   3.751
  448   2HG   LYS  60           HG2      LYS  60  12.691   4.581   4.581
  449   1HD   LYS  60           HD1      LYS  60  11.869   6.734   6.734
  450   2HD   LYS  60           HD2      LYS  60  10.802   5.703   5.703
  451   1HE   LYS  60           HE1      LYS  60  12.860   6.072   6.072
  452   2HE   LYS  60           HE2      LYS  60  12.829   4.388   4.388
  453   1HZ   LYS  60           HZ1      LYS  60  14.033   5.910   5.910
  454   2HZ   LYS  60           HZ2      LYS  60  14.755   6.324   6.324
  455   3HZ   LYS  60           HZ3      LYS  60  14.729   4.704   4.704
  456    H    LEU  61           HN       LEU  61   8.183   4.282   4.282
  457    HA   LEU  61           HA       LEU  61   7.692   1.807   1.807
  458   1HB   LEU  61           HB1      LEU  61   5.741   3.377   3.377
  459   2HB   LEU  61           HB2      LEU  61   5.335   2.266   2.266
  460    HG   LEU  61           HG       LEU  61   6.798   4.929   4.929
  461   1HD1  LEU  61          HD11      LEU  61   4.136   3.961   3.961
  462   2HD1  LEU  61          HD12      LEU  61   4.861   5.534   5.534
  463   3HD1  LEU  61          HD13      LEU  61   4.404   5.105   5.105
  464   1HD2  LEU  61          HD21      LEU  61   6.281   2.866   2.866
  465   2HD2  LEU  61          HD22      LEU  61   7.854   3.337   3.337
  466   3HD2  LEU  61          HD23      LEU  61   6.890   4.498   4.498
  467    H    LYS  62           HN       LYS  62   7.188   2.667   2.667
  468    HA   LYS  62           HA       LYS  62   6.330   0.245   0.245
  469   1HB   LYS  62           HB1      LYS  62   8.531   2.020   2.020
  470   2HB   LYS  62           HB2      LYS  62   7.589   0.837   0.837
  471   1HG   LYS  62           HG1      LYS  62   5.864   2.777   2.777
  472   2HG   LYS  62           HG2      LYS  62   6.961   3.572   3.572
  473   1HD   LYS  62           HD1      LYS  62   5.194   1.218   1.218
  474   2HD   LYS  62           HD2      LYS  62   4.734   2.898   2.898
  475   1HE   LYS  62           HE1      LYS  62   6.701   3.277   3.277
  476   2HE   LYS  62           HE2      LYS  62   7.238   1.622   1.622
  477   1HZ   LYS  62           HZ1      LYS  62   4.566   1.578   1.578
  478   2HZ   LYS  62           HZ2      LYS  62   5.419   2.595   2.595
  479   3HZ   LYS  62           HZ3      LYS  62   5.934   0.995   0.995
  480    H    GLU  63           HN       GLU  63   9.563   1.316   1.316
  481    HA   GLU  63           HA       GLU  63  11.136  -0.846  -0.846
  482   1HB   GLU  63           HB1      GLU  63  11.300   1.601   1.601
  483   2HB   GLU  63           HB2      GLU  63  12.420   0.395   0.395
  484   1HG   GLU  63           HG1      GLU  63  13.556   1.791   1.791
  485   2HG   GLU  63           HG2      GLU  63  13.202   0.337   0.337
  486    H    LYS  64           HN       LYS  64   9.796  -0.153  -0.153
  487    HA   LYS  64           HA       LYS  64  10.686  -2.520  -2.520
  488   1HB   LYS  64           HB1      LYS  64   8.131  -0.923  -0.923
  489   2HB   LYS  64           HB2      LYS  64   8.731  -2.180  -2.180
  490   1HG   LYS  64           HG1      LYS  64  10.886  -0.945  -0.945
  491   2HG   LYS  64           HG2      LYS  64  10.243   0.344   0.344
  492   1HD   LYS  64           HD1      LYS  64   8.412   0.730   0.730
  493   2HD   LYS  64           HD2      LYS  64   9.023  -0.570  -0.570
  494   1HE   LYS  64           HE1      LYS  64  10.545   1.976   1.976
  495   2HE   LYS  64           HE2      LYS  64   9.805   1.622   1.622
  496   1HZ   LYS  64           HZ1      LYS  64  11.445  -0.528  -0.528
  497   2HZ   LYS  64           HZ2      LYS  64  12.338   0.890   0.890
  498   3HZ   LYS  64           HZ3      LYS  64  11.634   0.589   0.589
  499    H    TYR  65           HN       TYR  65   7.613  -1.903  -1.903
  500    HA   TYR  65           HA       TYR  65   6.409  -4.437  -4.437
  501   1HB   TYR  65           HB1      TYR  65   4.956  -2.739  -2.739
  502   2HB   TYR  65           HB2      TYR  65   6.135  -2.065  -2.065
  503    HD1  TYR  65           HD1      TYR  65   6.425  -3.086  -3.086
  504    HD2  TYR  65           HD2      TYR  65   3.351  -4.428  -4.428
  505    HE1  TYR  65           HE1      TYR  65   5.342  -4.221  -4.221
  506    HE2  TYR  65           HE2      TYR  65   2.260  -5.568  -5.568
  507    HH   TYR  65           HH       TYR  65   3.111  -6.542  -6.542
  508    H    GLU  66           HN       GLU  66   8.422  -3.305  -3.305
  509    HA   GLU  66           HA       GLU  66   8.257  -5.566  -5.566
  510   1HB   GLU  66           HB1      GLU  66  10.653  -3.807  -3.807
  511   2HB   GLU  66           HB2      GLU  66  10.470  -4.917  -4.917
  512   1HG   GLU  66           HG1      GLU  66   8.087  -3.364  -3.364
  513   2HG   GLU  66           HG2      GLU  66   9.358  -2.214  -2.214
  514    H    LYS  67           HN       LYS  67  10.093  -5.084  -5.084
  515    HA   LYS  67           HA       LYS  67  11.641  -7.551  -7.551
  516   1HB   LYS  67           HB1      LYS  67  11.642  -6.091  -6.091
  517   2HB   LYS  67           HB2      LYS  67  12.936  -6.997  -6.997
  518   1HG   LYS  67           HG1      LYS  67  12.043  -4.178  -4.178
  519   2HG   LYS  67           HG2      LYS  67  13.621  -4.777  -4.777
  520   1HD   LYS  67           HD1      LYS  67  13.590  -5.931  -5.931
  521   2HD   LYS  67           HD2      LYS  67  12.245  -4.859  -4.859
  522   1HE   LYS  67           HE1      LYS  67  14.313  -3.767  -3.767
  523   2HE   LYS  67           HE2      LYS  67  13.603  -2.895  -2.895
  524   1HZ   LYS  67           HZ1      LYS  67  15.278  -4.813  -4.813
  525   2HZ   LYS  67           HZ2      LYS  67  16.144  -4.085  -4.085
  526   3HZ   LYS  67           HZ3      LYS  67  15.495  -3.131  -3.131
  527    H    ASP  68           HN       ASP  68   8.745  -6.703  -6.703
  528    HA   ASP  68           HA       ASP  68   8.657  -8.986  -8.986
  529   1HB   ASP  68           HB1      ASP  68   7.870  -6.538  -6.538
  530   2HB   ASP  68           HB2      ASP  68   6.439  -6.983  -6.983
  531    H    ILE  69           HN       ILE  69   7.740  -7.887  -7.887
  532    HA   ILE  69           HA       ILE  69   5.657  -9.952  -9.952
  533    HB   ILE  69           HB       ILE  69   5.330  -7.793  -7.793
  534   1HG1  ILE  69          HG11      ILE  69   4.881  -8.664  -8.664
  535   2HG1  ILE  69          HG12      ILE  69   6.143  -9.882  -9.882
  536   1HG2  ILE  69          HG21      ILE  69   7.690  -7.282  -7.282
  537   2HG2  ILE  69          HG22      ILE  69   7.884  -8.511  -8.511
  538   3HG2  ILE  69          HG23      ILE  69   6.846  -7.128  -7.128
  539   1HD1  ILE  69          HD11      ILE  69   3.643  -9.793  -9.793
  540   2HD1  ILE  69          HD12      ILE  69   3.918 -10.871 -10.871
  541   3HD1  ILE  69          HD13      ILE  69   4.889 -11.035 -11.035
  542    H    ALA  70           HN       ALA  70   8.839  -9.124  -9.124
  543    HA   ALA  70           HA       ALA  70   9.470 -11.426 -11.426
  544   1HB   ALA  70           HB1      ALA  70  11.340  -9.814  -9.814
  545   2HB   ALA  70           HB2      ALA  70  11.866 -10.892 -10.892
  546   3HB   ALA  70           HB3      ALA  70  10.994  -9.421  -9.421
  547    H    ALA  71           HN       ALA  71   9.425 -10.754 -10.754
  548    HA   ALA  71           HA       ALA  71  10.557 -13.289 -13.289
  549   1HB   ALA  71           HB1      ALA  71   8.990 -11.221 -11.221
  550   2HB   ALA  71           HB2      ALA  71   9.869 -12.576 -12.576
  551   3HB   ALA  71           HB3      ALA  71  10.740 -11.300 -11.300
  552    H    TYR  72           HN       TYR  72   7.318 -11.945 -11.945
  553    HA   TYR  72           HA       TYR  72   5.869 -14.133 -14.133
  554   1HB   TYR  72           HB1      TYR  72   4.768 -12.066 -12.066
  555   2HB   TYR  72           HB2      TYR  72   5.223 -11.888 -11.888
  556    HD1  TYR  72           HD1      TYR  72   3.588 -14.811 -14.811
  557    HD2  TYR  72           HD2      TYR  72   3.220 -11.641 -11.641
  558    HE1  TYR  72           HE1      TYR  72   1.425 -15.699 -15.699
  559    HE2  TYR  72           HE2      TYR  72   1.057 -12.520 -12.520
  560    HH   TYR  72           HH       TYR  72   0.039 -15.463 -15.463
  561    H    ARG  73           HN       ARG  73   6.687 -13.412 -13.412
  562    HA   ARG  73           HA       ARG  73   5.416 -15.706 -15.706
  563   1HB   ARG  73           HB1      ARG  73   7.599 -13.824 -13.824
  564   2HB   ARG  73           HB2      ARG  73   7.124 -15.215 -15.215
  565   1HG   ARG  73           HG1      ARG  73   4.713 -14.336 -14.336
  566   2HG   ARG  73           HG2      ARG  73   5.388 -12.866 -12.866
  567   1HD   ARG  73           HD1      ARG  73   6.389 -12.208 -12.208
  568   2HD   ARG  73           HD2      ARG  73   6.676 -13.860 -13.860
  569    HE   ARG  73           HE       ARG  73   4.005 -12.502 -12.502
  570   1HH1  ARG  73          HH11      ARG  73   4.844 -15.580 -15.580
  571   2HH1  ARG  73          HH12      ARG  73   4.582 -15.848 -15.848
  572   1HH2  ARG  73          HH21      ARG  73   4.302 -12.430 -12.430
  573   2HH2  ARG  73          HH22      ARG  73   4.270 -14.022 -14.022
  574    H    ALA  74           HN       ALA  74   8.361 -15.023 -15.023
  575    HA   ALA  74           HA       ALA  74   9.651 -17.536 -17.536
  576   1HB   ALA  74           HB1      ALA  74  10.507 -15.301 -15.301
  577   2HB   ALA  74           HB2      ALA  74  11.539 -16.639 -16.639
  578   3HB   ALA  74           HB3      ALA  74  10.964 -15.489 -15.489
  579    H    LYS  75           HN       LYS  75   7.194 -17.741 -17.741
  580    HA   LYS  75           HA       LYS  75   6.223 -19.017 -19.017
  581   1HB   LYS  75           HB1      LYS  75   8.309 -20.524 -20.524
  582   2HB   LYS  75           HB2      LYS  75   9.012 -20.051 -20.051
  583   1HG   LYS  75           HG1      LYS  75   7.939 -22.121 -22.121
  584   2HG   LYS  75           HG2      LYS  75   6.857 -20.914 -20.914
  585   1HD   LYS  75           HD1      LYS  75   5.423 -21.027 -21.027
  586   2HD   LYS  75           HD2      LYS  75   6.563 -22.108 -22.108
  587   1HE   LYS  75           HE1      LYS  75   6.143 -23.806 -23.806
  588   2HE   LYS  75           HE2      LYS  75   4.953 -22.724 -22.724
  589   1HZ   LYS  75           HZ1      LYS  75   4.383 -22.964 -22.964
  590   2HZ   LYS  75           HZ2      LYS  75   4.623 -24.525 -24.525
  591   3HZ   LYS  75           HZ3      LYS  75   3.466 -23.506 -23.506
  592    H    GLY  76           HN       GLY  76   6.194 -16.668 -16.668
  593   1HA   GLY  76           HA1      GLY  76   7.722 -16.110 -16.110
  594   2HA   GLY  76           HA2      GLY  76   6.815 -14.933 -14.933
  595    H    LYS  77           HN       LYS  77   6.190 -17.982 -17.982
  596    HA   LYS  77           HA       LYS  77   3.626 -17.030 -17.030
  597   1HB   LYS  77           HB1      LYS  77   4.884 -19.795 -19.795
  598   2HB   LYS  77           HB2      LYS  77   3.357 -19.524 -19.524
  599   1HG   LYS  77           HG1      LYS  77   2.560 -18.485 -18.485
  600   2HG   LYS  77           HG2      LYS  77   4.023 -19.173 -19.173
  601   1HD   LYS  77           HD1      LYS  77   3.351 -21.437 -21.437
  602   2HD   LYS  77           HD2      LYS  77   1.891 -20.741 -20.741
  603   1HE   LYS  77           HE1      LYS  77   1.209 -20.008 -20.008
  604   2HE   LYS  77           HE2      LYS  77   2.617 -20.852 -20.852
  605   1HZ   LYS  77           HZ1      LYS  77   1.264 -22.587 -22.587
  606   2HZ   LYS  77           HZ2      LYS  77   0.121 -21.900 -21.900
  607   3HZ   LYS  77           HZ3      LYS  77   1.473 -22.712 -22.712
  608    HA   PRO  78           HA       PRO  78   5.380 -16.644 -16.644
  609   1HB   PRO  78           HB1      PRO  78   3.316 -17.040 -17.040
  610   2HB   PRO  78           HB2      PRO  78   3.244 -15.765 -15.765
  611   1HG   PRO  78           HG1      PRO  78   2.173 -18.629 -18.629
  612   2HG   PRO  78           HG2      PRO  78   1.258 -17.128 -17.128
  613   1HD   PRO  78           HD1      PRO  78   2.321 -18.349 -18.349
  614   2HD   PRO  78           HD2      PRO  78   2.352 -16.578 -16.578
  615    H    ASP  79           HN       ASP  79   6.325 -18.953 -18.953
  616    HA   ASP  79           HA       ASP  79   6.457 -20.711 -20.711
  617   1HB   ASP  79           HB1      ASP  79   6.213 -21.633 -21.633
  618   2HB   ASP  79           HB2      ASP  79   6.420 -22.709 -22.709
  619    H    ALA  80           HN       ALA  80   7.788 -19.220 -19.220
  620    HA   ALA  80           HA       ALA  80  10.578 -20.162 -20.162
  621   1HB   ALA  80           HB1      ALA  80   9.426 -18.952 -18.952
  622   2HB   ALA  80           HB2      ALA  80  11.090 -19.480 -19.480
  623   3HB   ALA  80           HB3      ALA  80   9.785 -20.656 -20.656
  624    H    ALA  81           HN       ALA  81  11.244 -18.783 -18.783
  625    HA   ALA  81           HA       ALA  81  11.444 -16.825 -16.825
  626   1HB   ALA  81           HB1      ALA  81  13.501 -17.188 -17.188
  627   2HB   ALA  81           HB2      ALA  81  12.870 -16.283 -16.283
  628   3HB   ALA  81           HB3      ALA  81  13.215 -15.461 -15.461
  629   1H1   BME  16           HE1      MER  16  -9.776   9.623   9.623
  630   2H1   BME  16           HE2      MER  16  -8.560   8.458   8.458
  631   1H2   BME  16           HZ1      MER  16  -8.219  11.484  11.484
  632   2H2   BME  16           HZ2      MER  16  -7.578  10.485  10.485
  633    HO1  BME  16           HH       MER  16  -9.293   8.821   8.821

  Start of MODEL   43
    1    H    ASN   3           HN       ASN   3   1.842 -10.371 -10.371
    2    HA   ASN   3           HA       ASN   3   2.447 -12.784 -12.784
    3   1HB   ASN   3           HB1      ASN   3   0.845 -13.385 -13.385
    4   2HB   ASN   3           HB2      ASN   3  -0.196 -12.043 -12.043
    5   1HD2  ASN   3          HD21      ASN   3  -1.913 -13.980 -13.980
    6   2HD2  ASN   3          HD22      ASN   3  -1.920 -12.696 -12.696
    7    H    ALA   4           HN       ALA   4   3.136 -11.394 -11.394
    8    HA   ALA   4           HA       ALA   4   2.823 -10.353 -10.353
    9   1HB   ALA   4           HB1      ALA   4   0.946 -11.959 -11.959
   10   2HB   ALA   4           HB2      ALA   4  -0.170 -10.874 -10.874
   11   3HB   ALA   4           HB3      ALA   4   0.584 -10.393 -10.393
   12    HA   PRO   5           HA       PRO   5   2.094  -6.314  -6.314
   13   1HB   PRO   5           HB1      PRO   5   4.405  -5.739  -5.739
   14   2HB   PRO   5           HB2      PRO   5   4.167  -5.244  -5.244
   15   1HG   PRO   5           HG1      PRO   5   5.888  -7.228  -7.228
   16   2HG   PRO   5           HG2      PRO   5   4.756  -7.428  -7.428
   17   1HD   PRO   5           HD1      PRO   5   4.449  -8.503  -8.503
   18   2HD   PRO   5           HD2      PRO   5   4.332  -9.416  -9.416
   19    H    LYS   6           HN       LYS   6   0.390  -5.542  -5.542
   20    HA   LYS   6           HA       LYS   6  -0.168  -5.690  -5.690
   21   1HB   LYS   6           HB1      LYS   6  -1.807  -5.917  -5.917
   22   2HB   LYS   6           HB2      LYS   6  -1.937  -4.192  -4.192
   23   1HG   LYS   6           HG1      LYS   6  -3.702  -4.940  -4.940
   24   2HG   LYS   6           HG2      LYS   6  -2.454  -4.821  -4.821
   25   1HD   LYS   6           HD1      LYS   6  -1.931  -7.284  -7.284
   26   2HD   LYS   6           HD2      LYS   6  -3.243  -7.366  -7.366
   27   1HE   LYS   6           HE1      LYS   6  -3.547  -6.653  -6.653
   28   2HE   LYS   6           HE2      LYS   6  -4.029  -8.161  -8.161
   29   1HZ   LYS   6           HZ1      LYS   6  -5.178  -6.052  -6.052
   30   2HZ   LYS   6           HZ2      LYS   6  -5.496  -5.808  -5.808
   31   3HZ   LYS   6           HZ3      LYS   6  -5.949  -7.263  -7.263
   32    H    ARG   7           HN       ARG   7  -0.641  -3.776  -3.776
   33    HA   ARG   7           HA       ARG   7   1.225  -1.901  -1.901
   34   1HB   ARG   7           HB1      ARG   7  -0.396  -2.072  -2.072
   35   2HB   ARG   7           HB2      ARG   7  -1.724  -1.689  -1.689
   36   1HG   ARG   7           HG1      ARG   7  -0.994   0.637   0.637
   37   2HG   ARG   7           HG2      ARG   7   0.495   0.287   0.287
   38   1HD   ARG   7           HD1      ARG   7  -0.702  -0.057  -0.057
   39   2HD   ARG   7           HD2      ARG   7  -2.260  -0.057  -0.057
   40    HE   ARG   7           HE       ARG   7  -1.904   2.330   2.330
   41   1HH1  ARG   7          HH11      ARG   7   0.694   3.110   3.110
   42   2HH1  ARG   7          HH12      ARG   7   0.986   3.626   3.626
   43   1HH2  ARG   7          HH21      ARG   7  -1.842   1.953   1.953
   44   2HH2  ARG   7          HH22      ARG   7  -0.492   2.952   2.952
   45    HA   PRO   8           HA       PRO   8   0.673   0.599   0.599
   46   1HB   PRO   8           HB1      PRO   8   3.044   1.997   1.997
   47   2HB   PRO   8           HB2      PRO   8   2.984   0.318   0.318
   48   1HG   PRO   8           HG1      PRO   8   3.445   1.397   1.397
   49   2HG   PRO   8           HG2      PRO   8   4.463   0.280   0.280
   50   1HD   PRO   8           HD1      PRO   8   2.680  -0.662  -0.662
   51   2HD   PRO   8           HD2      PRO   8   2.873  -1.527  -1.527
   52    HA   PRO   9           HA       PRO   9  -0.737   4.800   4.800
   53   1HB   PRO   9           HB1      PRO   9   1.980   5.587   5.587
   54   2HB   PRO   9           HB2      PRO   9   0.455   6.468   6.468
   55   1HG   PRO   9           HG1      PRO   9   1.028   4.860   4.860
   56   2HG   PRO   9           HG2      PRO   9  -0.573   4.652   4.652
   57   1HD   PRO   9           HD1      PRO   9   1.928   3.000   3.000
   58   2HD   PRO   9           HD2      PRO   9   0.262   2.426   2.426
   59    H    SER  10           HN       SER  10   0.115   7.021   7.021
   60    HA   SER  10           HA       SER  10   1.273   6.519   6.519
   61   1HB   SER  10           HB1      SER  10  -0.184   8.425   8.425
   62   2HB   SER  10           HB2      SER  10  -1.117   7.081   7.081
   63    HG   SER  10           HG       SER  10  -1.742   8.386   8.386
   64    H    ALA  11           HN       ALA  11   1.002   9.029   9.029
   65    HA   ALA  11           HA       ALA  11   3.319  10.099  10.099
   66   1HB   ALA  11           HB1      ALA  11   2.614  11.260  11.260
   67   2HB   ALA  11           HB2      ALA  11   3.905  11.834  11.834
   68   3HB   ALA  11           HB3      ALA  11   4.040  10.265  10.265
   69    H    PHE  12           HN       PHE  12   0.652  10.865  10.865
   70    HA   PHE  12           HA       PHE  12  -0.285  13.300  13.300
   71   1HB   PHE  12           HB1      PHE  12  -1.030  12.614  12.614
   72   2HB   PHE  12           HB2      PHE  12  -1.376  10.960  10.960
   73    HD1  PHE  12           HD1      PHE  12  -3.041  13.152  13.152
   74    HD2  PHE  12           HD2      PHE  12  -3.223  11.600  11.600
   75    HE1  PHE  12           HE1      PHE  12  -5.436  13.580  13.580
   76    HE2  PHE  12           HE2      PHE  12  -5.633  12.041  12.041
   77    HZ   PHE  12           HZ       PHE  12  -6.749  13.028  13.028
   78    H    PHE  13           HN       PHE  13  -0.945   9.877   9.877
   79    HA   PHE  13           HA       PHE  13  -2.923   9.888   9.888
   80   1HB   PHE  13           HB1      PHE  13  -1.317   7.954   7.954
   81   2HB   PHE  13           HB2      PHE  13  -0.509   8.243   8.243
   82    HD1  PHE  13           HD1      PHE  13  -3.893   7.772   7.772
   83    HD2  PHE  13           HD2      PHE  13  -1.466   7.239   7.239
   84    HE1  PHE  13           HE1      PHE  13  -5.748   6.606   6.606
   85    HE2  PHE  13           HE2      PHE  13  -3.322   6.059   6.059
   86    HZ   PHE  13           HZ       PHE  13  -5.461   5.740   5.740
   87    H    LEU  14           HN       LEU  14   0.464  10.587  10.587
   88    HA   LEU  14           HA       LEU  14   0.000  10.846  10.846
   89   1HB   LEU  14           HB1      LEU  14   2.031  12.367  12.367
   90   2HB   LEU  14           HB2      LEU  14   2.113  12.200  12.200
   91    HG   LEU  14           HG       LEU  14   3.715  10.735  10.735
   92   1HD1  LEU  14          HD11      LEU  14   2.340   9.466   9.466
   93   2HD1  LEU  14          HD12      LEU  14   1.337   8.862   8.862
   94   3HD1  LEU  14          HD13      LEU  14   3.031   8.413   8.413
   95   1HD2  LEU  14          HD21      LEU  14   3.383  10.843  10.843
   96   2HD2  LEU  14          HD22      LEU  14   3.597   9.174   9.174
   97   3HD2  LEU  14          HD23      LEU  14   1.996   9.766   9.766
   98    H    PHE  15           HN       PHE  15   0.421  13.334  13.334
   99    HA   PHE  15           HA       PHE  15  -0.441  15.620  15.620
  100   1HB   PHE  15           HB1      PHE  15   0.646  15.983  15.983
  101   2HB   PHE  15           HB2      PHE  15  -0.096  14.552  14.552
  102    HD1  PHE  15           HD1      PHE  15  -0.557  18.217  18.217
  103    HD2  PHE  15           HD2      PHE  15  -1.940  14.660  14.660
  104    HE1  PHE  15           HE1      PHE  15  -1.993  19.543  19.543
  105    HE2  PHE  15           HE2      PHE  15  -3.364  15.978  15.978
  106    HZ   PHE  15           HZ       PHE  15  -3.395  18.423  18.423
  107    H    CYS  16           HN       MER  16  -2.453  13.433  13.433
  108    HA   CYS  16           HA       MER  16  -4.975  14.593  14.593
  109   1HB   CYS  16           HB1      MER  16  -5.834  12.573  12.573
  110   2HB   CYS  16           HB2      MER  16  -4.168  12.383  12.383
  111    H    SER  17           HN       SER  17  -3.637  12.143  12.143
  112    HA   SER  17           HA       SER  17  -5.849  12.139  12.139
  113   1HB   SER  17           HB1      SER  17  -4.282  11.016  11.016
  114   2HB   SER  17           HB2      SER  17  -3.996  10.433  10.433
  115    HG   SER  17           HG       SER  17  -2.090  11.257  11.257
  116    H    GLU  18           HN       GLU  18  -3.040  14.139  14.139
  117    HA   GLU  18           HA       GLU  18  -3.598  15.596  15.596
  118   1HB   GLU  18           HB1      GLU  18  -1.309  15.078  15.078
  119   2HB   GLU  18           HB2      GLU  18  -1.684  16.354  16.354
  120   1HG   GLU  18           HG1      GLU  18  -0.455  17.449  17.449
  121   2HG   GLU  18           HG2      GLU  18  -2.115  17.861  17.861
  122    H    TYR  19           HN       TYR  19  -4.999  15.666  15.666
  123    HA   TYR  19           HA       TYR  19  -5.455  18.610  18.610
  124   1HB   TYR  19           HB1      TYR  19  -5.280  16.482  16.482
  125   2HB   TYR  19           HB2      TYR  19  -6.689  17.550  17.550
  126    HD1  TYR  19           HD1      TYR  19  -3.149  17.976  17.976
  127    HD2  TYR  19           HD2      TYR  19  -6.258  19.328  19.328
  128    HE1  TYR  19           HE1      TYR  19  -1.667  19.713  19.713
  129    HE2  TYR  19           HE2      TYR  19  -4.779  21.064  21.064
  130    HH   TYR  19           HH       TYR  19  -2.823  22.138  22.138
  131    H    ARG  20           HN       ARG  20  -7.099  15.646  15.646
  132    HA   ARG  20           HA       ARG  20  -9.706  15.929  15.929
  133   1HB   ARG  20           HB1      ARG  20  -8.611  14.097  14.097
  134   2HB   ARG  20           HB2      ARG  20  -8.880  15.058  15.058
  135   1HG   ARG  20           HG1      ARG  20 -11.317  15.216  15.216
  136   2HG   ARG  20           HG2      ARG  20 -11.008  14.195  14.195
  137   1HD   ARG  20           HD1      ARG  20 -10.120  12.430  12.430
  138   2HD   ARG  20           HD2      ARG  20 -10.703  13.443  13.443
  139    HE   ARG  20           HE       ARG  20 -12.492  11.849  11.849
  140   1HH1  ARG  20          HH11      ARG  20 -13.865  14.377  14.377
  141   2HH1  ARG  20          HH12      ARG  20 -14.545  14.280  14.280
  142   1HH2  ARG  20          HH21      ARG  20 -12.425  11.660  11.660
  143   2HH2  ARG  20          HH22      ARG  20 -13.709  12.701  12.701
  144    HA   PRO  21           HA       PRO  21 -10.888  18.766  18.766
  145   1HB   PRO  21           HB1      PRO  21  -8.843  20.191  20.191
  146   2HB   PRO  21           HB2      PRO  21  -9.363  18.588  18.588
  147   1HG   PRO  21           HG1      PRO  21  -7.112  19.183  19.183
  148   2HG   PRO  21           HG2      PRO  21  -6.991  18.295  18.295
  149   1HD   PRO  21           HD1      PRO  21  -7.398  16.869  16.869
  150   2HD   PRO  21           HD2      PRO  21  -8.471  16.544  16.544
  151    H    LYS  22           HN       LYS  22  -7.978  20.207  20.207
  152    HA   LYS  22           HA       LYS  22  -8.875  22.759  22.759
  153   1HB   LYS  22           HB1      LYS  22  -7.094  21.034  21.034
  154   2HB   LYS  22           HB2      LYS  22  -7.265  22.771  22.771
  155   1HG   LYS  22           HG1      LYS  22  -6.479  23.073  23.073
  156   2HG   LYS  22           HG2      LYS  22  -6.227  21.338  21.338
  157   1HD   LYS  22           HD1      LYS  22  -4.559  21.395  21.395
  158   2HD   LYS  22           HD2      LYS  22  -4.889  23.090  23.090
  159   1HE   LYS  22           HE1      LYS  22  -2.844  22.879  22.879
  160   2HE   LYS  22           HE2      LYS  22  -4.103  23.653  23.653
  161   1HZ   LYS  22           HZ1      LYS  22  -4.304  20.876  20.876
  162   2HZ   LYS  22           HZ2      LYS  22  -2.692  21.343  21.343
  163   3HZ   LYS  22           HZ3      LYS  22  -3.939  22.067  22.067
  164    H    ILE  23           HN       ILE  23  -9.777  19.914  19.914
  165    HA   ILE  23           HA       ILE  23 -10.931  21.661  21.661
  166    HB   ILE  23           HB       ILE  23 -11.801  18.832  18.832
  167   1HG1  ILE  23          HG11      ILE  23  -8.782  19.316  19.316
  168   2HG1  ILE  23          HG12      ILE  23  -9.692  18.384  18.384
  169   1HG2  ILE  23          HG21      ILE  23 -11.878  20.484  20.484
  170   2HG2  ILE  23          HG22      ILE  23 -10.127  20.625  20.625
  171   3HG2  ILE  23          HG23      ILE  23 -10.888  19.123  19.123
  172   1HD1  ILE  23          HD11      ILE  23 -10.469  16.866  16.866
  173   2HD1  ILE  23          HD12      ILE  23  -9.528  17.691  17.691
  174   3HD1  ILE  23          HD13      ILE  23  -8.723  16.874  16.874
  175    H    LYS  24           HN       LYS  24 -11.853  19.448  19.448
  176    HA   LYS  24           HA       LYS  24 -14.601  19.433  19.433
  177   1HB   LYS  24           HB1      LYS  24 -13.107  18.143  18.143
  178   2HB   LYS  24           HB2      LYS  24 -12.808  19.572  19.572
  179   1HG   LYS  24           HG1      LYS  24 -15.247  19.791  19.791
  180   2HG   LYS  24           HG2      LYS  24 -15.572  18.288  18.288
  181   1HD   LYS  24           HD1      LYS  24 -13.689  18.612  18.612
  182   2HD   LYS  24           HD2      LYS  24 -15.324  17.999  17.999
  183   1HE   LYS  24           HE1      LYS  24 -14.659  16.143  16.143
  184   2HE   LYS  24           HE2      LYS  24 -12.996  16.712  16.712
  185   1HZ   LYS  24           HZ1      LYS  24 -14.005  16.460  16.460
  186   2HZ   LYS  24           HZ2      LYS  24 -14.322  15.021  15.021
  187   3HZ   LYS  24           HZ3      LYS  24 -12.733  15.610  15.610
  188    H    GLY  25           HN       GLY  25 -12.518  21.829  21.829
  189   1HA   GLY  25           HA1      GLY  25 -14.525  23.508  23.508
  190   2HA   GLY  25           HA2      GLY  25 -12.856  23.959  23.959
  191    H    GLU  26           HN       GLU  26 -12.714  23.622  23.622
  192    HA   GLU  26           HA       GLU  26 -14.001  25.993  25.993
  193   1HB   GLU  26           HB1      GLU  26 -12.341  23.870  23.870
  194   2HB   GLU  26           HB2      GLU  26 -12.752  25.420  25.420
  195   1HG   GLU  26           HG1      GLU  26 -11.335  25.136  25.136
  196   2HG   GLU  26           HG2      GLU  26 -10.464  25.284  25.284
  197    H    HIS  27           HN       HIS  27 -14.371  22.630  22.630
  198    HA   HIS  27           HA       HIS  27 -16.946  23.086  23.086
  199   1HB   HIS  27           HB1      HIS  27 -14.923  21.116  21.116
  200   2HB   HIS  27           HB2      HIS  27 -16.306  21.887  21.887
  201    HD1  HIS  27           HD1      HIS  27 -15.923  24.581  24.581
  202    HD2  HIS  27           HD2      HIS  27 -12.549  22.350  22.350
  203    HE1  HIS  27           HE1      HIS  27 -14.036  25.963  25.963
  204    HA   PRO  28           HA       PRO  28 -17.665  19.577  19.577
  205   1HB   PRO  28           HB1      PRO  28 -19.483  20.681  20.681
  206   2HB   PRO  28           HB2      PRO  28 -17.769  20.967  20.967
  207   1HG   PRO  28           HG1      PRO  28 -19.795  22.742  22.742
  208   2HG   PRO  28           HG2      PRO  28 -18.641  23.226  23.226
  209   1HD   PRO  28           HD1      PRO  28 -18.102  23.519  23.519
  210   2HD   PRO  28           HD2      PRO  28 -16.801  23.265  23.265
  211    H    GLY  29           HN       GLY  29 -18.421  19.989  19.989
  212   1HA   GLY  29           HA1      GLY  29 -21.266  19.211  19.211
  213   2HA   GLY  29           HA2      GLY  29 -20.742  20.454  20.454
  214    H    LEU  30           HN       LEU  30 -18.265  18.128  18.128
  215    HA   LEU  30           HA       LEU  30 -19.365  16.831  16.831
  216   1HB   LEU  30           HB1      LEU  30 -16.546  16.282  16.282
  217   2HB   LEU  30           HB2      LEU  30 -17.382  16.994  16.994
  218    HG   LEU  30           HG       LEU  30 -15.653  18.550  18.550
  219   1HD1  LEU  30          HD11      LEU  30 -17.774  19.574  19.574
  220   2HD1  LEU  30          HD12      LEU  30 -18.086  19.768  19.768
  221   3HD1  LEU  30          HD13      LEU  30 -16.662  20.474  20.474
  222   1HD2  LEU  30          HD21      LEU  30 -16.468  18.110  18.110
  223   2HD2  LEU  30          HD22      LEU  30 -15.083  17.454  17.454
  224   3HD2  LEU  30          HD23      LEU  30 -15.182  19.166  19.166
  225    H    SER  31           HN       SER  31 -17.881  14.755  14.755
  226    HA   SER  31           HA       SER  31 -18.391  12.913  12.913
  227   1HB   SER  31           HB1      SER  31 -18.599  12.425  12.425
  228   2HB   SER  31           HB2      SER  31 -18.838  11.183  11.183
  229    HG   SER  31           HG       SER  31 -20.525  13.077  13.077
  230    H    ILE  32           HN       ILE  32 -17.149  10.840  10.840
  231    HA   ILE  32           HA       ILE  32 -14.403  11.363  11.363
  232    HB   ILE  32           HB       ILE  32 -15.733   9.436   9.436
  233   1HG1  ILE  32          HG11      ILE  32 -14.033   7.629   7.629
  234   2HG1  ILE  32          HG12      ILE  32 -13.342   8.468   8.468
  235   1HG2  ILE  32          HG21      ILE  32 -15.644   8.412   8.412
  236   2HG2  ILE  32          HG22      ILE  32 -16.210   7.479   7.479
  237   3HG2  ILE  32          HG23      ILE  32 -17.076   8.917   8.917
  238   1HD1  ILE  32          HD11      ILE  32 -13.372   9.515   9.515
  239   2HD1  ILE  32          HD12      ILE  32 -11.985   8.838   8.838
  240   3HD1  ILE  32          HD13      ILE  32 -12.664  10.362  10.362
  241    H    GLY  33           HN       GLY  33 -16.070  11.317  11.317
  242   1HA   GLY  33           HA1      GLY  33 -13.766  10.494  10.494
  243   2HA   GLY  33           HA2      GLY  33 -15.418  10.701  10.701
  244    H    ASP  34           HN       ASP  34 -15.040  13.281  13.281
  245    HA   ASP  34           HA       ASP  34 -14.059  15.043  15.043
  246   1HB   ASP  34           HB1      ASP  34 -15.940  15.304  15.304
  247   2HB   ASP  34           HB2      ASP  34 -15.577  16.709  16.709
  248    H    VAL  35           HN       VAL  35 -14.178  14.298  14.298
  249    HA   VAL  35           HA       VAL  35 -12.306  16.212  16.212
  250    HB   VAL  35           HB       VAL  35 -13.267  13.437  13.437
  251   1HG1  VAL  35          HG11      VAL  35 -11.518  15.312  15.312
  252   2HG1  VAL  35          HG12      VAL  35 -12.249  13.835  13.835
  253   3HG1  VAL  35          HG13      VAL  35 -11.010  13.768  13.768
  254   1HG2  VAL  35          HG21      VAL  35 -13.819  16.238  16.238
  255   2HG2  VAL  35          HG22      VAL  35 -14.933  15.287  15.287
  256   3HG2  VAL  35          HG23      VAL  35 -14.490  14.749  14.749
  257    H    ALA  36           HN       ALA  36 -12.116  13.164  13.164
  258    HA   ALA  36           HA       ALA  36  -9.234  12.933  12.933
  259   1HB   ALA  36           HB1      ALA  36 -10.700  10.989  10.989
  260   2HB   ALA  36           HB2      ALA  36 -11.326  11.275  11.275
  261   3HB   ALA  36           HB3      ALA  36  -9.663  10.743  10.743
  262    H    LYS  37           HN       LYS  37 -11.561  13.396  13.396
  263    HA   LYS  37           HA       LYS  37  -9.287  13.625  13.625
  264   1HB   LYS  37           HB1      LYS  37 -12.255  14.049  14.049
  265   2HB   LYS  37           HB2      LYS  37 -11.096  14.327  14.327
  266   1HG   LYS  37           HG1      LYS  37 -10.224  11.999  11.999
  267   2HG   LYS  37           HG2      LYS  37 -11.424  11.685  11.685
  268   1HD   LYS  37           HD1      LYS  37 -13.250  11.875  11.875
  269   2HD   LYS  37           HD2      LYS  37 -12.263  12.643  12.643
  270   1HE   LYS  37           HE1      LYS  37 -11.878   9.772   9.772
  271   2HE   LYS  37           HE2      LYS  37 -12.711  10.232  10.232
  272   1HZ   LYS  37           HZ1      LYS  37 -10.234  11.529  11.529
  273   2HZ   LYS  37           HZ2      LYS  37  -9.974   9.889   9.889
  274   3HZ   LYS  37           HZ3      LYS  37 -10.783  10.333  10.333
  275    H    LYS  38           HN       LYS  38 -10.744  15.872  15.872
  276    HA   LYS  38           HA       LYS  38  -9.987  18.141  18.141
  277   1HB   LYS  38           HB1      LYS  38 -12.219  18.004  18.004
  278   2HB   LYS  38           HB2      LYS  38 -11.231  18.284  18.284
  279   1HG   LYS  38           HG1      LYS  38 -10.444  20.414  20.414
  280   2HG   LYS  38           HG2      LYS  38 -11.215  20.093  20.093
  281   1HD   LYS  38           HD1      LYS  38 -13.444  19.960  19.960
  282   2HD   LYS  38           HD2      LYS  38 -12.576  20.555  20.555
  283   1HE   LYS  38           HE1      LYS  38 -13.644  22.436  22.436
  284   2HE   LYS  38           HE2      LYS  38 -11.895  22.585  22.585
  285   1HZ   LYS  38           HZ1      LYS  38 -12.809  21.008  21.008
  286   2HZ   LYS  38           HZ2      LYS  38 -13.774  22.401  22.401
  287   3HZ   LYS  38           HZ3      LYS  38 -12.089  22.543  22.543
  288    H    LEU  39           HN       LEU  39  -9.412  16.768  16.768
  289    HA   LEU  39           HA       LEU  39  -7.159  18.571  18.571
  290   1HB   LEU  39           HB1      LEU  39  -7.405  17.816  17.816
  291   2HB   LEU  39           HB2      LEU  39  -8.717  16.817  16.817
  292    HG   LEU  39           HG       LEU  39  -6.755  15.129  15.129
  293   1HD1  LEU  39          HD11      LEU  39  -5.044  16.921  16.921
  294   2HD1  LEU  39          HD12      LEU  39  -5.540  16.891  16.891
  295   3HD1  LEU  39          HD13      LEU  39  -4.797  15.460  15.460
  296   1HD2  LEU  39          HD21      LEU  39  -8.408  14.789  14.789
  297   2HD2  LEU  39          HD22      LEU  39  -6.786  14.224  14.224
  298   3HD2  LEU  39          HD23      LEU  39  -7.308  15.759  15.759
  299    H    GLY  40           HN       GLY  40  -7.749  15.694  15.694
  300   1HA   GLY  40           HA1      GLY  40  -4.948  14.817  14.817
  301   2HA   GLY  40           HA2      GLY  40  -6.253  14.186  14.186
  302    H    GLU  41           HN       GLU  41  -7.199  16.777  16.777
  303    HA   GLU  41           HA       GLU  41  -5.537  17.199  17.199
  304   1HB   GLU  41           HB1      GLU  41  -7.943  17.794  17.794
  305   2HB   GLU  41           HB2      GLU  41  -7.412  19.181  19.181
  306   1HG   GLU  41           HG1      GLU  41  -7.890  19.980  19.980
  307   2HG   GLU  41           HG2      GLU  41  -6.137  19.962  19.962
  308    H    MET  42           HN       MET  42  -6.052  18.970  18.970
  309    HA   MET  42           HA       MET  42  -4.138  20.991  20.991
  310   1HB   MET  42           HB1      MET  42  -4.827  19.424  19.424
  311   2HB   MET  42           HB2      MET  42  -3.916  20.931  20.931
  312   1HG   MET  42           HG1      MET  42  -5.988  21.807  21.807
  313   2HG   MET  42           HG2      MET  42  -6.806  20.459  20.459
  314   1HE   MET  42           HE1      MET  42  -8.179  20.512  20.512
  315   2HE   MET  42           HE2      MET  42  -6.847  20.223  20.223
  316   3HE   MET  42           HE3      MET  42  -8.050  21.479  21.479
  317    H    TRP  43           HN       TRP  43  -3.708  17.735  17.735
  318    HA   TRP  43           HA       TRP  43  -1.001  17.733  17.733
  319   1HB   TRP  43           HB1      TRP  43  -2.430  15.679  15.679
  320   2HB   TRP  43           HB2      TRP  43  -2.541  15.534  15.534
  321    HD1  TRP  43           HD1      TRP  43  -0.940  14.051  14.051
  322    HE1  TRP  43           HE1      TRP  43   1.287  13.179  13.179
  323    HE3  TRP  43           HE3      TRP  43  -0.289  16.481  16.481
  324    HZ2  TRP  43           HZ2      TRP  43   3.257  13.380  13.380
  325    HZ3  TRP  43           HZ3      TRP  43   1.704  16.144  16.144
  326    HH2  TRP  43           HH2      TRP  43   3.498  14.596  14.596
  327    H    ASN  44           HN       ASN  44  -2.482  17.104  17.104
  328    HA   ASN  44           HA       ASN  44  -0.074  16.827  16.827
  329   1HB   ASN  44           HB1      ASN  44  -2.771  17.732  17.732
  330   2HB   ASN  44           HB2      ASN  44  -1.438  16.976  16.976
  331   1HD2  ASN  44          HD21      ASN  44  -4.117  14.552  14.552
  332   2HD2  ASN  44          HD22      ASN  44  -4.382  16.152  16.152
  333    H    ASN  45           HN       ASN  45  -1.052  19.530  19.530
  334    HA   ASN  45           HA       ASN  45   0.730  21.277  21.277
  335   1HB   ASN  45           HB1      ASN  45  -1.002  23.057  23.057
  336   2HB   ASN  45           HB2      ASN  45  -1.508  21.602  21.602
  337   1HD2  ASN  45          HD21      ASN  45  -4.491  21.372  21.372
  338   2HD2  ASN  45          HD22      ASN  45  -3.638  20.847  20.847
  339    H    THR  46           HN       THR  46   0.955  20.174  20.174
  340    HA   THR  46           HA       THR  46   0.118  22.224  22.224
  341    HB   THR  46           HB       THR  46   0.361  19.811  19.811
  342    HG1  THR  46           HG1      THR  46   0.796  20.744  20.744
  343   1HG2  THR  46          HG21      THR  46   2.535  19.221  19.221
  344   2HG2  THR  46          HG22      THR  46   3.401  20.291  20.291
  345   3HG2  THR  46          HG23      THR  46   2.597  18.875  18.875
  346    H    ALA  47           HN       ALA  47   3.120  21.181  21.181
  347    HA   ALA  47           HA       ALA  47   4.337  23.707  23.707
  348   1HB   ALA  47           HB1      ALA  47   4.497  23.713  23.713
  349   2HB   ALA  47           HB2      ALA  47   5.404  22.213  22.213
  350   3HB   ALA  47           HB3      ALA  47   6.057  23.695  23.695
  351    H    ALA  48           HN       ALA  48   4.987  20.505  20.505
  352    HA   ALA  48           HA       ALA  48   5.782  18.638  18.638
  353   1HB   ALA  48           HB1      ALA  48   6.103  19.996  19.996
  354   2HB   ALA  48           HB2      ALA  48   7.576  20.674  20.674
  355   3HB   ALA  48           HB3      ALA  48   7.465  18.952  18.952
  356    H    ASP  49           HN       ASP  49   7.585  21.479  21.479
  357    HA   ASP  49           HA       ASP  49   9.814  20.027  20.027
  358   1HB   ASP  49           HB1      ASP  49  10.579  22.387  22.387
  359   2HB   ASP  49           HB2      ASP  49  10.218  22.167  22.167
  360    H    ASP  50           HN       ASP  50   6.753  20.550  20.550
  361    HA   ASP  50           HA       ASP  50   7.218  20.697  20.697
  362   1HB   ASP  50           HB1      ASP  50   5.730  22.501  22.501
  363   2HB   ASP  50           HB2      ASP  50   4.626  21.209  21.209
  364    H    LYS  51           HN       LYS  51   6.514  18.741  18.741
  365    HA   LYS  51           HA       LYS  51   4.785  16.800  16.800
  366   1HB   LYS  51           HB1      LYS  51   6.413  16.538  16.538
  367   2HB   LYS  51           HB2      LYS  51   5.335  15.315  15.315
  368   1HG   LYS  51           HG1      LYS  51   3.428  16.881  16.881
  369   2HG   LYS  51           HG2      LYS  51   4.520  18.083  18.083
  370   1HD   LYS  51           HD1      LYS  51   5.087  16.529  16.529
  371   2HD   LYS  51           HD2      LYS  51   4.069  15.290  15.290
  372   1HE   LYS  51           HE1      LYS  51   2.094  16.603  16.603
  373   2HE   LYS  51           HE2      LYS  51   3.018  17.981  17.981
  374   1HZ   LYS  51           HZ1      LYS  51   3.698  15.714  15.714
  375   2HZ   LYS  51           HZ2      LYS  51   2.002  15.802  15.802
  376   3HZ   LYS  51           HZ3      LYS  51   2.896  17.119  17.119
  377    H    GLN  52           HN       GLN  52   8.058  17.161  17.161
  378    HA   GLN  52           HA       GLN  52   9.569  15.134  15.134
  379   1HB   GLN  52           HB1      GLN  52   9.883  17.996  17.996
  380   2HB   GLN  52           HB2      GLN  52  10.851  17.111  17.111
  381   1HG   GLN  52           HG1      GLN  52  12.214  17.610  17.610
  382   2HG   GLN  52           HG2      GLN  52  11.939  15.886  15.886
  383   1HE2  GLN  52          HE21      GLN  52   9.437  16.645  16.645
  384   2HE2  GLN  52          HE22      GLN  52   9.087  16.322  16.322
  385    HA   PRO  53           HA       PRO  53   9.648  15.121  15.121
  386   1HB   PRO  53           HB1      PRO  53   7.268  16.186  16.186
  387   2HB   PRO  53           HB2      PRO  53   8.827  17.001  17.001
  388   1HG   PRO  53           HG1      PRO  53   6.590  17.140  17.140
  389   2HG   PRO  53           HG2      PRO  53   7.429  18.492  18.492
  390   1HD   PRO  53           HD1      PRO  53   8.286  17.778  17.778
  391   2HD   PRO  53           HD2      PRO  53   9.535  17.931  17.931
  392    H    TYR  54           HN       TYR  54   6.534  15.053  15.053
  393    HA   TYR  54           HA       TYR  54   5.586  12.645  12.645
  394   1HB   TYR  54           HB1      TYR  54   4.486  14.204  14.204
  395   2HB   TYR  54           HB2      TYR  54   3.634  12.895  12.895
  396    HD1  TYR  54           HD1      TYR  54   3.897  13.428  13.428
  397    HD2  TYR  54           HD2      TYR  54   3.546  16.242  16.242
  398    HE1  TYR  54           HE1      TYR  54   2.983  15.077  15.077
  399    HE2  TYR  54           HE2      TYR  54   2.633  17.893  17.893
  400    HH   TYR  54           HH       TYR  54   2.945  17.911  17.911
  401    H    GLU  55           HN       GLU  55   6.356  13.531  13.531
  402    HA   GLU  55           HA       GLU  55   6.067  11.081  11.081
  403   1HB   GLU  55           HB1      GLU  55   7.278  13.652  13.652
  404   2HB   GLU  55           HB2      GLU  55   8.383  12.439  12.439
  405   1HG   GLU  55           HG1      GLU  55   6.364  11.386  11.386
  406   2HG   GLU  55           HG2      GLU  55   5.437  12.787  12.787
  407    H    LYS  56           HN       LYS  56   9.118  12.278  12.278
  408    HA   LYS  56           HA       LYS  56  10.760  10.114  10.114
  409   1HB   LYS  56           HB1      LYS  56  11.524  12.300  12.300
  410   2HB   LYS  56           HB2      LYS  56  10.703  11.996  11.996
  411   1HG   LYS  56           HG1      LYS  56  12.198  10.293  10.293
  412   2HG   LYS  56           HG2      LYS  56  12.839  10.058  10.058
  413   1HD   LYS  56           HD1      LYS  56  13.188  12.804  12.804
  414   2HD   LYS  56           HD2      LYS  56  14.081  11.528  11.528
  415   1HE   LYS  56           HE1      LYS  56  15.462  12.548  12.548
  416   2HE   LYS  56           HE2      LYS  56  15.106  10.877  10.877
  417   1HZ   LYS  56           HZ1      LYS  56  13.086  12.490  12.490
  418   2HZ   LYS  56           HZ2      LYS  56  14.579  13.162  13.162
  419   3HZ   LYS  56           HZ3      LYS  56  14.236  11.546  11.546
  420    H    LYS  57           HN       LYS  57   8.334  10.451  10.451
  421    HA   LYS  57           HA       LYS  57   9.165   8.119   8.119
  422   1HB   LYS  57           HB1      LYS  57   7.671  10.163  10.163
  423   2HB   LYS  57           HB2      LYS  57   6.352   9.292   9.292
  424   1HG   LYS  57           HG1      LYS  57   6.844   7.298   7.298
  425   2HG   LYS  57           HG2      LYS  57   8.166   8.171   8.171
  426   1HD   LYS  57           HD1      LYS  57   6.452   9.943   9.943
  427   2HD   LYS  57           HD2      LYS  57   5.196   8.859   8.859
  428   1HE   LYS  57           HE1      LYS  57   5.503   8.522   8.522
  429   2HE   LYS  57           HE2      LYS  57   6.059   7.082   7.082
  430   1HZ   LYS  57           HZ1      LYS  57   8.185   8.900   8.900
  431   2HZ   LYS  57           HZ2      LYS  57   7.486   8.730   8.730
  432   3HZ   LYS  57           HZ3      LYS  57   8.042   7.360   7.360
  433    H    ALA  58           HN       ALA  58   6.448   8.841   8.841
  434    HA   ALA  58           HA       ALA  58   5.229   6.375   6.375
  435   1HB   ALA  58           HB1      ALA  58   4.499   8.423   8.423
  436   2HB   ALA  58           HB2      ALA  58   5.875   8.292   8.292
  437   3HB   ALA  58           HB3      ALA  58   4.620   7.062   7.062
  438    H    ALA  59           HN       ALA  59   7.963   7.547   7.547
  439    HA   ALA  59           HA       ALA  59   8.585   5.367   5.367
  440   1HB   ALA  59           HB1      ALA  59   9.785   7.547   7.547
  441   2HB   ALA  59           HB2      ALA  59  10.564   7.190   7.190
  442   3HB   ALA  59           HB3      ALA  59  10.930   6.222   6.222
  443    H    LYS  60           HN       LYS  60  10.115   5.996   5.996
  444    HA   LYS  60           HA       LYS  60  11.548   3.702   3.702
  445   1HB   LYS  60           HB1      LYS  60  11.421   5.760   5.760
  446   2HB   LYS  60           HB2      LYS  60   9.885   5.205   5.205
  447   1HG   LYS  60           HG1      LYS  60  10.849   3.365   3.365
  448   2HG   LYS  60           HG2      LYS  60  12.339   3.447   3.447
  449   1HD   LYS  60           HD1      LYS  60  12.885   5.647   5.647
  450   2HD   LYS  60           HD2      LYS  60  11.374   5.618   5.618
  451   1HE   LYS  60           HE1      LYS  60  13.516   3.477   3.477
  452   2HE   LYS  60           HE2      LYS  60  13.389   4.890   4.890
  453   1HZ   LYS  60           HZ1      LYS  60  10.860   3.727   3.727
  454   2HZ   LYS  60           HZ2      LYS  60  11.972   2.499   2.499
  455   3HZ   LYS  60           HZ3      LYS  60  11.853   3.874   3.874
  456    H    LEU  61           HN       LEU  61   8.106   4.141   4.141
  457    HA   LEU  61           HA       LEU  61   7.685   1.474   1.474
  458   1HB   LEU  61           HB1      LEU  61   5.637   3.254   3.254
  459   2HB   LEU  61           HB2      LEU  61   5.297   1.967   1.967
  460    HG   LEU  61           HG       LEU  61   6.785   4.566   4.566
  461   1HD1  LEU  61          HD11      LEU  61   4.157   3.493   3.493
  462   2HD1  LEU  61          HD12      LEU  61   4.930   4.993   4.993
  463   3HD1  LEU  61          HD13      LEU  61   4.384   4.803   4.803
  464   1HD2  LEU  61          HD21      LEU  61   6.313   2.220   2.220
  465   2HD2  LEU  61          HD22      LEU  61   7.874   2.732   2.732
  466   3HD2  LEU  61          HD23      LEU  61   6.982   3.784   3.784
  467    H    LYS  62           HN       LYS  62   6.899   2.765   2.765
  468    HA   LYS  62           HA       LYS  62   6.117   0.403   0.403
  469   1HB   LYS  62           HB1      LYS  62   8.122   2.376   2.376
  470   2HB   LYS  62           HB2      LYS  62   7.109   1.234   1.234
  471   1HG   LYS  62           HG1      LYS  62   5.065   2.427   2.427
  472   2HG   LYS  62           HG2      LYS  62   6.102   3.575   3.575
  473   1HD   LYS  62           HD1      LYS  62   5.398   4.543   4.543
  474   2HD   LYS  62           HD2      LYS  62   7.122   4.240   4.240
  475   1HE   LYS  62           HE1      LYS  62   5.975   3.537   3.537
  476   2HE   LYS  62           HE2      LYS  62   6.785   2.190   2.190
  477   1HZ   LYS  62           HZ1      LYS  62   4.180   2.387   2.387
  478   2HZ   LYS  62           HZ2      LYS  62   4.097   2.434   2.434
  479   3HZ   LYS  62           HZ3      LYS  62   4.867   1.137   1.137
  480    H    GLU  63           HN       GLU  63   9.335   1.555   1.555
  481    HA   GLU  63           HA       GLU  63  10.923  -0.445  -0.445
  482   1HB   GLU  63           HB1      GLU  63  11.312   1.928   1.928
  483   2HB   GLU  63           HB2      GLU  63  11.896   0.745   0.745
  484   1HG   GLU  63           HG1      GLU  63  13.457  -0.160  -0.160
  485   2HG   GLU  63           HG2      GLU  63  12.906   1.135   1.135
  486    H    LYS  64           HN       LYS  64   9.914  -0.177  -0.177
  487    HA   LYS  64           HA       LYS  64  11.011  -2.619  -2.619
  488   1HB   LYS  64           HB1      LYS  64   9.831  -2.251  -2.251
  489   2HB   LYS  64           HB2      LYS  64   9.755  -0.659  -0.659
  490   1HG   LYS  64           HG1      LYS  64   7.567  -0.918  -0.918
  491   2HG   LYS  64           HG2      LYS  64   7.397  -1.476  -1.476
  492   1HD   LYS  64           HD1      LYS  64   7.645  -3.855  -3.855
  493   2HD   LYS  64           HD2      LYS  64   7.742  -3.277  -3.277
  494   1HE   LYS  64           HE1      LYS  64   5.385  -2.855  -2.855
  495   2HE   LYS  64           HE2      LYS  64   5.447  -4.005  -4.005
  496   1HZ   LYS  64           HZ1      LYS  64   6.132  -1.513  -1.513
  497   2HZ   LYS  64           HZ2      LYS  64   4.749  -1.299  -1.299
  498   3HZ   LYS  64           HZ3      LYS  64   4.738  -2.431  -2.431
  499    H    TYR  65           HN       TYR  65   7.896  -2.057  -2.057
  500    HA   TYR  65           HA       TYR  65   6.804  -4.660  -4.660
  501   1HB   TYR  65           HB1      TYR  65   5.370  -2.888  -2.888
  502   2HB   TYR  65           HB2      TYR  65   6.461  -2.422  -2.422
  503    HD1  TYR  65           HD1      TYR  65   5.654  -6.009  -6.009
  504    HD2  TYR  65           HD2      TYR  65   4.490  -2.306  -2.306
  505    HE1  TYR  65           HE1      TYR  65   4.275  -7.203  -7.203
  506    HE2  TYR  65           HE2      TYR  65   3.110  -3.506  -3.506
  507    HH   TYR  65           HH       TYR  65   2.173  -6.633  -6.633
  508    H    GLU  66           HN       GLU  66   8.377  -3.245  -3.245
  509    HA   GLU  66           HA       GLU  66   8.642  -5.472  -5.472
  510   1HB   GLU  66           HB1      GLU  66  10.723  -3.369  -3.369
  511   2HB   GLU  66           HB2      GLU  66  10.553  -4.437  -4.437
  512   1HG   GLU  66           HG1      GLU  66   8.070  -3.486  -3.486
  513   2HG   GLU  66           HG2      GLU  66   8.692  -2.229  -2.229
  514    H    LYS  67           HN       LYS  67  10.502  -4.928  -4.928
  515    HA   LYS  67           HA       LYS  67  12.491  -6.969  -6.969
  516   1HB   LYS  67           HB1      LYS  67  12.202  -4.967  -4.967
  517   2HB   LYS  67           HB2      LYS  67  13.197  -6.371  -6.371
  518   1HG   LYS  67           HG1      LYS  67  14.606  -4.634  -4.634
  519   2HG   LYS  67           HG2      LYS  67  14.529  -5.876  -5.876
  520   1HD   LYS  67           HD1      LYS  67  12.875  -4.469  -4.469
  521   2HD   LYS  67           HD2      LYS  67  13.002  -3.241  -3.241
  522   1HE   LYS  67           HE1      LYS  67  15.415  -2.989  -2.989
  523   2HE   LYS  67           HE2      LYS  67  15.307  -4.211  -4.211
  524   1HZ   LYS  67           HZ1      LYS  67  13.310  -2.293  -2.293
  525   2HZ   LYS  67           HZ2      LYS  67  14.786  -1.489  -1.489
  526   3HZ   LYS  67           HZ3      LYS  67  14.650  -2.671  -2.671
  527    H    ASP  68           HN       ASP  68   9.829  -6.585  -6.585
  528    HA   ASP  68           HA       ASP  68  10.192  -9.063  -9.063
  529   1HB   ASP  68           HB1      ASP  68   9.277  -6.936  -6.936
  530   2HB   ASP  68           HB2      ASP  68   7.864  -7.116  -7.116
  531    H    ILE  69           HN       ILE  69   8.733  -7.888  -7.888
  532    HA   ILE  69           HA       ILE  69   6.953 -10.213 -10.213
  533    HB   ILE  69           HB       ILE  69   6.257  -7.972  -7.972
  534   1HG1  ILE  69          HG11      ILE  69   5.380  -8.700  -8.700
  535   2HG1  ILE  69          HG12      ILE  69   6.700  -9.838  -9.838
  536   1HG2  ILE  69          HG21      ILE  69   8.486  -7.300  -7.300
  537   2HG2  ILE  69          HG22      ILE  69   8.469  -8.469  -8.469
  538   3HG2  ILE  69          HG23      ILE  69   7.321  -7.135  -7.135
  539   1HD1  ILE  69          HD11      ILE  69   4.648 -10.071 -10.071
  540   2HD1  ILE  69          HD12      ILE  69   4.638 -10.998 -10.998
  541   3HD1  ILE  69          HD13      ILE  69   5.935 -11.211 -11.211
  542    H    ALA  70           HN       ALA  70   9.867  -8.926  -8.926
  543    HA   ALA  70           HA       ALA  70  10.540 -10.944 -10.944
  544   1HB   ALA  70           HB1      ALA  70  12.447  -9.287  -9.287
  545   2HB   ALA  70           HB2      ALA  70  12.920 -10.167 -10.167
  546   3HB   ALA  70           HB3      ALA  70  11.847  -8.787  -8.787
  547    H    ALA  71           HN       ALA  71  10.754 -10.712 -10.712
  548    HA   ALA  71           HA       ALA  71  12.219 -13.226 -13.226
  549   1HB   ALA  71           HB1      ALA  71  12.641 -11.313 -11.313
  550   2HB   ALA  71           HB2      ALA  71  10.956 -11.332 -11.332
  551   3HB   ALA  71           HB3      ALA  71  12.003 -12.695 -12.695
  552    H    TYR  72           HN       TYR  72   8.993 -11.939 -11.939
  553    HA   TYR  72           HA       TYR  72   7.655 -14.068 -14.068
  554   1HB   TYR  72           HB1      TYR  72   6.612 -11.932 -11.932
  555   2HB   TYR  72           HB2      TYR  72   6.671 -12.192 -12.192
  556    HD1  TYR  72           HD1      TYR  72   5.186 -13.510 -13.510
  557    HD2  TYR  72           HD2      TYR  72   4.933 -13.343 -13.343
  558    HE1  TYR  72           HE1      TYR  72   3.004 -14.619 -14.619
  559    HE2  TYR  72           HE2      TYR  72   2.752 -14.457 -14.457
  560    HH   TYR  72           HH       TYR  72   1.622 -16.087 -16.087
  561    H    ARG  73           HN       ARG  73   8.229 -13.411 -13.411
  562    HA   ARG  73           HA       ARG  73   6.986 -15.804 -15.804
  563   1HB   ARG  73           HB1      ARG  73   8.884 -13.771 -13.771
  564   2HB   ARG  73           HB2      ARG  73   8.034 -15.027 -15.027
  565   1HG   ARG  73           HG1      ARG  73   5.864 -14.071 -14.071
  566   2HG   ARG  73           HG2      ARG  73   6.633 -12.872 -12.872
  567   1HD   ARG  73           HD1      ARG  73   6.942 -13.087 -13.087
  568   2HD   ARG  73           HD2      ARG  73   5.972 -11.886 -11.886
  569    HE   ARG  73           HE       ARG  73   8.409 -11.423 -11.423
  570   1HH1  ARG  73          HH11      ARG  73  10.009 -12.604 -12.604
  571   2HH1  ARG  73          HH12      ARG  73  10.100 -11.385 -11.385
  572   1HH2  ARG  73          HH21      ARG  73   7.365  -9.605  -9.605
  573   2HH2  ARG  73          HH22      ARG  73   8.569  -9.644  -9.644
  574    H    ALA  74           HN       ALA  74  10.126 -14.747 -14.747
  575    HA   ALA  74           HA       ALA  74  11.869 -16.610 -16.610
  576   1HB   ALA  74           HB1      ALA  74  12.566 -14.903 -14.903
  577   2HB   ALA  74           HB2      ALA  74  11.827 -15.875 -15.875
  578   3HB   ALA  74           HB3      ALA  74  13.212 -16.487 -16.487
  579    H    LYS  75           HN       LYS  75   9.736 -16.955 -16.955
  580    HA   LYS  75           HA       LYS  75   8.331 -18.663 -18.663
  581   1HB   LYS  75           HB1      LYS  75   8.890 -19.950 -19.950
  582   2HB   LYS  75           HB2      LYS  75  10.202 -20.729 -20.729
  583   1HG   LYS  75           HG1      LYS  75   8.588 -21.560 -21.560
  584   2HG   LYS  75           HG2      LYS  75   7.279 -20.739 -20.739
  585   1HD   LYS  75           HD1      LYS  75   7.743 -22.123 -22.123
  586   2HD   LYS  75           HD2      LYS  75   9.013 -22.959 -22.959
  587   1HE   LYS  75           HE1      LYS  75   6.954 -24.301 -24.301
  588   2HE   LYS  75           HE2      LYS  75   7.299 -23.709 -23.709
  589   1HZ   LYS  75           HZ1      LYS  75   5.732 -21.814 -21.814
  590   2HZ   LYS  75           HZ2      LYS  75   5.005 -23.340 -23.340
  591   3HZ   LYS  75           HZ3      LYS  75   5.348 -22.708 -22.708
  592    H    GLY  76           HN       GLY  76   9.642 -17.484 -17.484
  593   1HA   GLY  76           HA1      GLY  76  11.688 -19.085 -19.085
  594   2HA   GLY  76           HA2      GLY  76  11.234 -17.441 -17.441
  595    H    LYS  77           HN       LYS  77   8.873 -17.258 -17.258
  596    HA   LYS  77           HA       LYS  77   7.418 -17.632 -17.632
  597   1HB   LYS  77           HB1      LYS  77   7.778 -20.403 -20.403
  598   2HB   LYS  77           HB2      LYS  77   6.698 -20.221 -20.221
  599   1HG   LYS  77           HG1      LYS  77   6.508 -18.509 -18.509
  600   2HG   LYS  77           HG2      LYS  77   5.657 -20.030 -20.030
  601   1HD   LYS  77           HD1      LYS  77   4.446 -19.184 -19.184
  602   2HD   LYS  77           HD2      LYS  77   5.342 -17.681 -17.681
  603   1HE   LYS  77           HE1      LYS  77   3.539 -18.632 -18.632
  604   2HE   LYS  77           HE2      LYS  77   3.071 -17.457 -17.457
  605   1HZ   LYS  77           HZ1      LYS  77   5.541 -16.697 -16.697
  606   2HZ   LYS  77           HZ2      LYS  77   4.460 -17.002 -17.002
  607   3HZ   LYS  77           HZ3      LYS  77   4.051 -15.886 -15.886
  608    HA   PRO  78           HA       PRO  78   9.611 -19.397 -19.397
  609   1HB   PRO  78           HB1      PRO  78   7.097 -20.339 -20.339
  610   2HB   PRO  78           HB2      PRO  78   8.151 -19.020 -19.020
  611   1HG   PRO  78           HG1      PRO  78   5.682 -18.499 -18.499
  612   2HG   PRO  78           HG2      PRO  78   7.049 -17.443 -17.443
  613   1HD   PRO  78           HD1      PRO  78   6.043 -19.813 -19.813
  614   2HD   PRO  78           HD2      PRO  78   6.266 -18.120 -18.120
  615    H    ASP  79           HN       ASP  79   9.246 -21.083 -21.083
  616    HA   ASP  79           HA       ASP  79   9.421 -23.757 -23.757
  617   1HB   ASP  79           HB1      ASP  79   7.174 -23.193 -23.193
  618   2HB   ASP  79           HB2      ASP  79   8.121 -23.317 -23.317
  619    H    ALA  80           HN       ALA  80  11.462 -22.036 -22.036
  620    HA   ALA  80           HA       ALA  80  12.989 -23.396 -23.396
  621   1HB   ALA  80           HB1      ALA  80  13.055 -20.440 -20.440
  622   2HB   ALA  80           HB2      ALA  80  14.091 -21.190 -21.190
  623   3HB   ALA  80           HB3      ALA  80  12.360 -21.100 -21.100
  624    H    ALA  81           HN       ALA  81  13.172 -24.618 -24.618
  625    HA   ALA  81           HA       ALA  81  15.540 -23.596 -23.596
  626   1HB   ALA  81           HB1      ALA  81  13.358 -25.525 -25.525
  627   2HB   ALA  81           HB2      ALA  81  14.729 -25.032 -25.032
  628   3HB   ALA  81           HB3      ALA  81  13.520 -23.852 -23.852
  629   1H1   BME  16           HE1      MER  16  -8.968   9.497   9.497
  630   2H1   BME  16           HE2      MER  16  -7.222   9.271   9.271
  631   1H2   BME  16           HZ1      MER  16  -8.573  10.017  10.017
  632   2H2   BME  16           HZ2      MER  16  -7.745  11.148  11.148
  633    HO1  BME  16           HH       MER  16  -7.475   7.369   7.369

  Start of MODEL   44
    1    H    ASN   3           HN       ASN   3  -4.499 -11.190 -11.190
    2    HA   ASN   3           HA       ASN   3  -2.051 -12.706 -12.706
    3   1HB   ASN   3           HB1      ASN   3  -3.263 -13.164 -13.164
    4   2HB   ASN   3           HB2      ASN   3  -4.028 -13.909 -13.909
    5   1HD2  ASN   3          HD21      ASN   3  -6.192 -11.406 -11.406
    6   2HD2  ASN   3          HD22      ASN   3  -4.728 -12.099 -12.099
    7    H    ALA   4           HN       ALA   4  -0.681 -11.734 -11.734
    8    HA   ALA   4           HA       ALA   4   0.399 -10.006 -10.006
    9   1HB   ALA   4           HB1      ALA   4  -1.452 -10.257 -10.257
   10   2HB   ALA   4           HB2      ALA   4  -2.444  -9.135  -9.135
   11   3HB   ALA   4           HB3      ALA   4  -0.979  -8.572  -8.572
   12    HA   PRO   5           HA       PRO   5   0.654  -6.594  -6.594
   13   1HB   PRO   5           HB1      PRO   5   3.026  -6.468  -6.468
   14   2HB   PRO   5           HB2      PRO   5   2.949  -6.060  -6.060
   15   1HG   PRO   5           HG1      PRO   5   3.964  -8.443  -8.443
   16   2HG   PRO   5           HG2      PRO   5   2.767  -8.378  -8.378
   17   1HD   PRO   5           HD1      PRO   5   2.298  -9.204  -9.204
   18   2HD   PRO   5           HD2      PRO   5   1.716  -9.978  -9.978
   19    H    LYS   6           HN       LYS   6  -0.504  -4.998  -4.998
   20    HA   LYS   6           HA       LYS   6  -0.949  -4.134  -4.134
   21   1HB   LYS   6           HB1      LYS   6  -3.111  -3.261  -3.261
   22   2HB   LYS   6           HB2      LYS   6  -2.975  -4.923  -4.923
   23   1HG   LYS   6           HG1      LYS   6  -2.105  -4.010  -4.010
   24   2HG   LYS   6           HG2      LYS   6  -2.559  -2.414  -2.414
   25   1HD   LYS   6           HD1      LYS   6  -4.462  -4.767  -4.767
   26   2HD   LYS   6           HD2      LYS   6  -4.325  -3.447  -3.447
   27   1HE   LYS   6           HE1      LYS   6  -5.044  -1.839  -1.839
   28   2HE   LYS   6           HE2      LYS   6  -5.214  -3.177  -3.177
   29   1HZ   LYS   6           HZ1      LYS   6  -6.575  -3.783  -3.783
   30   2HZ   LYS   6           HZ2      LYS   6  -7.061  -2.249  -2.249
   31   3HZ   LYS   6           HZ3      LYS   6  -7.204  -3.590  -3.590
   32    H    ARG   7           HN       ARG   7  -0.964  -1.798  -1.798
   33    HA   ARG   7           HA       ARG   7   1.213  -0.450  -0.450
   34   1HB   ARG   7           HB1      ARG   7   0.240   1.602   1.602
   35   2HB   ARG   7           HB2      ARG   7   0.168   0.236   0.236
   36   1HG   ARG   7           HG1      ARG   7  -2.288  -0.060  -0.060
   37   2HG   ARG   7           HG2      ARG   7  -2.151   1.494   1.494
   38   1HD   ARG   7           HD1      ARG   7  -1.324   2.517   2.517
   39   2HD   ARG   7           HD2      ARG   7  -1.631   0.985   0.985
   40    HE   ARG   7           HE       ARG   7  -4.066   1.311   1.311
   41   1HH1  ARG   7          HH11      ARG   7  -4.078   3.660   3.660
   42   2HH1  ARG   7          HH12      ARG   7  -4.280   4.966   4.966
   43   1HH2  ARG   7          HH21      ARG   7  -3.318   3.009   3.009
   44   2HH2  ARG   7          HH22      ARG   7  -3.837   4.589   4.589
   45    HA   PRO   8           HA       PRO   8  -0.213   0.618   0.618
   46   1HB   PRO   8           HB1      PRO   8   2.586   1.780   1.780
   47   2HB   PRO   8           HB2      PRO   8   1.829   0.786   0.786
   48   1HG   PRO   8           HG1      PRO   8   3.551  -0.413  -0.413
   49   2HG   PRO   8           HG2      PRO   8   2.002  -1.222  -1.222
   50   1HD   PRO   8           HD1      PRO   8   2.737   0.613   0.613
   51   2HD   PRO   8           HD2      PRO   8   2.114  -1.050  -1.050
   52    HA   PRO   9           HA       PRO   9  -0.892   5.177   5.177
   53   1HB   PRO   9           HB1      PRO   9   1.907   5.550   5.550
   54   2HB   PRO   9           HB2      PRO   9   0.447   6.485   6.485
   55   1HG   PRO   9           HG1      PRO   9   1.015   4.543   4.543
   56   2HG   PRO   9           HG2      PRO   9  -0.634   4.562   4.562
   57   1HD   PRO   9           HD1      PRO   9   1.733   2.882   2.882
   58   2HD   PRO   9           HD2      PRO   9   0.067   2.332   2.332
   59    H    SER  10           HN       SER  10  -0.088   7.253   7.253
   60    HA   SER  10           HA       SER  10   1.323   6.731   6.731
   61   1HB   SER  10           HB1      SER  10  -0.064   8.669   8.669
   62   2HB   SER  10           HB2      SER  10  -1.029   7.295   7.295
   63    HG   SER  10           HG       SER  10  -1.782   8.553   8.553
   64    H    ALA  11           HN       ALA  11   0.984   9.065   9.065
   65    HA   ALA  11           HA       ALA  11   3.202  10.134  10.134
   66   1HB   ALA  11           HB1      ALA  11   2.746  11.360  11.360
   67   2HB   ALA  11           HB2      ALA  11   3.948  11.913  11.913
   68   3HB   ALA  11           HB3      ALA  11   4.145  10.359  10.359
   69    H    PHE  12           HN       PHE  12   0.640  10.950  10.950
   70    HA   PHE  12           HA       PHE  12  -0.320  13.388  13.388
   71   1HB   PHE  12           HB1      PHE  12  -1.081  12.720  12.720
   72   2HB   PHE  12           HB2      PHE  12  -1.380  11.049  11.049
   73    HD1  PHE  12           HD1      PHE  12  -3.202  13.166  13.166
   74    HD2  PHE  12           HD2      PHE  12  -3.172  11.645  11.645
   75    HE1  PHE  12           HE1      PHE  12  -5.626  13.469  13.469
   76    HE2  PHE  12           HE2      PHE  12  -5.594  11.960  11.960
   77    HZ   PHE  12           HZ       PHE  12  -6.831  12.873  12.873
   78    H    PHE  13           HN       PHE  13  -0.838   9.955   9.955
   79    HA   PHE  13           HA       PHE  13  -2.871  10.056  10.056
   80   1HB   PHE  13           HB1      PHE  13  -1.351   8.057   8.057
   81   2HB   PHE  13           HB2      PHE  13  -0.412   8.450   8.450
   82    HD1  PHE  13           HD1      PHE  13  -1.760   8.633   8.633
   83    HD2  PHE  13           HD2      PHE  13  -3.347   6.827   6.827
   84    HE1  PHE  13           HE1      PHE  13  -3.492   7.527   7.527
   85    HE2  PHE  13           HE2      PHE  13  -5.077   5.724   5.724
   86    HZ   PHE  13           HZ       PHE  13  -5.147   6.064   6.064
   87    H    LEU  14           HN       LEU  14   0.559  10.667  10.667
   88    HA   LEU  14           HA       LEU  14   0.258  11.179  11.179
   89   1HB   LEU  14           HB1      LEU  14   2.127  12.617  12.617
   90   2HB   LEU  14           HB2      LEU  14   2.242  12.572  12.572
   91    HG   LEU  14           HG       LEU  14   3.849  11.108  11.108
   92   1HD1  LEU  14          HD11      LEU  14   2.465   9.880   9.880
   93   2HD1  LEU  14          HD12      LEU  14   1.496   9.210   9.210
   94   3HD1  LEU  14          HD13      LEU  14   3.184   8.768   8.768
   95   1HD2  LEU  14          HD21      LEU  14   3.538  11.056  11.056
   96   2HD2  LEU  14          HD22      LEU  14   3.782   9.417   9.417
   97   3HD2  LEU  14          HD23      LEU  14   2.171   9.953   9.953
   98    H    PHE  15           HN       PHE  15   0.424  13.558  13.558
   99    HA   PHE  15           HA       PHE  15  -0.386  15.815  15.815
  100   1HB   PHE  15           HB1      PHE  15   0.593  16.522  16.522
  101   2HB   PHE  15           HB2      PHE  15   0.252  14.966  14.966
  102    HD1  PHE  15           HD1      PHE  15  -1.729  14.646  14.646
  103    HD2  PHE  15           HD2      PHE  15  -0.756  18.478  18.478
  104    HE1  PHE  15           HE1      PHE  15  -3.272  15.676  15.676
  105    HE2  PHE  15           HE2      PHE  15  -2.316  19.517  19.517
  106    HZ   PHE  15           HZ       PHE  15  -3.571  18.112  18.112
  107    H    CYS  16           HN       MER  16  -2.419  13.682  13.682
  108    HA   CYS  16           HA       MER  16  -4.913  14.930  14.930
  109   1HB   CYS  16           HB1      MER  16  -5.954  12.905  12.905
  110   2HB   CYS  16           HB2      MER  16  -4.357  12.661  12.661
  111    H    SER  17           HN       SER  17  -3.357  12.595  12.595
  112    HA   SER  17           HA       SER  17  -5.368  12.408  12.408
  113   1HB   SER  17           HB1      SER  17  -2.321  12.248  12.248
  114   2HB   SER  17           HB2      SER  17  -3.550  11.573  11.573
  115    HG   SER  17           HG       SER  17  -2.615  10.591  10.591
  116    H    GLU  18           HN       GLU  18  -2.720  14.618  14.618
  117    HA   GLU  18           HA       GLU  18  -3.410  16.162  16.162
  118   1HB   GLU  18           HB1      GLU  18  -1.081  15.718  15.718
  119   2HB   GLU  18           HB2      GLU  18  -1.521  16.919  16.919
  120   1HG   GLU  18           HG1      GLU  18  -0.432  18.276  18.276
  121   2HG   GLU  18           HG2      GLU  18  -2.073  18.429  18.429
  122    H    TYR  19           HN       TYR  19  -4.859  15.993  15.993
  123    HA   TYR  19           HA       TYR  19  -5.470  18.896  18.896
  124   1HB   TYR  19           HB1      TYR  19  -5.172  16.676  16.676
  125   2HB   TYR  19           HB2      TYR  19  -6.650  17.633  17.633
  126    HD1  TYR  19           HD1      TYR  19  -3.115  18.268  18.268
  127    HD2  TYR  19           HD2      TYR  19  -6.386  19.405  19.405
  128    HE1  TYR  19           HE1      TYR  19  -1.745  20.038  20.038
  129    HE2  TYR  19           HE2      TYR  19  -5.029  21.175  21.175
  130    HH   TYR  19           HH       TYR  19  -3.095  22.227  22.227
  131    H    ARG  20           HN       ARG  20  -6.920  15.841  15.841
  132    HA   ARG  20           HA       ARG  20  -9.537  15.980  15.980
  133   1HB   ARG  20           HB1      ARG  20  -8.375  14.204  14.204
  134   2HB   ARG  20           HB2      ARG  20  -8.553  15.188  15.188
  135   1HG   ARG  20           HG1      ARG  20 -10.828  14.759  14.759
  136   2HG   ARG  20           HG2      ARG  20 -11.087  14.896  14.896
  137   1HD   ARG  20           HD1      ARG  20  -9.857  12.574  12.574
  138   2HD   ARG  20           HD2      ARG  20 -10.173  12.478  12.478
  139    HE   ARG  20           HE       ARG  20 -12.435  13.063  13.063
  140   1HH1  ARG  20          HH11      ARG  20 -12.126  12.134  12.134
  141   2HH1  ARG  20          HH12      ARG  20 -12.914  10.597  10.597
  142   1HH2  ARG  20          HH21      ARG  20 -12.869  10.655  10.655
  143   2HH2  ARG  20          HH22      ARG  20 -13.347   9.732   9.732
  144    HA   PRO  21           HA       PRO  21 -11.029  18.636  18.636
  145   1HB   PRO  21           HB1      PRO  21  -9.300  20.185  20.185
  146   2HB   PRO  21           HB2      PRO  21  -9.583  18.477  18.477
  147   1HG   PRO  21           HG1      PRO  21  -7.357  19.602  19.602
  148   2HG   PRO  21           HG2      PRO  21  -7.172  18.627  18.627
  149   1HD   PRO  21           HD1      PRO  21  -7.236  17.342  17.342
  150   2HD   PRO  21           HD2      PRO  21  -8.239  16.700  16.700
  151    H    LYS  22           HN       LYS  22  -8.202  20.205  20.205
  152    HA   LYS  22           HA       LYS  22  -9.277  22.762  22.762
  153   1HB   LYS  22           HB1      LYS  22  -6.978  21.229  21.229
  154   2HB   LYS  22           HB2      LYS  22  -7.491  22.521  22.521
  155   1HG   LYS  22           HG1      LYS  22  -7.387  24.136  24.136
  156   2HG   LYS  22           HG2      LYS  22  -6.831  22.857  22.857
  157   1HD   LYS  22           HD1      LYS  22  -5.358  23.577  23.577
  158   2HD   LYS  22           HD2      LYS  22  -5.023  24.393  24.393
  159   1HE   LYS  22           HE1      LYS  22  -4.841  21.362  21.362
  160   2HE   LYS  22           HE2      LYS  22  -3.471  22.455  22.455
  161   1HZ   LYS  22           HZ1      LYS  22  -4.882  23.064  23.064
  162   2HZ   LYS  22           HZ2      LYS  22  -4.648  21.381  21.381
  163   3HZ   LYS  22           HZ3      LYS  22  -3.316  22.432  22.432
  164    H    ILE  23           HN       ILE  23  -9.674  20.032  20.032
  165    HA   ILE  23           HA       ILE  23 -10.922  21.898  21.898
  166    HB   ILE  23           HB       ILE  23 -11.189  19.716  19.716
  167   1HG1  ILE  23          HG11      ILE  23  -9.033  18.700  18.700
  168   2HG1  ILE  23          HG12      ILE  23 -10.708  18.199  18.199
  169   1HG2  ILE  23          HG21      ILE  23  -9.494  21.475  21.475
  170   2HG2  ILE  23          HG22      ILE  23  -8.429  20.770  20.770
  171   3HG2  ILE  23          HG23      ILE  23  -8.774  19.902  19.902
  172   1HD1  ILE  23          HD11      ILE  23 -10.647  17.390  17.390
  173   2HD1  ILE  23          HD12      ILE  23  -8.964  17.849  17.849
  174   3HD1  ILE  23          HD13      ILE  23  -9.446  16.579  16.579
  175    H    LYS  24           HN       LYS  24 -11.630  19.562  19.562
  176    HA   LYS  24           HA       LYS  24 -14.327  18.974  18.974
  177   1HB   LYS  24           HB1      LYS  24 -12.902  17.710  17.710
  178   2HB   LYS  24           HB2      LYS  24 -12.708  19.052  19.052
  179   1HG   LYS  24           HG1      LYS  24 -15.570  18.630  18.630
  180   2HG   LYS  24           HG2      LYS  24 -14.859  17.044  17.044
  181   1HD   LYS  24           HD1      LYS  24 -15.351  17.916  17.916
  182   2HD   LYS  24           HD2      LYS  24 -13.612  17.853  17.853
  183   1HE   LYS  24           HE1      LYS  24 -14.262  19.998  19.998
  184   2HE   LYS  24           HE2      LYS  24 -13.610  20.319  20.319
  185   1HZ   LYS  24           HZ1      LYS  24 -16.357  19.839  19.839
  186   2HZ   LYS  24           HZ2      LYS  24 -16.125  20.971  20.971
  187   3HZ   LYS  24           HZ3      LYS  24 -15.498  21.266  21.266
  188    H    GLY  25           HN       GLY  25 -12.687  21.443  21.443
  189   1HA   GLY  25           HA1      GLY  25 -14.902  22.843  22.843
  190   2HA   GLY  25           HA2      GLY  25 -13.287  23.494  23.494
  191    H    GLU  26           HN       GLU  26 -12.958  23.428  23.428
  192    HA   GLU  26           HA       GLU  26 -14.411  25.679  25.679
  193   1HB   GLU  26           HB1      GLU  26 -12.704  23.663  23.663
  194   2HB   GLU  26           HB2      GLU  26 -13.171  25.231  25.231
  195   1HG   GLU  26           HG1      GLU  26 -11.702  25.005  25.005
  196   2HG   GLU  26           HG2      GLU  26 -10.811  24.929  24.929
  197    H    HIS  27           HN       HIS  27 -14.537  22.305  22.305
  198    HA   HIS  27           HA       HIS  27 -17.168  22.588  22.588
  199   1HB   HIS  27           HB1      HIS  27 -14.958  20.738  20.738
  200   2HB   HIS  27           HB2      HIS  27 -16.428  21.253  21.253
  201    HD1  HIS  27           HD1      HIS  27 -16.379  24.017  24.017
  202    HD2  HIS  27           HD2      HIS  27 -12.777  22.152  22.152
  203    HE1  HIS  27           HE1      HIS  27 -14.676  25.552  25.552
  204    HA   PRO  28           HA       PRO  28 -17.702  19.193  19.193
  205   1HB   PRO  28           HB1      PRO  28 -19.536  20.295  20.295
  206   2HB   PRO  28           HB2      PRO  28 -17.839  20.729  20.729
  207   1HG   PRO  28           HG1      PRO  28 -20.029  22.236  22.236
  208   2HG   PRO  28           HG2      PRO  28 -18.904  22.892  22.892
  209   1HD   PRO  28           HD1      PRO  28 -18.379  23.021  23.021
  210   2HD   PRO  28           HD2      PRO  28 -17.082  22.933  22.933
  211    H    GLY  29           HN       GLY  29 -18.547  19.471  19.471
  212   1HA   GLY  29           HA1      GLY  29 -21.321  18.474  18.474
  213   2HA   GLY  29           HA2      GLY  29 -20.937  19.715  19.715
  214    H    LEU  30           HN       LEU  30 -18.311  17.536  17.536
  215    HA   LEU  30           HA       LEU  30 -19.374  16.138  16.138
  216   1HB   LEU  30           HB1      LEU  30 -16.508  15.781  15.781
  217   2HB   LEU  30           HB2      LEU  30 -17.457  16.430  16.430
  218    HG   LEU  30           HG       LEU  30 -15.790  18.092  18.092
  219   1HD1  LEU  30          HD11      LEU  30 -18.034  18.904  18.904
  220   2HD1  LEU  30          HD12      LEU  30 -18.306  19.165  19.165
  221   3HD1  LEU  30          HD13      LEU  30 -16.978  19.948  19.948
  222   1HD2  LEU  30          HD21      LEU  30 -16.570  17.711  17.711
  223   2HD2  LEU  30          HD22      LEU  30 -15.125  17.166  17.166
  224   3HD2  LEU  30          HD23      LEU  30 -15.412  18.866  18.866
  225    H    SER  31           HN       SER  31 -17.789  14.154  14.154
  226    HA   SER  31           HA       SER  31 -18.218  12.285  12.285
  227   1HB   SER  31           HB1      SER  31 -18.195  11.757  11.757
  228   2HB   SER  31           HB2      SER  31 -18.422  10.515  10.515
  229    HG   SER  31           HG       SER  31 -20.402  11.168  11.168
  230    H    ILE  32           HN       ILE  32 -16.759  10.265  10.265
  231    HA   ILE  32           HA       ILE  32 -14.043  11.132  11.132
  232    HB   ILE  32           HB       ILE  32 -15.497   9.147   9.147
  233   1HG1  ILE  32          HG11      ILE  32 -13.279   9.446   9.446
  234   2HG1  ILE  32          HG12      ILE  32 -13.595   7.760   7.760
  235   1HG2  ILE  32          HG21      ILE  32 -16.046   8.063   8.063
  236   2HG2  ILE  32          HG22      ILE  32 -14.352   7.752   7.752
  237   3HG2  ILE  32          HG23      ILE  32 -15.139   6.955   6.955
  238   1HD1  ILE  32          HD11      ILE  32 -12.188   7.916   7.916
  239   2HD1  ILE  32          HD12      ILE  32 -11.838   9.599   9.599
  240   3HD1  ILE  32          HD13      ILE  32 -11.300   8.322   8.322
  241    H    GLY  33           HN       GLY  33 -15.770  10.839  10.839
  242   1HA   GLY  33           HA1      GLY  33 -13.602   9.954   9.954
  243   2HA   GLY  33           HA2      GLY  33 -15.314  10.026  10.026
  244    H    ASP  34           HN       ASP  34 -15.173  12.723  12.723
  245    HA   ASP  34           HA       ASP  34 -14.415  14.379  14.379
  246   1HB   ASP  34           HB1      ASP  34 -16.211  14.672  14.672
  247   2HB   ASP  34           HB2      ASP  34 -15.902  16.074  16.074
  248    H    VAL  35           HN       VAL  35 -14.210  13.997  13.997
  249    HA   VAL  35           HA       VAL  35 -12.457  16.121  16.121
  250    HB   VAL  35           HB       VAL  35 -12.923  13.308  13.308
  251   1HG1  VAL  35          HG11      VAL  35 -10.648  14.061  14.061
  252   2HG1  VAL  35          HG12      VAL  35 -11.356  15.551  15.551
  253   3HG1  VAL  35          HG13      VAL  35 -11.769  14.024  14.024
  254   1HG2  VAL  35          HG21      VAL  35 -14.822  14.938  14.938
  255   2HG2  VAL  35          HG22      VAL  35 -14.157  14.495  14.495
  256   3HG2  VAL  35          HG23      VAL  35 -13.743  16.041  16.041
  257    H    ALA  36           HN       ALA  36 -12.068  12.991  12.991
  258    HA   ALA  36           HA       ALA  36  -9.200  12.938  12.938
  259   1HB   ALA  36           HB1      ALA  36 -11.318  11.186  11.186
  260   2HB   ALA  36           HB2      ALA  36  -9.622  10.725  10.725
  261   3HB   ALA  36           HB3      ALA  36 -10.567  10.922  10.922
  262    H    LYS  37           HN       LYS  37 -11.658  13.239  13.239
  263    HA   LYS  37           HA       LYS  37  -9.543  13.503  13.503
  264   1HB   LYS  37           HB1      LYS  37 -11.172  13.664  13.664
  265   2HB   LYS  37           HB2      LYS  37 -12.093  12.875  12.875
  266   1HG   LYS  37           HG1      LYS  37 -13.030  15.118  15.118
  267   2HG   LYS  37           HG2      LYS  37 -12.138  15.873  15.873
  268   1HD   LYS  37           HD1      LYS  37 -14.312  13.790  13.790
  269   2HD   LYS  37           HD2      LYS  37 -14.457  15.507  15.507
  270   1HE   LYS  37           HE1      LYS  37 -12.632  15.322  15.322
  271   2HE   LYS  37           HE2      LYS  37 -12.624  13.581  13.581
  272   1HZ   LYS  37           HZ1      LYS  37 -15.263  14.396  14.396
  273   2HZ   LYS  37           HZ2      LYS  37 -14.310  15.057  15.057
  274   3HZ   LYS  37           HZ3      LYS  37 -14.304  13.381  13.381
  275    H    LYS  38           HN       LYS  38 -11.159  15.839  15.839
  276    HA   LYS  38           HA       LYS  38 -10.341  18.102  18.102
  277   1HB   LYS  38           HB1      LYS  38 -12.369  17.718  17.718
  278   2HB   LYS  38           HB2      LYS  38 -11.239  18.290  18.290
  279   1HG   LYS  38           HG1      LYS  38 -10.892  20.374  20.374
  280   2HG   LYS  38           HG2      LYS  38 -11.878  19.783  19.783
  281   1HD   LYS  38           HD1      LYS  38 -12.846  20.355  20.355
  282   2HD   LYS  38           HD2      LYS  38 -13.177  21.332  21.332
  283   1HE   LYS  38           HE1      LYS  38 -14.186  18.475  18.475
  284   2HE   LYS  38           HE2      LYS  38 -15.140  19.939  19.939
  285   1HZ   LYS  38           HZ1      LYS  38 -13.762  19.894  19.894
  286   2HZ   LYS  38           HZ2      LYS  38 -14.472  18.370  18.370
  287   3HZ   LYS  38           HZ3      LYS  38 -15.431  19.769  19.769
  288    H    LEU  39           HN       LEU  39  -9.397  16.756  16.756
  289    HA   LEU  39           HA       LEU  39  -7.166  18.611  18.611
  290   1HB   LEU  39           HB1      LEU  39  -7.182  17.923  17.923
  291   2HB   LEU  39           HB2      LEU  39  -8.659  17.092  17.092
  292    HG   LEU  39           HG       LEU  39  -7.059  15.128  15.128
  293   1HD1  LEU  39          HD11      LEU  39  -5.393  16.854  16.854
  294   2HD1  LEU  39          HD12      LEU  39  -4.977  15.225  15.225
  295   3HD1  LEU  39          HD13      LEU  39  -5.068  16.494  16.494
  296   1HD2  LEU  39          HD21      LEU  39  -8.623  15.197  15.197
  297   2HD2  LEU  39          HD22      LEU  39  -7.103  14.388  14.388
  298   3HD2  LEU  39          HD23      LEU  39  -7.341  16.040  16.040
  299    H    GLY  40           HN       GLY  40  -7.669  15.367  15.367
  300   1HA   GLY  40           HA1      GLY  40  -4.929  14.650  14.650
  301   2HA   GLY  40           HA2      GLY  40  -6.200  14.032  14.032
  302    H    GLU  41           HN       GLU  41  -7.010  16.585  16.585
  303    HA   GLU  41           HA       GLU  41  -5.124  16.857  16.857
  304   1HB   GLU  41           HB1      GLU  41  -7.295  18.661  18.661
  305   2HB   GLU  41           HB2      GLU  41  -6.390  19.064  19.064
  306   1HG   GLU  41           HG1      GLU  41  -7.132  17.103  17.103
  307   2HG   GLU  41           HG2      GLU  41  -7.835  16.400  16.400
  308    H    MET  42           HN       MET  42  -5.864  18.847  18.847
  309    HA   MET  42           HA       MET  42  -4.027  20.915  20.915
  310   1HB   MET  42           HB1      MET  42  -4.565  19.317  19.317
  311   2HB   MET  42           HB2      MET  42  -3.862  20.913  20.913
  312   1HG   MET  42           HG1      MET  42  -6.577  20.254  20.254
  313   2HG   MET  42           HG2      MET  42  -6.433  20.781  20.781
  314   1HE   MET  42           HE1      MET  42  -8.294  21.888  21.888
  315   2HE   MET  42           HE2      MET  42  -7.633  23.236  23.236
  316   3HE   MET  42           HE3      MET  42  -7.008  21.623  21.623
  317    H    TRP  43           HN       TRP  43  -3.477  17.834  17.834
  318    HA   TRP  43           HA       TRP  43  -0.781  17.847  17.847
  319   1HB   TRP  43           HB1      TRP  43  -2.125  15.974  15.974
  320   2HB   TRP  43           HB2      TRP  43  -2.500  15.558  15.558
  321    HD1  TRP  43           HD1      TRP  43  -0.854  14.015  14.015
  322    HE1  TRP  43           HE1      TRP  43   1.372  13.083  13.083
  323    HE3  TRP  43           HE3      TRP  43  -0.113  16.537  16.537
  324    HZ2  TRP  43           HZ2      TRP  43   3.336  13.311  13.311
  325    HZ3  TRP  43           HZ3      TRP  43   1.895  16.181  16.181
  326    HH2  TRP  43           HH2      TRP  43   3.632  14.570  14.570
  327    H    ASN  44           HN       ASN  44  -2.208  16.730  16.730
  328    HA   ASN  44           HA       ASN  44   0.152  16.117  16.117
  329   1HB   ASN  44           HB1      ASN  44  -1.122  15.933  15.933
  330   2HB   ASN  44           HB2      ASN  44  -2.442  16.066  16.066
  331   1HD2  ASN  44          HD21      ASN  44  -3.836  18.683  18.683
  332   2HD2  ASN  44          HD22      ASN  44  -4.042  17.293  17.293
  333    H    ASN  45           HN       ASN  45  -1.305  19.205  19.205
  334    HA   ASN  45           HA       ASN  45   1.104  20.582  20.582
  335   1HB   ASN  45           HB1      ASN  45  -0.434  22.490  22.490
  336   2HB   ASN  45           HB2      ASN  45  -0.953  21.030  21.030
  337   1HD2  ASN  45          HD21      ASN  45  -4.057  20.983  20.983
  338   2HD2  ASN  45          HD22      ASN  45  -3.105  20.371  20.371
  339    H    THR  46           HN       THR  46   1.062  19.747  19.747
  340    HA   THR  46           HA       THR  46   0.283  21.958  21.958
  341    HB   THR  46           HB       THR  46   0.655  19.739  19.739
  342    HG1  THR  46           HG1      THR  46   1.317  20.888  20.888
  343   1HG2  THR  46          HG21      THR  46   2.655  18.882  18.882
  344   2HG2  THR  46          HG22      THR  46   3.666  20.042  20.042
  345   3HG2  THR  46          HG23      THR  46   2.870  18.765  18.765
  346    H    ALA  47           HN       ALA  47   3.325  20.928  20.928
  347    HA   ALA  47           HA       ALA  47   4.396  23.482  23.482
  348   1HB   ALA  47           HB1      ALA  47   4.758  23.622  23.622
  349   2HB   ALA  47           HB2      ALA  47   5.676  22.131  22.131
  350   3HB   ALA  47           HB3      ALA  47   6.266  23.582  23.582
  351    H    ALA  48           HN       ALA  48   5.123  20.399  20.399
  352    HA   ALA  48           HA       ALA  48   5.764  18.404  18.404
  353   1HB   ALA  48           HB1      ALA  48   5.990  19.526  19.526
  354   2HB   ALA  48           HB2      ALA  48   7.514  20.232  20.232
  355   3HB   ALA  48           HB3      ALA  48   7.346  18.495  18.495
  356    H    ASP  49           HN       ASP  49   7.593  21.277  21.277
  357    HA   ASP  49           HA       ASP  49   9.894  19.904  19.904
  358   1HB   ASP  49           HB1      ASP  49  10.171  21.942  21.942
  359   2HB   ASP  49           HB2      ASP  49   9.209  22.869  22.869
  360    H    ASP  50           HN       ASP  50   6.982  20.165  20.165
  361    HA   ASP  50           HA       ASP  50   7.501  20.786  20.786
  362   1HB   ASP  50           HB1      ASP  50   5.921  22.410  22.410
  363   2HB   ASP  50           HB2      ASP  50   4.884  21.063  21.063
  364    H    LYS  51           HN       LYS  51   6.691  18.599  18.599
  365    HA   LYS  51           HA       LYS  51   5.181  16.688  16.688
  366   1HB   LYS  51           HB1      LYS  51   6.557  16.302  16.302
  367   2HB   LYS  51           HB2      LYS  51   5.538  15.117  15.117
  368   1HG   LYS  51           HG1      LYS  51   3.597  16.640  16.640
  369   2HG   LYS  51           HG2      LYS  51   4.652  17.827  17.827
  370   1HD   LYS  51           HD1      LYS  51   5.236  16.187  16.187
  371   2HD   LYS  51           HD2      LYS  51   4.213  14.983  14.983
  372   1HE   LYS  51           HE1      LYS  51   2.228  16.269  16.269
  373   2HE   LYS  51           HE2      LYS  51   3.159  17.644  17.644
  374   1HZ   LYS  51           HZ1      LYS  51   3.913  15.378  15.378
  375   2HZ   LYS  51           HZ2      LYS  51   2.215  15.431  15.431
  376   3HZ   LYS  51           HZ3      LYS  51   3.096  16.760  16.760
  377    H    GLN  52           HN       GLN  52   8.280  16.863  16.863
  378    HA   GLN  52           HA       GLN  52   9.776  14.832  14.832
  379   1HB   GLN  52           HB1      GLN  52  10.365  17.482  17.482
  380   2HB   GLN  52           HB2      GLN  52  11.041  17.322  17.322
  381   1HG   GLN  52           HG1      GLN  52  12.794  16.818  16.818
  382   2HG   GLN  52           HG2      GLN  52  12.359  15.324  15.324
  383   1HE2  GLN  52          HE21      GLN  52  10.383  15.127  15.127
  384   2HE2  GLN  52          HE22      GLN  52   9.833  16.032  16.032
  385    HA   PRO  53           HA       PRO  53  10.485  15.353  15.353
  386   1HB   PRO  53           HB1      PRO  53   8.353  16.698  16.698
  387   2HB   PRO  53           HB2      PRO  53   9.927  17.403  17.403
  388   1HG   PRO  53           HG1      PRO  53   7.423  17.438  17.438
  389   2HG   PRO  53           HG2      PRO  53   8.402  18.822  18.822
  390   1HD   PRO  53           HD1      PRO  53   8.914  17.816  17.816
  391   2HD   PRO  53           HD2      PRO  53  10.308  18.060  18.060
  392    H    TYR  54           HN       TYR  54   7.072  15.461  15.461
  393    HA   TYR  54           HA       TYR  54   6.205  13.284  13.284
  394   1HB   TYR  54           HB1      TYR  54   5.003  14.514  14.514
  395   2HB   TYR  54           HB2      TYR  54   4.198  13.247  13.247
  396    HD1  TYR  54           HD1      TYR  54   3.714  13.759  13.759
  397    HD2  TYR  54           HD2      TYR  54   4.839  16.757  16.757
  398    HE1  TYR  54           HE1      TYR  54   2.822  15.486  15.486
  399    HE2  TYR  54           HE2      TYR  54   3.957  18.487  18.487
  400    HH   TYR  54           HH       TYR  54   3.550  18.630  18.630
  401    H    GLU  55           HN       GLU  55   6.813  13.626  13.626
  402    HA   GLU  55           HA       GLU  55   6.416  11.057  11.057
  403   1HB   GLU  55           HB1      GLU  55   7.620  13.487  13.487
  404   2HB   GLU  55           HB2      GLU  55   8.780  12.231  12.231
  405   1HG   GLU  55           HG1      GLU  55   6.860  10.895  10.895
  406   2HG   GLU  55           HG2      GLU  55   5.810  12.263  12.263
  407    H    LYS  56           HN       LYS  56   9.578  12.240  12.240
  408    HA   LYS  56           HA       LYS  56  11.138  10.035  10.035
  409   1HB   LYS  56           HB1      LYS  56  10.976  12.275  12.275
  410   2HB   LYS  56           HB2      LYS  56  11.723  10.880  10.880
  411   1HG   LYS  56           HG1      LYS  56  12.592  12.027  12.027
  412   2HG   LYS  56           HG2      LYS  56  13.310  12.514  12.514
  413   1HD   LYS  56           HD1      LYS  56  13.217   9.587   9.587
  414   2HD   LYS  56           HD2      LYS  56  14.542  10.647  10.647
  415   1HE   LYS  56           HE1      LYS  56  13.663  10.109  10.109
  416   2HE   LYS  56           HE2      LYS  56  14.981   9.280   9.280
  417   1HZ   LYS  56           HZ1      LYS  56  15.346  12.019  12.019
  418   2HZ   LYS  56           HZ2      LYS  56  15.016  11.757  11.757
  419   3HZ   LYS  56           HZ3      LYS  56  16.297  10.935  10.935
  420    H    LYS  57           HN       LYS  57   8.594  10.381  10.381
  421    HA   LYS  57           HA       LYS  57   9.219   7.872   7.872
  422   1HB   LYS  57           HB1      LYS  57   6.616   9.490   9.490
  423   2HB   LYS  57           HB2      LYS  57   7.085   8.267   8.267
  424   1HG   LYS  57           HG1      LYS  57   9.145   9.704   9.704
  425   2HG   LYS  57           HG2      LYS  57   8.432  10.957  10.957
  426   1HD   LYS  57           HD1      LYS  57   6.394  10.950  10.950
  427   2HD   LYS  57           HD2      LYS  57   7.152   9.753   9.753
  428   1HE   LYS  57           HE1      LYS  57   9.065  11.367  11.367
  429   2HE   LYS  57           HE2      LYS  57   8.186  12.573  12.573
  430   1HZ   LYS  57           HZ1      LYS  57   6.457  11.505  11.505
  431   2HZ   LYS  57           HZ2      LYS  57   7.907  11.941  11.941
  432   3HZ   LYS  57           HZ3      LYS  57   7.049  13.092  13.092
  433    H    ALA  58           HN       ALA  58   6.643   8.986   8.986
  434    HA   ALA  58           HA       ALA  58   5.208   6.678   6.678
  435   1HB   ALA  58           HB1      ALA  58   4.729   8.867   8.867
  436   2HB   ALA  58           HB2      ALA  58   6.117   8.691   8.691
  437   3HB   ALA  58           HB3      ALA  58   4.753   7.598   7.598
  438    H    ALA  59           HN       ALA  59   8.147   7.698   7.698
  439    HA   ALA  59           HA       ALA  59   8.660   5.670   5.670
  440   1HB   ALA  59           HB1      ALA  59  10.052   7.732   7.732
  441   2HB   ALA  59           HB2      ALA  59  10.684   7.126   7.126
  442   3HB   ALA  59           HB3      ALA  59  11.077   6.311   6.311
  443    H    LYS  60           HN       LYS  60  10.108   5.788   5.788
  444    HA   LYS  60           HA       LYS  60  11.189   3.323   3.323
  445   1HB   LYS  60           HB1      LYS  60  10.959   5.235   5.235
  446   2HB   LYS  60           HB2      LYS  60   9.412   4.523   4.523
  447   1HG   LYS  60           HG1      LYS  60  10.566   2.357   2.357
  448   2HG   LYS  60           HG2      LYS  60  12.099   3.070   3.070
  449   1HD   LYS  60           HD1      LYS  60  12.023   3.220   3.220
  450   2HD   LYS  60           HD2      LYS  60  11.709   4.840   4.840
  451   1HE   LYS  60           HE1      LYS  60  10.115   4.301   4.301
  452   2HE   LYS  60           HE2      LYS  60   9.229   4.424   4.424
  453   1HZ   LYS  60           HZ1      LYS  60  10.138   1.792   1.792
  454   2HZ   LYS  60           HZ2      LYS  60   9.397   2.261   2.261
  455   3HZ   LYS  60           HZ3      LYS  60   8.540   2.363   2.363
  456    H    LEU  61           HN       LEU  61   7.753   4.046   4.046
  457    HA   LEU  61           HA       LEU  61   6.949   1.348   1.348
  458   1HB   LEU  61           HB1      LEU  61   5.213   3.479   3.479
  459   2HB   LEU  61           HB2      LEU  61   4.695   2.159   2.159
  460    HG   LEU  61           HG       LEU  61   6.405   4.544   4.544
  461   1HD1  LEU  61          HD11      LEU  61   3.625   3.685   3.685
  462   2HD1  LEU  61          HD12      LEU  61   4.516   5.061   5.061
  463   3HD1  LEU  61          HD13      LEU  61   4.041   5.039   5.039
  464   1HD2  LEU  61          HD21      LEU  61   5.585   2.137   2.137
  465   2HD2  LEU  61          HD22      LEU  61   7.222   2.517   2.517
  466   3HD2  LEU  61          HD23      LEU  61   6.387   3.585   3.585
  467    H    LYS  62           HN       LYS  62   6.594   3.115   3.115
  468    HA   LYS  62           HA       LYS  62   5.601   1.000   1.000
  469   1HB   LYS  62           HB1      LYS  62   7.637   3.136   3.136
  470   2HB   LYS  62           HB2      LYS  62   6.866   2.071   2.071
  471   1HG   LYS  62           HG1      LYS  62   4.609   2.902   2.902
  472   2HG   LYS  62           HG2      LYS  62   5.532   4.134   4.134
  473   1HD   LYS  62           HD1      LYS  62   5.493   3.726   3.726
  474   2HD   LYS  62           HD2      LYS  62   4.596   4.943   4.943
  475   1HE   LYS  62           HE1      LYS  62   6.708   5.981   5.981
  476   2HE   LYS  62           HE2      LYS  62   7.621   4.755   4.755
  477   1HZ   LYS  62           HZ1      LYS  62   5.881   5.770   5.770
  478   2HZ   LYS  62           HZ2      LYS  62   6.452   7.122   7.122
  479   3HZ   LYS  62           HZ3      LYS  62   7.547   6.063   6.063
  480    H    GLU  63           HN       GLU  63   8.847   1.796   1.796
  481    HA   GLU  63           HA       GLU  63  10.323  -0.175  -0.175
  482   1HB   GLU  63           HB1      GLU  63  10.671   1.660   1.660
  483   2HB   GLU  63           HB2      GLU  63  11.770   0.308   0.308
  484   1HG   GLU  63           HG1      GLU  63  12.852   2.118   2.118
  485   2HG   GLU  63           HG2      GLU  63  12.388   1.006   1.006
  486    H    LYS  64           HN       LYS  64   9.002  -0.219  -0.219
  487    HA   LYS  64           HA       LYS  64   9.734  -2.776  -2.776
  488   1HB   LYS  64           HB1      LYS  64   8.384  -1.078  -1.078
  489   2HB   LYS  64           HB2      LYS  64   6.961  -1.540  -1.540
  490   1HG   LYS  64           HG1      LYS  64   7.460  -3.972  -3.972
  491   2HG   LYS  64           HG2      LYS  64   8.566  -3.268  -3.268
  492   1HD   LYS  64           HD1      LYS  64   6.685  -1.909  -1.909
  493   2HD   LYS  64           HD2      LYS  64   5.593  -2.631  -2.631
  494   1HE   LYS  64           HE1      LYS  64   6.160  -4.913  -4.913
  495   2HE   LYS  64           HE2      LYS  64   7.121  -4.126  -4.126
  496   1HZ   LYS  64           HZ1      LYS  64   4.592  -2.923  -2.923
  497   2HZ   LYS  64           HZ2      LYS  64   4.390  -4.608  -4.608
  498   3HZ   LYS  64           HZ3      LYS  64   5.312  -3.820  -3.820
  499    H    TYR  65           HN       TYR  65   6.856  -1.858  -1.858
  500    HA   TYR  65           HA       TYR  65   5.641  -4.337  -4.337
  501   1HB   TYR  65           HB1      TYR  65   4.330  -2.485  -2.485
  502   2HB   TYR  65           HB2      TYR  65   5.700  -1.628  -1.628
  503    HD1  TYR  65           HD1      TYR  65   6.465  -2.376  -2.376
  504    HD2  TYR  65           HD2      TYR  65   2.746  -3.637  -3.637
  505    HE1  TYR  65           HE1      TYR  65   5.711  -2.991  -2.991
  506    HE2  TYR  65           HE2      TYR  65   1.989  -4.237  -4.237
  507    HH   TYR  65           HH       TYR  65   2.645  -3.430  -3.430
  508    H    GLU  66           HN       GLU  66   7.802  -2.687  -2.687
  509    HA   GLU  66           HA       GLU  66   8.015  -4.596  -4.596
  510   1HB   GLU  66           HB1      GLU  66  10.395  -3.137  -3.137
  511   2HB   GLU  66           HB2      GLU  66  10.284  -3.868  -3.868
  512   1HG   GLU  66           HG1      GLU  66   8.125  -2.268  -2.268
  513   2HG   GLU  66           HG2      GLU  66   8.988  -1.364  -1.364
  514    H    LYS  67           HN       LYS  67   9.571  -4.815  -4.815
  515    HA   LYS  67           HA       LYS  67  11.147  -7.127  -7.127
  516   1HB   LYS  67           HB1      LYS  67  10.904  -5.703  -5.703
  517   2HB   LYS  67           HB2      LYS  67  11.768  -7.222  -7.222
  518   1HG   LYS  67           HG1      LYS  67  13.480  -5.732  -5.732
  519   2HG   LYS  67           HG2      LYS  67  13.011  -6.143  -6.143
  520   1HD   LYS  67           HD1      LYS  67  13.193  -3.818  -3.818
  521   2HD   LYS  67           HD2      LYS  67  11.485  -4.001  -4.001
  522   1HE   LYS  67           HE1      LYS  67  12.339  -2.256  -2.256
  523   2HE   LYS  67           HE2      LYS  67  11.989  -3.666  -3.666
  524   1HZ   LYS  67           HZ1      LYS  67  14.580  -3.928  -3.928
  525   2HZ   LYS  67           HZ2      LYS  67  14.435  -2.361  -2.361
  526   3HZ   LYS  67           HZ3      LYS  67  14.095  -3.707  -3.707
  527    H    ASP  68           HN       ASP  68   8.260  -6.647  -6.647
  528    HA   ASP  68           HA       ASP  68   8.018  -9.407  -9.407
  529   1HB   ASP  68           HB1      ASP  68   6.134  -7.030  -7.030
  530   2HB   ASP  68           HB2      ASP  68   5.797  -8.616  -8.616
  531    H    ILE  69           HN       ILE  69   7.219  -7.463  -7.463
  532    HA   ILE  69           HA       ILE  69   5.124  -9.331  -9.331
  533    HB   ILE  69           HB       ILE  69   5.223  -6.674  -6.674
  534   1HG1  ILE  69          HG11      ILE  69   3.358  -7.448  -7.448
  535   2HG1  ILE  69          HG12      ILE  69   4.204  -6.786  -6.786
  536   1HG2  ILE  69          HG21      ILE  69   7.407  -6.539  -6.539
  537   2HG2  ILE  69          HG22      ILE  69   6.876  -7.381  -7.381
  538   3HG2  ILE  69          HG23      ILE  69   6.222  -5.794  -5.794
  539   1HD1  ILE  69          HD11      ILE  69   5.029  -9.101  -9.101
  540   2HD1  ILE  69          HD12      ILE  69   4.083  -9.736  -9.736
  541   3HD1  ILE  69          HD13      ILE  69   3.273  -9.001  -9.001
  542    H    ALA  70           HN       ALA  70   8.352  -8.194  -8.194
  543    HA   ALA  70           HA       ALA  70   8.973  -9.826  -9.826
  544   1HB   ALA  70           HB1      ALA  70  10.873  -8.830  -8.830
  545   2HB   ALA  70           HB2      ALA  70  11.384  -9.493  -9.493
  546   3HB   ALA  70           HB3      ALA  70  10.513  -7.979  -7.979
  547    H    ALA  71           HN       ALA  71   8.766 -10.329 -10.329
  548    HA   ALA  71           HA       ALA  71  10.061 -12.937 -12.937
  549   1HB   ALA  71           HB1      ALA  71   8.333 -11.544 -11.544
  550   2HB   ALA  71           HB2      ALA  71   9.256 -13.019 -13.019
  551   3HB   ALA  71           HB3      ALA  71  10.091 -11.511 -11.511
  552    H    TYR  72           HN       TYR  72   6.817 -11.597 -11.597
  553    HA   TYR  72           HA       TYR  72   5.279 -13.956 -13.956
  554   1HB   TYR  72           HB1      TYR  72   4.389 -11.722 -11.722
  555   2HB   TYR  72           HB2      TYR  72   4.760 -11.478 -11.478
  556    HD1  TYR  72           HD1      TYR  72   3.399 -12.557 -12.557
  557    HD2  TYR  72           HD2      TYR  72   2.428 -12.941 -12.941
  558    HE1  TYR  72           HE1      TYR  72   1.153 -13.337 -13.337
  559    HE2  TYR  72           HE2      TYR  72   0.185 -13.720 -13.720
  560    HH   TYR  72           HH       TYR  72  -0.665 -14.858 -14.858
  561    H    ARG  73           HN       ARG  73   6.551 -12.420 -12.420
  562    HA   ARG  73           HA       ARG  73   5.525 -14.335 -14.335
  563   1HB   ARG  73           HB1      ARG  73   7.883 -12.389 -12.389
  564   2HB   ARG  73           HB2      ARG  73   7.162 -13.233 -13.233
  565   1HG   ARG  73           HG1      ARG  73   5.056 -12.008 -12.008
  566   2HG   ARG  73           HG2      ARG  73   5.653 -11.237 -11.237
  567   1HD   ARG  73           HD1      ARG  73   7.533 -10.220 -10.220
  568   2HD   ARG  73           HD2      ARG  73   6.808 -10.932 -10.932
  569    HE   ARG  73           HE       ARG  73   5.433  -8.880  -8.880
  570   1HH1  ARG  73          HH11      ARG  73   3.336  -9.392  -9.392
  571   2HH1  ARG  73          HH12      ARG  73   3.564  -8.758  -8.758
  572   1HH2  ARG  73          HH21      ARG  73   7.040  -8.507  -8.507
  573   2HH2  ARG  73          HH22      ARG  73   5.726  -8.239  -8.239
  574    H    ALA  74           HN       ALA  74   8.349 -13.879 -13.879
  575    HA   ALA  74           HA       ALA  74   9.631 -16.319 -16.319
  576   1HB   ALA  74           HB1      ALA  74  10.933 -14.230 -14.230
  577   2HB   ALA  74           HB2      ALA  74  10.705 -14.107 -14.107
  578   3HB   ALA  74           HB3      ALA  74  11.661 -15.422 -15.422
  579    H    LYS  75           HN       LYS  75   7.424 -16.729 -16.729
  580    HA   LYS  75           HA       LYS  75   8.486 -17.720 -17.720
  581   1HB   LYS  75           HB1      LYS  75   6.284 -17.592 -17.592
  582   2HB   LYS  75           HB2      LYS  75   6.341 -16.163 -16.163
  583   1HG   LYS  75           HG1      LYS  75   5.095 -17.387 -17.387
  584   2HG   LYS  75           HG2      LYS  75   5.068 -18.815 -18.815
  585   1HD   LYS  75           HD1      LYS  75   3.841 -17.577 -17.577
  586   2HD   LYS  75           HD2      LYS  75   3.800 -16.160 -16.160
  587   1HE   LYS  75           HE1      LYS  75   2.468 -17.368 -17.368
  588   2HE   LYS  75           HE2      LYS  75   2.611 -18.859 -18.859
  589   1HZ   LYS  75           HZ1      LYS  75   1.633 -16.921 -16.921
  590   2HZ   LYS  75           HZ2      LYS  75   0.735 -16.800 -16.800
  591   3HZ   LYS  75           HZ3      LYS  75   0.830 -18.284 -18.284
  592    H    GLY  76           HN       GLY  76   6.882 -18.352 -18.352
  593   1HA   GLY  76           HA1      GLY  76   7.814 -20.857 -20.857
  594   2HA   GLY  76           HA2      GLY  76   6.411 -21.177 -21.177
  595    H    LYS  77           HN       LYS  77   5.851 -18.301 -18.301
  596    HA   LYS  77           HA       LYS  77   4.537 -17.641 -17.641
  597   1HB   LYS  77           HB1      LYS  77   5.290 -20.322 -20.322
  598   2HB   LYS  77           HB2      LYS  77   4.644 -18.924 -18.924
  599   1HG   LYS  77           HG1      LYS  77   6.633 -17.601 -17.601
  600   2HG   LYS  77           HG2      LYS  77   7.294 -18.893 -18.893
  601   1HD   LYS  77           HD1      LYS  77   7.353 -20.408 -20.408
  602   2HD   LYS  77           HD2      LYS  77   6.694 -19.138 -19.138
  603   1HE   LYS  77           HE1      LYS  77   9.344 -18.968 -18.968
  604   2HE   LYS  77           HE2      LYS  77   9.175 -19.308 -19.308
  605   1HZ   LYS  77           HZ1      LYS  77   7.714 -16.999 -16.999
  606   2HZ   LYS  77           HZ2      LYS  77   9.243 -16.825 -16.825
  607   3HZ   LYS  77           HZ3      LYS  77   9.118 -17.164 -17.164
  608    HA   PRO  78           HA       PRO  78   0.681 -19.532 -19.532
  609   1HB   PRO  78           HB1      PRO  78  -1.018 -18.119 -18.119
  610   2HB   PRO  78           HB2      PRO  78   0.065 -17.258 -17.258
  611   1HG   PRO  78           HG1      PRO  78   0.522 -17.826 -17.826
  612   2HG   PRO  78           HG2      PRO  78   0.564 -16.261 -16.261
  613   1HD   PRO  78           HD1      PRO  78   2.855 -17.752 -17.752
  614   2HD   PRO  78           HD2      PRO  78   2.679 -16.703 -16.703
  615    H    ASP  79           HN       ASP  79   2.245 -21.125 -21.125
  616    HA   ASP  79           HA       ASP  79   0.118 -22.508 -22.508
  617   1HB   ASP  79           HB1      ASP  79   1.857 -21.123 -21.123
  618   2HB   ASP  79           HB2      ASP  79   3.011 -22.357 -22.357
  619    H    ALA  80           HN       ALA  80   2.695 -22.551 -22.551
  620    HA   ALA  80           HA       ALA  80   2.681 -25.537 -25.537
  621   1HB   ALA  80           HB1      ALA  80   4.955 -23.598 -23.598
  622   2HB   ALA  80           HB2      ALA  80   5.026 -25.335 -25.335
  623   3HB   ALA  80           HB3      ALA  80   4.856 -24.673 -24.673
  624    H    ALA  81           HN       ALA  81   3.216 -22.525 -22.525
  625    HA   ALA  81           HA       ALA  81   1.937 -23.813 -23.813
  626   1HB   ALA  81           HB1      ALA  81   4.420 -22.050 -22.050
  627   2HB   ALA  81           HB2      ALA  81   3.623 -22.668 -22.668
  628   3HB   ALA  81           HB3      ALA  81   4.386 -23.778 -23.778
  629   1H1   BME  16           HE1      MER  16  -8.938   8.359   8.359
  630   2H1   BME  16           HE2      MER  16  -9.290  10.004  10.004
  631   1H2   BME  16           HZ1      MER  16  -6.804   8.992   8.992
  632   2H2   BME  16           HZ2      MER  16  -7.950  10.169  10.169
  633    HO1  BME  16           HH       MER  16  -6.927   9.382   9.382

  Start of MODEL   45
    1    H    ASN   3           HN       ASN   3   1.102 -10.332 -10.332
    2    HA   ASN   3           HA       ASN   3   1.401 -11.691 -11.691
    3   1HB   ASN   3           HB1      ASN   3  -0.237 -12.490 -12.490
    4   2HB   ASN   3           HB2      ASN   3  -1.541 -11.735 -11.735
    5   1HD2  ASN   3          HD21      ASN   3  -0.443 -15.429 -15.429
    6   2HD2  ASN   3          HD22      ASN   3  -0.044 -14.681 -14.681
    7    H    ALA   4           HN       ALA   4   1.823 -10.098 -10.098
    8    HA   ALA   4           HA       ALA   4   1.666  -9.749  -9.749
    9   1HB   ALA   4           HB1      ALA   4  -0.323 -11.248 -11.248
   10   2HB   ALA   4           HB2      ALA   4  -1.377  -9.937  -9.937
   11   3HB   ALA   4           HB3      ALA   4  -0.447  -9.764  -9.764
   12    HA   PRO   5           HA       PRO   5   0.898  -5.520  -5.520
   13   1HB   PRO   5           HB1      PRO   5   3.571  -5.021  -5.021
   14   2HB   PRO   5           HB2      PRO   5   3.015  -4.684  -4.684
   15   1HG   PRO   5           HG1      PRO   5   4.761  -6.720  -6.720
   16   2HG   PRO   5           HG2      PRO   5   3.444  -6.907  -6.907
   17   1HD   PRO   5           HD1      PRO   5   3.454  -7.851  -7.851
   18   2HD   PRO   5           HD2      PRO   5   3.119  -8.801  -8.801
   19    H    LYS   6           HN       LYS   6  -0.505  -4.758  -4.758
   20    HA   LYS   6           HA       LYS   6  -0.450  -5.102  -5.102
   21   1HB   LYS   6           HB1      LYS   6  -2.464  -3.206  -3.206
   22   2HB   LYS   6           HB2      LYS   6  -2.683  -4.932  -4.932
   23   1HG   LYS   6           HG1      LYS   6  -3.719  -4.131  -4.131
   24   2HG   LYS   6           HG2      LYS   6  -2.363  -5.135  -5.135
   25   1HD   LYS   6           HD1      LYS   6  -2.203  -3.235  -3.235
   26   2HD   LYS   6           HD2      LYS   6  -0.990  -2.919  -2.919
   27   1HE   LYS   6           HE1      LYS   6  -2.265  -0.883  -0.883
   28   2HE   LYS   6           HE2      LYS   6  -2.673  -1.488  -1.488
   29   1HZ   LYS   6           HZ1      LYS   6  -4.387  -2.675  -2.675
   30   2HZ   LYS   6           HZ2      LYS   6  -4.375  -1.000  -1.000
   31   3HZ   LYS   6           HZ3      LYS   6  -4.773  -1.608  -1.608
   32    H    ARG   7           HN       ARG   7  -0.332  -3.495  -3.495
   33    HA   ARG   7           HA       ARG   7   1.765  -1.794  -1.794
   34   1HB   ARG   7           HB1      ARG   7   0.628  -2.555  -2.555
   35   2HB   ARG   7           HB2      ARG   7  -0.709  -1.468  -1.468
   36   1HG   ARG   7           HG1      ARG   7   0.664   0.481   0.481
   37   2HG   ARG   7           HG2      ARG   7   2.150  -0.455  -0.455
   38   1HD   ARG   7           HD1      ARG   7   1.513  -1.673  -1.673
   39   2HD   ARG   7           HD2      ARG   7  -0.006  -0.784  -0.784
   40    HE   ARG   7           HE       ARG   7   2.667   0.566   0.566
   41   1HH1  ARG   7          HH11      ARG   7  -0.447   1.471   1.471
   42   2HH1  ARG   7          HH12      ARG   7  -0.508   2.128   2.128
   43   1HH2  ARG   7          HH21      ARG   7   2.593   0.758   0.758
   44   2HH2  ARG   7          HH22      ARG   7   1.261   1.711   1.711
   45    HA   PRO   8           HA       PRO   8   0.136   0.945   0.945
   46   1HB   PRO   8           HB1      PRO   8   2.383   2.517   2.517
   47   2HB   PRO   8           HB2      PRO   8   2.290   0.834   0.834
   48   1HG   PRO   8           HG1      PRO   8   3.366   1.935   1.935
   49   2HG   PRO   8           HG2      PRO   8   4.216   0.913   0.913
   50   1HD   PRO   8           HD1      PRO   8   3.014  -0.238  -0.238
   51   2HD   PRO   8           HD2      PRO   8   2.799  -0.997  -0.997
   52    HA   PRO   9           HA       PRO   9  -1.097   5.278   5.278
   53   1HB   PRO   9           HB1      PRO   9   1.437   6.411   6.411
   54   2HB   PRO   9           HB2      PRO   9  -0.186   6.532   6.532
   55   1HG   PRO   9           HG1      PRO   9   1.953   4.501   4.501
   56   2HG   PRO   9           HG2      PRO   9   0.661   5.096   5.096
   57   1HD   PRO   9           HD1      PRO   9   0.409   2.643   2.643
   58   2HD   PRO   9           HD2      PRO   9  -1.002   3.716   3.716
   59    H    SER  10           HN       SER  10  -0.352   7.342   7.342
   60    HA   SER  10           HA       SER  10   0.936   6.752   6.752
   61   1HB   SER  10           HB1      SER  10  -0.944   9.018   9.018
   62   2HB   SER  10           HB2      SER  10  -0.338   8.724   8.724
   63    HG   SER  10           HG       SER  10  -2.351   7.546   7.546
   64    H    ALA  11           HN       ALA  11   0.648   9.442   9.442
   65    HA   ALA  11           HA       ALA  11   3.161  10.130  10.130
   66   1HB   ALA  11           HB1      ALA  11   2.533  11.488  11.488
   67   2HB   ALA  11           HB2      ALA  11   3.861  11.902  11.902
   68   3HB   ALA  11           HB3      ALA  11   3.869  10.363  10.363
   69    H    PHE  12           HN       PHE  12   0.361  11.287  11.287
   70    HA   PHE  12           HA       PHE  12   0.062  13.725  13.725
   71   1HB   PHE  12           HB1      PHE  12  -1.220  14.206  14.206
   72   2HB   PHE  12           HB2      PHE  12  -0.869  12.582  12.582
   73    HD1  PHE  12           HD1      PHE  12  -3.398  12.919  12.919
   74    HD2  PHE  12           HD2      PHE  12  -2.576  12.764  12.764
   75    HE1  PHE  12           HE1      PHE  12  -5.783  12.623  12.623
   76    HE2  PHE  12           HE2      PHE  12  -4.956  12.466  12.466
   77    HZ   PHE  12           HZ       PHE  12  -6.571  12.381  12.381
   78    H    PHE  13           HN       PHE  13  -0.833  10.410  10.410
   79    HA   PHE  13           HA       PHE  13  -3.024  10.336  10.336
   80   1HB   PHE  13           HB1      PHE  13  -1.721   8.355   8.355
   81   2HB   PHE  13           HB2      PHE  13  -0.529   8.691   8.691
   82    HD1  PHE  13           HD1      PHE  13  -4.086   7.873   7.873
   83    HD2  PHE  13           HD2      PHE  13  -1.014   8.125   8.125
   84    HE1  PHE  13           HE1      PHE  13  -5.554   6.765   6.765
   85    HE2  PHE  13           HE2      PHE  13  -2.483   7.019   7.019
   86    HZ   PHE  13           HZ       PHE  13  -4.755   6.337   6.337
   87    H    LEU  14           HN       LEU  14   0.349  10.881  10.881
   88    HA   LEU  14           HA       LEU  14   0.001  11.102  11.102
   89   1HB   LEU  14           HB1      LEU  14   1.970  12.621  12.621
   90   2HB   LEU  14           HB2      LEU  14   2.104  12.488  12.488
   91    HG   LEU  14           HG       LEU  14   3.657  10.933  10.933
   92   1HD1  LEU  14          HD11      LEU  14   2.325   9.798   9.798
   93   2HD1  LEU  14          HD12      LEU  14   1.212   9.203   9.203
   94   3HD1  LEU  14          HD13      LEU  14   2.881   8.664   8.664
   95   1HD2  LEU  14          HD21      LEU  14   1.779   9.941   9.941
   96   2HD2  LEU  14          HD22      LEU  14   3.203  10.957  10.957
   97   3HD2  LEU  14          HD23      LEU  14   3.370   9.304   9.304
   98    H    PHE  15           HN       PHE  15   0.264  13.688  13.688
   99    HA   PHE  15           HA       PHE  15  -0.487  15.933  15.933
  100   1HB   PHE  15           HB1      PHE  15   0.358  16.174  16.174
  101   2HB   PHE  15           HB2      PHE  15  -0.841  15.038  15.038
  102    HD1  PHE  15           HD1      PHE  15  -3.431  16.317  16.317
  103    HD2  PHE  15           HD2      PHE  15   0.276  18.087  18.087
  104    HE1  PHE  15           HE1      PHE  15  -4.623  18.181  18.181
  105    HE2  PHE  15           HE2      PHE  15  -0.934  19.937  19.937
  106    HZ   PHE  15           HZ       PHE  15  -3.383  19.992  19.992
  107    H    CYS  16           HN       MER  16  -2.666  13.938  13.938
  108    HA   CYS  16           HA       MER  16  -5.152  14.957  14.957
  109   1HB   CYS  16           HB1      MER  16  -4.956  13.242  13.242
  110   2HB   CYS  16           HB2      MER  16  -4.305  12.112  12.112
  111    H    SER  17           HN       SER  17  -3.486  12.450  12.450
  112    HA   SER  17           HA       SER  17  -5.464  12.089  12.089
  113   1HB   SER  17           HB1      SER  17  -3.426  10.650  10.650
  114   2HB   SER  17           HB2      SER  17  -2.416  11.989  11.989
  115    HG   SER  17           HG       SER  17  -3.029  11.536  11.536
  116    H    GLU  18           HN       GLU  18  -2.835  14.315  14.315
  117    HA   GLU  18           HA       GLU  18  -3.570  15.734  15.734
  118   1HB   GLU  18           HB1      GLU  18  -1.258  15.250  15.250
  119   2HB   GLU  18           HB2      GLU  18  -1.511  16.279  16.279
  120   1HG   GLU  18           HG1      GLU  18  -1.787  18.255  18.255
  121   2HG   GLU  18           HG2      GLU  18  -1.701  17.268  17.268
  122    H    TYR  19           HN       TYR  19  -4.974  15.767  15.767
  123    HA   TYR  19           HA       TYR  19  -5.519  18.701  18.701
  124   1HB   TYR  19           HB1      TYR  19  -5.089  16.662  16.662
  125   2HB   TYR  19           HB2      TYR  19  -6.448  17.775  17.775
  126    HD1  TYR  19           HD1      TYR  19  -2.857  17.892  17.892
  127    HD2  TYR  19           HD2      TYR  19  -6.010  19.761  19.761
  128    HE1  TYR  19           HE1      TYR  19  -1.304  19.620  19.620
  129    HE2  TYR  19           HE2      TYR  19  -4.463  21.505  21.505
  130    HH   TYR  19           HH       TYR  19  -1.707  22.232  22.232
  131    H    ARG  20           HN       ARG  20  -7.033  15.585  15.585
  132    HA   ARG  20           HA       ARG  20  -9.585  15.843  15.843
  133   1HB   ARG  20           HB1      ARG  20  -8.478  14.543  14.543
  134   2HB   ARG  20           HB2      ARG  20 -10.210  14.523  14.523
  135   1HG   ARG  20           HG1      ARG  20  -9.533  13.661  13.661
  136   2HG   ARG  20           HG2      ARG  20  -7.958  13.381  13.381
  137   1HD   ARG  20           HD1      ARG  20 -10.522  12.169  12.169
  138   2HD   ARG  20           HD2      ARG  20  -9.407  11.337  11.337
  139    HE   ARG  20           HE       ARG  20  -7.680  11.823  11.823
  140   1HH1  ARG  20          HH11      ARG  20  -9.996  12.917  12.917
  141   2HH1  ARG  20          HH12      ARG  20 -10.340  11.550  11.550
  142   1HH2  ARG  20          HH21      ARG  20  -8.526   9.352   9.352
  143   2HH2  ARG  20          HH22      ARG  20  -9.483   9.466   9.466
  144    HA   PRO  21           HA       PRO  21 -11.453  17.836  17.836
  145   1HB   PRO  21           HB1      PRO  21  -9.572  18.626  18.626
  146   2HB   PRO  21           HB2      PRO  21 -10.737  17.289  17.289
  147   1HG   PRO  21           HG1      PRO  21  -7.999  16.861  16.861
  148   2HG   PRO  21           HG2      PRO  21  -9.137  15.717  15.717
  149   1HD   PRO  21           HD1      PRO  21  -7.638  17.983  17.983
  150   2HD   PRO  21           HD2      PRO  21  -7.726  16.280  16.280
  151    H    LYS  22           HN       LYS  22  -8.911  19.302  19.302
  152    HA   LYS  22           HA       LYS  22  -9.532  22.070  22.070
  153   1HB   LYS  22           HB1      LYS  22  -7.158  20.798  20.798
  154   2HB   LYS  22           HB2      LYS  22  -7.376  21.403  21.403
  155   1HG   LYS  22           HG1      LYS  22  -7.700  23.722  23.722
  156   2HG   LYS  22           HG2      LYS  22  -7.401  23.091  23.091
  157   1HD   LYS  22           HD1      LYS  22  -5.417  22.993  22.993
  158   2HD   LYS  22           HD2      LYS  22  -5.347  24.112  24.112
  159   1HE   LYS  22           HE1      LYS  22  -5.084  21.073  21.073
  160   2HE   LYS  22           HE2      LYS  22  -3.772  22.227  22.227
  161   1HZ   LYS  22           HZ1      LYS  22  -5.769  23.014  23.014
  162   2HZ   LYS  22           HZ2      LYS  22  -5.457  21.361  21.361
  163   3HZ   LYS  22           HZ3      LYS  22  -4.191  22.490  22.490
  164    H    ILE  23           HN       ILE  23  -9.716  19.862  19.862
  165    HA   ILE  23           HA       ILE  23 -10.700  22.095  22.095
  166    HB   ILE  23           HB       ILE  23 -11.012  19.941  19.941
  167   1HG1  ILE  23          HG11      ILE  23  -8.635  19.116  19.116
  168   2HG1  ILE  23          HG12      ILE  23 -10.185  18.298  18.298
  169   1HG2  ILE  23          HG21      ILE  23  -9.705  21.966  21.966
  170   2HG2  ILE  23          HG22      ILE  23  -8.410  21.376  21.376
  171   3HG2  ILE  23          HG23      ILE  23  -8.771  20.565  20.565
  172   1HD1  ILE  23          HD11      ILE  23  -9.986  17.851  17.851
  173   2HD1  ILE  23          HD12      ILE  23  -8.385  18.555  18.555
  174   3HD1  ILE  23          HD13      ILE  23  -8.717  17.096  17.096
  175    H    LYS  24           HN       LYS  24 -11.589  19.289  19.289
  176    HA   LYS  24           HA       LYS  24 -14.336  19.150  19.150
  177   1HB   LYS  24           HB1      LYS  24 -12.947  17.295  17.295
  178   2HB   LYS  24           HB2      LYS  24 -12.911  18.166  18.166
  179   1HG   LYS  24           HG1      LYS  24 -15.374  18.022  18.022
  180   2HG   LYS  24           HG2      LYS  24 -15.526  17.262  17.262
  181   1HD   LYS  24           HD1      LYS  24 -15.703  15.552  15.552
  182   2HD   LYS  24           HD2      LYS  24 -14.217  15.304  15.304
  183   1HE   LYS  24           HE1      LYS  24 -12.910  16.364  16.364
  184   2HE   LYS  24           HE2      LYS  24 -14.384  16.740  16.740
  185   1HZ   LYS  24           HZ1      LYS  24 -14.415  14.025  14.025
  186   2HZ   LYS  24           HZ2      LYS  24 -12.879  14.390  14.390
  187   3HZ   LYS  24           HZ3      LYS  24 -14.268  14.770  14.770
  188    H    GLY  25           HN       GLY  25 -12.399  20.647  20.647
  189   1HA   GLY  25           HA1      GLY  25 -14.412  21.646  21.646
  190   2HA   GLY  25           HA2      GLY  25 -12.824  22.387  22.387
  191    H    GLU  26           HN       GLU  26 -12.901  22.969  22.969
  192    HA   GLU  26           HA       GLU  26 -14.428  25.402  25.402
  193   1HB   GLU  26           HB1      GLU  26 -12.799  23.987  23.987
  194   2HB   GLU  26           HB2      GLU  26 -13.357  25.641  25.641
  195   1HG   GLU  26           HG1      GLU  26 -11.685  24.757  24.757
  196   2HG   GLU  26           HG2      GLU  26 -10.901  25.141  25.141
  197    H    HIS  27           HN       HIS  27 -14.517  22.438  22.438
  198    HA   HIS  27           HA       HIS  27 -17.254  23.029  23.029
  199   1HB   HIS  27           HB1      HIS  27 -15.235  21.291  21.291
  200   2HB   HIS  27           HB2      HIS  27 -16.699  22.055  22.055
  201    HD1  HIS  27           HD1      HIS  27 -16.499  24.804  24.804
  202    HD2  HIS  27           HD2      HIS  27 -12.958  22.774  22.774
  203    HE1  HIS  27           HE1      HIS  27 -14.740  26.427  26.427
  204    HA   PRO  28           HA       PRO  28 -17.813  19.009  19.009
  205   1HB   PRO  28           HB1      PRO  28 -19.612  19.763  19.763
  206   2HB   PRO  28           HB2      PRO  28 -17.897  20.110  20.110
  207   1HG   PRO  28           HG1      PRO  28 -20.010  21.988  21.988
  208   2HG   PRO  28           HG2      PRO  28 -18.927  22.309  22.309
  209   1HD   PRO  28           HD1      PRO  28 -18.282  23.081  23.081
  210   2HD   PRO  28           HD2      PRO  28 -17.016  22.594  22.594
  211    H    GLY  29           HN       GLY  29 -18.458  19.784  19.784
  212   1HA   GLY  29           HA1      GLY  29 -21.348  19.274  19.274
  213   2HA   GLY  29           HA2      GLY  29 -20.493  20.433  20.433
  214    H    LEU  30           HN       LEU  30 -18.079  18.553  18.553
  215    HA   LEU  30           HA       LEU  30 -18.972  16.914  16.914
  216   1HB   LEU  30           HB1      LEU  30 -16.173  16.549  16.549
  217   2HB   LEU  30           HB2      LEU  30 -16.968  17.322  17.322
  218    HG   LEU  30           HG       LEU  30 -16.296  18.828  18.828
  219   1HD1  LEU  30          HD11      LEU  30 -14.242  17.851  17.851
  220   2HD1  LEU  30          HD12      LEU  30 -14.709  18.568  18.568
  221   3HD1  LEU  30          HD13      LEU  30 -14.283  19.595  19.595
  222   1HD2  LEU  30          HD21      LEU  30 -16.857  19.671  19.671
  223   2HD2  LEU  30          HD22      LEU  30 -17.999  19.872  19.872
  224   3HD2  LEU  30          HD23      LEU  30 -16.487  20.762  20.762
  225    H    SER  31           HN       SER  31 -17.543  14.842  14.842
  226    HA   SER  31           HA       SER  31 -17.973  13.167  13.167
  227   1HB   SER  31           HB1      SER  31 -18.125  12.381  12.381
  228   2HB   SER  31           HB2      SER  31 -18.399  11.287  11.287
  229    HG   SER  31           HG       SER  31 -20.072  13.054  13.054
  230    H    ILE  32           HN       ILE  32 -16.597  11.053  11.053
  231    HA   ILE  32           HA       ILE  32 -13.865  11.848  11.848
  232    HB   ILE  32           HB       ILE  32 -14.950   9.943   9.943
  233   1HG1  ILE  32          HG11      ILE  32 -13.112   8.276   8.276
  234   2HG1  ILE  32          HG12      ILE  32 -12.621   8.926   8.926
  235   1HG2  ILE  32          HG21      ILE  32 -14.960   8.557   8.557
  236   2HG2  ILE  32          HG22      ILE  32 -15.349   7.776   7.776
  237   3HG2  ILE  32          HG23      ILE  32 -16.370   9.064   9.064
  238   1HD1  ILE  32          HD11      ILE  32 -12.500  10.423  10.423
  239   2HD1  ILE  32          HD12      ILE  32 -11.129   9.735   9.735
  240   3HD1  ILE  32          HD13      ILE  32 -11.996  11.087  11.087
  241    H    GLY  33           HN       GLY  33 -15.695  11.360  11.360
  242   1HA   GLY  33           HA1      GLY  33 -13.502  10.456  10.456
  243   2HA   GLY  33           HA2      GLY  33 -15.210  10.532  10.532
  244    H    ASP  34           HN       ASP  34 -14.967  13.255  13.255
  245    HA   ASP  34           HA       ASP  34 -14.252  14.883  14.883
  246   1HB   ASP  34           HB1      ASP  34 -15.974  15.328  15.328
  247   2HB   ASP  34           HB2      ASP  34 -15.681  16.601  16.601
  248    H    VAL  35           HN       VAL  35 -13.920  14.521  14.521
  249    HA   VAL  35           HA       VAL  35 -12.118  16.715  16.715
  250    HB   VAL  35           HB       VAL  35 -12.812  14.131  14.131
  251   1HG1  VAL  35          HG11      VAL  35 -10.575  14.942  14.942
  252   2HG1  VAL  35          HG12      VAL  35 -11.285  16.513  16.513
  253   3HG1  VAL  35          HG13      VAL  35 -11.796  15.106  15.106
  254   1HG2  VAL  35          HG21      VAL  35 -14.691  15.775  15.775
  255   2HG2  VAL  35          HG22      VAL  35 -14.114  15.612  15.612
  256   3HG2  VAL  35          HG23      VAL  35 -13.660  17.012  17.012
  257    H    ALA  36           HN       ALA  36 -11.874  13.529  13.529
  258    HA   ALA  36           HA       ALA  36  -8.977  13.371  13.371
  259   1HB   ALA  36           HB1      ALA  36 -10.386  11.433  11.433
  260   2HB   ALA  36           HB2      ALA  36 -11.025  11.471  11.471
  261   3HB   ALA  36           HB3      ALA  36  -9.338  11.054  11.054
  262    H    LYS  37           HN       LYS  37 -11.473  13.411  13.411
  263    HA   LYS  37           HA       LYS  37  -9.544  13.377  13.377
  264   1HB   LYS  37           HB1      LYS  37 -11.910  12.725  12.725
  265   2HB   LYS  37           HB2      LYS  37 -12.398  14.409  14.409
  266   1HG   LYS  37           HG1      LYS  37 -12.445  13.990  13.990
  267   2HG   LYS  37           HG2      LYS  37 -10.916  14.816  14.816
  268   1HD   LYS  37           HD1      LYS  37 -10.014  13.040  13.040
  269   2HD   LYS  37           HD2      LYS  37 -10.097  12.189  12.189
  270   1HE   LYS  37           HE1      LYS  37 -12.213  12.106  12.106
  271   2HE   LYS  37           HE2      LYS  37 -11.101  10.817  10.817
  272   1HZ   LYS  37           HZ1      LYS  37 -12.490  11.544  11.544
  273   2HZ   LYS  37           HZ2      LYS  37 -13.608  11.336  11.336
  274   3HZ   LYS  37           HZ3      LYS  37 -12.534  10.088  10.088
  275    H    LYS  38           HN       LYS  38 -11.065  15.997  15.997
  276    HA   LYS  38           HA       LYS  38 -10.076  18.066  18.066
  277   1HB   LYS  38           HB1      LYS  38 -12.157  18.195  18.195
  278   2HB   LYS  38           HB2      LYS  38 -11.117  18.291  18.291
  279   1HG   LYS  38           HG1      LYS  38 -10.622  20.484  20.484
  280   2HG   LYS  38           HG2      LYS  38 -10.335  20.249  20.249
  281   1HD   LYS  38           HD1      LYS  38 -12.806  20.171  20.171
  282   2HD   LYS  38           HD2      LYS  38 -13.089  20.451  20.451
  283   1HE   LYS  38           HE1      LYS  38 -11.578  22.355  22.355
  284   2HE   LYS  38           HE2      LYS  38 -13.261  22.546  22.546
  285   1HZ   LYS  38           HZ1      LYS  38 -11.743  22.151  22.151
  286   2HZ   LYS  38           HZ2      LYS  38 -10.977  23.345  23.345
  287   3HZ   LYS  38           HZ3      LYS  38 -12.602  23.531  23.531
  288    H    LEU  39           HN       LEU  39  -9.142  16.882  16.882
  289    HA   LEU  39           HA       LEU  39  -6.886  18.669  18.669
  290   1HB   LEU  39           HB1      LEU  39  -6.493  17.793  17.793
  291   2HB   LEU  39           HB2      LEU  39  -8.134  17.237  17.237
  292    HG   LEU  39           HG       LEU  39  -7.114  15.097  15.097
  293   1HD1  LEU  39          HD11      LEU  39  -4.737  16.295  16.295
  294   2HD1  LEU  39          HD12      LEU  39  -4.876  14.616  14.616
  295   3HD1  LEU  39          HD13      LEU  39  -4.763  15.712  15.712
  296   1HD2  LEU  39          HD21      LEU  39  -8.121  15.490  15.490
  297   2HD2  LEU  39          HD22      LEU  39  -6.801  14.358  14.358
  298   3HD2  LEU  39          HD23      LEU  39  -6.538  16.030  16.030
  299    H    GLY  40           HN       GLY  40  -7.422  15.525  15.525
  300   1HA   GLY  40           HA1      GLY  40  -4.703  14.859  14.859
  301   2HA   GLY  40           HA2      GLY  40  -6.000  14.353  14.353
  302    H    GLU  41           HN       GLU  41  -6.817  16.929  16.929
  303    HA   GLU  41           HA       GLU  41  -4.887  17.540  17.540
  304   1HB   GLU  41           HB1      GLU  41  -7.185  19.168  19.168
  305   2HB   GLU  41           HB2      GLU  41  -6.315  19.564  19.564
  306   1HG   GLU  41           HG1      GLU  41  -6.991  17.422  17.422
  307   2HG   GLU  41           HG2      GLU  41  -7.809  16.937  16.937
  308    H    MET  42           HN       MET  42  -5.851  19.128  19.128
  309    HA   MET  42           HA       MET  42  -4.203  21.371  21.371
  310   1HB   MET  42           HB1      MET  42  -4.739  19.549  19.549
  311   2HB   MET  42           HB2      MET  42  -4.172  21.209  21.209
  312   1HG   MET  42           HG1      MET  42  -6.770  20.422  20.422
  313   2HG   MET  42           HG2      MET  42  -6.702  20.889  20.889
  314   1HE   MET  42           HE1      MET  42  -8.658  21.903  21.903
  315   2HE   MET  42           HE2      MET  42  -8.336  23.431  23.431
  316   3HE   MET  42           HE3      MET  42  -7.592  21.965  21.965
  317    H    TRP  43           HN       TRP  43  -3.450  18.157  18.157
  318    HA   TRP  43           HA       TRP  43  -0.782  18.402  18.402
  319   1HB   TRP  43           HB1      TRP  43  -1.989  16.432  16.432
  320   2HB   TRP  43           HB2      TRP  43  -2.428  16.174  16.174
  321    HD1  TRP  43           HD1      TRP  43  -0.717  14.861  14.861
  322    HE1  TRP  43           HE1      TRP  43   1.465  13.818  13.818
  323    HE3  TRP  43           HE3      TRP  43  -0.081  16.771  16.771
  324    HZ2  TRP  43           HZ2      TRP  43   3.391  13.719  13.719
  325    HZ3  TRP  43           HZ3      TRP  43   1.866  16.225  16.225
  326    HH2  TRP  43           HH2      TRP  43   3.624  14.694  14.694
  327    H    ASN  44           HN       ASN  44  -2.111  17.530  17.530
  328    HA   ASN  44           HA       ASN  44   0.295  17.258  17.258
  329   1HB   ASN  44           HB1      ASN  44  -1.224  16.663  16.663
  330   2HB   ASN  44           HB2      ASN  44  -2.528  17.233  17.233
  331   1HD2  ASN  44          HD21      ASN  44  -3.455  19.659  19.659
  332   2HD2  ASN  44          HD22      ASN  44  -3.853  18.702  18.702
  333    H    ASN  45           HN       ASN  45  -1.316  20.040  20.040
  334    HA   ASN  45           HA       ASN  45   0.754  21.866  21.866
  335   1HB   ASN  45           HB1      ASN  45  -1.994  22.912  22.912
  336   2HB   ASN  45           HB2      ASN  45  -0.850  23.530  23.530
  337   1HD2  ASN  45          HD21      ASN  45  -3.768  21.016  21.016
  338   2HD2  ASN  45          HD22      ASN  45  -3.630  21.761  21.761
  339    H    THR  46           HN       THR  46   1.026  20.584  20.584
  340    HA   THR  46           HA       THR  46   0.194  22.645  22.645
  341    HB   THR  46           HB       THR  46   0.363  20.127  20.127
  342    HG1  THR  46           HG1      THR  46   0.481  21.112  21.112
  343   1HG2  THR  46          HG21      THR  46   2.695  19.703  19.703
  344   2HG2  THR  46          HG22      THR  46   3.366  20.725  20.725
  345   3HG2  THR  46          HG23      THR  46   2.531  19.252  19.252
  346    H    ALA  47           HN       ALA  47   3.214  21.435  21.435
  347    HA   ALA  47           HA       ALA  47   4.443  24.034  24.034
  348   1HB   ALA  47           HB1      ALA  47   4.725  23.568  23.568
  349   2HB   ALA  47           HB2      ALA  47   5.582  22.100  22.100
  350   3HB   ALA  47           HB3      ALA  47   6.258  23.668  23.668
  351    H    ALA  48           HN       ALA  48   5.176  20.712  20.712
  352    HA   ALA  48           HA       ALA  48   5.868  19.052  19.052
  353   1HB   ALA  48           HB1      ALA  48   6.057  20.723  20.723
  354   2HB   ALA  48           HB2      ALA  48   7.566  21.301  21.301
  355   3HB   ALA  48           HB3      ALA  48   7.429  19.637  19.637
  356    H    ASP  49           HN       ASP  49   7.638  21.767  21.767
  357    HA   ASP  49           HA       ASP  49   9.935  20.201  20.201
  358   1HB   ASP  49           HB1      ASP  49  10.836  22.482  22.482
  359   2HB   ASP  49           HB2      ASP  49  10.368  22.370  22.370
  360    H    ASP  50           HN       ASP  50   6.980  20.550  20.550
  361    HA   ASP  50           HA       ASP  50   7.723  20.535  20.535
  362   1HB   ASP  50           HB1      ASP  50   6.261  22.554  22.554
  363   2HB   ASP  50           HB2      ASP  50   5.033  21.384  21.384
  364    H    LYS  51           HN       LYS  51   6.918  18.788  18.788
  365    HA   LYS  51           HA       LYS  51   5.044  16.887  16.887
  366   1HB   LYS  51           HB1      LYS  51   6.204  17.117  17.117
  367   2HB   LYS  51           HB2      LYS  51   5.241  15.743  15.743
  368   1HG   LYS  51           HG1      LYS  51   3.376  17.224  17.224
  369   2HG   LYS  51           HG2      LYS  51   4.383  18.607  18.607
  370   1HD   LYS  51           HD1      LYS  51   2.583  17.799  17.799
  371   2HD   LYS  51           HD2      LYS  51   4.062  18.443  18.443
  372   1HE   LYS  51           HE1      LYS  51   4.817  16.007  16.007
  373   2HE   LYS  51           HE2      LYS  51   3.216  15.521  15.521
  374   1HZ   LYS  51           HZ1      LYS  51   2.932  17.456  17.456
  375   2HZ   LYS  51           HZ2      LYS  51   4.013  16.275  16.275
  376   3HZ   LYS  51           HZ3      LYS  51   2.463  15.823  15.823
  377    H    GLN  52           HN       GLN  52   8.158  17.109  17.109
  378    HA   GLN  52           HA       GLN  52   9.426  14.834  14.834
  379   1HB   GLN  52           HB1      GLN  52  10.264  17.491  17.491
  380   2HB   GLN  52           HB2      GLN  52  10.979  16.907  16.907
  381   1HG   GLN  52           HG1      GLN  52  12.577  16.599  16.599
  382   2HG   GLN  52           HG2      GLN  52  12.038  15.021  15.021
  383   1HE2  GLN  52          HE21      GLN  52   9.857  15.642  15.642
  384   2HE2  GLN  52          HE22      GLN  52   9.464  16.322  16.322
  385    HA   PRO  53           HA       PRO  53  10.079  14.702  14.702
  386   1HB   PRO  53           HB1      PRO  53   7.892  15.943  15.943
  387   2HB   PRO  53           HB2      PRO  53   9.517  16.618  16.618
  388   1HG   PRO  53           HG1      PRO  53   7.150  17.014  17.014
  389   2HG   PRO  53           HG2      PRO  53   8.160  18.262  18.262
  390   1HD   PRO  53           HD1      PRO  53   8.789  17.561  17.561
  391   2HD   PRO  53           HD2      PRO  53  10.122  17.543  17.543
  392    H    TYR  54           HN       TYR  54   6.724  14.993  14.993
  393    HA   TYR  54           HA       TYR  54   5.800  12.609  12.609
  394   1HB   TYR  54           HB1      TYR  54   4.598  14.295  14.295
  395   2HB   TYR  54           HB2      TYR  54   3.746  12.975  12.975
  396    HD1  TYR  54           HD1      TYR  54   4.158  13.322  13.322
  397    HD2  TYR  54           HD2      TYR  54   3.823  16.366  16.366
  398    HE1  TYR  54           HE1      TYR  54   3.386  14.898  14.898
  399    HE2  TYR  54           HE2      TYR  54   3.048  17.941  17.941
  400    HH   TYR  54           HH       TYR  54   1.814  17.187  17.187
  401    H    GLU  55           HN       GLU  55   6.435  13.491  13.491
  402    HA   GLU  55           HA       GLU  55   5.826  11.114  11.114
  403   1HB   GLU  55           HB1      GLU  55   7.102  13.597  13.597
  404   2HB   GLU  55           HB2      GLU  55   8.262  12.401  12.401
  405   1HG   GLU  55           HG1      GLU  55   6.420  11.298  11.298
  406   2HG   GLU  55           HG2      GLU  55   5.345  12.594  12.594
  407    H    LYS  56           HN       LYS  56   9.009  12.001  12.001
  408    HA   LYS  56           HA       LYS  56  10.359   9.616   9.616
  409   1HB   LYS  56           HB1      LYS  56  11.310  11.866  11.866
  410   2HB   LYS  56           HB2      LYS  56  10.830  11.475  11.475
  411   1HG   LYS  56           HG1      LYS  56  12.564   9.544   9.544
  412   2HG   LYS  56           HG2      LYS  56  13.297  10.972  10.972
  413   1HD   LYS  56           HD1      LYS  56  11.718   9.014   9.014
  414   2HD   LYS  56           HD2      LYS  56  13.430   8.838   8.838
  415   1HE   LYS  56           HE1      LYS  56  13.801  11.141  11.141
  416   2HE   LYS  56           HE2      LYS  56  12.088  11.248  11.248
  417   1HZ   LYS  56           HZ1      LYS  56  13.062   8.829   8.829
  418   2HZ   LYS  56           HZ2      LYS  56  14.119  10.064  10.064
  419   3HZ   LYS  56           HZ3      LYS  56  12.466  10.169  10.169
  420    H    LYS  57           HN       LYS  57   8.181  10.487  10.487
  421    HA   LYS  57           HA       LYS  57   8.725   8.335   8.335
  422   1HB   LYS  57           HB1      LYS  57   7.125  10.486  10.486
  423   2HB   LYS  57           HB2      LYS  57   5.905   9.411   9.411
  424   1HG   LYS  57           HG1      LYS  57   5.586   8.459   8.459
  425   2HG   LYS  57           HG2      LYS  57   7.244   7.902   7.902
  426   1HD   LYS  57           HD1      LYS  57   6.306  10.653  10.653
  427   2HD   LYS  57           HD2      LYS  57   6.728   9.317   9.317
  428   1HE   LYS  57           HE1      LYS  57   9.064   9.345   9.345
  429   2HE   LYS  57           HE2      LYS  57   8.665  10.680  10.680
  430   1HZ   LYS  57           HZ1      LYS  57   7.843  11.353  11.353
  431   2HZ   LYS  57           HZ2      LYS  57   9.441  10.786  10.786
  432   3HZ   LYS  57           HZ3      LYS  57   9.049  12.068  12.068
  433    H    ALA  58           HN       ALA  58   6.184   8.760   8.760
  434    HA   ALA  58           HA       ALA  58   4.980   6.279   6.279
  435   1HB   ALA  58           HB1      ALA  58   4.330   8.146   8.146
  436   2HB   ALA  58           HB2      ALA  58   5.794   7.907   7.907
  437   3HB   ALA  58           HB3      ALA  58   4.557   6.662   6.662
  438    H    ALA  59           HN       ALA  59   7.829   7.196   7.196
  439    HA   ALA  59           HA       ALA  59   8.503   4.745   4.745
  440   1HB   ALA  59           HB1      ALA  59   9.703   6.876   6.876
  441   2HB   ALA  59           HB2      ALA  59  10.439   6.838   6.838
  442   3HB   ALA  59           HB3      ALA  59  10.847   5.610   5.610
  443    H    LYS  60           HN       LYS  60   9.897   5.986   5.986
  444    HA   LYS  60           HA       LYS  60  11.334   3.862   3.862
  445   1HB   LYS  60           HB1      LYS  60  10.874   6.189   6.189
  446   2HB   LYS  60           HB2      LYS  60   9.487   5.454   5.454
  447   1HG   LYS  60           HG1      LYS  60  10.966   3.761   3.761
  448   2HG   LYS  60           HG2      LYS  60  12.359   4.463   4.463
  449   1HD   LYS  60           HD1      LYS  60  11.796   6.676   6.676
  450   2HD   LYS  60           HD2      LYS  60  10.586   5.808   5.808
  451   1HE   LYS  60           HE1      LYS  60  13.577   5.193   5.193
  452   2HE   LYS  60           HE2      LYS  60  12.710   5.999   5.999
  453   1HZ   LYS  60           HZ1      LYS  60  11.394   3.598   3.598
  454   2HZ   LYS  60           HZ2      LYS  60  13.051   3.273   3.273
  455   3HZ   LYS  60           HZ3      LYS  60  12.206   4.057   4.057
  456    H    LEU  61           HN       LEU  61   7.862   4.251   4.251
  457    HA   LEU  61           HA       LEU  61   7.443   1.784   1.784
  458   1HB   LEU  61           HB1      LEU  61   5.456   3.320   3.320
  459   2HB   LEU  61           HB2      LEU  61   5.055   2.197   2.197
  460    HG   LEU  61           HG       LEU  61   6.649   4.784   4.784
  461   1HD1  LEU  61          HD11      LEU  61   3.776   4.139   4.139
  462   2HD1  LEU  61          HD12      LEU  61   4.633   5.626   5.626
  463   3HD1  LEU  61          HD13      LEU  61   4.345   5.216   5.216
  464   1HD2  LEU  61          HD21      LEU  61   5.572   2.815   2.815
  465   2HD2  LEU  61          HD22      LEU  61   7.264   3.055   3.055
  466   3HD2  LEU  61          HD23      LEU  61   6.357   4.346   4.346
  467    H    LYS  62           HN       LYS  62   6.707   2.615   2.615
  468    HA   LYS  62           HA       LYS  62   6.012   0.166   0.166
  469   1HB   LYS  62           HB1      LYS  62   6.101   1.648   1.648
  470   2HB   LYS  62           HB2      LYS  62   7.309   2.651   2.651
  471   1HG   LYS  62           HG1      LYS  62   9.087   1.089   1.089
  472   2HG   LYS  62           HG2      LYS  62   7.865   0.054   0.054
  473   1HD   LYS  62           HD1      LYS  62   7.216   1.906   1.906
  474   2HD   LYS  62           HD2      LYS  62   8.357   2.977   2.977
  475   1HE   LYS  62           HE1      LYS  62  10.244   1.532   1.532
  476   2HE   LYS  62           HE2      LYS  62   9.117   0.417   0.417
  477   1HZ   LYS  62           HZ1      LYS  62   8.561   2.978   2.978
  478   2HZ   LYS  62           HZ2      LYS  62  10.237   2.746   2.746
  479   3HZ   LYS  62           HZ3      LYS  62   9.174   1.648   1.648
  480    H    GLU  63           HN       GLU  63   9.230   1.337   1.337
  481    HA   GLU  63           HA       GLU  63  10.776  -0.866  -0.866
  482   1HB   GLU  63           HB1      GLU  63  11.711   1.399   1.399
  483   2HB   GLU  63           HB2      GLU  63  11.209   1.420   1.420
  484   1HG   GLU  63           HG1      GLU  63  13.321  -0.485  -0.485
  485   2HG   GLU  63           HG2      GLU  63  13.652   1.062   1.062
  486    H    LYS  64           HN       LYS  64   9.594   0.027   0.027
  487    HA   LYS  64           HA       LYS  64  10.562  -2.135  -2.135
  488   1HB   LYS  64           HB1      LYS  64   9.181  -0.097  -0.097
  489   2HB   LYS  64           HB2      LYS  64   7.750  -0.984  -0.984
  490   1HG   LYS  64           HG1      LYS  64   7.988  -1.431  -1.431
  491   2HG   LYS  64           HG2      LYS  64   8.529  -2.893  -2.893
  492   1HD   LYS  64           HD1      LYS  64  10.918  -2.102  -2.102
  493   2HD   LYS  64           HD2      LYS  64  10.342  -0.663  -0.663
  494   1HE   LYS  64           HE1      LYS  64   9.969  -3.525  -3.525
  495   2HE   LYS  64           HE2      LYS  64  11.116  -2.358  -2.358
  496   1HZ   LYS  64           HZ1      LYS  64   8.592  -1.170  -1.170
  497   2HZ   LYS  64           HZ2      LYS  64   8.445  -2.705  -2.705
  498   3HZ   LYS  64           HZ3      LYS  64   9.559  -1.585  -1.585
  499    H    TYR  65           HN       TYR  65   7.530  -1.863  -1.863
  500    HA   TYR  65           HA       TYR  65   6.373  -4.372  -4.372
  501   1HB   TYR  65           HB1      TYR  65   5.006  -2.783  -2.783
  502   2HB   TYR  65           HB2      TYR  65   6.283  -2.276  -2.276
  503    HD1  TYR  65           HD1      TYR  65   4.833  -5.706  -5.706
  504    HD2  TYR  65           HD2      TYR  65   5.351  -2.463  -2.463
  505    HE1  TYR  65           HE1      TYR  65   3.812  -7.023  -7.023
  506    HE2  TYR  65           HE2      TYR  65   4.333  -3.788  -3.788
  507    HH   TYR  65           HH       TYR  65   2.467  -6.239  -6.239
  508    H    GLU  66           HN       GLU  66   8.294  -3.351  -3.351
  509    HA   GLU  66           HA       GLU  66   8.580  -5.675  -5.675
  510   1HB   GLU  66           HB1      GLU  66  10.854  -3.826  -3.826
  511   2HB   GLU  66           HB2      GLU  66  10.739  -4.971  -4.971
  512   1HG   GLU  66           HG1      GLU  66   8.372  -3.566  -3.566
  513   2HG   GLU  66           HG2      GLU  66   9.417  -2.331  -2.331
  514    H    LYS  67           HN       LYS  67  10.152  -4.974  -4.974
  515    HA   LYS  67           HA       LYS  67  11.996  -7.226  -7.226
  516   1HB   LYS  67           HB1      LYS  67  11.449  -5.804  -5.804
  517   2HB   LYS  67           HB2      LYS  67  12.957  -6.482  -6.482
  518   1HG   LYS  67           HG1      LYS  67  11.588  -3.927  -3.927
  519   2HG   LYS  67           HG2      LYS  67  13.109  -4.065  -4.065
  520   1HD   LYS  67           HD1      LYS  67  13.008  -5.436  -5.436
  521   2HD   LYS  67           HD2      LYS  67  12.874  -3.700  -3.700
  522   1HE   LYS  67           HE1      LYS  67  15.245  -4.501  -4.501
  523   2HE   LYS  67           HE2      LYS  67  14.995  -3.466  -3.466
  524   1HZ   LYS  67           HZ1      LYS  67  14.480  -6.116  -6.116
  525   2HZ   LYS  67           HZ2      LYS  67  15.964  -6.073  -6.073
  526   3HZ   LYS  67           HZ3      LYS  67  15.710  -5.080  -5.080
  527    H    ASP  68           HN       ASP  68   8.987  -6.659  -6.659
  528    HA   ASP  68           HA       ASP  68   8.983  -9.104  -9.104
  529   1HB   ASP  68           HB1      ASP  68   6.845  -7.056  -7.056
  530   2HB   ASP  68           HB2      ASP  68   6.746  -8.354  -8.354
  531    H    ILE  69           HN       ILE  69   8.033  -7.926  -7.926
  532    HA   ILE  69           HA       ILE  69   6.145 -10.142 -10.142
  533    HB   ILE  69           HB       ILE  69   5.636  -7.827  -7.827
  534   1HG1  ILE  69          HG11      ILE  69   4.830  -8.390  -8.390
  535   2HG1  ILE  69          HG12      ILE  69   6.167  -9.471  -9.471
  536   1HG2  ILE  69          HG21      ILE  69   7.952  -7.265  -7.265
  537   2HG2  ILE  69          HG22      ILE  69   7.938  -8.325  -8.325
  538   3HG2  ILE  69          HG23      ILE  69   6.880  -6.922  -6.922
  539   1HD1  ILE  69          HD11      ILE  69   4.018  -9.925  -9.925
  540   2HD1  ILE  69          HD12      ILE  69   4.036 -10.710 -10.710
  541   3HD1  ILE  69          HD13      ILE  69   5.291 -11.049 -11.049
  542    H    ALA  70           HN       ALA  70   9.186  -9.028  -9.028
  543    HA   ALA  70           HA       ALA  70   9.871 -11.018 -11.018
  544   1HB   ALA  70           HB1      ALA  70  11.758  -9.561  -9.561
  545   2HB   ALA  70           HB2      ALA  70  12.264 -10.465 -10.465
  546   3HB   ALA  70           HB3      ALA  70  11.336  -8.999  -8.999
  547    H    ALA  71           HN       ALA  71   9.979 -10.708 -10.708
  548    HA   ALA  71           HA       ALA  71  11.258 -13.225 -13.225
  549   1HB   ALA  71           HB1      ALA  71   9.574 -11.398 -11.398
  550   2HB   ALA  71           HB2      ALA  71  10.545 -12.737 -12.737
  551   3HB   ALA  71           HB3      ALA  71  11.322 -11.352 -11.352
  552    H    TYR  72           HN       TYR  72   7.945 -12.020 -12.020
  553    HA   TYR  72           HA       TYR  72   6.604 -14.365 -14.365
  554   1HB   TYR  72           HB1      TYR  72   5.437 -12.281 -12.281
  555   2HB   TYR  72           HB2      TYR  72   5.756 -12.125 -12.125
  556    HD1  TYR  72           HD1      TYR  72   4.471 -15.098 -15.098
  557    HD2  TYR  72           HD2      TYR  72   3.644 -12.089 -12.089
  558    HE1  TYR  72           HE1      TYR  72   2.335 -16.176 -16.176
  559    HE2  TYR  72           HE2      TYR  72   1.515 -13.158 -13.158
  560    HH   TYR  72           HH       TYR  72   0.056 -15.379 -15.379
  561    H    ARG  73           HN       ARG  73   7.564 -13.374 -13.374
  562    HA   ARG  73           HA       ARG  73   6.448 -15.775 -15.775
  563   1HB   ARG  73           HB1      ARG  73   8.031 -13.403 -13.403
  564   2HB   ARG  73           HB2      ARG  73   7.536 -14.744 -14.744
  565   1HG   ARG  73           HG1      ARG  73   5.135 -14.329 -14.329
  566   2HG   ARG  73           HG2      ARG  73   5.705 -12.902 -12.902
  567   1HD   ARG  73           HD1      ARG  73   6.319 -13.203 -13.203
  568   2HD   ARG  73           HD2      ARG  73   4.748 -12.607 -12.607
  569    HE   ARG  73           HE       ARG  73   5.974 -10.869 -10.869
  570   1HH1  ARG  73          HH11      ARG  73   8.725 -11.890 -11.890
  571   2HH1  ARG  73          HH12      ARG  73   9.362 -10.921 -10.921
  572   1HH2  ARG  73          HH21      ARG  73   6.169  -9.873  -9.873
  573   2HH2  ARG  73          HH22      ARG  73   7.865  -9.737  -9.737
  574    H    ALA  74           HN       ALA  74   9.187 -14.939 -14.939
  575    HA   ALA  74           HA       ALA  74  10.915 -16.877 -16.877
  576   1HB   ALA  74           HB1      ALA  74  11.533 -15.018 -15.018
  577   2HB   ALA  74           HB2      ALA  74  12.712 -16.055 -16.055
  578   3HB   ALA  74           HB3      ALA  74  11.971 -14.757 -14.757
  579    H    LYS  75           HN       LYS  75   8.541 -17.441 -17.441
  580    HA   LYS  75           HA       LYS  75   7.680 -18.793 -18.793
  581   1HB   LYS  75           HB1      LYS  75   8.488 -20.291 -20.291
  582   2HB   LYS  75           HB2      LYS  75   9.989 -20.528 -20.528
  583   1HG   LYS  75           HG1      LYS  75   8.758 -21.571 -21.571
  584   2HG   LYS  75           HG2      LYS  75   7.232 -21.219 -21.219
  585   1HD   LYS  75           HD1      LYS  75   7.886 -22.678 -22.678
  586   2HD   LYS  75           HD2      LYS  75   9.430 -23.004 -23.004
  587   1HE   LYS  75           HE1      LYS  75   8.273 -24.070 -24.070
  588   2HE   LYS  75           HE2      LYS  75   6.710 -23.692 -23.692
  589   1HZ   LYS  75           HZ1      LYS  75   8.249 -25.003 -25.003
  590   2HZ   LYS  75           HZ2      LYS  75   8.351 -25.896 -25.896
  591   3HZ   LYS  75           HZ3      LYS  75   6.832 -25.536 -25.536
  592    H    GLY  76           HN       GLY  76   8.922 -16.960 -16.960
  593   1HA   GLY  76           HA1      GLY  76  10.941 -17.990 -17.990
  594   2HA   GLY  76           HA2      GLY  76  10.432 -16.308 -16.308
  595    H    LYS  77           HN       LYS  77   8.159 -15.894 -15.894
  596    HA   LYS  77           HA       LYS  77   6.597 -15.597 -15.597
  597   1HB   LYS  77           HB1      LYS  77   6.610 -18.653 -18.653
  598   2HB   LYS  77           HB2      LYS  77   5.264 -17.722 -17.722
  599   1HG   LYS  77           HG1      LYS  77   5.413 -16.482 -16.482
  600   2HG   LYS  77           HG2      LYS  77   6.333 -17.890 -17.890
  601   1HD   LYS  77           HD1      LYS  77   4.092 -18.431 -18.431
  602   2HD   LYS  77           HD2      LYS  77   4.385 -19.333 -19.333
  603   1HE   LYS  77           HE1      LYS  77   2.180 -18.229 -18.229
  604   2HE   LYS  77           HE2      LYS  77   3.246 -17.484 -17.484
  605   1HZ   LYS  77           HZ1      LYS  77   3.542 -16.154 -16.154
  606   2HZ   LYS  77           HZ2      LYS  77   1.885 -16.266 -16.266
  607   3HZ   LYS  77           HZ3      LYS  77   2.941 -15.551 -15.551
  608    HA   PRO  78           HA       PRO  78   8.004 -16.289 -16.289
  609   1HB   PRO  78           HB1      PRO  78   5.381 -17.643 -17.643
  610   2HB   PRO  78           HB2      PRO  78   6.162 -16.244 -16.244
  611   1HG   PRO  78           HG1      PRO  78   4.070 -15.766 -15.766
  612   2HG   PRO  78           HG2      PRO  78   5.522 -14.775 -14.775
  613   1HD   PRO  78           HD1      PRO  78   4.778 -17.315 -17.315
  614   2HD   PRO  78           HD2      PRO  78   5.128 -15.718 -15.718
  615    H    ASP  79           HN       ASP  79   7.021 -18.925 -18.925
  616    HA   ASP  79           HA       ASP  79   8.694 -20.759 -20.759
  617   1HB   ASP  79           HB1      ASP  79   6.259 -21.325 -21.325
  618   2HB   ASP  79           HB2      ASP  79   6.221 -21.516 -21.516
  619    H    ALA  80           HN       ALA  80  10.509 -20.362 -20.362
  620    HA   ALA  80           HA       ALA  80  10.570 -20.989 -20.989
  621   1HB   ALA  80           HB1      ALA  80  11.646 -18.867 -18.867
  622   2HB   ALA  80           HB2      ALA  80  12.713 -19.767 -19.767
  623   3HB   ALA  80           HB3      ALA  80  12.834 -19.967 -19.967
  624    H    ALA  81           HN       ALA  81  11.322 -22.252 -22.252
  625    HA   ALA  81           HA       ALA  81  12.953 -24.474 -24.474
  626   1HB   ALA  81           HB1      ALA  81  12.920 -23.376 -23.376
  627   2HB   ALA  81           HB2      ALA  81  13.895 -24.728 -24.728
  628   3HB   ALA  81           HB3      ALA  81  14.190 -23.114 -23.114
  629   1H1   BME  16           HE1      MER  16  -8.410   8.875   8.875
  630   2H1   BME  16           HE2      MER  16  -7.129   7.686   7.686
  631   1H2   BME  16           HZ1      MER  16  -5.412   9.481   9.481
  632   2H2   BME  16           HZ2      MER  16  -6.721  10.585  10.585
  633    HO1  BME  16           HH       MER  16  -8.040   8.621   8.621

  Start of MODEL   46
    1    H    ASN   3           HN       ASN   3  -1.918  -9.717  -9.717
    2    HA   ASN   3           HA       ASN   3   0.006  -8.953  -8.953
    3   1HB   ASN   3           HB1      ASN   3   0.510 -11.959 -11.959
    4   2HB   ASN   3           HB2      ASN   3   1.761 -10.727 -10.727
    5   1HD2  ASN   3          HD21      ASN   3   1.860 -10.071 -10.071
    6   2HD2  ASN   3          HD22      ASN   3   2.631  -9.999  -9.999
    7    H    ALA   4           HN       ALA   4   1.823 -10.157 -10.157
    8    HA   ALA   4           HA       ALA   4   2.298 -10.734 -10.734
    9   1HB   ALA   4           HB1      ALA   4   0.292 -12.232 -12.232
   10   2HB   ALA   4           HB2      ALA   4  -0.713 -10.865 -10.865
   11   3HB   ALA   4           HB3      ALA   4   0.567 -11.388 -11.388
   12    HA   PRO   5           HA       PRO   5   3.043  -7.002  -7.002
   13   1HB   PRO   5           HB1      PRO   5   2.162  -8.021  -8.021
   14   2HB   PRO   5           HB2      PRO   5   3.804  -7.819  -7.819
   15   1HG   PRO   5           HG1      PRO   5   2.094 -10.268 -10.268
   16   2HG   PRO   5           HG2      PRO   5   3.850 -10.145 -10.145
   17   1HD   PRO   5           HD1      PRO   5   2.620 -10.881 -10.881
   18   2HD   PRO   5           HD2      PRO   5   3.947  -9.774  -9.774
   19    H    LYS   6           HN       LYS   6   1.671  -5.606  -5.606
   20    HA   LYS   6           HA       LYS   6  -0.993  -5.213  -5.213
   21   1HB   LYS   6           HB1      LYS   6  -1.001  -5.877  -5.877
   22   2HB   LYS   6           HB2      LYS   6  -0.071  -4.455  -4.455
   23   1HG   LYS   6           HG1      LYS   6  -2.188  -3.657  -3.657
   24   2HG   LYS   6           HG2      LYS   6  -2.113  -3.182  -3.182
   25   1HD   LYS   6           HD1      LYS   6  -3.292  -5.279  -5.279
   26   2HD   LYS   6           HD2      LYS   6  -3.412  -5.736  -5.736
   27   1HE   LYS   6           HE1      LYS   6  -4.637  -3.236  -3.236
   28   2HE   LYS   6           HE2      LYS   6  -5.513  -4.653  -4.653
   29   1HZ   LYS   6           HZ1      LYS   6  -3.928  -3.758  -3.758
   30   2HZ   LYS   6           HZ2      LYS   6  -4.738  -2.414  -2.414
   31   3HZ   LYS   6           HZ3      LYS   6  -5.621  -3.767  -3.767
   32    H    ARG   7           HN       ARG   7  -0.022  -3.949  -3.949
   33    HA   ARG   7           HA       ARG   7   1.354  -1.858  -1.858
   34   1HB   ARG   7           HB1      ARG   7  -1.577  -2.082  -2.082
   35   2HB   ARG   7           HB2      ARG   7  -0.732  -0.659  -0.659
   36   1HG   ARG   7           HG1      ARG   7   0.219  -3.459  -3.459
   37   2HG   ARG   7           HG2      ARG   7  -1.011  -2.642  -2.642
   38   1HD   ARG   7           HD1      ARG   7   1.790  -1.521  -1.521
   39   2HD   ARG   7           HD2      ARG   7   1.252  -2.264  -2.264
   40    HE   ARG   7           HE       ARG   7   0.008   0.230   0.230
   41   1HH1  ARG   7          HH11      ARG   7  -1.237  -1.231  -1.231
   42   2HH1  ARG   7          HH12      ARG   7  -0.606  -0.328  -0.328
   43   1HH2  ARG   7          HH21      ARG   7   1.897   1.184   1.184
   44   2HH2  ARG   7          HH22      ARG   7   1.205   1.065   1.065
   45    HA   PRO   8           HA       PRO   8   0.733   1.121   1.121
   46   1HB   PRO   8           HB1      PRO   8   3.011   2.601   2.601
   47   2HB   PRO   8           HB2      PRO   8   3.008   1.208   1.208
   48   1HG   PRO   8           HG1      PRO   8   3.515   1.225   1.225
   49   2HG   PRO   8           HG2      PRO   8   4.525   0.526   0.526
   50   1HD   PRO   8           HD1      PRO   8   2.884  -1.101  -1.101
   51   2HD   PRO   8           HD2      PRO   8   2.868  -1.180  -1.180
   52    HA   PRO   9           HA       PRO   9  -1.093   4.977   4.977
   53   1HB   PRO   9           HB1      PRO   9   1.115   6.719   6.719
   54   2HB   PRO   9           HB2      PRO   9  -0.338   6.421   6.421
   55   1HG   PRO   9           HG1      PRO   9   2.347   5.011   5.011
   56   2HG   PRO   9           HG2      PRO   9   1.307   5.553   5.553
   57   1HD   PRO   9           HD1      PRO   9   1.242   2.993   2.993
   58   2HD   PRO   9           HD2      PRO   9  -0.335   3.804   3.804
   59    H    SER  10           HN       SER  10  -0.392   7.114   7.114
   60    HA   SER  10           HA       SER  10   0.464   6.354   6.354
   61   1HB   SER  10           HB1      SER  10  -1.214   8.679   8.679
   62   2HB   SER  10           HB2      SER  10  -0.841   8.312   8.312
   63    HG   SER  10           HG       SER  10  -2.644   7.167   7.167
   64    H    ALA  11           HN       ALA  11   0.633   9.241   9.241
   65    HA   ALA  11           HA       ALA  11   3.212   9.956   9.956
   66   1HB   ALA  11           HB1      ALA  11   2.288  10.979  10.979
   67   2HB   ALA  11           HB2      ALA  11   3.765  11.435  11.435
   68   3HB   ALA  11           HB3      ALA  11   3.592   9.815   9.815
   69    H    PHE  12           HN       PHE  12   0.336  10.950  10.950
   70    HA   PHE  12           HA       PHE  12   0.055  13.529  13.529
   71   1HB   PHE  12           HB1      PHE  12  -1.002  13.690  13.690
   72   2HB   PHE  12           HB2      PHE  12  -1.169  11.921  11.921
   73    HD1  PHE  12           HD1      PHE  12  -3.033  13.995  13.995
   74    HD2  PHE  12           HD2      PHE  12  -3.082  11.894  11.894
   75    HE1  PHE  12           HE1      PHE  12  -5.480  14.173  14.173
   76    HE2  PHE  12           HE2      PHE  12  -5.522  12.093  12.093
   77    HZ   PHE  12           HZ       PHE  12  -6.727  13.224  13.224
   78    H    PHE  13           HN       PHE  13  -0.854  10.218  10.218
   79    HA   PHE  13           HA       PHE  13  -3.032  10.463  10.463
   80   1HB   PHE  13           HB1      PHE  13  -1.392   8.407   8.407
   81   2HB   PHE  13           HB2      PHE  13  -0.971   8.570   8.570
   82    HD1  PHE  13           HD1      PHE  13  -3.713   7.923   7.923
   83    HD2  PHE  13           HD2      PHE  13  -2.632   8.086   8.086
   84    HE1  PHE  13           HE1      PHE  13  -5.827   6.830   6.830
   85    HE2  PHE  13           HE2      PHE  13  -4.747   6.991   6.991
   86    HZ   PHE  13           HZ       PHE  13  -6.353   6.367   6.367
   87    H    LEU  14           HN       LEU  14   0.414  10.839  10.839
   88    HA   LEU  14           HA       LEU  14   0.155  11.208  11.208
   89   1HB   LEU  14           HB1      LEU  14   2.131  12.538  12.538
   90   2HB   LEU  14           HB2      LEU  14   2.291  12.513  12.513
   91    HG   LEU  14           HG       LEU  14   3.775  10.864  10.864
   92   1HD1  LEU  14          HD11      LEU  14   2.450   9.922   9.922
   93   2HD1  LEU  14          HD12      LEU  14   1.281   9.276   9.276
   94   3HD1  LEU  14          HD13      LEU  14   2.928   8.670   8.670
   95   1HD2  LEU  14          HD21      LEU  14   3.172  10.736  10.736
   96   2HD2  LEU  14          HD22      LEU  14   3.355   9.126   9.126
   97   3HD2  LEU  14          HD23      LEU  14   1.755   9.757   9.757
   98    H    PHE  15           HN       PHE  15   0.579  13.658  13.658
   99    HA   PHE  15           HA       PHE  15  -0.007  16.029  16.029
  100   1HB   PHE  15           HB1      PHE  15   0.819  16.068  16.068
  101   2HB   PHE  15           HB2      PHE  15  -0.389  14.887  14.887
  102    HD1  PHE  15           HD1      PHE  15  -0.935  18.244  18.244
  103    HD2  PHE  15           HD2      PHE  15  -1.330  15.800  15.800
  104    HE1  PHE  15           HE1      PHE  15  -2.231  20.002  20.002
  105    HE2  PHE  15           HE2      PHE  15  -2.620  17.561  17.561
  106    HZ   PHE  15           HZ       PHE  15  -3.076  19.662  19.662
  107    H    CYS  16           HN       MER  16  -2.285  14.095  14.095
  108    HA   CYS  16           HA       MER  16  -4.720  15.270  15.270
  109   1HB   CYS  16           HB1      MER  16  -5.118  13.595  13.595
  110   2HB   CYS  16           HB2      MER  16  -3.793  12.633  12.633
  111    H    SER  17           HN       SER  17  -3.291  12.675  12.675
  112    HA   SER  17           HA       SER  17  -5.286  12.301  12.301
  113   1HB   SER  17           HB1      SER  17  -3.151  10.982  10.982
  114   2HB   SER  17           HB2      SER  17  -2.287  12.306  12.306
  115    HG   SER  17           HG       SER  17  -3.060  11.623  11.623
  116    H    GLU  18           HN       GLU  18  -2.622  14.471  14.471
  117    HA   GLU  18           HA       GLU  18  -3.309  15.704  15.704
  118   1HB   GLU  18           HB1      GLU  18  -1.103  15.761  15.761
  119   2HB   GLU  18           HB2      GLU  18  -1.734  16.734  16.734
  120   1HG   GLU  18           HG1      GLU  18  -2.237  18.585  18.585
  121   2HG   GLU  18           HG2      GLU  18  -1.834  17.602  17.602
  122    H    TYR  19           HN       TYR  19  -4.518  16.178  16.178
  123    HA   TYR  19           HA       TYR  19  -5.815  18.765  18.765
  124   1HB   TYR  19           HB1      TYR  19  -5.367  17.140  17.140
  125   2HB   TYR  19           HB2      TYR  19  -6.693  18.331  18.331
  126    HD1  TYR  19           HD1      TYR  19  -3.382  18.766  18.766
  127    HD2  TYR  19           HD2      TYR  19  -5.891  19.809  19.809
  128    HE1  TYR  19           HE1      TYR  19  -1.862  20.595  20.595
  129    HE2  TYR  19           HE2      TYR  19  -4.383  21.636  21.636
  130    HH   TYR  19           HH       TYR  19  -1.440  21.906  21.906
  131    H    ARG  20           HN       ARG  20  -6.943  15.596  15.596
  132    HA   ARG  20           HA       ARG  20  -9.531  15.729  15.729
  133   1HB   ARG  20           HB1      ARG  20  -8.347  13.653  13.653
  134   2HB   ARG  20           HB2      ARG  20  -8.366  13.865  13.865
  135   1HG   ARG  20           HG1      ARG  20 -10.931  13.909  13.909
  136   2HG   ARG  20           HG2      ARG  20 -10.787  13.591  13.591
  137   1HD   ARG  20           HD1      ARG  20 -10.922  11.389  11.389
  138   2HD   ARG  20           HD2      ARG  20  -9.213  11.567  11.567
  139    HE   ARG  20           HE       ARG  20  -9.884  12.104  12.104
  140   1HH1  ARG  20          HH11      ARG  20 -12.776  12.020  12.020
  141   2HH1  ARG  20          HH12      ARG  20 -13.444  10.664  10.664
  142   1HH2  ARG  20          HH21      ARG  20 -10.331   9.736   9.736
  143   2HH2  ARG  20          HH22      ARG  20 -12.012   9.333   9.333
  144    HA   PRO  21           HA       PRO  21 -11.508  16.372  16.372
  145   1HB   PRO  21           HB1      PRO  21 -10.181  16.626  16.626
  146   2HB   PRO  21           HB2      PRO  21 -10.260  15.048  15.048
  147   1HG   PRO  21           HG1      PRO  21  -8.036  17.156  17.156
  148   2HG   PRO  21           HG2      PRO  21  -7.856  15.504  15.504
  149   1HD   PRO  21           HD1      PRO  21  -7.489  15.939  15.939
  150   2HD   PRO  21           HD2      PRO  21  -8.455  14.542  14.542
  151    H    LYS  22           HN       LYS  22  -9.057  18.319  18.319
  152    HA   LYS  22           HA       LYS  22  -9.903  20.768  20.768
  153   1HB   LYS  22           HB1      LYS  22  -7.515  20.087  20.087
  154   2HB   LYS  22           HB2      LYS  22  -7.608  20.224  20.224
  155   1HG   LYS  22           HG1      LYS  22  -8.078  22.616  22.616
  156   2HG   LYS  22           HG2      LYS  22  -8.134  22.550  22.550
  157   1HD   LYS  22           HD1      LYS  22  -5.676  21.820  21.820
  158   2HD   LYS  22           HD2      LYS  22  -5.927  23.395  23.395
  159   1HE   LYS  22           HE1      LYS  22  -5.936  22.397  22.397
  160   2HE   LYS  22           HE2      LYS  22  -5.755  20.782  20.782
  161   1HZ   LYS  22           HZ1      LYS  22  -3.751  22.442  22.442
  162   2HZ   LYS  22           HZ2      LYS  22  -3.766  22.583  22.583
  163   3HZ   LYS  22           HZ3      LYS  22  -3.603  21.057  21.057
  164    H    ILE  23           HN       ILE  23  -9.985  19.302  19.302
  165    HA   ILE  23           HA       ILE  23 -10.992  21.813  21.813
  166    HB   ILE  23           HB       ILE  23 -11.139  19.065  19.065
  167   1HG1  ILE  23          HG11      ILE  23  -8.792  21.004  21.004
  168   2HG1  ILE  23          HG12      ILE  23  -8.719  19.544  19.544
  169   1HG2  ILE  23          HG21      ILE  23 -12.400  21.024  21.024
  170   2HG2  ILE  23          HG22      ILE  23 -10.905  21.940  21.940
  171   3HG2  ILE  23          HG23      ILE  23 -11.127  20.537  20.537
  172   1HD1  ILE  23          HD11      ILE  23  -9.331  18.169  18.169
  173   2HD1  ILE  23          HD12      ILE  23  -9.398  19.601  19.601
  174   3HD1  ILE  23          HD13      ILE  23  -7.876  19.084  19.084
  175    H    LYS  24           HN       LYS  24 -11.862  18.608  18.608
  176    HA   LYS  24           HA       LYS  24 -14.642  18.685  18.685
  177   1HB   LYS  24           HB1      LYS  24 -13.011  16.755  16.755
  178   2HB   LYS  24           HB2      LYS  24 -13.077  16.998  16.998
  179   1HG   LYS  24           HG1      LYS  24 -15.812  16.862  16.862
  180   2HG   LYS  24           HG2      LYS  24 -14.897  15.450  15.450
  181   1HD   LYS  24           HD1      LYS  24 -15.236  16.388  16.388
  182   2HD   LYS  24           HD2      LYS  24 -16.195  15.133  15.133
  183   1HE   LYS  24           HE1      LYS  24 -14.034  13.865  13.865
  184   2HE   LYS  24           HE2      LYS  24 -13.189  15.042  15.042
  185   1HZ   LYS  24           HZ1      LYS  24 -15.464  14.146  14.146
  186   2HZ   LYS  24           HZ2      LYS  24 -14.583  12.801  12.801
  187   3HZ   LYS  24           HZ3      LYS  24 -13.826  13.979  13.979
  188    H    GLY  25           HN       GLY  25 -12.631  19.615  19.615
  189   1HA   GLY  25           HA1      GLY  25 -14.618  19.772  19.772
  190   2HA   GLY  25           HA2      GLY  25 -13.065  20.623  20.623
  191    H    GLU  26           HN       GLU  26 -13.295  22.035  22.035
  192    HA   GLU  26           HA       GLU  26 -14.936  24.274  24.274
  193   1HB   GLU  26           HB1      GLU  26 -13.244  23.753  23.753
  194   2HB   GLU  26           HB2      GLU  26 -13.916  25.318  25.318
  195   1HG   GLU  26           HG1      GLU  26 -12.120  23.796  23.796
  196   2HG   GLU  26           HG2      GLU  26 -11.439  24.818  24.818
  197    H    HIS  27           HN       HIS  27 -14.906  22.012  22.012
  198    HA   HIS  27           HA       HIS  27 -17.678  22.725  22.725
  199   1HB   HIS  27           HB1      HIS  27 -15.589  21.595  21.595
  200   2HB   HIS  27           HB2      HIS  27 -17.097  22.409  22.409
  201    HD1  HIS  27           HD1      HIS  27 -17.061  25.038  25.038
  202    HD2  HIS  27           HD2      HIS  27 -13.402  23.257  23.257
  203    HE1  HIS  27           HE1      HIS  27 -15.404  26.864  26.864
  204    HA   PRO  28           HA       PRO  28 -18.058  18.272  18.272
  205   1HB   PRO  28           HB1      PRO  28 -19.802  18.371  18.371
  206   2HB   PRO  28           HB2      PRO  28 -18.090  18.659  18.659
  207   1HG   PRO  28           HG1      PRO  28 -20.274  20.753  20.753
  208   2HG   PRO  28           HG2      PRO  28 -19.150  20.683  20.683
  209   1HD   PRO  28           HD1      PRO  28 -18.630  22.218  22.218
  210   2HD   PRO  28           HD2      PRO  28 -17.303  21.473  21.473
  211    H    GLY  29           HN       GLY  29 -18.748  19.705  19.705
  212   1HA   GLY  29           HA1      GLY  29 -21.660  19.426  19.426
  213   2HA   GLY  29           HA2      GLY  29 -20.705  20.722  20.722
  214    H    LEU  30           HN       LEU  30 -18.380  18.929  18.929
  215    HA   LEU  30           HA       LEU  30 -19.358  17.704  17.704
  216   1HB   LEU  30           HB1      LEU  30 -16.526  17.346  17.346
  217   2HB   LEU  30           HB2      LEU  30 -17.369  18.360  18.360
  218    HG   LEU  30           HG       LEU  30 -16.530  19.264  19.264
  219   1HD1  LEU  30          HD11      LEU  30 -14.600  18.652  18.652
  220   2HD1  LEU  30          HD12      LEU  30 -15.252  19.705  19.705
  221   3HD1  LEU  30          HD13      LEU  30 -14.663  20.378  20.378
  222   1HD2  LEU  30          HD21      LEU  30 -17.380  20.807  20.807
  223   2HD2  LEU  30          HD22      LEU  30 -18.406  20.616  20.616
  224   3HD2  LEU  30          HD23      LEU  30 -16.904  21.514  21.514
  225    H    SER  31           HN       SER  31 -17.766  15.729  15.729
  226    HA   SER  31           HA       SER  31 -18.222  13.715  13.715
  227   1HB   SER  31           HB1      SER  31 -19.549  13.393  13.393
  228   2HB   SER  31           HB2      SER  31 -18.009  13.211  13.211
  229    HG   SER  31           HG       SER  31 -17.890  11.294  11.294
  230    H    ILE  32           HN       ILE  32 -16.706  11.775  11.775
  231    HA   ILE  32           HA       ILE  32 -13.992  12.706  12.706
  232    HB   ILE  32           HB       ILE  32 -15.392  10.685  10.685
  233   1HG1  ILE  32          HG11      ILE  32 -13.176  11.050  11.050
  234   2HG1  ILE  32          HG12      ILE  32 -13.402   9.356   9.356
  235   1HG2  ILE  32          HG21      ILE  32 -14.262   9.341   9.341
  236   2HG2  ILE  32          HG22      ILE  32 -14.967   8.493   8.493
  237   3HG2  ILE  32          HG23      ILE  32 -15.960   9.571   9.571
  238   1HD1  ILE  32          HD11      ILE  32 -12.089   9.623   9.623
  239   2HD1  ILE  32          HD12      ILE  32 -11.843  11.325  11.325
  240   3HD1  ILE  32          HD13      ILE  32 -11.163  10.080  10.080
  241    H    GLY  33           HN       GLY  33 -15.870  12.343  12.343
  242   1HA   GLY  33           HA1      GLY  33 -13.789  11.496  11.496
  243   2HA   GLY  33           HA2      GLY  33 -15.524  11.600  11.600
  244    H    ASP  34           HN       ASP  34 -15.220  14.257  14.257
  245    HA   ASP  34           HA       ASP  34 -14.642  15.983  15.983
  246   1HB   ASP  34           HB1      ASP  34 -16.198  16.245  16.245
  247   2HB   ASP  34           HB2      ASP  34 -15.979  17.659  17.659
  248    H    VAL  35           HN       VAL  35 -14.068  15.489  15.489
  249    HA   VAL  35           HA       VAL  35 -12.118  17.565  17.565
  250    HB   VAL  35           HB       VAL  35 -12.781  14.929  14.929
  251   1HG1  VAL  35          HG11      VAL  35 -11.176  17.280  17.280
  252   2HG1  VAL  35          HG12      VAL  35 -11.640  15.869  15.869
  253   3HG1  VAL  35          HG13      VAL  35 -10.504  15.706  15.706
  254   1HG2  VAL  35          HG21      VAL  35 -14.662  16.578  16.578
  255   2HG2  VAL  35          HG22      VAL  35 -13.996  16.369  16.369
  256   3HG2  VAL  35          HG23      VAL  35 -13.588  17.791  17.791
  257    H    ALA  36           HN       ALA  36 -12.095  14.450  14.450
  258    HA   ALA  36           HA       ALA  36  -9.198  14.125  14.125
  259   1HB   ALA  36           HB1      ALA  36 -10.690  12.219  12.219
  260   2HB   ALA  36           HB2      ALA  36 -11.430  12.464  12.464
  261   3HB   ALA  36           HB3      ALA  36  -9.753  11.934  11.934
  262    H    LYS  37           HN       LYS  37 -11.862  14.669  14.669
  263    HA   LYS  37           HA       LYS  37 -10.242  14.672  14.672
  264   1HB   LYS  37           HB1      LYS  37 -12.546  14.360  14.360
  265   2HB   LYS  37           HB2      LYS  37 -12.968  15.690  15.690
  266   1HG   LYS  37           HG1      LYS  37 -12.252  17.321  17.321
  267   2HG   LYS  37           HG2      LYS  37 -11.651  16.053  16.053
  268   1HD   LYS  37           HD1      LYS  37 -13.844  15.263  15.263
  269   2HD   LYS  37           HD2      LYS  37 -14.547  16.055  16.055
  270   1HE   LYS  37           HE1      LYS  37 -14.122  18.276  18.276
  271   2HE   LYS  37           HE2      LYS  37 -13.422  17.480  17.480
  272   1HZ   LYS  37           HZ1      LYS  37 -15.902  16.313  16.313
  273   2HZ   LYS  37           HZ2      LYS  37 -16.111  17.995  17.995
  274   3HZ   LYS  37           HZ3      LYS  37 -15.443  17.298  17.298
  275    H    LYS  38           HN       LYS  38 -11.207  17.270  17.270
  276    HA   LYS  38           HA       LYS  38 -10.102  19.365  19.365
  277   1HB   LYS  38           HB1      LYS  38 -11.873  19.341  19.341
  278   2HB   LYS  38           HB2      LYS  38 -10.423  19.662  19.662
  279   1HG   LYS  38           HG1      LYS  38 -11.210  21.825  21.825
  280   2HG   LYS  38           HG2      LYS  38  -9.953  21.540  21.540
  281   1HD   LYS  38           HD1      LYS  38 -11.772  20.658  20.658
  282   2HD   LYS  38           HD2      LYS  38 -12.959  21.140  21.140
  283   1HE   LYS  38           HE1      LYS  38 -12.789  22.908  22.908
  284   2HE   LYS  38           HE2      LYS  38 -12.096  23.502  23.502
  285   1HZ   LYS  38           HZ1      LYS  38 -10.094  22.214  22.214
  286   2HZ   LYS  38           HZ2      LYS  38 -10.895  23.322  23.322
  287   3HZ   LYS  38           HZ3      LYS  38 -10.199  23.849  23.849
  288    H    LEU  39           HN       LEU  39  -8.981  17.791  17.791
  289    HA   LEU  39           HA       LEU  39  -6.454  19.180  19.180
  290   1HB   LEU  39           HB1      LEU  39  -6.403  18.516  18.516
  291   2HB   LEU  39           HB2      LEU  39  -8.000  17.872  17.872
  292    HG   LEU  39           HG       LEU  39  -6.730  15.751  15.751
  293   1HD1  LEU  39          HD11      LEU  39  -4.661  17.321  17.321
  294   2HD1  LEU  39          HD12      LEU  39  -4.479  15.617  15.617
  295   3HD1  LEU  39          HD13      LEU  39  -4.478  16.758  16.758
  296   1HD2  LEU  39          HD21      LEU  39  -8.075  16.003  16.003
  297   2HD2  LEU  39          HD22      LEU  39  -6.637  15.049  15.049
  298   3HD2  LEU  39          HD23      LEU  39  -6.672  16.742  16.742
  299    H    GLY  40           HN       GLY  40  -7.552  16.132  16.132
  300   1HA   GLY  40           HA1      GLY  40  -4.929  15.060  15.060
  301   2HA   GLY  40           HA2      GLY  40  -6.351  14.615  14.615
  302    H    GLU  41           HN       GLU  41  -6.948  17.393  17.393
  303    HA   GLU  41           HA       GLU  41  -5.298  17.614  17.614
  304   1HB   GLU  41           HB1      GLU  41  -7.142  19.571  19.571
  305   2HB   GLU  41           HB2      GLU  41  -6.454  19.847  19.847
  306   1HG   GLU  41           HG1      GLU  41  -7.655  18.093  18.093
  307   2HG   GLU  41           HG2      GLU  41  -8.015  17.299  17.299
  308    H    MET  42           HN       MET  42  -5.647  19.488  19.488
  309    HA   MET  42           HA       MET  42  -3.698  21.415  21.415
  310   1HB   MET  42           HB1      MET  42  -4.171  19.689  19.689
  311   2HB   MET  42           HB2      MET  42  -3.271  21.191  21.191
  312   1HG   MET  42           HG1      MET  42  -6.138  20.981  20.981
  313   2HG   MET  42           HG2      MET  42  -5.785  21.360  21.360
  314   1HE   MET  42           HE1      MET  42  -7.751  22.815  22.815
  315   2HE   MET  42           HE2      MET  42  -7.249  24.296  24.296
  316   3HE   MET  42           HE3      MET  42  -6.897  22.758  22.758
  317    H    TRP  43           HN       TRP  43  -3.216  18.208  18.208
  318    HA   TRP  43           HA       TRP  43  -0.528  17.966  17.966
  319   1HB   TRP  43           HB1      TRP  43  -2.075  16.126  16.126
  320   2HB   TRP  43           HB2      TRP  43  -2.401  15.963  15.963
  321    HD1  TRP  43           HD1      TRP  43  -1.025  14.239  14.239
  322    HE1  TRP  43           HE1      TRP  43   1.146  13.126  13.126
  323    HE3  TRP  43           HE3      TRP  43   0.187  16.694  16.694
  324    HZ2  TRP  43           HZ2      TRP  43   3.254  13.161  13.161
  325    HZ3  TRP  43           HZ3      TRP  43   2.177  16.171  16.171
  326    HH2  TRP  43           HH2      TRP  43   3.750  14.403  14.403
  327    H    ASN  44           HN       ASN  44  -2.167  17.256  17.256
  328    HA   ASN  44           HA       ASN  44   0.151  16.718  16.718
  329   1HB   ASN  44           HB1      ASN  44  -1.102  16.948  16.948
  330   2HB   ASN  44           HB2      ASN  44  -2.312  16.534  16.534
  331   1HD2  ASN  44          HD21      ASN  44  -4.335  19.137  19.137
  332   2HD2  ASN  44          HD22      ASN  44  -4.169  17.542  17.542
  333    H    ASN  45           HN       ASN  45  -1.229  19.797  19.797
  334    HA   ASN  45           HA       ASN  45   1.165  21.186  21.186
  335   1HB   ASN  45           HB1      ASN  45  -0.344  23.188  23.188
  336   2HB   ASN  45           HB2      ASN  45  -0.928  21.842  21.842
  337   1HD2  ASN  45          HD21      ASN  45  -3.936  21.588  21.588
  338   2HD2  ASN  45          HD22      ASN  45  -3.054  21.083  21.083
  339    H    THR  46           HN       THR  46   1.354  20.133  20.133
  340    HA   THR  46           HA       THR  46   0.751  22.248  22.248
  341    HB   THR  46           HB       THR  46   0.978  19.879  19.879
  342    HG1  THR  46           HG1      THR  46   3.127  20.915  20.915
  343   1HG2  THR  46          HG21      THR  46   2.961  19.049  19.049
  344   2HG2  THR  46          HG22      THR  46   4.013  20.106  20.106
  345   3HG2  THR  46          HG23      THR  46   3.165  18.802  18.802
  346    H    ALA  47           HN       ALA  47   3.609  21.067  21.067
  347    HA   ALA  47           HA       ALA  47   4.874  23.550  23.550
  348   1HB   ALA  47           HB1      ALA  47   6.066  21.966  21.966
  349   2HB   ALA  47           HB2      ALA  47   6.804  23.375  23.375
  350   3HB   ALA  47           HB3      ALA  47   5.315  23.541  23.541
  351    H    ALA  48           HN       ALA  48   5.417  20.306  20.306
  352    HA   ALA  48           HA       ALA  48   5.982  18.382  18.382
  353   1HB   ALA  48           HB1      ALA  48   6.067  19.632  19.632
  354   2HB   ALA  48           HB2      ALA  48   7.649  20.256  20.256
  355   3HB   ALA  48           HB3      ALA  48   7.413  18.537  18.537
  356    H    ASP  49           HN       ASP  49   7.671  21.050  21.050
  357    HA   ASP  49           HA       ASP  49  10.135  19.593  19.593
  358   1HB   ASP  49           HB1      ASP  49   9.723  22.115  22.115
  359   2HB   ASP  49           HB2      ASP  49   9.794  22.503  22.503
  360    H    ASP  50           HN       ASP  50   7.150  20.289  20.289
  361    HA   ASP  50           HA       ASP  50   7.859  20.286  20.286
  362   1HB   ASP  50           HB1      ASP  50   6.490  22.237  22.237
  363   2HB   ASP  50           HB2      ASP  50   5.237  21.088  21.088
  364    H    LYS  51           HN       LYS  51   6.989  18.374  18.374
  365    HA   LYS  51           HA       LYS  51   5.136  16.571  16.571
  366   1HB   LYS  51           HB1      LYS  51   6.601  16.274  16.274
  367   2HB   LYS  51           HB2      LYS  51   5.557  15.045  15.045
  368   1HG   LYS  51           HG1      LYS  51   3.653  16.694  16.694
  369   2HG   LYS  51           HG2      LYS  51   4.755  17.805  17.805
  370   1HD   LYS  51           HD1      LYS  51   5.198  16.100  16.100
  371   2HD   LYS  51           HD2      LYS  51   4.145  14.963  14.963
  372   1HE   LYS  51           HE1      LYS  51   2.214  16.391  16.391
  373   2HE   LYS  51           HE2      LYS  51   3.216  17.617  17.617
  374   1HZ   LYS  51           HZ1      LYS  51   3.703  15.153  15.153
  375   2HZ   LYS  51           HZ2      LYS  51   2.022  15.369  15.369
  376   3HZ   LYS  51           HZ3      LYS  51   2.988  16.539  16.539
  377    H    GLN  52           HN       GLN  52   8.355  16.740  16.740
  378    HA   GLN  52           HA       GLN  52   9.684  14.528  14.528
  379   1HB   GLN  52           HB1      GLN  52  10.430  17.203  17.203
  380   2HB   GLN  52           HB2      GLN  52  11.042  16.775  16.775
  381   1HG   GLN  52           HG1      GLN  52  12.804  16.359  16.359
  382   2HG   GLN  52           HG2      GLN  52  12.238  14.812  14.812
  383   1HE2  GLN  52          HE21      GLN  52  10.372  15.130  15.130
  384   2HE2  GLN  52          HE22      GLN  52   9.825  15.895  15.895
  385    HA   PRO  53           HA       PRO  53  10.128  14.754  14.754
  386   1HB   PRO  53           HB1      PRO  53   7.946  16.053  16.053
  387   2HB   PRO  53           HB2      PRO  53   9.546  16.741  16.741
  388   1HG   PRO  53           HG1      PRO  53   7.150  16.926  16.926
  389   2HG   PRO  53           HG2      PRO  53   8.125  18.260  18.260
  390   1HD   PRO  53           HD1      PRO  53   8.757  17.381  17.381
  391   2HD   PRO  53           HD2      PRO  53  10.094  17.515  17.515
  392    H    TYR  54           HN       TYR  54   6.855  14.833  14.833
  393    HA   TYR  54           HA       TYR  54   5.944  12.575  12.575
  394   1HB   TYR  54           HB1      TYR  54   4.669  13.962  13.962
  395   2HB   TYR  54           HB2      TYR  54   3.870  12.761  12.761
  396    HD1  TYR  54           HD1      TYR  54   4.241  13.420  13.420
  397    HD2  TYR  54           HD2      TYR  54   4.081  16.144  16.144
  398    HE1  TYR  54           HE1      TYR  54   3.585  15.221  15.221
  399    HE2  TYR  54           HE2      TYR  54   3.428  17.945  17.945
  400    HH   TYR  54           HH       TYR  54   2.154  17.877  17.877
  401    H    GLU  55           HN       GLU  55   6.652  13.147  13.147
  402    HA   GLU  55           HA       GLU  55   6.104  10.570  10.570
  403   1HB   GLU  55           HB1      GLU  55   7.404  13.010  13.010
  404   2HB   GLU  55           HB2      GLU  55   8.429  11.688  11.688
  405   1HG   GLU  55           HG1      GLU  55   6.377  10.605  10.605
  406   2HG   GLU  55           HG2      GLU  55   5.430  11.988  11.988
  407    H    LYS  56           HN       LYS  56   9.168  11.819  11.819
  408    HA   LYS  56           HA       LYS  56  10.724   9.496   9.496
  409   1HB   LYS  56           HB1      LYS  56  11.501  11.873  11.873
  410   2HB   LYS  56           HB2      LYS  56  10.876  11.560  11.560
  411   1HG   LYS  56           HG1      LYS  56  12.451   9.580   9.580
  412   2HG   LYS  56           HG2      LYS  56  13.036   9.942   9.942
  413   1HD   LYS  56           HD1      LYS  56  14.686  10.930  10.930
  414   2HD   LYS  56           HD2      LYS  56  13.658  12.293  12.293
  415   1HE   LYS  56           HE1      LYS  56  13.386  10.654  10.654
  416   2HE   LYS  56           HE2      LYS  56  14.327  12.128  12.128
  417   1HZ   LYS  56           HZ1      LYS  56  11.812  12.679  12.679
  418   2HZ   LYS  56           HZ2      LYS  56  11.585  11.852  11.852
  419   3HZ   LYS  56           HZ3      LYS  56  12.523  13.266  13.266
  420    H    LYS  57           HN       LYS  57   8.300  10.477  10.477
  421    HA   LYS  57           HA       LYS  57   8.901   8.542   8.542
  422   1HB   LYS  57           HB1      LYS  57   7.197  10.658  10.658
  423   2HB   LYS  57           HB2      LYS  57   6.043   9.455   9.455
  424   1HG   LYS  57           HG1      LYS  57   5.725   9.194   9.194
  425   2HG   LYS  57           HG2      LYS  57   7.043   8.061   8.061
  426   1HD   LYS  57           HD1      LYS  57   7.269  10.958  10.958
  427   2HD   LYS  57           HD2      LYS  57   7.475   9.527   9.527
  428   1HE   LYS  57           HE1      LYS  57   9.505   8.905   8.905
  429   2HE   LYS  57           HE2      LYS  57   9.315  10.379  10.379
  430   1HZ   LYS  57           HZ1      LYS  57   9.213  11.071  11.071
  431   2HZ   LYS  57           HZ2      LYS  57  10.561  10.064  10.064
  432   3HZ   LYS  57           HZ3      LYS  57  10.384  11.473  11.473
  433    H    ALA  58           HN       ALA  58   6.496   8.639   8.639
  434    HA   ALA  58           HA       ALA  58   5.325   6.155   6.155
  435   1HB   ALA  58           HB1      ALA  58   4.910   7.782   7.782
  436   2HB   ALA  58           HB2      ALA  58   6.474   7.374   7.374
  437   3HB   ALA  58           HB3      ALA  58   5.211   6.166   6.166
  438    H    ALA  59           HN       ALA  59   8.466   6.825   6.825
  439    HA   ALA  59           HA       ALA  59   9.240   4.199   4.199
  440   1HB   ALA  59           HB1      ALA  59  10.576   6.217   6.217
  441   2HB   ALA  59           HB2      ALA  59  11.064   6.417   6.417
  442   3HB   ALA  59           HB3      ALA  59  11.586   5.009   5.009
  443    H    LYS  60           HN       LYS  60  10.154   5.888   5.888
  444    HA   LYS  60           HA       LYS  60  11.381   3.905   3.905
  445   1HB   LYS  60           HB1      LYS  60  11.077   6.329   6.329
  446   2HB   LYS  60           HB2      LYS  60   9.426   5.988   5.988
  447   1HG   LYS  60           HG1      LYS  60  10.220   4.397   4.397
  448   2HG   LYS  60           HG2      LYS  60  11.880   4.662   4.662
  449   1HD   LYS  60           HD1      LYS  60  11.687   7.078   7.078
  450   2HD   LYS  60           HD2      LYS  60  10.025   6.832   6.832
  451   1HE   LYS  60           HE1      LYS  60  12.449   5.465   5.465
  452   2HE   LYS  60           HE2      LYS  60  11.607   6.852   6.852
  453   1HZ   LYS  60           HZ1      LYS  60   9.698   4.911   4.911
  454   2HZ   LYS  60           HZ2      LYS  60  10.968   4.144   4.144
  455   3HZ   LYS  60           HZ3      LYS  60  10.197   5.489   5.489
  456    H    LEU  61           HN       LEU  61   7.989   4.328   4.328
  457    HA   LEU  61           HA       LEU  61   7.153   2.204   2.204
  458   1HB   LEU  61           HB1      LEU  61   5.573   3.670   3.670
  459   2HB   LEU  61           HB2      LEU  61   4.888   2.706   2.706
  460    HG   LEU  61           HG       LEU  61   6.630   5.191   5.191
  461   1HD1  LEU  61          HD11      LEU  61   3.634   4.841   4.841
  462   2HD1  LEU  61          HD12      LEU  61   4.538   6.277   6.277
  463   3HD1  LEU  61          HD13      LEU  61   4.485   5.787   5.787
  464   1HD2  LEU  61          HD21      LEU  61   5.010   3.500   3.500
  465   2HD2  LEU  61          HD22      LEU  61   6.763   3.553   3.553
  466   3HD2  LEU  61          HD23      LEU  61   5.873   4.979   4.979
  467    H    LYS  62           HN       LYS  62   7.261   2.513   2.513
  468    HA   LYS  62           HA       LYS  62   6.476  -0.076  -0.076
  469   1HB   LYS  62           HB1      LYS  62   7.113   1.521   1.521
  470   2HB   LYS  62           HB2      LYS  62   8.748   1.647   1.647
  471   1HG   LYS  62           HG1      LYS  62   9.299  -0.600  -0.600
  472   2HG   LYS  62           HG2      LYS  62   7.623  -1.022  -1.022
  473   1HD   LYS  62           HD1      LYS  62   9.022   1.165   1.165
  474   2HD   LYS  62           HD2      LYS  62   9.095  -0.517  -0.517
  475   1HE   LYS  62           HE1      LYS  62   6.602  -0.606  -0.606
  476   2HE   LYS  62           HE2      LYS  62   6.518   1.086   1.086
  477   1HZ   LYS  62           HZ1      LYS  62   8.247   0.866   0.866
  478   2HZ   LYS  62           HZ2      LYS  62   6.821   0.017   0.017
  479   3HZ   LYS  62           HZ3      LYS  62   6.742   1.650   1.650
  480    H    GLU  63           HN       GLU  63   9.592   1.081   1.081
  481    HA   GLU  63           HA       GLU  63  11.167  -1.209  -1.209
  482   1HB   GLU  63           HB1      GLU  63  12.211   0.889   0.889
  483   2HB   GLU  63           HB2      GLU  63  11.036   1.395   1.395
  484   1HG   GLU  63           HG1      GLU  63  12.015  -0.299  -0.299
  485   2HG   GLU  63           HG2      GLU  63  13.264  -0.641  -0.641
  486    H    LYS  64           HN       LYS  64   9.233   0.153   0.153
  487    HA   LYS  64           HA       LYS  64   9.477  -1.849  -1.849
  488   1HB   LYS  64           HB1      LYS  64   8.338   0.193   0.193
  489   2HB   LYS  64           HB2      LYS  64   7.138  -0.020  -0.020
  490   1HG   LYS  64           HG1      LYS  64   6.173  -1.941  -1.941
  491   2HG   LYS  64           HG2      LYS  64   7.374  -1.775  -1.775
  492   1HD   LYS  64           HD1      LYS  64   6.528   0.455   0.455
  493   2HD   LYS  64           HD2      LYS  64   5.450   0.449   0.449
  494   1HE   LYS  64           HE1      LYS  64   4.213  -1.479  -1.479
  495   2HE   LYS  64           HE2      LYS  64   5.288  -1.476  -1.476
  496   1HZ   LYS  64           HZ1      LYS  64   4.299   1.118   1.118
  497   2HZ   LYS  64           HZ2      LYS  64   2.994   0.032   0.032
  498   3HZ   LYS  64           HZ3      LYS  64   4.057   0.082   0.082
  499    H    TYR  65           HN       TYR  65   7.018  -1.679  -1.679
  500    HA   TYR  65           HA       TYR  65   5.578  -4.053  -4.053
  501   1HB   TYR  65           HB1      TYR  65   4.716  -2.357  -2.357
  502   2HB   TYR  65           HB2      TYR  65   6.231  -2.274  -2.274
  503    HD1  TYR  65           HD1      TYR  65   6.757  -4.459  -4.459
  504    HD2  TYR  65           HD2      TYR  65   2.840  -3.305  -3.305
  505    HE1  TYR  65           HE1      TYR  65   5.818  -5.795  -5.795
  506    HE2  TYR  65           HE2      TYR  65   1.910  -4.642  -4.642
  507    HH   TYR  65           HH       TYR  65   3.609  -5.700  -5.700
  508    H    GLU  66           HN       GLU  66   8.309  -3.585  -3.585
  509    HA   GLU  66           HA       GLU  66   8.610  -6.256  -6.256
  510   1HB   GLU  66           HB1      GLU  66  10.884  -4.343  -4.343
  511   2HB   GLU  66           HB2      GLU  66  10.907  -5.747  -5.747
  512   1HG   GLU  66           HG1      GLU  66   8.797  -4.510  -4.510
  513   2HG   GLU  66           HG2      GLU  66   9.535  -3.114  -3.114
  514    H    LYS  67           HN       LYS  67   9.495  -4.796  -4.796
  515    HA   LYS  67           HA       LYS  67  11.253  -7.015  -7.015
  516   1HB   LYS  67           HB1      LYS  67  10.548  -4.346  -4.346
  517   2HB   LYS  67           HB2      LYS  67  11.098  -5.587  -5.587
  518   1HG   LYS  67           HG1      LYS  67  13.013  -4.406  -4.406
  519   2HG   LYS  67           HG2      LYS  67  13.044  -5.989  -5.989
  520   1HD   LYS  67           HD1      LYS  67  12.133  -4.893  -4.893
  521   2HD   LYS  67           HD2      LYS  67  12.288  -3.340  -3.340
  522   1HE   LYS  67           HE1      LYS  67  14.250  -3.744  -3.744
  523   2HE   LYS  67           HE2      LYS  67  14.733  -3.715  -3.715
  524   1HZ   LYS  67           HZ1      LYS  67  14.021  -6.337  -6.337
  525   2HZ   LYS  67           HZ2      LYS  67  15.104  -5.742  -5.742
  526   3HZ   LYS  67           HZ3      LYS  67  15.535  -5.736  -5.736
  527    H    ASP  68           HN       ASP  68   8.113  -6.322  -6.322
  528    HA   ASP  68           HA       ASP  68   7.464  -7.978  -7.978
  529   1HB   ASP  68           HB1      ASP  68   5.727  -6.491  -6.491
  530   2HB   ASP  68           HB2      ASP  68   5.105  -7.444  -7.444
  531    H    ILE  69           HN       ILE  69   7.528  -7.944  -7.944
  532    HA   ILE  69           HA       ILE  69   6.118 -10.518 -10.518
  533    HB   ILE  69           HB       ILE  69   5.854  -9.041  -9.041
  534   1HG1  ILE  69          HG11      ILE  69   6.600 -10.408 -10.408
  535   2HG1  ILE  69          HG12      ILE  69   7.907 -11.091 -11.091
  536   1HG2  ILE  69          HG21      ILE  69   7.827  -7.722  -7.722
  537   2HG2  ILE  69          HG22      ILE  69   8.850  -9.011  -9.011
  538   3HG2  ILE  69          HG23      ILE  69   7.662  -8.242  -8.242
  539   1HD1  ILE  69          HD11      ILE  69   4.954 -11.485 -11.485
  540   2HD1  ILE  69          HD12      ILE  69   6.015 -12.676 -12.676
  541   3HD1  ILE  69          HD13      ILE  69   6.260 -12.197 -12.197
  542    H    ALA  70           HN       ALA  70   9.282  -9.190  -9.190
  543    HA   ALA  70           HA       ALA  70  10.805 -11.519 -11.519
  544   1HB   ALA  70           HB1      ALA  70  11.587  -9.094  -9.094
  545   2HB   ALA  70           HB2      ALA  70  12.725 -10.267 -10.267
  546   3HB   ALA  70           HB3      ALA  70  11.809  -9.248  -9.248
  547    H    ALA  71           HN       ALA  71   9.405 -10.251 -10.251
  548    HA   ALA  71           HA       ALA  71  10.721 -12.170 -12.170
  549   1HB   ALA  71           HB1      ALA  71   8.406 -10.252 -10.252
  550   2HB   ALA  71           HB2      ALA  71   9.240 -11.166 -11.166
  551   3HB   ALA  71           HB3      ALA  71  10.101  -9.930  -9.930
  552    H    TYR  72           HN       TYR  72   7.610 -11.670 -11.670
  553    HA   TYR  72           HA       TYR  72   6.112 -13.764 -13.764
  554   1HB   TYR  72           HB1      TYR  72   5.094 -11.991 -11.991
  555   2HB   TYR  72           HB2      TYR  72   5.995 -12.448 -12.448
  556    HD1  TYR  72           HD1      TYR  72   4.377 -15.032 -15.032
  557    HD2  TYR  72           HD2      TYR  72   4.031 -12.563 -12.563
  558    HE1  TYR  72           HE1      TYR  72   2.505 -16.396 -16.396
  559    HE2  TYR  72           HE2      TYR  72   2.164 -13.927 -13.927
  560    HH   TYR  72           HH       TYR  72   1.454 -16.515 -16.515
  561    H    ARG  73           HN       ARG  73   8.050 -13.745 -13.745
  562    HA   ARG  73           HA       ARG  73   7.527 -16.500 -16.500
  563   1HB   ARG  73           HB1      ARG  73   9.034 -16.110 -16.110
  564   2HB   ARG  73           HB2      ARG  73   8.124 -14.627 -14.627
  565   1HG   ARG  73           HG1      ARG  73  10.042 -13.663 -13.663
  566   2HG   ARG  73           HG2      ARG  73  10.983 -15.100 -15.100
  567   1HD   ARG  73           HD1      ARG  73   9.813 -13.186 -13.186
  568   2HD   ARG  73           HD2      ARG  73  11.516 -13.365 -13.365
  569    HE   ARG  73           HE       ARG  73   9.919 -15.598 -15.598
  570   1HH1  ARG  73          HH11      ARG  73  12.765 -15.938 -15.938
  571   2HH1  ARG  73          HH12      ARG  73  13.669 -15.835 -15.835
  572   1HH2  ARG  73          HH21      ARG  73  10.986 -14.452 -14.452
  573   2HH2  ARG  73          HH22      ARG  73  12.633 -14.970 -14.970
  574    H    ALA  74           HN       ALA  74   9.810 -14.706 -14.706
  575    HA   ALA  74           HA       ALA  74  11.854 -16.705 -16.705
  576   1HB   ALA  74           HB1      ALA  74  11.084 -14.492 -14.492
  577   2HB   ALA  74           HB2      ALA  74  12.586 -15.398 -15.398
  578   3HB   ALA  74           HB3      ALA  74  12.229 -14.353 -14.353
  579    H    LYS  75           HN       LYS  75   8.729 -16.667 -16.667
  580    HA   LYS  75           HA       LYS  75   7.388 -18.201 -18.201
  581   1HB   LYS  75           HB1      LYS  75   9.582 -19.781 -19.781
  582   2HB   LYS  75           HB2      LYS  75   9.729 -19.584 -19.584
  583   1HG   LYS  75           HG1      LYS  75   8.345 -21.391 -21.391
  584   2HG   LYS  75           HG2      LYS  75   7.071 -20.215 -20.215
  585   1HD   LYS  75           HD1      LYS  75   8.416 -21.833 -21.833
  586   2HD   LYS  75           HD2      LYS  75   6.804 -22.093 -22.093
  587   1HE   LYS  75           HE1      LYS  75   7.712 -19.579 -19.579
  588   2HE   LYS  75           HE2      LYS  75   6.764 -20.880 -20.880
  589   1HZ   LYS  75           HZ1      LYS  75   5.514 -20.064 -20.064
  590   2HZ   LYS  75           HZ2      LYS  75   5.869 -18.676 -18.676
  591   3HZ   LYS  75           HZ3      LYS  75   4.960 -19.934 -19.934
  592    H    GLY  76           HN       GLY  76   8.676 -15.683 -15.683
  593   1HA   GLY  76           HA1      GLY  76   8.142 -14.449 -14.449
  594   2HA   GLY  76           HA2      GLY  76   7.624 -15.939 -15.939
  595    H    LYS  77           HN       LYS  77  10.545 -14.909 -14.909
  596    HA   LYS  77           HA       LYS  77  12.822 -14.976 -14.976
  597   1HB   LYS  77           HB1      LYS  77  11.711 -14.634 -14.634
  598   2HB   LYS  77           HB2      LYS  77  13.324 -14.211 -14.211
  599   1HG   LYS  77           HG1      LYS  77  12.379 -12.582 -12.582
  600   2HG   LYS  77           HG2      LYS  77  10.770 -12.950 -12.950
  601   1HD   LYS  77           HD1      LYS  77  11.363 -12.193 -12.193
  602   2HD   LYS  77           HD2      LYS  77  13.017 -11.886 -11.886
  603   1HE   LYS  77           HE1      LYS  77  10.573 -10.482 -10.482
  604   2HE   LYS  77           HE2      LYS  77  11.650  -9.795  -9.795
  605   1HZ   LYS  77           HZ1      LYS  77  13.209 -10.754 -10.754
  606   2HZ   LYS  77           HZ2      LYS  77  11.950  -9.833  -9.833
  607   3HZ   LYS  77           HZ3      LYS  77  12.975  -9.147  -9.147
  608    HA   PRO  78           HA       PRO  78  13.807 -19.087 -19.087
  609   1HB   PRO  78           HB1      PRO  78  15.938 -18.162 -18.162
  610   2HB   PRO  78           HB2      PRO  78  16.101 -19.162 -19.162
  611   1HG   PRO  78           HG1      PRO  78  16.960 -16.599 -16.599
  612   2HG   PRO  78           HG2      PRO  78  16.105 -17.249 -17.249
  613   1HD   PRO  78           HD1      PRO  78  14.908 -15.641 -15.641
  614   2HD   PRO  78           HD2      PRO  78  14.804 -15.284 -15.284
  615    H    ASP  79           HN       ASP  79  11.820 -17.548 -17.548
  616    HA   ASP  79           HA       ASP  79  11.458 -19.464 -19.464
  617   1HB   ASP  79           HB1      ASP  79  13.049 -17.882 -17.882
  618   2HB   ASP  79           HB2      ASP  79  11.999 -16.529 -16.529
  619    H    ALA  80           HN       ALA  80   9.424 -19.891 -19.891
  620    HA   ALA  80           HA       ALA  80   7.635 -17.814 -17.814
  621   1HB   ALA  80           HB1      ALA  80   7.474 -20.206 -20.206
  622   2HB   ALA  80           HB2      ALA  80   7.009 -20.679 -20.679
  623   3HB   ALA  80           HB3      ALA  80   5.952 -19.649 -19.649
  624    H    ALA  81           HN       ALA  81   7.534 -19.920 -19.920
  625    HA   ALA  81           HA       ALA  81   6.240 -17.709 -17.709
  626   1HB   ALA  81           HB1      ALA  81   5.592 -20.692 -20.692
  627   2HB   ALA  81           HB2      ALA  81   4.907 -19.499 -19.499
  628   3HB   ALA  81           HB3      ALA  81   4.563 -19.414 -19.414
  629   1H1   BME  16           HE1      MER  16  -7.562   9.019   9.019
  630   2H1   BME  16           HE2      MER  16  -7.569   8.869   8.869
  631   1H2   BME  16           HZ1      MER  16  -6.068  10.715  10.715
  632   2H2   BME  16           HZ2      MER  16  -7.372  11.321  11.321
  633    HO1  BME  16           HH       MER  16  -9.589   9.484   9.484

  Start of MODEL   47
    1    H    ASN   3           HN       ASN   3  -3.163 -10.873 -10.873
    2    HA   ASN   3           HA       ASN   3  -2.590 -11.605 -11.605
    3   1HB   ASN   3           HB1      ASN   3  -5.614 -11.953 -11.953
    4   2HB   ASN   3           HB2      ASN   3  -4.385 -12.580 -12.580
    5   1HD2  ASN   3          HD21      ASN   3  -4.488 -14.229 -14.229
    6   2HD2  ASN   3          HD22      ASN   3  -4.701 -12.560 -12.560
    7    H    ALA   4           HN       ALA   4  -1.803 -10.443 -10.443
    8    HA   ALA   4           HA       ALA   4  -1.521  -9.041  -9.041
    9   1HB   ALA   4           HB1      ALA   4  -3.665  -9.854  -9.854
   10   2HB   ALA   4           HB2      ALA   4  -4.581  -8.712  -8.712
   11   3HB   ALA   4           HB3      ALA   4  -3.546  -8.131  -8.131
   12    HA   PRO   5           HA       PRO   5  -0.196  -5.705  -5.705
   13   1HB   PRO   5           HB1      PRO   5  -0.320  -3.733  -3.733
   14   2HB   PRO   5           HB2      PRO   5   0.971  -4.909  -4.909
   15   1HG   PRO   5           HG1      PRO   5  -1.517  -5.129  -5.129
   16   2HG   PRO   5           HG2      PRO   5   0.133  -5.534  -5.534
   17   1HD   PRO   5           HD1      PRO   5  -1.473  -7.588  -7.588
   18   2HD   PRO   5           HD2      PRO   5   0.098  -7.555  -7.555
   19    H    LYS   6           HN       LYS   6  -0.745  -4.426  -4.426
   20    HA   LYS   6           HA       LYS   6  -3.413  -3.129  -3.129
   21   1HB   LYS   6           HB1      LYS   6  -2.461  -4.875  -4.875
   22   2HB   LYS   6           HB2      LYS   6  -2.009  -3.372  -3.372
   23   1HG   LYS   6           HG1      LYS   6  -4.564  -2.722  -2.722
   24   2HG   LYS   6           HG2      LYS   6  -4.736  -4.459  -4.459
   25   1HD   LYS   6           HD1      LYS   6  -5.303  -4.158  -4.158
   26   2HD   LYS   6           HD2      LYS   6  -3.571  -4.213  -4.213
   27   1HE   LYS   6           HE1      LYS   6  -5.180  -1.653  -1.653
   28   2HE   LYS   6           HE2      LYS   6  -4.655  -2.232  -2.232
   29   1HZ   LYS   6           HZ1      LYS   6  -2.424  -2.144  -2.144
   30   2HZ   LYS   6           HZ2      LYS   6  -3.260  -0.680  -0.680
   31   3HZ   LYS   6           HZ3      LYS   6  -2.756  -1.201  -1.201
   32    H    ARG   7           HN       ARG   7  -1.318  -1.990  -1.990
   33    HA   ARG   7           HA       ARG   7   0.395  -0.199  -0.199
   34   1HB   ARG   7           HB1      ARG   7  -0.879   1.593   1.593
   35   2HB   ARG   7           HB2      ARG   7  -0.529   0.059   0.059
   36   1HG   ARG   7           HG1      ARG   7  -3.219   0.504   0.504
   37   2HG   ARG   7           HG2      ARG   7  -2.931   1.065   1.065
   38   1HD   ARG   7           HD1      ARG   7  -2.115  -1.391  -1.391
   39   2HD   ARG   7           HD2      ARG   7  -2.918  -1.804  -1.804
   40    HE   ARG   7           HE       ARG   7  -5.038  -1.015  -1.015
   41   1HH1  ARG   7          HH11      ARG   7  -4.411   0.649   0.649
   42   2HH1  ARG   7          HH12      ARG   7  -4.433  -0.367  -0.367
   43   1HH2  ARG   7          HH21      ARG   7  -4.166  -3.310  -3.310
   44   2HH2  ARG   7          HH22      ARG   7  -4.289  -2.675  -2.675
   45    HA   PRO   8           HA       PRO   8  -1.322   2.058   2.058
   46   1HB   PRO   8           HB1      PRO   8   0.807   1.608   1.608
   47   2HB   PRO   8           HB2      PRO   8  -0.456   0.414   0.414
   48   1HG   PRO   8           HG1      PRO   8   2.379   0.565   0.565
   49   2HG   PRO   8           HG2      PRO   8   1.393  -0.852  -0.852
   50   1HD   PRO   8           HD1      PRO   8   1.831   0.321   0.321
   51   2HD   PRO   8           HD2      PRO   8   0.698  -0.986  -0.986
   52    HA   PRO   9           HA       PRO   9  -0.433   6.191   6.191
   53   1HB   PRO   9           HB1      PRO   9   2.249   5.676   5.676
   54   2HB   PRO   9           HB2      PRO   9   1.214   7.087   7.087
   55   1HG   PRO   9           HG1      PRO   9   1.038   4.814   4.814
   56   2HG   PRO   9           HG2      PRO   9  -0.313   5.914   5.914
   57   1HD   PRO   9           HD1      PRO   9  -0.199   3.165   3.165
   58   2HD   PRO   9           HD2      PRO   9  -1.437   4.325   4.325
   59    H    SER  10           HN       SER  10  -0.212   7.311   7.311
   60    HA   SER  10           HA       SER  10   1.918   6.696   6.696
   61   1HB   SER  10           HB1      SER  10  -0.484   6.531   6.531
   62   2HB   SER  10           HB2      SER  10  -0.674   8.258   8.258
   63    HG   SER  10           HG       SER  10   0.350   7.047   7.047
   64    H    ALA  11           HN       ALA  11   1.876   8.766   8.766
   65    HA   ALA  11           HA       ALA  11   3.561  10.463  10.463
   66   1HB   ALA  11           HB1      ALA  11   4.321  10.482  10.482
   67   2HB   ALA  11           HB2      ALA  11   2.879  11.423  11.423
   68   3HB   ALA  11           HB3      ALA  11   4.120  12.084  12.084
   69    H    PHE  12           HN       PHE  12   0.879  10.861  10.861
   70    HA   PHE  12           HA       PHE  12  -0.300  13.283  13.283
   71   1HB   PHE  12           HB1      PHE  12  -0.868  12.369  12.369
   72   2HB   PHE  12           HB2      PHE  12  -1.210  10.768  10.768
   73    HD1  PHE  12           HD1      PHE  12  -2.377  14.305  14.305
   74    HD2  PHE  12           HD2      PHE  12  -3.441  10.191  10.191
   75    HE1  PHE  12           HE1      PHE  12  -4.743  14.922  14.922
   76    HE2  PHE  12           HE2      PHE  12  -5.802  10.802  10.802
   77    HZ   PHE  12           HZ       PHE  12  -6.460  13.176  13.176
   78    H    PHE  13           HN       PHE  13  -0.046  10.261  10.261
   79    HA   PHE  13           HA       PHE  13  -2.520  10.361  10.361
   80   1HB   PHE  13           HB1      PHE  13  -1.047   8.311   8.311
   81   2HB   PHE  13           HB2      PHE  13  -0.106   8.745   8.745
   82    HD1  PHE  13           HD1      PHE  13  -1.610   9.212   9.212
   83    HD2  PHE  13           HD2      PHE  13  -2.863   6.886   6.886
   84    HE1  PHE  13           HE1      PHE  13  -3.315   8.126   8.126
   85    HE2  PHE  13           HE2      PHE  13  -4.568   5.802   5.802
   86    HZ   PHE  13           HZ       PHE  13  -4.797   6.421   6.421
   87    H    LEU  14           HN       LEU  14   0.916  10.779  10.779
   88    HA   LEU  14           HA       LEU  14   0.642  11.559  11.559
   89   1HB   LEU  14           HB1      LEU  14   2.497  12.898  12.898
   90   2HB   LEU  14           HB2      LEU  14   2.727  12.878  12.878
   91    HG   LEU  14           HG       LEU  14   4.288  11.368  11.368
   92   1HD1  LEU  14          HD11      LEU  14   3.030  10.220  10.220
   93   2HD1  LEU  14          HD12      LEU  14   1.940   9.516   9.516
   94   3HD1  LEU  14          HD13      LEU  14   3.636   9.063   9.063
   95   1HD2  LEU  14          HD21      LEU  14   3.795  11.309  11.309
   96   2HD2  LEU  14          HD22      LEU  14   4.085   9.679   9.679
   97   3HD2  LEU  14          HD23      LEU  14   2.452  10.203  10.203
   98    H    PHE  15           HN       PHE  15   0.567  13.496  13.496
   99    HA   PHE  15           HA       PHE  15  -0.139  16.024  16.024
  100   1HB   PHE  15           HB1      PHE  15   0.890  15.972  15.972
  101   2HB   PHE  15           HB2      PHE  15  -0.106  14.603  14.603
  102    HD1  PHE  15           HD1      PHE  15  -0.325  18.319  18.319
  103    HD2  PHE  15           HD2      PHE  15  -1.852  14.878  14.878
  104    HE1  PHE  15           HE1      PHE  15  -1.821  19.737  19.737
  105    HE2  PHE  15           HE2      PHE  15  -3.319  16.287  16.287
  106    HZ   PHE  15           HZ       PHE  15  -3.317  18.711  18.711
  107    H    CYS  16           HN       MER  16  -2.288  13.656  13.656
  108    HA   CYS  16           HA       MER  16  -4.726  15.012  15.012
  109   1HB   CYS  16           HB1      MER  16  -5.875  12.943  12.943
  110   2HB   CYS  16           HB2      MER  16  -4.481  12.861  12.861
  111    H    SER  17           HN       SER  17  -3.056  12.830  12.830
  112    HA   SER  17           HA       SER  17  -5.019  12.694  12.694
  113   1HB   SER  17           HB1      SER  17  -1.962  12.700  12.700
  114   2HB   SER  17           HB2      SER  17  -3.128  12.041  12.041
  115    HG   SER  17           HG       SER  17  -2.188  10.958  10.958
  116    H    GLU  18           HN       GLU  18  -2.456  14.971  14.971
  117    HA   GLU  18           HA       GLU  18  -2.958  16.651  16.651
  118   1HB   GLU  18           HB1      GLU  18  -0.759  16.409  16.409
  119   2HB   GLU  18           HB2      GLU  18  -1.453  17.225  17.225
  120   1HG   GLU  18           HG1      GLU  18  -1.815  19.269  19.269
  121   2HG   GLU  18           HG2      GLU  18  -1.259  18.490  18.490
  122    H    TYR  19           HN       TYR  19  -4.601  16.269  16.269
  123    HA   TYR  19           HA       TYR  19  -5.578  19.060  19.060
  124   1HB   TYR  19           HB1      TYR  19  -5.378  16.779  16.779
  125   2HB   TYR  19           HB2      TYR  19  -6.916  17.672  17.672
  126    HD1  TYR  19           HD1      TYR  19  -3.337  18.510  18.510
  127    HD2  TYR  19           HD2      TYR  19  -6.886  19.357  19.357
  128    HE1  TYR  19           HE1      TYR  19  -2.172  20.305  20.305
  129    HE2  TYR  19           HE2      TYR  19  -5.733  21.151  21.151
  130    HH   TYR  19           HH       TYR  19  -3.472  21.822  21.822
  131    H    ARG  20           HN       ARG  20  -6.865  15.871  15.871
  132    HA   ARG  20           HA       ARG  20  -9.462  15.834  15.834
  133   1HB   ARG  20           HB1      ARG  20  -7.673  15.041  15.041
  134   2HB   ARG  20           HB2      ARG  20  -9.403  14.771  14.771
  135   1HG   ARG  20           HG1      ARG  20  -9.175  13.539  13.539
  136   2HG   ARG  20           HG2      ARG  20  -7.437  13.642  13.642
  137   1HD   ARG  20           HD1      ARG  20  -9.416  12.369  12.369
  138   2HD   ARG  20           HD2      ARG  20  -8.297  11.497  11.497
  139    HE   ARG  20           HE       ARG  20  -7.304  13.453  13.453
  140   1HH1  ARG  20          HH11      ARG  20  -6.598  10.727  10.727
  141   2HH1  ARG  20          HH12      ARG  20  -5.620   9.964   9.964
  142   1HH2  ARG  20          HH21      ARG  20  -6.401  12.334  12.334
  143   2HH2  ARG  20          HH22      ARG  20  -5.500  10.892  10.892
  144    HA   PRO  21           HA       PRO  21 -10.851  18.031  18.031
  145   1HB   PRO  21           HB1      PRO  21  -9.196  19.351  19.351
  146   2HB   PRO  21           HB2      PRO  21  -9.246  17.573  17.573
  147   1HG   PRO  21           HG1      PRO  21  -7.350  19.379  19.379
  148   2HG   PRO  21           HG2      PRO  21  -6.892  18.170  18.170
  149   1HD   PRO  21           HD1      PRO  21  -6.995  17.418  17.418
  150   2HD   PRO  21           HD2      PRO  21  -7.750  16.361  16.361
  151    H    LYS  22           HN       LYS  22  -8.718  19.647  19.647
  152    HA   LYS  22           HA       LYS  22  -9.917  22.329  22.329
  153   1HB   LYS  22           HB1      LYS  22  -7.386  21.884  21.884
  154   2HB   LYS  22           HB2      LYS  22  -7.569  21.451  21.451
  155   1HG   LYS  22           HG1      LYS  22  -8.632  23.790  23.790
  156   2HG   LYS  22           HG2      LYS  22  -8.068  24.119  24.119
  157   1HD   LYS  22           HD1      LYS  22  -5.731  23.398  23.398
  158   2HD   LYS  22           HD2      LYS  22  -6.359  23.429  23.429
  159   1HE   LYS  22           HE1      LYS  22  -6.239  25.790  25.790
  160   2HE   LYS  22           HE2      LYS  22  -5.293  25.574  25.574
  161   1HZ   LYS  22           HZ1      LYS  22  -7.988  25.332  25.332
  162   2HZ   LYS  22           HZ2      LYS  22  -7.807  26.729  26.729
  163   3HZ   LYS  22           HZ3      LYS  22  -6.883  26.532  26.532
  164    H    ILE  23           HN       ILE  23  -9.848  19.575  19.575
  165    HA   ILE  23           HA       ILE  23 -10.849  20.917  20.917
  166    HB   ILE  23           HB       ILE  23  -9.530  18.470  18.470
  167   1HG1  ILE  23          HG11      ILE  23  -9.035  19.831  19.831
  168   2HG1  ILE  23          HG12      ILE  23  -9.173  18.126  18.126
  169   1HG2  ILE  23          HG21      ILE  23 -12.166  17.778  17.778
  170   2HG2  ILE  23          HG22      ILE  23 -10.775  16.715  16.715
  171   3HG2  ILE  23          HG23      ILE  23 -11.624  17.314  17.314
  172   1HD1  ILE  23          HD11      ILE  23 -11.379  20.179  20.179
  173   2HD1  ILE  23          HD12      ILE  23 -10.362  19.514  19.514
  174   3HD1  ILE  23          HD13      ILE  23 -11.496  18.479  18.479
  175    H    LYS  24           HN       LYS  24 -11.768  18.883  18.883
  176    HA   LYS  24           HA       LYS  24 -14.514  18.451  18.451
  177   1HB   LYS  24           HB1      LYS  24 -12.820  17.186  17.186
  178   2HB   LYS  24           HB2      LYS  24 -12.848  18.499  18.499
  179   1HG   LYS  24           HG1      LYS  24 -14.496  17.304  17.304
  180   2HG   LYS  24           HG2      LYS  24 -15.563  17.948  17.948
  181   1HD   LYS  24           HD1      LYS  24 -14.114  15.259  15.259
  182   2HD   LYS  24           HD2      LYS  24 -15.829  15.507  15.507
  183   1HE   LYS  24           HE1      LYS  24 -14.309  16.251  16.251
  184   2HE   LYS  24           HE2      LYS  24 -15.322  14.838  14.838
  185   1HZ   LYS  24           HZ1      LYS  24 -16.803  17.054  17.054
  186   2HZ   LYS  24           HZ2      LYS  24 -16.100  17.429  17.429
  187   3HZ   LYS  24           HZ3      LYS  24 -17.063  16.039  16.039
  188    H    GLY  25           HN       GLY  25 -12.671  20.724  20.724
  189   1HA   GLY  25           HA1      GLY  25 -14.760  22.072  22.072
  190   2HA   GLY  25           HA2      GLY  25 -13.161  22.735  22.735
  191    H    GLU  26           HN       GLU  26 -13.277  22.603  22.603
  192    HA   GLU  26           HA       GLU  26 -14.764  25.014  25.014
  193   1HB   GLU  26           HB1      GLU  26 -12.921  23.275  23.275
  194   2HB   GLU  26           HB2      GLU  26 -13.526  24.827  24.827
  195   1HG   GLU  26           HG1      GLU  26 -12.033  24.450  24.450
  196   2HG   GLU  26           HG2      GLU  26 -11.181  24.787  24.787
  197    H    HIS  27           HN       HIS  27 -14.734  21.746  21.746
  198    HA   HIS  27           HA       HIS  27 -17.421  22.170  22.170
  199   1HB   HIS  27           HB1      HIS  27 -15.369  20.246  20.246
  200   2HB   HIS  27           HB2      HIS  27 -16.707  21.044  21.044
  201    HD1  HIS  27           HD1      HIS  27 -16.247  23.752  23.752
  202    HD2  HIS  27           HD2      HIS  27 -12.971  21.474  21.474
  203    HE1  HIS  27           HE1      HIS  27 -14.279  25.142  25.142
  204    HA   PRO  28           HA       PRO  28 -17.951  18.445  18.445
  205   1HB   PRO  28           HB1      PRO  28 -19.806  19.348  19.348
  206   2HB   PRO  28           HB2      PRO  28 -18.107  19.769  19.769
  207   1HG   PRO  28           HG1      PRO  28 -20.262  21.437  21.437
  208   2HG   PRO  28           HG2      PRO  28 -19.193  21.943  21.943
  209   1HD   PRO  28           HD1      PRO  28 -18.553  22.416  22.416
  210   2HD   PRO  28           HD2      PRO  28 -17.292  22.128  22.128
  211    H    GLY  29           HN       GLY  29 -18.700  19.068  19.068
  212   1HA   GLY  29           HA1      GLY  29 -21.461  18.037  18.037
  213   2HA   GLY  29           HA2      GLY  29 -21.004  19.415  19.415
  214    H    LEU  30           HN       LEU  30 -18.275  17.544  17.544
  215    HA   LEU  30           HA       LEU  30 -18.942  16.305  16.305
  216   1HB   LEU  30           HB1      LEU  30 -16.301  16.008  16.008
  217   2HB   LEU  30           HB2      LEU  30 -17.030  17.525  17.525
  218    HG   LEU  30           HG       LEU  30 -16.653  18.426  18.426
  219   1HD1  LEU  30          HD11      LEU  30 -15.778  15.664  15.664
  220   2HD1  LEU  30          HD12      LEU  30 -15.448  17.142  17.142
  221   3HD1  LEU  30          HD13      LEU  30 -17.084  16.612  16.612
  222   1HD2  LEU  30          HD21      LEU  30 -14.189  17.046  17.046
  223   2HD2  LEU  30          HD22      LEU  30 -14.817  18.619  18.619
  224   3HD2  LEU  30          HD23      LEU  30 -14.154  18.350  18.350
  225    H    SER  31           HN       SER  31 -17.598  14.342  14.342
  226    HA   SER  31           HA       SER  31 -17.910  12.275  12.275
  227   1HB   SER  31           HB1      SER  31 -18.356  10.685  10.685
  228   2HB   SER  31           HB2      SER  31 -19.477  12.044  12.044
  229    HG   SER  31           HG       SER  31 -17.517  11.360  11.360
  230    H    ILE  32           HN       ILE  32 -16.622  10.245  10.245
  231    HA   ILE  32           HA       ILE  32 -13.864  10.910  10.910
  232    HB   ILE  32           HB       ILE  32 -14.945   8.862   8.862
  233   1HG1  ILE  32          HG11      ILE  32 -13.226   7.185   7.185
  234   2HG1  ILE  32          HG12      ILE  32 -12.785   8.087   8.087
  235   1HG2  ILE  32          HG21      ILE  32 -16.522   8.439   8.439
  236   2HG2  ILE  32          HG22      ILE  32 -15.206   8.064   8.064
  237   3HG2  ILE  32          HG23      ILE  32 -15.554   7.005   7.005
  238   1HD1  ILE  32          HD11      ILE  32 -12.391   9.033   9.033
  239   2HD1  ILE  32          HD12      ILE  32 -11.134   8.456   8.456
  240   3HD1  ILE  32          HD13      ILE  32 -11.955   9.966   9.966
  241    H    GLY  33           HN       GLY  33 -15.804  11.095  11.095
  242   1HA   GLY  33           HA1      GLY  33 -13.728  10.500  10.500
  243   2HA   GLY  33           HA2      GLY  33 -15.450  10.685  10.685
  244    H    ASP  34           HN       ASP  34 -15.061  13.036  13.036
  245    HA   ASP  34           HA       ASP  34 -14.416  15.051  15.051
  246   1HB   ASP  34           HB1      ASP  34 -16.190  14.936  14.936
  247   2HB   ASP  34           HB2      ASP  34 -15.771  16.523  16.523
  248    H    VAL  35           HN       VAL  35 -14.058  14.229  14.229
  249    HA   VAL  35           HA       VAL  35 -12.154  16.218  16.218
  250    HB   VAL  35           HB       VAL  35 -12.610  13.348  13.348
  251   1HG1  VAL  35          HG11      VAL  35 -11.042  15.606  15.606
  252   2HG1  VAL  35          HG12      VAL  35 -11.411  14.080  14.080
  253   3HG1  VAL  35          HG13      VAL  35 -10.361  14.112  14.112
  254   1HG2  VAL  35          HG21      VAL  35 -14.531  14.846  14.846
  255   2HG2  VAL  35          HG22      VAL  35 -13.837  14.338  14.338
  256   3HG2  VAL  35          HG23      VAL  35 -13.521  15.951  15.951
  257    H    ALA  36           HN       ALA  36 -12.044  13.146  13.146
  258    HA   ALA  36           HA       ALA  36  -9.172  12.952  12.952
  259   1HB   ALA  36           HB1      ALA  36 -10.611  10.974  10.974
  260   2HB   ALA  36           HB2      ALA  36 -11.373  11.379  11.379
  261   3HB   ALA  36           HB3      ALA  36  -9.689  10.859  10.859
  262    H    LYS  37           HN       LYS  37 -11.678  13.653  13.653
  263    HA   LYS  37           HA       LYS  37  -9.545  13.856  13.856
  264   1HB   LYS  37           HB1      LYS  37 -11.194  14.069  14.069
  265   2HB   LYS  37           HB2      LYS  37 -12.078  13.272  13.272
  266   1HG   LYS  37           HG1      LYS  37 -13.616  14.948  14.948
  267   2HG   LYS  37           HG2      LYS  37 -12.704  15.768  15.768
  268   1HD   LYS  37           HD1      LYS  37 -12.997  17.292  17.292
  269   2HD   LYS  37           HD2      LYS  37 -11.306  16.883  16.883
  270   1HE   LYS  37           HE1      LYS  37 -11.739  15.101  15.101
  271   2HE   LYS  37           HE2      LYS  37 -13.379  15.713  15.713
  272   1HZ   LYS  37           HZ1      LYS  37 -11.637  17.883  17.883
  273   2HZ   LYS  37           HZ2      LYS  37 -11.074  16.690  16.690
  274   3HZ   LYS  37           HZ3      LYS  37 -12.664  17.273  17.273
  275    H    LYS  38           HN       LYS  38 -11.018  16.092  16.092
  276    HA   LYS  38           HA       LYS  38 -10.141  18.461  18.461
  277   1HB   LYS  38           HB1      LYS  38 -12.245  18.366  18.366
  278   2HB   LYS  38           HB2      LYS  38 -11.264  18.059  18.059
  279   1HG   LYS  38           HG1      LYS  38 -10.257  20.213  20.213
  280   2HG   LYS  38           HG2      LYS  38 -10.906  20.555  20.555
  281   1HD   LYS  38           HD1      LYS  38 -13.227  20.465  20.465
  282   2HD   LYS  38           HD2      LYS  38 -12.559  20.137  20.137
  283   1HE   LYS  38           HE1      LYS  38 -11.912  22.635  22.635
  284   2HE   LYS  38           HE2      LYS  38 -13.128  22.577  22.577
  285   1HZ   LYS  38           HZ1      LYS  38 -10.767  21.481  21.481
  286   2HZ   LYS  38           HZ2      LYS  38 -10.385  22.960  22.960
  287   3HZ   LYS  38           HZ3      LYS  38 -11.567  22.900  22.900
  288    H    LEU  39           HN       LEU  39  -9.306  16.859  16.859
  289    HA   LEU  39           HA       LEU  39  -6.961  18.552  18.552
  290   1HB   LEU  39           HB1      LEU  39  -7.268  17.859  17.859
  291   2HB   LEU  39           HB2      LEU  39  -8.614  16.893  16.893
  292    HG   LEU  39           HG       LEU  39  -6.745  15.155  15.155
  293   1HD1  LEU  39          HD11      LEU  39  -5.009  16.840  16.840
  294   2HD1  LEU  39          HD12      LEU  39  -5.532  16.837  16.837
  295   3HD1  LEU  39          HD13      LEU  39  -4.817  15.377  15.377
  296   1HD2  LEU  39          HD21      LEU  39  -7.531  15.758  15.758
  297   2HD2  LEU  39          HD22      LEU  39  -8.487  14.785  14.785
  298   3HD2  LEU  39          HD23      LEU  39  -6.914  14.218  14.218
  299    H    GLY  40           HN       GLY  40  -7.674  15.533  15.533
  300   1HA   GLY  40           HA1      GLY  40  -4.978  14.521  14.521
  301   2HA   GLY  40           HA2      GLY  40  -6.289  14.078  14.078
  302    H    GLU  41           HN       GLU  41  -6.993  16.642  16.642
  303    HA   GLU  41           HA       GLU  41  -5.220  17.058  17.058
  304   1HB   GLU  41           HB1      GLU  41  -7.356  17.706  17.706
  305   2HB   GLU  41           HB2      GLU  41  -7.557  18.379  18.379
  306   1HG   GLU  41           HG1      GLU  41  -6.233  20.336  20.336
  307   2HG   GLU  41           HG2      GLU  41  -5.913  19.671  19.671
  308    H    MET  42           HN       MET  42  -5.822  18.954  18.954
  309    HA   MET  42           HA       MET  42  -3.931  20.946  20.946
  310   1HB   MET  42           HB1      MET  42  -4.694  19.408  19.408
  311   2HB   MET  42           HB2      MET  42  -3.736  20.887  20.887
  312   1HG   MET  42           HG1      MET  42  -5.716  21.815  21.815
  313   2HG   MET  42           HG2      MET  42  -6.579  20.460  20.460
  314   1HE   MET  42           HE1      MET  42  -8.596  21.612  21.612
  315   2HE   MET  42           HE2      MET  42  -8.020  20.369  20.369
  316   3HE   MET  42           HE3      MET  42  -8.615  21.907  21.907
  317    H    TRP  43           HN       TRP  43  -3.454  17.788  17.788
  318    HA   TRP  43           HA       TRP  43  -0.712  17.880  17.880
  319   1HB   TRP  43           HB1      TRP  43  -2.077  16.126  16.126
  320   2HB   TRP  43           HB2      TRP  43  -2.536  15.605  15.605
  321    HD1  TRP  43           HD1      TRP  43  -0.882  13.982  13.982
  322    HE1  TRP  43           HE1      TRP  43   1.305  13.050  13.050
  323    HE3  TRP  43           HE3      TRP  43  -0.150  16.674  16.674
  324    HZ2  TRP  43           HZ2      TRP  43   3.268  13.352  13.352
  325    HZ3  TRP  43           HZ3      TRP  43   1.822  16.356  16.356
  326    HH2  TRP  43           HH2      TRP  43   3.550  14.693  14.693
  327    H    ASN  44           HN       ASN  44  -2.347  16.758  16.758
  328    HA   ASN  44           HA       ASN  44  -0.029  16.129  16.129
  329   1HB   ASN  44           HB1      ASN  44  -2.704  17.176  17.176
  330   2HB   ASN  44           HB2      ASN  44  -1.447  16.380  16.380
  331   1HD2  ASN  44          HD21      ASN  44  -4.090  14.013  14.013
  332   2HD2  ASN  44          HD22      ASN  44  -4.346  15.613  15.613
  333    H    ASN  45           HN       ASN  45  -1.378  19.184  19.184
  334    HA   ASN  45           HA       ASN  45   0.806  20.561  20.561
  335   1HB   ASN  45           HB1      ASN  45  -0.816  22.383  22.383
  336   2HB   ASN  45           HB2      ASN  45  -1.381  20.860  20.860
  337   1HD2  ASN  45          HD21      ASN  45  -4.393  21.064  21.064
  338   2HD2  ASN  45          HD22      ASN  45  -3.585  20.406  20.406
  339    H    THR  46           HN       THR  46   0.968  19.841  19.841
  340    HA   THR  46           HA       THR  46   0.269  22.218  22.218
  341    HB   THR  46           HB       THR  46   0.488  19.909  19.909
  342    HG1  THR  46           HG1      THR  46   0.846  21.163  21.163
  343   1HG2  THR  46          HG21      THR  46   2.697  19.143  19.143
  344   2HG2  THR  46          HG22      THR  46   3.537  20.359  20.359
  345   3HG2  THR  46          HG23      THR  46   2.688  19.068  19.068
  346    H    ALA  47           HN       ALA  47   3.241  20.810  20.810
  347    HA   ALA  47           HA       ALA  47   4.468  23.293  23.293
  348   1HB   ALA  47           HB1      ALA  47   4.859  23.404  23.404
  349   2HB   ALA  47           HB2      ALA  47   5.674  21.849  21.849
  350   3HB   ALA  47           HB3      ALA  47   6.354  23.258  23.258
  351    H    ALA  48           HN       ALA  48   5.126  20.154  20.154
  352    HA   ALA  48           HA       ALA  48   5.707  18.156  18.156
  353   1HB   ALA  48           HB1      ALA  48   5.786  19.296  19.296
  354   2HB   ALA  48           HB2      ALA  48   7.367  19.951  19.951
  355   3HB   ALA  48           HB3      ALA  48   7.132  18.216  18.216
  356    H    ASP  49           HN       ASP  49   7.606  20.999  20.999
  357    HA   ASP  49           HA       ASP  49   9.922  19.540  19.540
  358   1HB   ASP  49           HB1      ASP  49  10.944  21.865  21.865
  359   2HB   ASP  49           HB2      ASP  49  10.320  21.372  21.372
  360    H    ASP  50           HN       ASP  50   7.137  20.011  20.011
  361    HA   ASP  50           HA       ASP  50   8.014  20.788  20.788
  362   1HB   ASP  50           HB1      ASP  50   6.469  22.516  22.516
  363   2HB   ASP  50           HB2      ASP  50   5.232  21.276  21.276
  364    H    LYS  51           HN       LYS  51   6.958  18.562  18.562
  365    HA   LYS  51           HA       LYS  51   5.300  16.910  16.910
  366   1HB   LYS  51           HB1      LYS  51   6.328  16.604  16.604
  367   2HB   LYS  51           HB2      LYS  51   5.425  15.337  15.337
  368   1HG   LYS  51           HG1      LYS  51   3.552  16.956  16.956
  369   2HG   LYS  51           HG2      LYS  51   4.509  18.183  18.183
  370   1HD   LYS  51           HD1      LYS  51   2.543  16.797  16.797
  371   2HD   LYS  51           HD2      LYS  51   3.856  17.543  17.543
  372   1HE   LYS  51           HE1      LYS  51   3.892  14.669  14.669
  373   2HE   LYS  51           HE2      LYS  51   3.362  15.166  15.166
  374   1HZ   LYS  51           HZ1      LYS  51   5.808  16.370  16.370
  375   2HZ   LYS  51           HZ2      LYS  51   5.965  14.754  14.754
  376   3HZ   LYS  51           HZ3      LYS  51   5.453  15.128  15.128
  377    H    GLN  52           HN       GLN  52   8.330  16.889  16.889
  378    HA   GLN  52           HA       GLN  52   9.653  14.695  14.695
  379   1HB   GLN  52           HB1      GLN  52  10.471  17.281  17.281
  380   2HB   GLN  52           HB2      GLN  52  11.179  17.051  17.051
  381   1HG   GLN  52           HG1      GLN  52  12.814  16.375  16.375
  382   2HG   GLN  52           HG2      GLN  52  12.269  14.942  14.942
  383   1HE2  GLN  52          HE21      GLN  52  10.143  14.840  14.840
  384   2HE2  GLN  52          HE22      GLN  52   9.736  15.827  15.827
  385    HA   PRO  53           HA       PRO  53  10.491  15.314  15.314
  386   1HB   PRO  53           HB1      PRO  53   8.367  16.740  16.740
  387   2HB   PRO  53           HB2      PRO  53   9.972  17.385  17.385
  388   1HG   PRO  53           HG1      PRO  53   7.513  17.476  17.476
  389   2HG   PRO  53           HG2      PRO  53   8.535  18.833  18.833
  390   1HD   PRO  53           HD1      PRO  53   9.055  17.767  17.767
  391   2HD   PRO  53           HD2      PRO  53  10.442  17.944  17.944
  392    H    TYR  54           HN       TYR  54   7.052  15.494  15.494
  393    HA   TYR  54           HA       TYR  54   6.191  13.359  13.359
  394   1HB   TYR  54           HB1      TYR  54   4.961  14.576  14.576
  395   2HB   TYR  54           HB2      TYR  54   4.146  13.338  13.338
  396    HD1  TYR  54           HD1      TYR  54   4.394  14.010  14.010
  397    HD2  TYR  54           HD2      TYR  54   4.184  16.730  16.730
  398    HE1  TYR  54           HE1      TYR  54   3.562  15.751  15.751
  399    HE2  TYR  54           HE2      TYR  54   3.353  18.473  18.473
  400    HH   TYR  54           HH       TYR  54   3.689  18.621  18.621
  401    H    GLU  55           HN       GLU  55   6.791  13.622  13.622
  402    HA   GLU  55           HA       GLU  55   6.379  11.052  11.052
  403   1HB   GLU  55           HB1      GLU  55   7.532  13.422  13.422
  404   2HB   GLU  55           HB2      GLU  55   8.856  12.281  12.281
  405   1HG   GLU  55           HG1      GLU  55   7.353  10.694  10.694
  406   2HG   GLU  55           HG2      GLU  55   6.062  11.883  11.883
  407    H    LYS  56           HN       LYS  56   9.570  12.154  12.154
  408    HA   LYS  56           HA       LYS  56  11.063   9.897   9.897
  409   1HB   LYS  56           HB1      LYS  56  10.924  12.039  12.039
  410   2HB   LYS  56           HB2      LYS  56  12.148  10.816  10.816
  411   1HG   LYS  56           HG1      LYS  56  12.033  12.011  12.011
  412   2HG   LYS  56           HG2      LYS  56  12.193  13.250  13.250
  413   1HD   LYS  56           HD1      LYS  56  14.407  12.621  12.621
  414   2HD   LYS  56           HD2      LYS  56  14.226  12.128  12.128
  415   1HE   LYS  56           HE1      LYS  56  13.687  10.179  10.179
  416   2HE   LYS  56           HE2      LYS  56  15.312  10.438  10.438
  417   1HZ   LYS  56           HZ1      LYS  56  13.652  10.035  10.035
  418   2HZ   LYS  56           HZ2      LYS  56  13.298   8.824   8.824
  419   3HZ   LYS  56           HZ3      LYS  56  14.888   9.042   9.042
  420    H    LYS  57           HN       LYS  57   8.661  10.527  10.527
  421    HA   LYS  57           HA       LYS  57   9.323   8.171   8.171
  422   1HB   LYS  57           HB1      LYS  57   6.901  10.026  10.026
  423   2HB   LYS  57           HB2      LYS  57   7.024   8.677   8.677
  424   1HG   LYS  57           HG1      LYS  57   9.111   9.592   9.592
  425   2HG   LYS  57           HG2      LYS  57   9.090  10.911  10.911
  426   1HD   LYS  57           HD1      LYS  57   7.123  11.885  11.885
  427   2HD   LYS  57           HD2      LYS  57   6.772  10.447  10.447
  428   1HE   LYS  57           HE1      LYS  57   7.755  12.236  12.236
  429   2HE   LYS  57           HE2      LYS  57   8.829  10.847  10.847
  430   1HZ   LYS  57           HZ1      LYS  57   9.487  12.557  12.557
  431   2HZ   LYS  57           HZ2      LYS  57   9.380  13.482  13.482
  432   3HZ   LYS  57           HZ3      LYS  57  10.408  12.137  12.137
  433    H    ALA  58           HN       ALA  58   6.595   9.019   9.019
  434    HA   ALA  58           HA       ALA  58   5.273   6.558   6.558
  435   1HB   ALA  58           HB1      ALA  58   5.641   8.493   8.493
  436   2HB   ALA  58           HB2      ALA  58   4.397   7.256   7.256
  437   3HB   ALA  58           HB3      ALA  58   4.389   8.592   8.592
  438    H    ALA  59           HN       ALA  59   7.933   7.622   7.622
  439    HA   ALA  59           HA       ALA  59   8.188   5.402   5.402
  440   1HB   ALA  59           HB1      ALA  59   9.550   7.492   7.492
  441   2HB   ALA  59           HB2      ALA  59  10.420   7.095   7.095
  442   3HB   ALA  59           HB3      ALA  59  10.604   6.086   6.086
  443    H    LYS  60           HN       LYS  60  10.158   5.875   5.875
  444    HA   LYS  60           HA       LYS  60  11.381   3.445   3.445
  445   1HB   LYS  60           HB1      LYS  60  11.803   5.401   5.401
  446   2HB   LYS  60           HB2      LYS  60  10.262   5.208   5.208
  447   1HG   LYS  60           HG1      LYS  60  10.972   3.208   3.208
  448   2HG   LYS  60           HG2      LYS  60  12.358   3.012   3.012
  449   1HD   LYS  60           HD1      LYS  60  13.011   3.838   3.838
  450   2HD   LYS  60           HD2      LYS  60  13.459   4.969   4.969
  451   1HE   LYS  60           HE1      LYS  60  10.892   5.262   5.262
  452   2HE   LYS  60           HE2      LYS  60  12.412   5.986   5.986
  453   1HZ   LYS  60           HZ1      LYS  60  11.998   6.638   6.638
  454   2HZ   LYS  60           HZ2      LYS  60  10.554   6.950   6.950
  455   3HZ   LYS  60           HZ3      LYS  60  12.009   7.660   7.660
  456    H    LEU  61           HN       LEU  61   8.167   4.099   4.099
  457    HA   LEU  61           HA       LEU  61   7.978   1.322   1.322
  458   1HB   LEU  61           HB1      LEU  61   5.709   2.002   2.002
  459   2HB   LEU  61           HB2      LEU  61   6.962   3.103   3.103
  460    HG   LEU  61           HG       LEU  61   6.311   4.366   4.366
  461   1HD1  LEU  61          HD11      LEU  61   4.540   2.691   2.691
  462   2HD1  LEU  61          HD12      LEU  61   3.713   3.016   3.016
  463   3HD1  LEU  61          HD13      LEU  61   3.878   4.278   4.278
  464   1HD2  LEU  61          HD21      LEU  61   4.795   4.567   4.567
  465   2HD2  LEU  61          HD22      LEU  61   6.330   5.332   5.332
  466   3HD2  LEU  61          HD23      LEU  61   4.879   5.813   5.813
  467    H    LYS  62           HN       LYS  62   6.583   3.132   3.132
  468    HA   LYS  62           HA       LYS  62   4.837   1.127   1.127
  469   1HB   LYS  62           HB1      LYS  62   4.891   3.448   3.448
  470   2HB   LYS  62           HB2      LYS  62   6.506   3.187   3.187
  471   1HG   LYS  62           HG1      LYS  62   5.663   1.437   1.437
  472   2HG   LYS  62           HG2      LYS  62   4.071   1.533   1.533
  473   1HD   LYS  62           HD1      LYS  62   3.810   3.848   3.848
  474   2HD   LYS  62           HD2      LYS  62   5.447   3.831   3.831
  475   1HE   LYS  62           HE1      LYS  62   3.738   3.346   3.346
  476   2HE   LYS  62           HE2      LYS  62   4.839   1.993   1.993
  477   1HZ   LYS  62           HZ1      LYS  62   2.698   1.712   1.712
  478   2HZ   LYS  62           HZ2      LYS  62   2.066   2.008   2.008
  479   3HZ   LYS  62           HZ3      LYS  62   3.139   0.712   0.712
  480    H    GLU  63           HN       GLU  63   8.165   1.854   1.854
  481    HA   GLU  63           HA       GLU  63   8.997  -0.060  -0.060
  482   1HB   GLU  63           HB1      GLU  63  10.453   1.757   1.757
  483   2HB   GLU  63           HB2      GLU  63  10.367   1.293   1.293
  484   1HG   GLU  63           HG1      GLU  63  11.730  -0.385  -0.385
  485   2HG   GLU  63           HG2      GLU  63  12.559   0.770   0.770
  486    H    LYS  64           HN       LYS  64   8.680  -0.325  -0.325
  487    HA   LYS  64           HA       LYS  64   9.590  -3.062  -3.062
  488   1HB   LYS  64           HB1      LYS  64   7.710  -1.570  -1.570
  489   2HB   LYS  64           HB2      LYS  64   8.286  -3.201  -3.201
  490   1HG   LYS  64           HG1      LYS  64  10.680  -2.165  -2.165
  491   2HG   LYS  64           HG2      LYS  64   9.881  -0.633  -0.633
  492   1HD   LYS  64           HD1      LYS  64   9.123  -1.484  -1.484
  493   2HD   LYS  64           HD2      LYS  64   9.917  -3.017  -3.017
  494   1HE   LYS  64           HE1      LYS  64  12.105  -1.752  -1.752
  495   2HE   LYS  64           HE2      LYS  64  11.266  -0.305  -0.305
  496   1HZ   LYS  64           HZ1      LYS  64  10.697  -2.375  -2.375
  497   2HZ   LYS  64           HZ2      LYS  64  12.373  -2.346  -2.346
  498   3HZ   LYS  64           HZ3      LYS  64  11.571  -0.948  -0.948
  499    H    TYR  65           HN       TYR  65   6.278  -1.807  -1.807
  500    HA   TYR  65           HA       TYR  65   4.936  -4.285  -4.285
  501   1HB   TYR  65           HB1      TYR  65   3.774  -1.996  -1.996
  502   2HB   TYR  65           HB2      TYR  65   4.105  -2.130  -2.130
  503    HD1  TYR  65           HD1      TYR  65   3.413  -4.449  -4.449
  504    HD2  TYR  65           HD2      TYR  65   1.816  -3.068  -3.068
  505    HE1  TYR  65           HE1      TYR  65   1.461  -5.887  -5.887
  506    HE2  TYR  65           HE2      TYR  65  -0.125  -4.495  -4.495
  507    HH   TYR  65           HH       TYR  65  -0.860  -6.025  -6.025
  508    H    GLU  66           HN       GLU  66   6.269  -2.565  -2.565
  509    HA   GLU  66           HA       GLU  66   5.781  -4.258  -4.258
  510   1HB   GLU  66           HB1      GLU  66   8.382  -2.818  -2.818
  511   2HB   GLU  66           HB2      GLU  66   7.763  -3.328  -3.328
  512   1HG   GLU  66           HG1      GLU  66   5.706  -1.889  -1.889
  513   2HG   GLU  66           HG2      GLU  66   6.397  -1.313  -1.313
  514    H    LYS  67           HN       LYS  67   8.193  -4.691  -4.691
  515    HA   LYS  67           HA       LYS  67   9.437  -6.949  -6.949
  516   1HB   LYS  67           HB1      LYS  67   9.846  -5.504  -5.504
  517   2HB   LYS  67           HB2      LYS  67  10.447  -7.145  -7.145
  518   1HG   LYS  67           HG1      LYS  67  12.168  -5.611  -5.611
  519   2HG   LYS  67           HG2      LYS  67  11.734  -6.625  -6.625
  520   1HD   LYS  67           HD1      LYS  67  10.398  -4.779  -4.779
  521   2HD   LYS  67           HD2      LYS  67  10.755  -3.768  -3.768
  522   1HE   LYS  67           HE1      LYS  67  12.810  -4.886  -4.886
  523   2HE   LYS  67           HE2      LYS  67  12.249  -3.221  -3.221
  524   1HZ   LYS  67           HZ1      LYS  67  13.099  -3.941  -3.941
  525   2HZ   LYS  67           HZ2      LYS  67  14.306  -4.400  -4.400
  526   3HZ   LYS  67           HZ3      LYS  67  13.766  -2.790  -2.790
  527    H    ASP  68           HN       ASP  68   6.959  -6.556  -6.556
  528    HA   ASP  68           HA       ASP  68   6.800  -9.279  -9.279
  529   1HB   ASP  68           HB1      ASP  68   5.724  -6.703  -6.703
  530   2HB   ASP  68           HB2      ASP  68   4.345  -7.746  -7.746
  531    H    ILE  69           HN       ILE  69   5.522  -7.266  -7.266
  532    HA   ILE  69           HA       ILE  69   3.501  -9.297  -9.297
  533    HB   ILE  69           HB       ILE  69   2.880  -7.038  -7.038
  534   1HG1  ILE  69          HG11      ILE  69   2.541  -7.110  -7.110
  535   2HG1  ILE  69          HG12      ILE  69   3.868  -8.253  -8.253
  536   1HG2  ILE  69          HG21      ILE  69   5.037  -6.023  -6.023
  537   2HG2  ILE  69          HG22      ILE  69   5.438  -6.760  -6.760
  538   3HG2  ILE  69          HG23      ILE  69   4.147  -5.574  -5.574
  539   1HD1  ILE  69          HD11      ILE  69   1.362  -8.802  -8.802
  540   2HD1  ILE  69          HD12      ILE  69   1.635  -9.377  -9.377
  541   3HD1  ILE  69          HD13      ILE  69   2.642  -9.948  -9.948
  542    H    ALA  70           HN       ALA  70   6.539  -8.013  -8.013
  543    HA   ALA  70           HA       ALA  70   7.053  -9.724  -9.724
  544   1HB   ALA  70           HB1      ALA  70   9.047  -8.797  -8.797
  545   2HB   ALA  70           HB2      ALA  70   9.486  -9.390  -9.390
  546   3HB   ALA  70           HB3      ALA  70   8.602  -7.881  -7.881
  547    H    ALA  71           HN       ALA  71   7.163 -10.359 -10.359
  548    HA   ALA  71           HA       ALA  71   8.340 -12.997 -12.997
  549   1HB   ALA  71           HB1      ALA  71   6.988 -11.636 -11.636
  550   2HB   ALA  71           HB2      ALA  71   7.895 -13.141 -13.141
  551   3HB   ALA  71           HB3      ALA  71   8.713 -11.645 -11.645
  552    H    TYR  72           HN       TYR  72   5.158 -11.642 -11.642
  553    HA   TYR  72           HA       TYR  72   3.663 -14.026 -14.026
  554   1HB   TYR  72           HB1      TYR  72   2.693 -11.955 -11.955
  555   2HB   TYR  72           HB2      TYR  72   2.989 -11.288 -11.288
  556    HD1  TYR  72           HD1      TYR  72   1.553 -12.052 -12.052
  557    HD2  TYR  72           HD2      TYR  72   0.728 -13.193 -13.193
  558    HE1  TYR  72           HE1      TYR  72  -0.715 -12.716 -12.716
  559    HE2  TYR  72           HE2      TYR  72  -1.536 -13.856 -13.856
  560    HH   TYR  72           HH       TYR  72  -3.067 -13.838 -13.838
  561    H    ARG  73           HN       ARG  73   4.601 -12.332 -12.332
  562    HA   ARG  73           HA       ARG  73   3.133 -13.791 -13.791
  563   1HB   ARG  73           HB1      ARG  73   4.756 -11.421 -11.421
  564   2HB   ARG  73           HB2      ARG  73   5.615 -12.450 -12.450
  565   1HG   ARG  73           HG1      ARG  73   2.676 -11.927 -11.927
  566   2HG   ARG  73           HG2      ARG  73   3.870 -10.748 -10.748
  567   1HD   ARG  73           HD1      ARG  73   4.981 -12.547 -12.547
  568   2HD   ARG  73           HD2      ARG  73   3.645 -13.623 -13.623
  569    HE   ARG  73           HE       ARG  73   2.123 -12.052 -12.052
  570   1HH1  ARG  73          HH11      ARG  73   3.797  -9.629  -9.629
  571   2HH1  ARG  73          HH12      ARG  73   4.433  -9.503  -9.503
  572   1HH2  ARG  73          HH21      ARG  73   3.633 -12.830 -12.830
  573   2HH2  ARG  73          HH22      ARG  73   4.337 -11.369 -11.369
  574    H    ALA  74           HN       ALA  74   6.192 -13.873 -13.873
  575    HA   ALA  74           HA       ALA  74   7.418 -15.844 -15.844
  576   1HB   ALA  74           HB1      ALA  74   8.718 -14.396 -14.396
  577   2HB   ALA  74           HB2      ALA  74   8.043 -15.230 -15.230
  578   3HB   ALA  74           HB3      ALA  74   9.079 -16.093 -16.093
  579    H    LYS  75           HN       LYS  75   5.309 -16.046 -16.046
  580    HA   LYS  75           HA       LYS  75   4.952 -18.958 -18.958
  581   1HB   LYS  75           HB1      LYS  75   6.685 -18.414 -18.414
  582   2HB   LYS  75           HB2      LYS  75   5.292 -17.898 -17.898
  583   1HG   LYS  75           HG1      LYS  75   4.223 -20.151 -20.151
  584   2HG   LYS  75           HG2      LYS  75   5.683 -20.644 -20.644
  585   1HD   LYS  75           HD1      LYS  75   6.957 -20.098 -20.098
  586   2HD   LYS  75           HD2      LYS  75   5.383 -19.967 -19.967
  587   1HE   LYS  75           HE1      LYS  75   6.455 -22.433 -22.433
  588   2HE   LYS  75           HE2      LYS  75   6.272 -22.253 -22.253
  589   1HZ   LYS  75           HZ1      LYS  75   3.818 -21.654 -21.654
  590   2HZ   LYS  75           HZ2      LYS  75   4.386 -23.110 -23.110
  591   3HZ   LYS  75           HZ3      LYS  75   4.211 -22.955 -22.955
  592    H    GLY  76           HN       GLY  76   3.182 -17.542 -17.542
  593   1HA   GLY  76           HA1      GLY  76   1.103 -16.627 -16.627
  594   2HA   GLY  76           HA2      GLY  76   1.014 -16.578 -16.578
  595    H    LYS  77           HN       LYS  77   1.036 -18.759 -18.759
  596    HA   LYS  77           HA       LYS  77  -0.988 -20.509 -20.509
  597   1HB   LYS  77           HB1      LYS  77   1.395 -21.270 -21.270
  598   2HB   LYS  77           HB2      LYS  77   0.143 -22.399 -22.399
  599   1HG   LYS  77           HG1      LYS  77   0.690 -21.885 -21.885
  600   2HG   LYS  77           HG2      LYS  77   2.010 -20.888 -20.888
  601   1HD   LYS  77           HD1      LYS  77   2.971 -23.008 -23.008
  602   2HD   LYS  77           HD2      LYS  77   3.003 -22.925 -22.925
  603   1HE   LYS  77           HE1      LYS  77   0.755 -24.327 -24.327
  604   2HE   LYS  77           HE2      LYS  77   2.219 -25.157 -25.157
  605   1HZ   LYS  77           HZ1      LYS  77   1.255 -23.773 -23.773
  606   2HZ   LYS  77           HZ2      LYS  77  -0.057 -24.595 -24.595
  607   3HZ   LYS  77           HZ3      LYS  77   1.339 -25.449 -25.449
  608    HA   PRO  78           HA       PRO  78  -3.230 -19.842 -19.842
  609   1HB   PRO  78           HB1      PRO  78  -4.686 -22.118 -22.118
  610   2HB   PRO  78           HB2      PRO  78  -4.928 -21.137 -21.137
  611   1HG   PRO  78           HG1      PRO  78  -3.160 -23.604 -23.604
  612   2HG   PRO  78           HG2      PRO  78  -4.416 -23.296 -23.296
  613   1HD   PRO  78           HD1      PRO  78  -1.804 -22.759 -22.759
  614   2HD   PRO  78           HD2      PRO  78  -3.080 -21.705 -21.705
  615    H    ASP  79           HN       ASP  79  -0.466 -21.148 -21.148
  616    HA   ASP  79           HA       ASP  79  -0.578 -21.853 -21.853
  617   1HB   ASP  79           HB1      ASP  79   1.146 -23.183 -23.183
  618   2HB   ASP  79           HB2      ASP  79   1.330 -23.506 -23.506
  619    H    ALA  80           HN       ALA  80   0.100 -19.487 -19.487
  620    HA   ALA  80           HA       ALA  80   2.837 -18.830 -18.830
  621   1HB   ALA  80           HB1      ALA  80   0.428 -16.980 -16.980
  622   2HB   ALA  80           HB2      ALA  80   2.058 -16.459 -16.459
  623   3HB   ALA  80           HB3      ALA  80   1.149 -17.458 -17.458
  624    H    ALA  81           HN       ALA  81   0.378 -17.737 -17.737
  625    HA   ALA  81           HA       ALA  81   2.405 -17.827 -17.827
  626   1HB   ALA  81           HB1      ALA  81   1.939 -15.498 -15.498
  627   2HB   ALA  81           HB2      ALA  81   0.217 -15.757 -15.757
  628   3HB   ALA  81           HB3      ALA  81   1.312 -15.786 -15.786
  629   1H1   BME  16           HE1      MER  16  -8.467   8.285   8.285
  630   2H1   BME  16           HE2      MER  16  -8.438   9.461   9.461
  631   1H2   BME  16           HZ1      MER  16  -6.386   9.203   9.203
  632   2H2   BME  16           HZ2      MER  16  -7.610  10.463  10.463
  633    HO1  BME  16           HH       MER  16  -6.019   8.330   8.330

  Start of MODEL   48
    1    H    ASN   3           HN       ASN   3  -2.478  -7.574  -7.574
    2    HA   ASN   3           HA       ASN   3  -0.294  -8.335  -8.335
    3   1HB   ASN   3           HB1      ASN   3  -1.490 -11.122 -11.122
    4   2HB   ASN   3           HB2      ASN   3   0.201 -10.687 -10.687
    5   1HD2  ASN   3          HD21      ASN   3  -1.583 -11.767 -11.767
    6   2HD2  ASN   3          HD22      ASN   3  -2.247 -12.036 -12.036
    7    H    ALA   4           HN       ALA   4   0.741  -9.232  -9.232
    8    HA   ALA   4           HA       ALA   4   0.868  -9.027  -9.027
    9   1HB   ALA   4           HB1      ALA   4  -1.011 -10.666 -10.666
   10   2HB   ALA   4           HB2      ALA   4  -2.185  -9.365  -9.365
   11   3HB   ALA   4           HB3      ALA   4  -1.165  -9.509  -9.509
   12    HA   PRO   5           HA       PRO   5  -0.015  -4.544  -4.544
   13   1HB   PRO   5           HB1      PRO   5   2.604  -4.519  -4.519
   14   2HB   PRO   5           HB2      PRO   5   2.101  -3.579  -3.579
   15   1HG   PRO   5           HG1      PRO   5   3.839  -5.602  -5.602
   16   2HG   PRO   5           HG2      PRO   5   2.532  -5.357  -5.357
   17   1HD   PRO   5           HD1      PRO   5   2.565  -7.343  -7.343
   18   2HD   PRO   5           HD2      PRO   5   2.178  -7.667  -7.667
   19    H    LYS   6           HN       LYS   6  -1.588  -4.369  -4.369
   20    HA   LYS   6           HA       LYS   6  -1.250  -5.290  -5.290
   21   1HB   LYS   6           HB1      LYS   6  -3.718  -4.166  -4.166
   22   2HB   LYS   6           HB2      LYS   6  -3.713  -4.908  -4.908
   23   1HG   LYS   6           HG1      LYS   6  -3.127  -7.086  -7.086
   24   2HG   LYS   6           HG2      LYS   6  -2.857  -6.383  -6.383
   25   1HD   LYS   6           HD1      LYS   6  -5.024  -7.429  -7.429
   26   2HD   LYS   6           HD2      LYS   6  -5.253  -5.697  -5.697
   27   1HE   LYS   6           HE1      LYS   6  -6.883  -6.707  -6.707
   28   2HE   LYS   6           HE2      LYS   6  -5.765  -5.721  -5.721
   29   1HZ   LYS   6           HZ1      LYS   6  -4.693  -8.293  -8.293
   30   2HZ   LYS   6           HZ2      LYS   6  -6.315  -8.439  -8.439
   31   3HZ   LYS   6           HZ3      LYS   6  -5.240  -7.491  -7.491
   32    H    ARG   7           HN       ARG   7   0.387  -3.444  -3.444
   33    HA   ARG   7           HA       ARG   7   1.210  -1.562  -1.562
   34   1HB   ARG   7           HB1      ARG   7  -0.601  -1.903  -1.903
   35   2HB   ARG   7           HB2      ARG   7  -1.626  -0.804  -0.804
   36   1HG   ARG   7           HG1      ARG   7   0.500   0.813   0.813
   37   2HG   ARG   7           HG2      ARG   7   0.979  -0.226  -0.226
   38   1HD   ARG   7           HD1      ARG   7  -1.656   1.286   1.286
   39   2HD   ARG   7           HD2      ARG   7  -0.277   1.732   1.732
   40    HE   ARG   7           HE       ARG   7  -1.762  -0.843  -0.843
   41   1HH1  ARG   7          HH11      ARG   7  -1.660   2.180   2.180
   42   2HH1  ARG   7          HH12      ARG   7  -1.209   1.697   1.697
   43   1HH2  ARG   7          HH21      ARG   7  -0.533  -1.602  -1.602
   44   2HH2  ARG   7          HH22      ARG   7  -0.555  -0.497  -0.497
   45    HA   PRO   8           HA       PRO   8   0.050   0.913   0.913
   46   1HB   PRO   8           HB1      PRO   8   2.514   2.191   2.191
   47   2HB   PRO   8           HB2      PRO   8   2.193   0.596   0.596
   48   1HG   PRO   8           HG1      PRO   8   3.375   1.280   1.280
   49   2HG   PRO   8           HG2      PRO   8   4.045   0.200   0.200
   50   1HD   PRO   8           HD1      PRO   8   2.636  -0.845  -0.845
   51   2HD   PRO   8           HD2      PRO   8   2.309  -1.467  -1.467
   52    HA   PRO   9           HA       PRO   9  -0.997   5.148   5.148
   53   1HB   PRO   9           HB1      PRO   9   1.557   6.395   6.395
   54   2HB   PRO   9           HB2      PRO   9  -0.015   6.501   6.501
   55   1HG   PRO   9           HG1      PRO   9   2.227   4.544   4.544
   56   2HG   PRO   9           HG2      PRO   9   1.046   5.214   5.214
   57   1HD   PRO   9           HD1      PRO   9   0.697   2.703   2.703
   58   2HD   PRO   9           HD2      PRO   9  -0.713   3.776   3.776
   59    H    SER  10           HN       SER  10  -0.240   7.197   7.197
   60    HA   SER  10           HA       SER  10   0.790   6.440   6.440
   61   1HB   SER  10           HB1      SER  10  -1.010   8.728   8.728
   62   2HB   SER  10           HB2      SER  10  -0.503   8.380   8.380
   63    HG   SER  10           HG       SER  10  -1.960   6.896   6.896
   64    H    ALA  11           HN       ALA  11   0.757   9.308   9.308
   65    HA   ALA  11           HA       ALA  11   3.285  10.093  10.093
   66   1HB   ALA  11           HB1      ALA  11   2.526  11.136  11.136
   67   2HB   ALA  11           HB2      ALA  11   3.928  11.613  11.613
   68   3HB   ALA  11           HB3      ALA  11   3.839   9.999   9.999
   69    H    PHE  12           HN       PHE  12   0.414  10.988  10.988
   70    HA   PHE  12           HA       PHE  12   0.063  13.539  13.539
   71   1HB   PHE  12           HB1      PHE  12  -1.007  13.851  13.851
   72   2HB   PHE  12           HB2      PHE  12  -0.950  12.106  12.106
   73    HD1  PHE  12           HD1      PHE  12  -3.169  13.874  13.874
   74    HD2  PHE  12           HD2      PHE  12  -2.794  11.760  11.760
   75    HE1  PHE  12           HE1      PHE  12  -5.599  13.819  13.819
   76    HE2  PHE  12           HE2      PHE  12  -5.234  11.725  11.725
   77    HZ   PHE  12           HZ       PHE  12  -6.650  12.744  12.744
   78    H    PHE  13           HN       PHE  13  -0.447  10.265  10.265
   79    HA   PHE  13           HA       PHE  13  -2.852  10.509  10.509
   80   1HB   PHE  13           HB1      PHE  13  -1.595   8.355   8.355
   81   2HB   PHE  13           HB2      PHE  13  -0.624   8.608   8.608
   82    HD1  PHE  13           HD1      PHE  13  -1.937   8.936   8.936
   83    HD2  PHE  13           HD2      PHE  13  -3.747   7.414   7.414
   84    HE1  PHE  13           HE1      PHE  13  -3.812   8.067   8.067
   85    HE2  PHE  13           HE2      PHE  13  -5.623   6.553   6.553
   86    HZ   PHE  13           HZ       PHE  13  -5.658   6.875   6.875
   87    H    LEU  14           HN       LEU  14   0.624  10.918  10.918
   88    HA   LEU  14           HA       LEU  14   0.351  11.414  11.414
   89   1HB   LEU  14           HB1      LEU  14   2.328  12.725  12.725
   90   2HB   LEU  14           HB2      LEU  14   2.490  12.687  12.687
   91    HG   LEU  14           HG       LEU  14   4.000  11.075  11.075
   92   1HD1  LEU  14          HD11      LEU  14   2.710  10.098  10.098
   93   2HD1  LEU  14          HD12      LEU  14   1.547   9.423   9.423
   94   3HD1  LEU  14          HD13      LEU  14   3.211   8.859   8.859
   95   1HD2  LEU  14          HD21      LEU  14   3.453  10.965  10.965
   96   2HD2  LEU  14          HD22      LEU  14   3.660   9.351   9.351
   97   3HD2  LEU  14          HD23      LEU  14   2.052   9.952   9.952
   98    H    PHE  15           HN       PHE  15   0.541  13.626  13.626
   99    HA   PHE  15           HA       PHE  15  -0.050  16.115  16.115
  100   1HB   PHE  15           HB1      PHE  15   0.745  15.766  15.766
  101   2HB   PHE  15           HB2      PHE  15  -0.661  14.747  14.747
  102    HD1  PHE  15           HD1      PHE  15  -0.171  18.325  18.325
  103    HD2  PHE  15           HD2      PHE  15  -1.984  15.585  15.585
  104    HE1  PHE  15           HE1      PHE  15  -1.278  20.174  20.174
  105    HE2  PHE  15           HE2      PHE  15  -3.077  17.441  17.441
  106    HZ   PHE  15           HZ       PHE  15  -2.719  19.741  19.741
  107    H    CYS  16           HN       MER  16  -2.415  13.934  13.934
  108    HA   CYS  16           HA       MER  16  -4.805  15.249  15.249
  109   1HB   CYS  16           HB1      MER  16  -5.961  13.207  13.207
  110   2HB   CYS  16           HB2      MER  16  -4.585  13.112  13.112
  111    H    SER  17           HN       SER  17  -3.088  12.982  12.982
  112    HA   SER  17           HA       SER  17  -5.035  12.998  12.998
  113   1HB   SER  17           HB1      SER  17  -3.276  12.144  12.144
  114   2HB   SER  17           HB2      SER  17  -2.881  11.527  11.527
  115    HG   SER  17           HG       SER  17  -1.086  12.603  12.603
  116    H    GLU  18           HN       GLU  18  -2.361  15.124  15.124
  117    HA   GLU  18           HA       GLU  18  -2.766  16.861  16.861
  118   1HB   GLU  18           HB1      GLU  18  -0.588  16.442  16.442
  119   2HB   GLU  18           HB2      GLU  18  -1.189  17.283  17.283
  120   1HG   GLU  18           HG1      GLU  18  -1.424  19.373  19.373
  121   2HG   GLU  18           HG2      GLU  18  -0.913  18.556  18.556
  122    H    TYR  19           HN       TYR  19  -4.483  16.493  16.493
  123    HA   TYR  19           HA       TYR  19  -5.343  19.334  19.334
  124   1HB   TYR  19           HB1      TYR  19  -5.112  17.056  17.056
  125   2HB   TYR  19           HB2      TYR  19  -6.602  18.014  18.014
  126    HD1  TYR  19           HD1      TYR  19  -3.053  18.782  18.782
  127    HD2  TYR  19           HD2      TYR  19  -6.372  19.659  19.659
  128    HE1  TYR  19           HE1      TYR  19  -1.744  20.524  20.524
  129    HE2  TYR  19           HE2      TYR  19  -5.065  21.395  21.395
  130    HH   TYR  19           HH       TYR  19  -3.164  22.549  22.549
  131    H    ARG  20           HN       ARG  20  -6.603  16.155  16.155
  132    HA   ARG  20           HA       ARG  20  -9.190  16.025  16.025
  133   1HB   ARG  20           HB1      ARG  20  -7.307  15.326  15.326
  134   2HB   ARG  20           HB2      ARG  20  -8.952  15.475  15.475
  135   1HG   ARG  20           HG1      ARG  20  -9.759  13.829  13.829
  136   2HG   ARG  20           HG2      ARG  20  -8.207  13.768  13.768
  137   1HD   ARG  20           HD1      ARG  20  -7.119  12.829  12.829
  138   2HD   ARG  20           HD2      ARG  20  -8.567  13.058  13.058
  139    HE   ARG  20           HE       ARG  20  -8.518  11.209  11.209
  140   1HH1  ARG  20          HH11      ARG  20 -10.758  12.137  12.137
  141   2HH1  ARG  20          HH12      ARG  20 -10.955  10.631  10.631
  142   1HH2  ARG  20          HH21      ARG  20  -8.064   9.241   9.241
  143   2HH2  ARG  20          HH22      ARG  20  -9.387   8.946   8.946
  144    HA   PRO  21           HA       PRO  21 -10.708  18.507  18.507
  145   1HB   PRO  21           HB1      PRO  21  -9.125  20.113  20.113
  146   2HB   PRO  21           HB2      PRO  21  -9.106  18.345  18.345
  147   1HG   PRO  21           HG1      PRO  21  -7.267  19.994  19.994
  148   2HG   PRO  21           HG2      PRO  21  -6.776  18.963  18.963
  149   1HD   PRO  21           HD1      PRO  21  -6.848  17.870  17.870
  150   2HD   PRO  21           HD2      PRO  21  -7.614  16.961  16.961
  151    H    LYS  22           HN       LYS  22  -8.624  20.069  20.069
  152    HA   LYS  22           HA       LYS  22  -9.709  22.750  22.750
  153   1HB   LYS  22           HB1      LYS  22  -7.990  21.372  21.372
  154   2HB   LYS  22           HB2      LYS  22  -8.341  23.079  23.079
  155   1HG   LYS  22           HG1      LYS  22  -7.073  21.801  21.801
  156   2HG   LYS  22           HG2      LYS  22  -6.097  22.197  22.197
  157   1HD   LYS  22           HD1      LYS  22  -6.886  24.566  24.566
  158   2HD   LYS  22           HD2      LYS  22  -7.869  24.180  24.180
  159   1HE   LYS  22           HE1      LYS  22  -5.679  25.198  25.198
  160   2HE   LYS  22           HE2      LYS  22  -5.810  23.554  23.554
  161   1HZ   LYS  22           HZ1      LYS  22  -4.711  23.446  23.446
  162   2HZ   LYS  22           HZ2      LYS  22  -3.874  24.637  24.637
  163   3HZ   LYS  22           HZ3      LYS  22  -3.977  23.056  23.056
  164    H    ILE  23           HN       ILE  23 -10.114  19.972  19.972
  165    HA   ILE  23           HA       ILE  23 -12.040  21.526  21.526
  166    HB   ILE  23           HB       ILE  23 -12.189  18.717  18.717
  167   1HG1  ILE  23          HG11      ILE  23  -9.295  19.672  19.672
  168   2HG1  ILE  23          HG12      ILE  23 -10.029  18.379  18.379
  169   1HG2  ILE  23          HG21      ILE  23 -12.484  20.689  20.689
  170   2HG2  ILE  23          HG22      ILE  23 -10.777  21.074  21.074
  171   3HG2  ILE  23          HG23      ILE  23 -11.282  19.608  19.608
  172   1HD1  ILE  23          HD11      ILE  23 -10.489  17.139  17.139
  173   2HD1  ILE  23          HD12      ILE  23  -9.670  18.366  18.366
  174   3HD1  ILE  23          HD13      ILE  23  -8.770  17.416  17.416
  175    H    LYS  24           HN       LYS  24 -11.867  19.005  19.005
  176    HA   LYS  24           HA       LYS  24 -14.507  18.085  18.085
  177   1HB   LYS  24           HB1      LYS  24 -12.421  17.109  17.109
  178   2HB   LYS  24           HB2      LYS  24 -12.356  18.390  18.390
  179   1HG   LYS  24           HG1      LYS  24 -14.674  17.615  17.615
  180   2HG   LYS  24           HG2      LYS  24 -14.496  16.208  16.208
  181   1HD   LYS  24           HD1      LYS  24 -12.659  17.030  17.030
  182   2HD   LYS  24           HD2      LYS  24 -13.802  15.707  15.707
  183   1HE   LYS  24           HE1      LYS  24 -11.343  15.891  15.891
  184   2HE   LYS  24           HE2      LYS  24 -11.511  14.858  14.858
  185   1HZ   LYS  24           HZ1      LYS  24 -13.705  14.419  14.419
  186   2HZ   LYS  24           HZ2      LYS  24 -12.289  14.336  14.336
  187   3HZ   LYS  24           HZ3      LYS  24 -12.464  13.341  13.341
  188    H    GLY  25           HN       GLY  25 -12.945  20.890  20.890
  189   1HA   GLY  25           HA1      GLY  25 -14.993  21.659  21.659
  190   2HA   GLY  25           HA2      GLY  25 -13.643  22.658  22.658
  191    H    GLU  26           HN       GLU  26 -13.965  22.695  22.695
  192    HA   GLU  26           HA       GLU  26 -15.933  24.667  24.667
  193   1HB   GLU  26           HB1      GLU  26 -14.321  22.942  22.942
  194   2HB   GLU  26           HB2      GLU  26 -15.262  24.332  24.332
  195   1HG   GLU  26           HG1      GLU  26 -13.120  24.506  24.506
  196   2HG   GLU  26           HG2      GLU  26 -12.760  24.761  24.761
  197    H    HIS  27           HN       HIS  27 -15.809  21.342  21.342
  198    HA   HIS  27           HA       HIS  27 -18.728  21.118  21.118
  199   1HB   HIS  27           HB1      HIS  27 -17.714  19.874  19.874
  200   2HB   HIS  27           HB2      HIS  27 -18.861  21.176  21.176
  201    HD1  HIS  27           HD1      HIS  27 -18.044  23.337  23.337
  202    HD2  HIS  27           HD2      HIS  27 -14.892  20.867  20.867
  203    HE1  HIS  27           HE1      HIS  27 -16.040  24.486  24.486
  204    HA   PRO  28           HA       PRO  28 -17.223  17.087  17.087
  205   1HB   PRO  28           HB1      PRO  28 -18.732  16.899  16.899
  206   2HB   PRO  28           HB2      PRO  28 -17.222  17.801  17.801
  207   1HG   PRO  28           HG1      PRO  28 -20.071  18.882  18.882
  208   2HG   PRO  28           HG2      PRO  28 -18.841  19.471  19.471
  209   1HD   PRO  28           HD1      PRO  28 -19.247  20.617  20.617
  210   2HD   PRO  28           HD2      PRO  28 -17.658  20.631  20.631
  211    H    GLY  29           HN       GLY  29 -18.909  17.985  17.985
  212   1HA   GLY  29           HA1      GLY  29 -20.976  15.908  15.908
  213   2HA   GLY  29           HA2      GLY  29 -21.501  17.559  17.559
  214    H    LEU  30           HN       LEU  30 -18.467  16.032  16.032
  215    HA   LEU  30           HA       LEU  30 -19.087  16.611  16.611
  216   1HB   LEU  30           HB1      LEU  30 -16.531  15.861  15.861
  217   2HB   LEU  30           HB2      LEU  30 -16.621  16.146  16.146
  218    HG   LEU  30           HG       LEU  30 -17.081  18.056  18.056
  219   1HD1  LEU  30          HD11      LEU  30 -14.750  17.556  17.556
  220   2HD1  LEU  30          HD12      LEU  30 -14.956  17.897  17.897
  221   3HD1  LEU  30          HD13      LEU  30 -15.075  19.190  19.190
  222   1HD2  LEU  30          HD21      LEU  30 -17.345  18.516  18.516
  223   2HD2  LEU  30          HD22      LEU  30 -18.659  18.642  18.642
  224   3HD2  LEU  30          HD23      LEU  30 -17.360  19.814  19.814
  225    H    SER  31           HN       SER  31 -16.956  14.145  14.145
  226    HA   SER  31           HA       SER  31 -18.001  11.694  11.694
  227   1HB   SER  31           HB1      SER  31 -17.917  12.645  12.645
  228   2HB   SER  31           HB2      SER  31 -17.672  10.935  10.935
  229    HG   SER  31           HG       SER  31 -19.734  10.826  10.826
  230    H    ILE  32           HN       ILE  32 -16.453  10.019  10.019
  231    HA   ILE  32           HA       ILE  32 -13.726  10.860  10.860
  232    HB   ILE  32           HB       ILE  32 -15.142   8.726   8.726
  233   1HG1  ILE  32          HG11      ILE  32 -12.909   8.852   8.852
  234   2HG1  ILE  32          HG12      ILE  32 -13.204   7.261   7.261
  235   1HG2  ILE  32          HG21      ILE  32 -14.089   7.820   7.820
  236   2HG2  ILE  32          HG22      ILE  32 -14.795   6.761   6.761
  237   3HG2  ILE  32          HG23      ILE  32 -15.772   8.020   8.020
  238   1HD1  ILE  32          HD11      ILE  32 -11.910   7.894   7.894
  239   2HD1  ILE  32          HD12      ILE  32 -11.573   9.464   9.464
  240   3HD1  ILE  32          HD13      ILE  32 -10.947   8.000   8.000
  241    H    GLY  33           HN       GLY  33 -15.583  10.977  10.977
  242   1HA   GLY  33           HA1      GLY  33 -13.465  10.534  10.534
  243   2HA   GLY  33           HA2      GLY  33 -15.198  10.590  10.590
  244    H    ASP  34           HN       ASP  34 -15.122  12.896  12.896
  245    HA   ASP  34           HA       ASP  34 -14.614  15.025  15.025
  246   1HB   ASP  34           HB1      ASP  34 -16.335  14.605  14.605
  247   2HB   ASP  34           HB2      ASP  34 -16.040  16.256  16.256
  248    H    VAL  35           HN       VAL  35 -14.101  14.151  14.151
  249    HA   VAL  35           HA       VAL  35 -12.293  16.217  16.217
  250    HB   VAL  35           HB       VAL  35 -12.885  13.376  13.376
  251   1HG1  VAL  35          HG11      VAL  35 -10.988  15.272  15.272
  252   2HG1  VAL  35          HG12      VAL  35 -11.583  13.757  13.757
  253   3HG1  VAL  35          HG13      VAL  35 -10.541  13.763  13.763
  254   1HG2  VAL  35          HG21      VAL  35 -13.458  16.083  16.083
  255   2HG2  VAL  35          HG22      VAL  35 -14.625  15.046  15.046
  256   3HG2  VAL  35          HG23      VAL  35 -13.900  14.535  14.535
  257    H    ALA  36           HN       ALA  36 -11.995  13.317  13.317
  258    HA   ALA  36           HA       ALA  36  -9.093  13.269  13.269
  259   1HB   ALA  36           HB1      ALA  36 -10.415  11.210  11.210
  260   2HB   ALA  36           HB2      ALA  36 -11.155  11.560  11.560
  261   3HB   ALA  36           HB3      ALA  36  -9.440  11.160  11.160
  262    H    LYS  37           HN       LYS  37 -11.697  13.898  13.898
  263    HA   LYS  37           HA       LYS  37  -9.859  14.238  14.238
  264   1HB   LYS  37           HB1      LYS  37 -12.293  13.729  13.729
  265   2HB   LYS  37           HB2      LYS  37 -12.659  15.385  15.385
  266   1HG   LYS  37           HG1      LYS  37 -11.308  16.151  16.151
  267   2HG   LYS  37           HG2      LYS  37 -10.981  14.462  14.462
  268   1HD   LYS  37           HD1      LYS  37 -12.814  15.015  15.015
  269   2HD   LYS  37           HD2      LYS  37 -13.535  14.146  14.146
  270   1HE   LYS  37           HE1      LYS  37 -14.214  16.261  16.261
  271   2HE   LYS  37           HE2      LYS  37 -13.433  17.180  17.180
  272   1HZ   LYS  37           HZ1      LYS  37 -15.146  15.354  15.354
  273   2HZ   LYS  37           HZ2      LYS  37 -16.008  16.095  16.095
  274   3HZ   LYS  37           HZ3      LYS  37 -15.281  17.046  17.046
  275    H    LYS  38           HN       LYS  38 -11.215  16.474  16.474
  276    HA   LYS  38           HA       LYS  38 -10.219  18.816  18.816
  277   1HB   LYS  38           HB1      LYS  38 -12.109  19.041  19.041
  278   2HB   LYS  38           HB2      LYS  38 -11.273  18.201  18.201
  279   1HG   LYS  38           HG1      LYS  38 -11.354  20.627  20.627
  280   2HG   LYS  38           HG2      LYS  38  -9.712  20.060  20.060
  281   1HD   LYS  38           HD1      LYS  38  -9.923  22.183  22.183
  282   2HD   LYS  38           HD2      LYS  38  -9.613  20.932  20.932
  283   1HE   LYS  38           HE1      LYS  38 -12.025  20.841  20.841
  284   2HE   LYS  38           HE2      LYS  38 -12.379  22.040  22.040
  285   1HZ   LYS  38           HZ1      LYS  38 -10.330  22.990  22.990
  286   2HZ   LYS  38           HZ2      LYS  38 -11.623  22.458  22.458
  287   3HZ   LYS  38           HZ3      LYS  38 -11.884  23.626  23.626
  288    H    LEU  39           HN       LEU  39  -9.156  17.157  17.157
  289    HA   LEU  39           HA       LEU  39  -6.739  18.728  18.728
  290   1HB   LEU  39           HB1      LEU  39  -6.839  18.011  18.011
  291   2HB   LEU  39           HB2      LEU  39  -8.330  17.206  17.206
  292    HG   LEU  39           HG       LEU  39  -6.802  15.309  15.309
  293   1HD1  LEU  39          HD11      LEU  39  -5.014  16.959  16.959
  294   2HD1  LEU  39          HD12      LEU  39  -4.647  15.311  15.311
  295   3HD1  LEU  39          HD13      LEU  39  -4.662  16.547  16.547
  296   1HD2  LEU  39          HD21      LEU  39  -8.318  15.314  15.314
  297   2HD2  LEU  39          HD22      LEU  39  -6.805  14.514  14.514
  298   3HD2  LEU  39          HD23      LEU  39  -7.057  16.165  16.165
  299    H    GLY  40           HN       GLY  40  -7.525  15.613  15.613
  300   1HA   GLY  40           HA1      GLY  40  -4.827  14.754  14.754
  301   2HA   GLY  40           HA2      GLY  40  -6.166  14.277  14.277
  302    H    GLU  41           HN       GLU  41  -6.913  16.955  16.955
  303    HA   GLU  41           HA       GLU  41  -5.118  17.345  17.345
  304   1HB   GLU  41           HB1      GLU  41  -7.196  19.087  19.087
  305   2HB   GLU  41           HB2      GLU  41  -6.379  19.568  19.568
  306   1HG   GLU  41           HG1      GLU  41  -7.214  17.661  17.661
  307   2HG   GLU  41           HG2      GLU  41  -7.896  16.932  16.932
  308    H    MET  42           HN       MET  42  -5.717  19.124  19.124
  309    HA   MET  42           HA       MET  42  -3.859  21.188  21.188
  310   1HB   MET  42           HB1      MET  42  -4.580  19.515  19.515
  311   2HB   MET  42           HB2      MET  42  -3.745  21.064  21.064
  312   1HG   MET  42           HG1      MET  42  -6.450  20.677  20.677
  313   2HG   MET  42           HG2      MET  42  -6.322  21.158  21.158
  314   1HE   MET  42           HE1      MET  42  -5.584  22.015  22.015
  315   2HE   MET  42           HE2      MET  42  -7.281  22.306  22.306
  316   3HE   MET  42           HE3      MET  42  -6.233  23.638  23.638
  317    H    TRP  43           HN       TRP  43  -3.352  17.961  17.961
  318    HA   TRP  43           HA       TRP  43  -0.665  17.999  17.999
  319   1HB   TRP  43           HB1      TRP  43  -2.042  16.022  16.022
  320   2HB   TRP  43           HB2      TRP  43  -2.303  15.868  15.868
  321    HD1  TRP  43           HD1      TRP  43  -0.808  14.278  14.278
  322    HE1  TRP  43           HE1      TRP  43   1.405  13.266  13.266
  323    HE3  TRP  43           HE3      TRP  43   0.145  16.641  16.641
  324    HZ2  TRP  43           HZ2      TRP  43   3.442  13.324  13.324
  325    HZ3  TRP  43           HZ3      TRP  43   2.127  16.175  16.175
  326    HH2  TRP  43           HH2      TRP  43   3.817  14.517  14.517
  327    H    ASN  44           HN       ASN  44  -2.029  17.270  17.270
  328    HA   ASN  44           HA       ASN  44   0.419  16.957  16.957
  329   1HB   ASN  44           HB1      ASN  44  -2.212  17.994  17.994
  330   2HB   ASN  44           HB2      ASN  44  -0.867  17.289  17.289
  331   1HD2  ASN  44          HD21      ASN  44  -3.562  14.772  14.772
  332   2HD2  ASN  44          HD22      ASN  44  -3.831  16.398  16.398
  333    H    ASN  45           HN       ASN  45  -0.961  19.730  19.730
  334    HA   ASN  45           HA       ASN  45   1.027  21.493  21.493
  335   1HB   ASN  45           HB1      ASN  45  -1.680  22.568  22.568
  336   2HB   ASN  45           HB2      ASN  45  -0.589  23.205  23.205
  337   1HD2  ASN  45          HD21      ASN  45  -3.499  20.641  20.641
  338   2HD2  ASN  45          HD22      ASN  45  -3.340  21.367  21.367
  339    H    THR  46           HN       THR  46   1.353  20.186  20.186
  340    HA   THR  46           HA       THR  46   0.776  22.203  22.203
  341    HB   THR  46           HB       THR  46   0.974  19.736  19.736
  342    HG1  THR  46           HG1      THR  46   1.503  20.631  20.631
  343   1HG2  THR  46          HG21      THR  46   4.006  20.144  20.144
  344   2HG2  THR  46          HG22      THR  46   3.193  18.741  18.741
  345   3HG2  THR  46          HG23      THR  46   3.050  19.124  19.124
  346    H    ALA  47           HN       ALA  47   3.588  21.121  21.121
  347    HA   ALA  47           HA       ALA  47   4.880  23.584  23.584
  348   1HB   ALA  47           HB1      ALA  47   5.264  23.567  23.567
  349   2HB   ALA  47           HB2      ALA  47   6.055  22.013  22.013
  350   3HB   ALA  47           HB3      ALA  47   6.762  23.449  23.449
  351    H    ALA  48           HN       ALA  48   5.453  20.341  20.341
  352    HA   ALA  48           HA       ALA  48   6.095  18.451  18.451
  353   1HB   ALA  48           HB1      ALA  48   6.344  19.797  19.797
  354   2HB   ALA  48           HB2      ALA  48   7.879  20.417  20.417
  355   3HB   ALA  48           HB3      ALA  48   7.676  18.701  18.701
  356    H    ASP  49           HN       ASP  49   7.875  21.205  21.205
  357    HA   ASP  49           HA       ASP  49  10.238  19.794  19.794
  358   1HB   ASP  49           HB1      ASP  49   9.455  22.724  22.724
  359   2HB   ASP  49           HB2      ASP  49  11.075  22.046  22.046
  360    H    ASP  50           HN       ASP  50   7.177  20.285  20.285
  361    HA   ASP  50           HA       ASP  50   7.788  20.287  20.287
  362   1HB   ASP  50           HB1      ASP  50   6.338  22.198  22.198
  363   2HB   ASP  50           HB2      ASP  50   5.218  21.047  21.047
  364    H    LYS  51           HN       LYS  51   7.013  18.420  18.420
  365    HA   LYS  51           HA       LYS  51   5.226  16.521  16.521
  366   1HB   LYS  51           HB1      LYS  51   6.678  16.290  16.290
  367   2HB   LYS  51           HB2      LYS  51   5.599  15.078  15.078
  368   1HG   LYS  51           HG1      LYS  51   3.739  16.740  16.740
  369   2HG   LYS  51           HG2      LYS  51   4.852  17.880  17.880
  370   1HD   LYS  51           HD1      LYS  51   5.281  16.301  16.301
  371   2HD   LYS  51           HD2      LYS  51   4.234  15.108  15.108
  372   1HE   LYS  51           HE1      LYS  51   2.308  16.527  16.527
  373   2HE   LYS  51           HE2      LYS  51   3.278  17.842  17.842
  374   1HZ   LYS  51           HZ1      LYS  51   3.781  15.486  15.486
  375   2HZ   LYS  51           HZ2      LYS  51   2.102  15.724  15.724
  376   3HZ   LYS  51           HZ3      LYS  51   3.102  16.945  16.945
  377    H    GLN  52           HN       GLN  52   8.404  16.687  16.687
  378    HA   GLN  52           HA       GLN  52   9.745  14.507  14.507
  379   1HB   GLN  52           HB1      GLN  52  10.499  17.179  17.179
  380   2HB   GLN  52           HB2      GLN  52  11.143  16.759  16.759
  381   1HG   GLN  52           HG1      GLN  52  12.867  16.346  16.346
  382   2HG   GLN  52           HG2      GLN  52  12.326  14.800  14.800
  383   1HE2  GLN  52          HE21      GLN  52  10.389  15.086  15.086
  384   2HE2  GLN  52          HE22      GLN  52   9.858  15.859  15.859
  385    HA   PRO  53           HA       PRO  53  10.270  14.595  14.595
  386   1HB   PRO  53           HB1      PRO  53   8.183  15.947  15.947
  387   2HB   PRO  53           HB2      PRO  53   9.800  16.608  16.608
  388   1HG   PRO  53           HG1      PRO  53   7.349  16.890  16.890
  389   2HG   PRO  53           HG2      PRO  53   8.365  18.184  18.184
  390   1HD   PRO  53           HD1      PRO  53   8.925  17.351  17.351
  391   2HD   PRO  53           HD2      PRO  53  10.289  17.441  17.441
  392    H    TYR  54           HN       TYR  54   6.907  14.984  14.984
  393    HA   TYR  54           HA       TYR  54   5.876  12.742  12.742
  394   1HB   TYR  54           HB1      TYR  54   4.792  14.188  14.188
  395   2HB   TYR  54           HB2      TYR  54   3.872  13.028  13.028
  396    HD1  TYR  54           HD1      TYR  54   4.320  13.702  13.702
  397    HD2  TYR  54           HD2      TYR  54   4.095  16.369  16.369
  398    HE1  TYR  54           HE1      TYR  54   3.650  15.512  15.512
  399    HE2  TYR  54           HE2      TYR  54   3.431  18.182  18.182
  400    HH   TYR  54           HH       TYR  54   3.905  18.440  18.440
  401    H    GLU  55           HN       GLU  55   6.685  13.250  13.250
  402    HA   GLU  55           HA       GLU  55   6.104  10.729  10.729
  403   1HB   GLU  55           HB1      GLU  55   7.427  13.159  13.159
  404   2HB   GLU  55           HB2      GLU  55   8.520  11.871  11.871
  405   1HG   GLU  55           HG1      GLU  55   6.607  10.741  10.741
  406   2HG   GLU  55           HG2      GLU  55   5.569  12.072  12.072
  407    H    LYS  56           HN       LYS  56   9.234  11.805  11.805
  408    HA   LYS  56           HA       LYS  56  10.776   9.561   9.561
  409   1HB   LYS  56           HB1      LYS  56  11.466  11.805  11.805
  410   2HB   LYS  56           HB2      LYS  56  10.723  11.345  11.345
  411   1HG   LYS  56           HG1      LYS  56  12.605   9.294   9.294
  412   2HG   LYS  56           HG2      LYS  56  13.378  10.835  10.835
  413   1HD   LYS  56           HD1      LYS  56  11.767   9.414   9.414
  414   2HD   LYS  56           HD2      LYS  56  13.504   9.278   9.278
  415   1HE   LYS  56           HE1      LYS  56  13.709  11.777  11.777
  416   2HE   LYS  56           HE2      LYS  56  11.981  11.873  11.873
  417   1HZ   LYS  56           HZ1      LYS  56  13.063   9.917   9.917
  418   2HZ   LYS  56           HZ2      LYS  56  14.006  11.321  11.321
  419   3HZ   LYS  56           HZ3      LYS  56  12.334  11.393  11.393
  420    H    LYS  57           HN       LYS  57   8.291  10.152  10.152
  421    HA   LYS  57           HA       LYS  57   8.858   7.785   7.785
  422   1HB   LYS  57           HB1      LYS  57   6.338   9.484   9.484
  423   2HB   LYS  57           HB2      LYS  57   6.434   8.124   8.124
  424   1HG   LYS  57           HG1      LYS  57   8.782   9.692   9.692
  425   2HG   LYS  57           HG2      LYS  57   7.487  10.846  10.846
  426   1HD   LYS  57           HD1      LYS  57   7.522  10.244  10.244
  427   2HD   LYS  57           HD2      LYS  57   6.086   9.537   9.537
  428   1HE   LYS  57           HE1      LYS  57   7.197   7.877   7.877
  429   2HE   LYS  57           HE2      LYS  57   7.272   7.324   7.324
  430   1HZ   LYS  57           HZ1      LYS  57   9.519   8.910   8.910
  431   2HZ   LYS  57           HZ2      LYS  57   9.369   7.781   7.781
  432   3HZ   LYS  57           HZ3      LYS  57   9.440   7.249   7.249
  433    H    ALA  58           HN       ALA  58   6.290   8.568   8.568
  434    HA   ALA  58           HA       ALA  58   5.019   6.137   6.137
  435   1HB   ALA  58           HB1      ALA  58   5.869   7.970   7.970
  436   2HB   ALA  58           HB2      ALA  58   4.603   6.755   6.755
  437   3HB   ALA  58           HB3      ALA  58   4.411   8.155   8.155
  438    H    ALA  59           HN       ALA  59   7.930   7.112   7.112
  439    HA   ALA  59           HA       ALA  59   8.504   4.737   4.737
  440   1HB   ALA  59           HB1      ALA  59  10.471   6.759   6.759
  441   2HB   ALA  59           HB2      ALA  59  10.856   5.597   5.597
  442   3HB   ALA  59           HB3      ALA  59   9.708   6.884   6.884
  443    H    LYS  60           HN       LYS  60  10.000   5.768   5.768
  444    HA   LYS  60           HA       LYS  60  11.421   3.624   3.624
  445   1HB   LYS  60           HB1      LYS  60  11.043   5.790   5.790
  446   2HB   LYS  60           HB2      LYS  60   9.500   5.169   5.169
  447   1HG   LYS  60           HG1      LYS  60  10.895   3.113   3.113
  448   2HG   LYS  60           HG2      LYS  60  12.263   4.196   4.196
  449   1HD   LYS  60           HD1      LYS  60  11.099   5.884   5.884
  450   2HD   LYS  60           HD2      LYS  60   9.758   4.765   4.765
  451   1HE   LYS  60           HE1      LYS  60  11.402   3.066   3.066
  452   2HE   LYS  60           HE2      LYS  60  12.620   4.338   4.338
  453   1HZ   LYS  60           HZ1      LYS  60  10.323   5.355   5.355
  454   2HZ   LYS  60           HZ2      LYS  60  10.656   3.848   3.848
  455   3HZ   LYS  60           HZ3      LYS  60  11.847   5.058   5.058
  456    H    LEU  61           HN       LEU  61   7.962   4.018   4.018
  457    HA   LEU  61           HA       LEU  61   7.596   1.418   1.418
  458   1HB   LEU  61           HB1      LEU  61   5.547   3.236   3.236
  459   2HB   LEU  61           HB2      LEU  61   5.204   1.988   1.988
  460    HG   LEU  61           HG       LEU  61   6.915   4.495   4.495
  461   1HD1  LEU  61          HD11      LEU  61   4.222   3.718   3.718
  462   2HD1  LEU  61          HD12      LEU  61   5.160   5.142   5.142
  463   3HD1  LEU  61          HD13      LEU  61   4.571   4.973   4.973
  464   1HD2  LEU  61          HD21      LEU  61   6.293   2.270   2.270
  465   2HD2  LEU  61          HD22      LEU  61   7.871   2.613   2.613
  466   3HD2  LEU  61          HD23      LEU  61   7.113   3.782   3.782
  467    H    LYS  62           HN       LYS  62   6.545   2.548   2.548
  468    HA   LYS  62           HA       LYS  62   5.681   0.223   0.223
  469   1HB   LYS  62           HB1      LYS  62   6.181   2.576   2.576
  470   2HB   LYS  62           HB2      LYS  62   7.771   1.931   1.931
  471   1HG   LYS  62           HG1      LYS  62   6.595   1.373   1.373
  472   2HG   LYS  62           HG2      LYS  62   6.556  -0.115  -0.115
  473   1HD   LYS  62           HD1      LYS  62   4.303   0.206   0.206
  474   2HD   LYS  62           HD2      LYS  62   4.259   0.590   0.590
  475   1HE   LYS  62           HE1      LYS  62   3.037   2.313   2.313
  476   2HE   LYS  62           HE2      LYS  62   4.465   3.051   3.051
  477   1HZ   LYS  62           HZ1      LYS  62   5.130   1.960   1.960
  478   2HZ   LYS  62           HZ2      LYS  62   3.740   2.917   2.917
  479   3HZ   LYS  62           HZ3      LYS  62   5.153   3.584   3.584
  480    H    GLU  63           HN       GLU  63   9.007   1.186   1.186
  481    HA   GLU  63           HA       GLU  63  10.314  -1.044  -1.044
  482   1HB   GLU  63           HB1      GLU  63  11.389   1.186   1.186
  483   2HB   GLU  63           HB2      GLU  63  11.188   0.969   0.969
  484   1HG   GLU  63           HG1      GLU  63  12.787  -0.957  -0.957
  485   2HG   GLU  63           HG2      GLU  63  12.984  -0.740  -0.740
  486    H    LYS  64           HN       LYS  64   9.692  -0.297  -0.297
  487    HA   LYS  64           HA       LYS  64  10.738  -2.733  -2.733
  488   1HB   LYS  64           HB1      LYS  64   8.589  -0.848  -0.848
  489   2HB   LYS  64           HB2      LYS  64   8.959  -2.331  -2.331
  490   1HG   LYS  64           HG1      LYS  64  11.410  -1.636  -1.636
  491   2HG   LYS  64           HG2      LYS  64  10.903  -0.096  -0.096
  492   1HD   LYS  64           HD1      LYS  64   9.636   0.468   0.468
  493   2HD   LYS  64           HD2      LYS  64   9.766  -1.164  -1.164
  494   1HE   LYS  64           HE1      LYS  64  12.132   0.717   0.717
  495   2HE   LYS  64           HE2      LYS  64  11.378   0.386   0.386
  496   1HZ   LYS  64           HZ1      LYS  64  11.962  -2.065  -2.065
  497   2HZ   LYS  64           HZ2      LYS  64  13.344  -1.095  -1.095
  498   3HZ   LYS  64           HZ3      LYS  64  12.659  -1.375  -1.375
  499    H    TYR  65           HN       TYR  65   7.509  -1.971  -1.971
  500    HA   TYR  65           HA       TYR  65   6.168  -4.357  -4.357
  501   1HB   TYR  65           HB1      TYR  65   4.797  -2.619  -2.619
  502   2HB   TYR  65           HB2      TYR  65   5.907  -2.209  -2.209
  503    HD1  TYR  65           HD1      TYR  65   4.361  -5.531  -5.531
  504    HD2  TYR  65           HD2      TYR  65   4.534  -2.248  -2.248
  505    HE1  TYR  65           HE1      TYR  65   2.956  -6.750  -6.750
  506    HE2  TYR  65           HE2      TYR  65   3.129  -3.478  -3.478
  507    HH   TYR  65           HH       TYR  65   1.301  -5.440  -5.440
  508    H    GLU  66           HN       GLU  66   7.526  -3.511  -3.511
  509    HA   GLU  66           HA       GLU  66   7.384  -5.868  -5.868
  510   1HB   GLU  66           HB1      GLU  66   9.709  -3.971  -3.971
  511   2HB   GLU  66           HB2      GLU  66   9.476  -5.198  -5.198
  512   1HG   GLU  66           HG1      GLU  66   7.088  -3.455  -3.455
  513   2HG   GLU  66           HG2      GLU  66   8.479  -2.589  -2.589
  514    H    LYS  67           HN       LYS  67   9.714  -5.210  -5.210
  515    HA   LYS  67           HA       LYS  67  11.276  -7.608  -7.608
  516   1HB   LYS  67           HB1      LYS  67  11.488  -5.311  -5.311
  517   2HB   LYS  67           HB2      LYS  67  12.304  -6.786  -6.786
  518   1HG   LYS  67           HG1      LYS  67  13.826  -5.355  -5.355
  519   2HG   LYS  67           HG2      LYS  67  13.516  -6.806  -6.806
  520   1HD   LYS  67           HD1      LYS  67  11.904  -5.481  -5.481
  521   2HD   LYS  67           HD2      LYS  67  12.277  -4.057  -4.057
  522   1HE   LYS  67           HE1      LYS  67  13.617  -4.087  -4.087
  523   2HE   LYS  67           HE2      LYS  67  14.663  -4.220  -4.220
  524   1HZ   LYS  67           HZ1      LYS  67  13.864  -6.790  -6.790
  525   2HZ   LYS  67           HZ2      LYS  67  14.421  -5.980  -5.980
  526   3HZ   LYS  67           HZ3      LYS  67  15.422  -6.117  -6.117
  527    H    ASP  68           HN       ASP  68   8.969  -6.640  -6.640
  528    HA   ASP  68           HA       ASP  68   9.199  -8.964  -8.964
  529   1HB   ASP  68           HB1      ASP  68   7.180  -6.714  -6.714
  530   2HB   ASP  68           HB2      ASP  68   7.325  -7.913  -7.913
  531    H    ILE  69           HN       ILE  69   7.536  -7.915  -7.915
  532    HA   ILE  69           HA       ILE  69   5.428  -9.933  -9.933
  533    HB   ILE  69           HB       ILE  69   4.881  -7.696  -7.696
  534   1HG1  ILE  69          HG11      ILE  69   3.519  -8.501  -8.501
  535   2HG1  ILE  69          HG12      ILE  69   4.620  -9.819  -9.819
  536   1HG2  ILE  69          HG21      ILE  69   7.001  -7.474  -7.474
  537   2HG2  ILE  69          HG22      ILE  69   6.526  -8.714  -8.714
  538   3HG2  ILE  69          HG23      ILE  69   5.627  -7.198  -7.198
  539   1HD1  ILE  69          HD11      ILE  69   3.031  -9.549  -9.549
  540   2HD1  ILE  69          HD12      ILE  69   2.605 -10.620 -10.620
  541   3HD1  ILE  69          HD13      ILE  69   4.069 -10.891 -10.891
  542    H    ALA  70           HN       ALA  70   8.287  -9.358  -9.358
  543    HA   ALA  70           HA       ALA  70   8.260 -11.504 -11.504
  544   1HB   ALA  70           HB1      ALA  70  10.646 -10.043 -10.043
  545   2HB   ALA  70           HB2      ALA  70  10.732 -11.095 -11.095
  546   3HB   ALA  70           HB3      ALA  70   9.847  -9.593  -9.593
  547    H    ALA  71           HN       ALA  71   9.094 -10.994 -10.994
  548    HA   ALA  71           HA       ALA  71  10.374 -13.563 -13.563
  549   1HB   ALA  71           HB1      ALA  71   9.278 -11.459 -11.459
  550   2HB   ALA  71           HB2      ALA  71  10.285 -12.825 -12.825
  551   3HB   ALA  71           HB3      ALA  71  10.940 -11.548 -11.548
  552    H    TYR  72           HN       TYR  72   7.298 -11.987 -11.987
  553    HA   TYR  72           HA       TYR  72   5.870 -14.078 -14.078
  554   1HB   TYR  72           HB1      TYR  72   5.410 -11.494 -11.494
  555   2HB   TYR  72           HB2      TYR  72   4.319 -12.401 -12.401
  556    HD1  TYR  72           HD1      TYR  72   5.203 -11.761 -11.761
  557    HD2  TYR  72           HD2      TYR  72   2.332 -13.372 -13.372
  558    HE1  TYR  72           HE1      TYR  72   3.602 -11.960 -11.960
  559    HE2  TYR  72           HE2      TYR  72   0.725 -13.577 -13.577
  560    HH   TYR  72           HH       TYR  72   1.395 -13.668 -13.668
  561    H    ARG  73           HN       ARG  73   6.478 -13.242 -13.242
  562    HA   ARG  73           HA       ARG  73   4.767 -15.033 -15.033
  563   1HB   ARG  73           HB1      ARG  73   5.313 -12.958 -12.958
  564   2HB   ARG  73           HB2      ARG  73   6.998 -13.096 -13.096
  565   1HG   ARG  73           HG1      ARG  73   7.509 -14.670 -14.670
  566   2HG   ARG  73           HG2      ARG  73   5.812 -14.896 -14.896
  567   1HD   ARG  73           HD1      ARG  73   5.732 -12.600 -12.600
  568   2HD   ARG  73           HD2      ARG  73   7.346 -12.262 -12.262
  569    HE   ARG  73           HE       ARG  73   6.805 -14.263 -14.263
  570   1HH1  ARG  73          HH11      ARG  73   9.443 -14.680 -14.680
  571   2HH1  ARG  73          HH12      ARG  73  10.396 -13.485 -13.485
  572   1HH2  ARG  73          HH21      ARG  73   7.614 -11.479 -11.479
  573   2HH2  ARG  73          HH22      ARG  73   9.332 -11.620 -11.620
  574    H    ALA  74           HN       ALA  74   7.915 -14.974 -14.974
  575    HA   ALA  74           HA       ALA  74   9.536 -16.750 -16.750
  576   1HB   ALA  74           HB1      ALA  74  10.014 -15.788 -15.788
  577   2HB   ALA  74           HB2      ALA  74   8.900 -16.935 -16.935
  578   3HB   ALA  74           HB3      ALA  74  10.374 -17.507 -17.507
  579    H    LYS  75           HN       LYS  75   6.737 -17.713 -17.713
  580    HA   LYS  75           HA       LYS  75   7.031 -20.585 -20.585
  581   1HB   LYS  75           HB1      LYS  75   6.601 -20.092 -20.092
  582   2HB   LYS  75           HB2      LYS  75   5.226 -19.095 -19.095
  583   1HG   LYS  75           HG1      LYS  75   5.237 -22.008 -22.008
  584   2HG   LYS  75           HG2      LYS  75   4.870 -21.590 -21.590
  585   1HD   LYS  75           HD1      LYS  75   2.973 -20.219 -20.219
  586   2HD   LYS  75           HD2      LYS  75   3.320 -20.436 -20.436
  587   1HE   LYS  75           HE1      LYS  75   2.636 -22.705 -22.705
  588   2HE   LYS  75           HE2      LYS  75   1.526 -21.978 -21.978
  589   1HZ   LYS  75           HZ1      LYS  75   3.874 -22.651 -22.651
  590   2HZ   LYS  75           HZ2      LYS  75   3.378 -23.998 -23.998
  591   3HZ   LYS  75           HZ3      LYS  75   2.311 -23.280 -23.280
  592    H    GLY  76           HN       GLY  76   4.688 -17.955 -17.955
  593   1HA   GLY  76           HA1      GLY  76   3.551 -17.514 -17.514
  594   2HA   GLY  76           HA2      GLY  76   3.223 -19.257 -19.257
  595    H    LYS  77           HN       LYS  77   3.266 -17.335 -17.335
  596    HA   LYS  77           HA       LYS  77   1.723 -16.853 -16.853
  597   1HB   LYS  77           HB1      LYS  77  -0.263 -16.791 -16.791
  598   2HB   LYS  77           HB2      LYS  77  -0.451 -15.978 -15.978
  599   1HG   LYS  77           HG1      LYS  77   1.616 -14.632 -14.632
  600   2HG   LYS  77           HG2      LYS  77   1.800 -15.431 -15.431
  601   1HD   LYS  77           HD1      LYS  77   0.794 -13.324 -13.324
  602   2HD   LYS  77           HD2      LYS  77  -0.452 -14.533 -14.533
  603   1HE   LYS  77           HE1      LYS  77  -1.398 -14.046 -14.046
  604   2HE   LYS  77           HE2      LYS  77  -0.107 -12.885 -12.885
  605   1HZ   LYS  77           HZ1      LYS  77  -1.282 -12.250 -12.250
  606   2HZ   LYS  77           HZ2      LYS  77  -2.538 -12.498 -12.498
  607   3HZ   LYS  77           HZ3      LYS  77  -1.315 -11.366 -11.366
  608    HA   PRO  78           HA       PRO  78  -0.573 -20.671 -20.671
  609   1HB   PRO  78           HB1      PRO  78  -1.959 -20.134 -20.134
  610   2HB   PRO  78           HB2      PRO  78  -0.192 -20.022 -20.022
  611   1HG   PRO  78           HG1      PRO  78  -2.203 -17.750 -17.750
  612   2HG   PRO  78           HG2      PRO  78  -0.873 -17.815 -17.815
  613   1HD   PRO  78           HD1      PRO  78  -0.635 -16.613 -16.613
  614   2HD   PRO  78           HD2      PRO  78   0.754 -17.325 -17.325
  615    H    ASP  79           HN       ASP  79  -1.513 -18.663 -18.663
  616    HA   ASP  79           HA       ASP  79  -4.355 -19.498 -19.498
  617   1HB   ASP  79           HB1      ASP  79  -4.205 -17.198 -17.198
  618   2HB   ASP  79           HB2      ASP  79  -3.371 -16.624 -16.624
  619    H    ALA  80           HN       ALA  80  -2.380 -20.703 -20.703
  620    HA   ALA  80           HA       ALA  80  -2.332 -19.558 -19.558
  621   1HB   ALA  80           HB1      ALA  80  -0.998 -22.044 -22.044
  622   2HB   ALA  80           HB2      ALA  80  -0.708 -21.407 -21.407
  623   3HB   ALA  80           HB3      ALA  80  -0.223 -20.483 -20.483
  624    H    ALA  81           HN       ALA  81  -3.034 -22.624 -22.624
  625    HA   ALA  81           HA       ALA  81  -4.269 -24.144 -24.144
  626   1HB   ALA  81           HB1      ALA  81  -3.978 -24.841 -24.841
  627   2HB   ALA  81           HB2      ALA  81  -5.250 -23.745 -23.745
  628   3HB   ALA  81           HB3      ALA  81  -5.634 -25.125 -25.125
  629   1H1   BME  16           HE1      MER  16  -9.017  10.758  10.758
  630   2H1   BME  16           HE2      MER  16  -9.132  10.569  10.569
  631   1H2   BME  16           HZ1      MER  16  -6.549  10.629  10.629
  632   2H2   BME  16           HZ2      MER  16  -7.266   9.172   9.172
  633    HO1  BME  16           HH       MER  16  -8.557  12.753  12.753

  Start of MODEL   49
    1    H    ASN   3           HN       ASN   3  -1.365 -12.720 -12.720
    2    HA   ASN   3           HA       ASN   3   0.569 -13.615 -13.615
    3   1HB   ASN   3           HB1      ASN   3  -1.436 -15.022 -15.022
    4   2HB   ASN   3           HB2      ASN   3  -2.476 -13.614 -13.614
    5   1HD2  ASN   3          HD21      ASN   3  -0.455 -13.443 -13.443
    6   2HD2  ASN   3          HD22      ASN   3   0.318 -13.133 -13.133
    7    H    ALA   4           HN       ALA   4   1.452 -11.896 -11.896
    8    HA   ALA   4           HA       ALA   4   1.744  -9.814  -9.814
    9   1HB   ALA   4           HB1      ALA   4  -1.268  -9.929  -9.929
   10   2HB   ALA   4           HB2      ALA   4  -0.212  -8.768  -8.768
   11   3HB   ALA   4           HB3      ALA   4  -0.071 -10.482 -10.482
   12    HA   PRO   5           HA       PRO   5   1.206  -7.244  -7.244
   13   1HB   PRO   5           HB1      PRO   5   3.622  -6.018  -6.018
   14   2HB   PRO   5           HB2      PRO   5   3.344  -6.472  -6.472
   15   1HG   PRO   5           HG1      PRO   5   4.888  -8.054  -8.054
   16   2HG   PRO   5           HG2      PRO   5   3.742  -8.791  -8.791
   17   1HD   PRO   5           HD1      PRO   5   3.376  -8.380  -8.380
   18   2HD   PRO   5           HD2      PRO   5   3.072  -9.804  -9.804
   19    H    LYS   6           HN       LYS   6  -0.251  -6.824  -6.824
   20    HA   LYS   6           HA       LYS   6  -1.406  -5.296  -5.296
   21   1HB   LYS   6           HB1      LYS   6  -1.583  -4.676  -4.676
   22   2HB   LYS   6           HB2      LYS   6  -1.943  -3.257  -3.257
   23   1HG   LYS   6           HG1      LYS   6  -4.019  -4.396  -4.396
   24   2HG   LYS   6           HG2      LYS   6  -3.533  -4.689  -4.689
   25   1HD   LYS   6           HD1      LYS   6  -2.402  -6.888  -6.888
   26   2HD   LYS   6           HD2      LYS   6  -3.580  -6.585  -6.585
   27   1HE   LYS   6           HE1      LYS   6  -5.391  -6.527  -6.527
   28   2HE   LYS   6           HE2      LYS   6  -4.171  -6.976  -6.976
   29   1HZ   LYS   6           HZ1      LYS   6  -3.996  -8.722  -8.722
   30   2HZ   LYS   6           HZ2      LYS   6  -5.612  -8.644  -8.644
   31   3HZ   LYS   6           HZ3      LYS   6  -4.391  -9.062  -9.062
   32    H    ARG   7           HN       ARG   7  -1.895  -2.845  -2.845
   33    HA   ARG   7           HA       ARG   7   0.633  -1.658  -1.658
   34   1HB   ARG   7           HB1      ARG   7  -0.898  -0.278  -0.278
   35   2HB   ARG   7           HB2      ARG   7  -0.810  -1.994  -1.994
   36   1HG   ARG   7           HG1      ARG   7  -2.974  -2.421  -2.421
   37   2HG   ARG   7           HG2      ARG   7  -3.040  -1.081  -1.081
   38   1HD   ARG   7           HD1      ARG   7  -3.029   0.464   0.464
   39   2HD   ARG   7           HD2      ARG   7  -3.202  -0.978  -0.978
   40    HE   ARG   7           HE       ARG   7  -5.367  -1.402  -1.402
   41   1HH1  ARG   7          HH11      ARG   7  -5.872  -0.128  -0.128
   42   2HH1  ARG   7          HH12      ARG   7  -6.441   1.470   1.470
   43   1HH2  ARG   7          HH21      ARG   7  -5.178   1.401   1.401
   44   2HH2  ARG   7          HH22      ARG   7  -6.040   2.354   2.354
   45    HA   PRO   8           HA       PRO   8  -0.406   0.875   0.875
   46   1HB   PRO   8           HB1      PRO   8   2.020   2.226   2.226
   47   2HB   PRO   8           HB2      PRO   8   1.801   0.548   0.548
   48   1HG   PRO   8           HG1      PRO   8   2.737   1.557   1.557
   49   2HG   PRO   8           HG2      PRO   8   3.584   0.443   0.443
   50   1HD   PRO   8           HD1      PRO   8   2.096  -0.571  -0.571
   51   2HD   PRO   8           HD2      PRO   8   1.905  -1.299  -1.299
   52    HA   PRO   9           HA       PRO   9  -1.273   5.338   5.338
   53   1HB   PRO   9           HB1      PRO   9   1.469   5.469   5.469
   54   2HB   PRO   9           HB2      PRO   9   0.196   6.702   6.702
   55   1HG   PRO   9           HG1      PRO   9   0.268   4.923   4.923
   56   2HG   PRO   9           HG2      PRO   9  -1.300   5.250   5.250
   57   1HD   PRO   9           HD1      PRO   9   0.471   2.835   2.835
   58   2HD   PRO   9           HD2      PRO   9  -1.296   2.933   2.933
   59    H    SER  10           HN       SER  10  -0.231   7.330   7.330
   60    HA   SER  10           HA       SER  10   1.165   6.524   6.524
   61   1HB   SER  10           HB1      SER  10  -0.793   8.804   8.804
   62   2HB   SER  10           HB2      SER  10  -0.015   8.398   8.398
   63    HG   SER  10           HG       SER  10  -1.431   6.892   6.892
   64    H    ALA  11           HN       ALA  11   0.851   9.294   9.294
   65    HA   ALA  11           HA       ALA  11   3.303  10.105  10.105
   66   1HB   ALA  11           HB1      ALA  11   2.699  11.314  11.314
   67   2HB   ALA  11           HB2      ALA  11   4.036  11.776  11.776
   68   3HB   ALA  11           HB3      ALA  11   4.031  10.202  10.202
   69    H    PHE  12           HN       PHE  12   0.651  11.089  11.089
   70    HA   PHE  12           HA       PHE  12   0.046  13.582  13.582
   71   1HB   PHE  12           HB1      PHE  12  -1.010  13.511  13.511
   72   2HB   PHE  12           HB2      PHE  12  -0.940  11.731  11.731
   73    HD1  PHE  12           HD1      PHE  12  -3.206  13.055  13.055
   74    HD2  PHE  12           HD2      PHE  12  -2.715  11.996  11.996
   75    HE1  PHE  12           HE1      PHE  12  -5.639  12.935  12.935
   76    HE2  PHE  12           HE2      PHE  12  -5.142  11.874  11.874
   77    HZ   PHE  12           HZ       PHE  12  -6.615  12.339  12.339
   78    H    PHE  13           HN       PHE  13  -0.709  10.205  10.205
   79    HA   PHE  13           HA       PHE  13  -2.817  10.404  10.404
   80   1HB   PHE  13           HB1      PHE  13  -1.481   8.320   8.320
   81   2HB   PHE  13           HB2      PHE  13  -0.404   8.709   8.709
   82    HD1  PHE  13           HD1      PHE  13  -3.946   8.041   8.041
   83    HD2  PHE  13           HD2      PHE  13  -1.097   8.211   8.211
   84    HE1  PHE  13           HE1      PHE  13  -5.603   7.080   7.080
   85    HE2  PHE  13           HE2      PHE  13  -2.757   7.251   7.251
   86    HZ   PHE  13           HZ       PHE  13  -5.011   6.690   6.690
   87    H    LEU  14           HN       LEU  14   0.608  10.928  10.928
   88    HA   LEU  14           HA       LEU  14   0.195  11.431  11.431
   89   1HB   LEU  14           HB1      LEU  14   2.259  12.749  12.749
   90   2HB   LEU  14           HB2      LEU  14   2.348  12.709  12.709
   91    HG   LEU  14           HG       LEU  14   3.870  11.110  11.110
   92   1HD1  LEU  14          HD11      LEU  14   2.435  10.077  10.077
   93   2HD1  LEU  14          HD12      LEU  14   1.358   9.462   9.462
   94   3HD1  LEU  14          HD13      LEU  14   3.002   8.865   8.865
   95   1HD2  LEU  14          HD21      LEU  14   3.454  11.025  11.025
   96   2HD2  LEU  14          HD22      LEU  14   3.623   9.405   9.405
   97   3HD2  LEU  14          HD23      LEU  14   2.036  10.013  10.013
   98    H    PHE  15           HN       PHE  15   0.623  13.713  13.713
   99    HA   PHE  15           HA       PHE  15  -0.051  16.147  16.147
  100   1HB   PHE  15           HB1      PHE  15   0.947  16.184  16.184
  101   2HB   PHE  15           HB2      PHE  15  -0.091  14.874  14.874
  102    HD1  PHE  15           HD1      PHE  15  -0.006  18.552  18.552
  103    HD2  PHE  15           HD2      PHE  15  -1.960  15.293  15.293
  104    HE1  PHE  15           HE1      PHE  15  -1.352  20.123  20.123
  105    HE2  PHE  15           HE2      PHE  15  -3.285  16.871  16.871
  106    HZ   PHE  15           HZ       PHE  15  -2.984  19.284  19.284
  107    H    CYS  16           HN       MER  16  -2.229  13.920  13.920
  108    HA   CYS  16           HA       MER  16  -4.701  15.190  15.190
  109   1HB   CYS  16           HB1      MER  16  -5.616  13.169  13.169
  110   2HB   CYS  16           HB2      MER  16  -3.956  12.781  12.781
  111    H    SER  17           HN       SER  17  -3.124  13.003  13.003
  112    HA   SER  17           HA       SER  17  -5.074  12.948  12.948
  113   1HB   SER  17           HB1      SER  17  -2.034  13.005  13.005
  114   2HB   SER  17           HB2      SER  17  -3.263  12.291  12.291
  115    HG   SER  17           HG       SER  17  -3.587  11.405  11.405
  116    H    GLU  18           HN       GLU  18  -2.426  15.131  15.131
  117    HA   GLU  18           HA       GLU  18  -2.967  16.880  16.880
  118   1HB   GLU  18           HB1      GLU  18  -0.770  16.596  16.596
  119   2HB   GLU  18           HB2      GLU  18  -1.380  17.294  17.294
  120   1HG   GLU  18           HG1      GLU  18  -1.765  19.458  19.458
  121   2HG   GLU  18           HG2      GLU  18  -1.283  18.790  18.790
  122    H    TYR  19           HN       TYR  19  -4.536  16.528  16.528
  123    HA   TYR  19           HA       TYR  19  -5.577  19.306  19.306
  124   1HB   TYR  19           HB1      TYR  19  -5.233  17.082  17.082
  125   2HB   TYR  19           HB2      TYR  19  -6.667  18.115  18.115
  126    HD1  TYR  19           HD1      TYR  19  -3.117  18.653  18.653
  127    HD2  TYR  19           HD2      TYR  19  -6.291  19.826  19.826
  128    HE1  TYR  19           HE1      TYR  19  -1.666  20.354  20.354
  129    HE2  TYR  19           HE2      TYR  19  -4.840  21.527  21.527
  130    HH   TYR  19           HH       TYR  19  -2.733  22.273  22.273
  131    H    ARG  20           HN       ARG  20  -6.728  16.031  16.031
  132    HA   ARG  20           HA       ARG  20  -9.335  15.918  15.918
  133   1HB   ARG  20           HB1      ARG  20  -7.593  14.955  14.955
  134   2HB   ARG  20           HB2      ARG  20  -9.294  14.987  14.987
  135   1HG   ARG  20           HG1      ARG  20  -9.660  13.744  13.744
  136   2HG   ARG  20           HG2      ARG  20  -7.925  13.459  13.459
  137   1HD   ARG  20           HD1      ARG  20  -8.083  12.288  12.288
  138   2HD   ARG  20           HD2      ARG  20  -9.772  12.748  12.748
  139    HE   ARG  20           HE       ARG  20 -10.133  11.361  11.361
  140   1HH1  ARG  20          HH11      ARG  20  -7.957  10.022  10.022
  141   2HH1  ARG  20          HH12      ARG  20  -7.717   8.675   8.675
  142   1HH2  ARG  20          HH21      ARG  20  -9.752  10.023  10.023
  143   2HH2  ARG  20          HH22      ARG  20  -8.762   8.671   8.671
  144    HA   PRO  21           HA       PRO  21 -11.042  18.029  18.029
  145   1HB   PRO  21           HB1      PRO  21  -9.540  19.204  19.204
  146   2HB   PRO  21           HB2      PRO  21  -9.588  17.436  17.436
  147   1HG   PRO  21           HG1      PRO  21  -7.537  19.301  19.301
  148   2HG   PRO  21           HG2      PRO  21  -7.204  18.010  18.010
  149   1HD   PRO  21           HD1      PRO  21  -7.090  17.441  17.441
  150   2HD   PRO  21           HD2      PRO  21  -7.927  16.304  16.304
  151    H    LYS  22           HN       LYS  22  -8.743  19.568  19.568
  152    HA   LYS  22           HA       LYS  22  -9.611  22.328  22.328
  153   1HB   LYS  22           HB1      LYS  22  -7.181  21.456  21.456
  154   2HB   LYS  22           HB2      LYS  22  -7.724  21.342  21.342
  155   1HG   LYS  22           HG1      LYS  22  -6.812  23.504  23.504
  156   2HG   LYS  22           HG2      LYS  22  -8.513  23.822  23.822
  157   1HD   LYS  22           HD1      LYS  22  -7.949  24.926  24.926
  158   2HD   LYS  22           HD2      LYS  22  -7.574  23.373  23.373
  159   1HE   LYS  22           HE1      LYS  22  -5.619  25.197  25.197
  160   2HE   LYS  22           HE2      LYS  22  -5.640  24.841  24.841
  161   1HZ   LYS  22           HZ1      LYS  22  -5.514  22.413  22.413
  162   2HZ   LYS  22           HZ2      LYS  22  -4.349  23.455  23.455
  163   3HZ   LYS  22           HZ3      LYS  22  -4.343  23.128  23.128
  164    H    ILE  23           HN       ILE  23  -9.976  19.779  19.779
  165    HA   ILE  23           HA       ILE  23 -11.388  21.674  21.674
  166    HB   ILE  23           HB       ILE  23 -11.599  18.696  18.696
  167   1HG1  ILE  23          HG11      ILE  23  -8.962  20.236  20.236
  168   2HG1  ILE  23          HG12      ILE  23  -9.261  18.860  18.860
  169   1HG2  ILE  23          HG21      ILE  23 -12.568  20.479  20.479
  170   2HG2  ILE  23          HG22      ILE  23 -10.965  21.152  21.152
  171   3HG2  ILE  23          HG23      ILE  23 -11.356  19.570  19.570
  172   1HD1  ILE  23          HD11      ILE  23  -9.762  17.421  17.421
  173   2HD1  ILE  23          HD12      ILE  23  -9.507  18.738  18.738
  174   3HD1  ILE  23          HD13      ILE  23  -8.165  18.122  18.122
  175    H    LYS  24           HN       LYS  24 -11.842  18.925  18.925
  176    HA   LYS  24           HA       LYS  24 -14.617  18.547  18.547
  177   1HB   LYS  24           HB1      LYS  24 -12.870  17.028  17.028
  178   2HB   LYS  24           HB2      LYS  24 -12.698  18.076  18.076
  179   1HG   LYS  24           HG1      LYS  24 -14.700  17.489  17.489
  180   2HG   LYS  24           HG2      LYS  24 -15.535  17.208  17.208
  181   1HD   LYS  24           HD1      LYS  24 -15.265  15.128  15.128
  182   2HD   LYS  24           HD2      LYS  24 -14.406  15.020  15.020
  183   1HE   LYS  24           HE1      LYS  24 -12.274  15.523  15.523
  184   2HE   LYS  24           HE2      LYS  24 -13.152  15.621  15.621
  185   1HZ   LYS  24           HZ1      LYS  24 -13.772  13.233  13.233
  186   2HZ   LYS  24           HZ2      LYS  24 -12.096  13.371  13.371
  187   3HZ   LYS  24           HZ3      LYS  24 -13.130  13.442  13.442
  188    H    GLY  25           HN       GLY  25 -12.648  20.738  20.738
  189   1HA   GLY  25           HA1      GLY  25 -14.613  21.675  21.675
  190   2HA   GLY  25           HA2      GLY  25 -13.099  22.481  22.481
  191    H    GLU  26           HN       GLU  26 -13.450  22.802  22.802
  192    HA   GLU  26           HA       GLU  26 -15.188  25.107  25.107
  193   1HB   GLU  26           HB1      GLU  26 -13.520  23.760  23.760
  194   2HB   GLU  26           HB2      GLU  26 -14.230  25.354  25.354
  195   1HG   GLU  26           HG1      GLU  26 -12.344  24.662  24.662
  196   2HG   GLU  26           HG2      GLU  26 -11.722  25.172  25.172
  197    H    HIS  27           HN       HIS  27 -15.117  22.064  22.064
  198    HA   HIS  27           HA       HIS  27 -17.936  22.342  22.342
  199   1HB   HIS  27           HB1      HIS  27 -15.837  20.825  20.825
  200   2HB   HIS  27           HB2      HIS  27 -17.397  21.452  21.452
  201    HD1  HIS  27           HD1      HIS  27 -17.429  24.216  24.216
  202    HD2  HIS  27           HD2      HIS  27 -13.725  22.484  22.484
  203    HE1  HIS  27           HE1      HIS  27 -15.845  25.979  25.979
  204    HA   PRO  28           HA       PRO  28 -17.871  18.288  18.288
  205   1HB   PRO  28           HB1      PRO  28 -19.700  18.796  18.796
  206   2HB   PRO  28           HB2      PRO  28 -18.034  19.329  19.329
  207   1HG   PRO  28           HG1      PRO  28 -20.383  20.962  20.962
  208   2HG   PRO  28           HG2      PRO  28 -19.315  21.398  21.398
  209   1HD   PRO  28           HD1      PRO  28 -18.834  22.280  22.280
  210   2HD   PRO  28           HD2      PRO  28 -17.478  21.920  21.920
  211    H    GLY  29           HN       GLY  29 -18.705  18.954  18.954
  212   1HA   GLY  29           HA1      GLY  29 -21.508  18.055  18.055
  213   2HA   GLY  29           HA2      GLY  29 -20.892  19.345  19.345
  214    H    LEU  30           HN       LEU  30 -18.238  17.701  17.701
  215    HA   LEU  30           HA       LEU  30 -19.075  16.107  16.107
  216   1HB   LEU  30           HB1      LEU  30 -16.230  15.966  15.966
  217   2HB   LEU  30           HB2      LEU  30 -17.127  16.685  16.685
  218    HG   LEU  30           HG       LEU  30 -16.517  18.156  18.156
  219   1HD1  LEU  30          HD11      LEU  30 -15.038  18.141  18.141
  220   2HD1  LEU  30          HD12      LEU  30 -14.677  19.209  19.209
  221   3HD1  LEU  30          HD13      LEU  30 -14.434  17.481  17.481
  222   1HD2  LEU  30          HD21      LEU  30 -17.311  19.067  19.067
  223   2HD2  LEU  30          HD22      LEU  30 -18.420  19.067  19.067
  224   3HD2  LEU  30          HD23      LEU  30 -17.028  20.131  20.131
  225    H    SER  31           HN       SER  31 -17.445  14.198  14.198
  226    HA   SER  31           HA       SER  31 -17.618  12.376  12.376
  227   1HB   SER  31           HB1      SER  31 -17.942  11.711  11.711
  228   2HB   SER  31           HB2      SER  31 -18.014  10.543  10.543
  229    HG   SER  31           HG       SER  31 -19.559  12.619  12.619
  230    H    ILE  32           HN       ILE  32 -16.150  10.462  10.462
  231    HA   ILE  32           HA       ILE  32 -13.470  11.365  11.365
  232    HB   ILE  32           HB       ILE  32 -14.985   8.863   8.863
  233   1HG1  ILE  32          HG11      ILE  32 -13.205   8.364   8.364
  234   2HG1  ILE  32          HG12      ILE  32 -12.213   9.657   9.657
  235   1HG2  ILE  32          HG21      ILE  32 -13.881   8.061   8.061
  236   2HG2  ILE  32          HG22      ILE  32 -12.309   8.439   8.439
  237   3HG2  ILE  32          HG23      ILE  32 -13.319   7.186   7.186
  238   1HD1  ILE  32          HD11      ILE  32 -14.947  10.039  10.039
  239   2HD1  ILE  32          HD12      ILE  32 -13.402  10.382  10.382
  240   3HD1  ILE  32          HD13      ILE  32 -13.933  11.338  11.338
  241    H    GLY  33           HN       GLY  33 -15.354  10.739  10.739
  242   1HA   GLY  33           HA1      GLY  33 -13.101  10.206  10.206
  243   2HA   GLY  33           HA2      GLY  33 -14.807  10.189  10.189
  244    H    ASP  34           HN       ASP  34 -14.786  12.849  12.849
  245    HA   ASP  34           HA       ASP  34 -14.231  14.617  14.617
  246   1HB   ASP  34           HB1      ASP  34 -15.823  14.891  14.891
  247   2HB   ASP  34           HB2      ASP  34 -15.703  16.225  16.225
  248    H    VAL  35           HN       VAL  35 -13.776  14.151  14.151
  249    HA   VAL  35           HA       VAL  35 -12.047  16.355  16.355
  250    HB   VAL  35           HB       VAL  35 -12.608  13.655  13.655
  251   1HG1  VAL  35          HG11      VAL  35 -10.405  14.509  14.509
  252   2HG1  VAL  35          HG12      VAL  35 -11.170  16.030  16.030
  253   3HG1  VAL  35          HG13      VAL  35 -11.624  14.569  14.569
  254   1HG2  VAL  35          HG21      VAL  35 -14.531  15.241  15.241
  255   2HG2  VAL  35          HG22      VAL  35 -13.994  15.004  15.004
  256   3HG2  VAL  35          HG23      VAL  35 -13.564  16.472  16.472
  257    H    ALA  36           HN       ALA  36 -11.661  13.213  13.213
  258    HA   ALA  36           HA       ALA  36  -8.752  13.222  13.222
  259   1HB   ALA  36           HB1      ALA  36 -10.019  11.183  11.183
  260   2HB   ALA  36           HB2      ALA  36 -10.694  11.277  11.277
  261   3HB   ALA  36           HB3      ALA  36  -8.976  10.955  10.955
  262    H    LYS  37           HN       LYS  37 -11.310  13.426  13.426
  263    HA   LYS  37           HA       LYS  37  -9.442  13.471  13.471
  264   1HB   LYS  37           HB1      LYS  37 -11.749  12.893  12.893
  265   2HB   LYS  37           HB2      LYS  37 -12.317  14.386  14.386
  266   1HG   LYS  37           HG1      LYS  37 -12.458  14.489  14.489
  267   2HG   LYS  37           HG2      LYS  37 -11.350  15.695  15.695
  268   1HD   LYS  37           HD1      LYS  37  -9.978  14.891  14.891
  269   2HD   LYS  37           HD2      LYS  37  -9.545  13.681  13.681
  270   1HE   LYS  37           HE1      LYS  37 -11.704  13.352  13.352
  271   2HE   LYS  37           HE2      LYS  37 -10.106  12.639  12.639
  272   1HZ   LYS  37           HZ1      LYS  37 -11.208  11.913  11.913
  273   2HZ   LYS  37           HZ2      LYS  37 -12.405  11.660  11.660
  274   3HZ   LYS  37           HZ3      LYS  37 -10.877  10.940  10.940
  275    H    LYS  38           HN       LYS  38 -10.992  16.078  16.078
  276    HA   LYS  38           HA       LYS  38  -9.950  18.219  18.219
  277   1HB   LYS  38           HB1      LYS  38 -11.952  18.199  18.199
  278   2HB   LYS  38           HB2      LYS  38 -10.812  18.196  18.196
  279   1HG   LYS  38           HG1      LYS  38 -10.308  20.322  20.322
  280   2HG   LYS  38           HG2      LYS  38 -11.857  20.449  20.449
  281   1HD   LYS  38           HD1      LYS  38 -10.714  20.375  20.375
  282   2HD   LYS  38           HD2      LYS  38  -9.158  20.284  20.284
  283   1HE   LYS  38           HE1      LYS  38  -9.559  22.468  22.468
  284   2HE   LYS  38           HE2      LYS  38 -11.182  22.539  22.539
  285   1HZ   LYS  38           HZ1      LYS  38  -9.380  22.110  22.110
  286   2HZ   LYS  38           HZ2      LYS  38  -8.803  23.399  23.399
  287   3HZ   LYS  38           HZ3      LYS  38 -10.371  23.457  23.457
  288    H    LEU  39           HN       LEU  39  -8.964  16.845  16.845
  289    HA   LEU  39           HA       LEU  39  -6.529  18.428  18.428
  290   1HB   LEU  39           HB1      LEU  39  -6.321  17.782  17.782
  291   2HB   LEU  39           HB2      LEU  39  -7.986  17.312  17.312
  292    HG   LEU  39           HG       LEU  39  -7.022  15.005  15.005
  293   1HD1  LEU  39          HD11      LEU  39  -4.724  16.308  16.308
  294   2HD1  LEU  39          HD12      LEU  39  -4.911  14.591  14.591
  295   3HD1  LEU  39          HD13      LEU  39  -4.648  15.494  15.494
  296   1HD2  LEU  39          HD21      LEU  39  -8.285  15.735  15.735
  297   2HD2  LEU  39          HD22      LEU  39  -7.093  14.492  14.492
  298   3HD2  LEU  39          HD23      LEU  39  -6.721  16.171  16.171
  299    H    GLY  40           HN       GLY  40  -7.430  15.539  15.539
  300   1HA   GLY  40           HA1      GLY  40  -4.692  14.483  14.483
  301   2HA   GLY  40           HA2      GLY  40  -6.090  13.833  13.833
  302    H    GLU  41           HN       GLU  41  -6.492  16.858  16.858
  303    HA   GLU  41           HA       GLU  41  -4.971  16.843  16.843
  304   1HB   GLU  41           HB1      GLU  41  -7.395  17.249  17.249
  305   2HB   GLU  41           HB2      GLU  41  -7.165  18.623  18.623
  306   1HG   GLU  41           HG1      GLU  41  -7.268  19.754  19.754
  307   2HG   GLU  41           HG2      GLU  41  -5.540  19.434  19.434
  308    H    MET  42           HN       MET  42  -5.733  18.698  18.698
  309    HA   MET  42           HA       MET  42  -4.021  20.898  20.898
  310   1HB   MET  42           HB1      MET  42  -4.731  19.347  19.347
  311   2HB   MET  42           HB2      MET  42  -4.021  20.959  20.959
  312   1HG   MET  42           HG1      MET  42  -6.808  20.351  20.351
  313   2HG   MET  42           HG2      MET  42  -6.054  21.891  21.891
  314   1HE   MET  42           HE1      MET  42  -5.037  22.800  22.800
  315   2HE   MET  42           HE2      MET  42  -6.265  22.992  22.992
  316   3HE   MET  42           HE3      MET  42  -6.615  23.503  23.503
  317    H    TRP  43           HN       TRP  43  -3.465  17.731  17.731
  318    HA   TRP  43           HA       TRP  43  -0.826  17.878  17.878
  319   1HB   TRP  43           HB1      TRP  43  -2.133  15.880  15.880
  320   2HB   TRP  43           HB2      TRP  43  -2.397  15.709  15.709
  321    HD1  TRP  43           HD1      TRP  43  -0.796  14.123  14.123
  322    HE1  TRP  43           HE1      TRP  43   1.434  13.221  13.221
  323    HE3  TRP  43           HE3      TRP  43   0.027  16.598  16.598
  324    HZ2  TRP  43           HZ2      TRP  43   3.465  13.405  13.405
  325    HZ3  TRP  43           HZ3      TRP  43   2.043  16.236  16.236
  326    HH2  TRP  43           HH2      TRP  43   3.787  14.646  14.646
  327    H    ASN  44           HN       ASN  44  -2.065  17.134  17.134
  328    HA   ASN  44           HA       ASN  44   0.518  16.862  16.862
  329   1HB   ASN  44           HB1      ASN  44  -0.703  16.137  16.137
  330   2HB   ASN  44           HB2      ASN  44  -2.110  16.343  16.343
  331   1HD2  ASN  44          HD21      ASN  44  -3.545  18.697  18.697
  332   2HD2  ASN  44          HD22      ASN  44  -3.726  17.670  17.670
  333    H    ASN  45           HN       ASN  45  -1.021  19.526  19.526
  334    HA   ASN  45           HA       ASN  45   0.748  21.430  21.430
  335   1HB   ASN  45           HB1      ASN  45  -2.040  22.211  22.211
  336   2HB   ASN  45           HB2      ASN  45  -1.009  23.019  23.019
  337   1HD2  ASN  45          HD21      ASN  45  -3.652  20.286  20.286
  338   2HD2  ASN  45          HD22      ASN  45  -3.615  20.983  20.983
  339    H    THR  46           HN       THR  46   1.270  20.207  20.207
  340    HA   THR  46           HA       THR  46   0.533  22.327  22.327
  341    HB   THR  46           HB       THR  46   0.727  19.965  19.965
  342    HG1  THR  46           HG1      THR  46   1.357  20.953  20.953
  343   1HG2  THR  46          HG21      THR  46   2.763  19.160  19.160
  344   2HG2  THR  46          HG22      THR  46   3.777  20.168  20.168
  345   3HG2  THR  46          HG23      THR  46   2.865  18.853  18.853
  346    H    ALA  47           HN       ALA  47   3.581  21.060  21.060
  347    HA   ALA  47           HA       ALA  47   4.663  23.639  23.639
  348   1HB   ALA  47           HB1      ALA  47   4.952  23.702  23.702
  349   2HB   ALA  47           HB2      ALA  47   5.825  22.180  22.180
  350   3HB   ALA  47           HB3      ALA  47   6.514  23.627  23.627
  351    H    ALA  48           HN       ALA  48   5.446  20.505  20.505
  352    HA   ALA  48           HA       ALA  48   6.195  18.608  18.608
  353   1HB   ALA  48           HB1      ALA  48   6.403  19.873  19.873
  354   2HB   ALA  48           HB2      ALA  48   7.875  20.625  20.625
  355   3HB   ALA  48           HB3      ALA  48   7.807  18.887  18.887
  356    H    ASP  49           HN       ASP  49   7.576  21.371  21.371
  357    HA   ASP  49           HA       ASP  49  10.061  20.123  20.123
  358   1HB   ASP  49           HB1      ASP  49   9.028  22.990  22.990
  359   2HB   ASP  49           HB2      ASP  49  10.633  22.460  22.460
  360    H    ASP  50           HN       ASP  50   6.904  20.706  20.706
  361    HA   ASP  50           HA       ASP  50   7.363  20.505  20.505
  362   1HB   ASP  50           HB1      ASP  50   5.085  21.674  21.674
  363   2HB   ASP  50           HB2      ASP  50   4.846  21.297  21.297
  364    H    LYS  51           HN       LYS  51   6.981  18.678  18.678
  365    HA   LYS  51           HA       LYS  51   4.978  16.772  16.772
  366   1HB   LYS  51           HB1      LYS  51   6.651  16.668  16.668
  367   2HB   LYS  51           HB2      LYS  51   5.608  15.373  15.373
  368   1HG   LYS  51           HG1      LYS  51   3.648  16.882  16.882
  369   2HG   LYS  51           HG2      LYS  51   4.731  18.122  18.122
  370   1HD   LYS  51           HD1      LYS  51   5.438  16.615  16.615
  371   2HD   LYS  51           HD2      LYS  51   4.471  15.315  15.315
  372   1HE   LYS  51           HE1      LYS  51   2.418  16.477  16.477
  373   2HE   LYS  51           HE2      LYS  51   3.263  17.949  17.949
  374   1HZ   LYS  51           HZ1      LYS  51   4.256  15.823  15.823
  375   2HZ   LYS  51           HZ2      LYS  51   2.558  15.765  15.765
  376   3HZ   LYS  51           HZ3      LYS  51   3.379  17.179  17.179
  377    H    GLN  52           HN       GLN  52   8.240  17.091  17.091
  378    HA   GLN  52           HA       GLN  52   9.645  14.947  14.947
  379   1HB   GLN  52           HB1      GLN  52  10.318  17.614  17.614
  380   2HB   GLN  52           HB2      GLN  52  10.832  17.288  17.288
  381   1HG   GLN  52           HG1      GLN  52  12.718  16.884  16.884
  382   2HG   GLN  52           HG2      GLN  52  12.174  15.335  15.335
  383   1HE2  GLN  52          HE21      GLN  52  10.568  15.425  15.425
  384   2HE2  GLN  52          HE22      GLN  52   9.866  16.191  16.191
  385    HA   PRO  53           HA       PRO  53   9.954  15.150  15.150
  386   1HB   PRO  53           HB1      PRO  53   7.690  16.373  16.373
  387   2HB   PRO  53           HB2      PRO  53   9.279  17.118  17.118
  388   1HG   PRO  53           HG1      PRO  53   6.932  17.266  17.266
  389   2HG   PRO  53           HG2      PRO  53   7.864  18.604  18.604
  390   1HD   PRO  53           HD1      PRO  53   8.575  17.756  17.756
  391   2HD   PRO  53           HD2      PRO  53   9.878  17.921  17.921
  392    H    TYR  54           HN       TYR  54   6.675  15.224  15.224
  393    HA   TYR  54           HA       TYR  54   5.733  12.933  12.933
  394   1HB   TYR  54           HB1      TYR  54   4.621  14.322  14.322
  395   2HB   TYR  54           HB2      TYR  54   3.749  13.117  13.117
  396    HD1  TYR  54           HD1      TYR  54   4.135  13.803  13.803
  397    HD2  TYR  54           HD2      TYR  54   3.820  16.470  16.470
  398    HE1  TYR  54           HE1      TYR  54   3.367  15.571  15.571
  399    HE2  TYR  54           HE2      TYR  54   3.064  18.243  18.243
  400    HH   TYR  54           HH       TYR  54   3.496  18.393  18.393
  401    H    GLU  55           HN       GLU  55   6.649  13.521  13.521
  402    HA   GLU  55           HA       GLU  55   6.248  10.975  10.975
  403   1HB   GLU  55           HB1      GLU  55   7.563  13.441  13.441
  404   2HB   GLU  55           HB2      GLU  55   8.680  12.164  12.164
  405   1HG   GLU  55           HG1      GLU  55   6.786  10.998  10.998
  406   2HG   GLU  55           HG2      GLU  55   5.759  12.370  12.370
  407    H    LYS  56           HN       LYS  56   9.294  12.132  12.132
  408    HA   LYS  56           HA       LYS  56  10.872   9.894   9.894
  409   1HB   LYS  56           HB1      LYS  56  10.540  11.824  11.824
  410   2HB   LYS  56           HB2      LYS  56  11.753  10.592  10.592
  411   1HG   LYS  56           HG1      LYS  56  11.971  11.935  11.935
  412   2HG   LYS  56           HG2      LYS  56  11.816  13.157  13.157
  413   1HD   LYS  56           HD1      LYS  56  14.136  12.836  12.836
  414   2HD   LYS  56           HD2      LYS  56  13.705  11.900  11.900
  415   1HE   LYS  56           HE1      LYS  56  14.186  10.779  10.779
  416   2HE   LYS  56           HE2      LYS  56  15.272  10.658  10.658
  417   1HZ   LYS  56           HZ1      LYS  56  12.885   9.574   9.574
  418   2HZ   LYS  56           HZ2      LYS  56  13.144   8.981   8.981
  419   3HZ   LYS  56           HZ3      LYS  56  14.328   8.782   8.782
  420    H    LYS  57           HN       LYS  57   8.257  10.389  10.389
  421    HA   LYS  57           HA       LYS  57   8.671   7.956   7.956
  422   1HB   LYS  57           HB1      LYS  57   6.509  10.044  10.044
  423   2HB   LYS  57           HB2      LYS  57   5.961   8.478   8.478
  424   1HG   LYS  57           HG1      LYS  57   6.503  10.007  10.007
  425   2HG   LYS  57           HG2      LYS  57   7.484   8.560   8.560
  426   1HD   LYS  57           HD1      LYS  57   9.433   9.710   9.710
  427   2HD   LYS  57           HD2      LYS  57   8.510  11.103  11.103
  428   1HE   LYS  57           HE1      LYS  57   8.746  10.226  10.226
  429   2HE   LYS  57           HE2      LYS  57   9.750  11.464  11.464
  430   1HZ   LYS  57           HZ1      LYS  57   7.101  12.070  12.070
  431   2HZ   LYS  57           HZ2      LYS  57   7.163  11.704  11.704
  432   3HZ   LYS  57           HZ3      LYS  57   8.168  12.913  12.913
  433    H    ALA  58           HN       ALA  58   6.252   8.903   8.903
  434    HA   ALA  58           HA       ALA  58   4.923   6.568   6.568
  435   1HB   ALA  58           HB1      ALA  58   6.022   8.456   8.456
  436   2HB   ALA  58           HB2      ALA  58   4.719   7.304   7.304
  437   3HB   ALA  58           HB3      ALA  58   4.526   8.642   8.642
  438    H    ALA  59           HN       ALA  59   7.959   7.507   7.507
  439    HA   ALA  59           HA       ALA  59   8.544   5.264   5.264
  440   1HB   ALA  59           HB1      ALA  59   9.961   7.334   7.334
  441   2HB   ALA  59           HB2      ALA  59  10.534   6.918   6.918
  442   3HB   ALA  59           HB3      ALA  59  10.953   5.907   5.907
  443    H    LYS  60           HN       LYS  60   9.912   5.782   5.782
  444    HA   LYS  60           HA       LYS  60  10.981   3.388   3.388
  445   1HB   LYS  60           HB1      LYS  60  10.757   5.433   5.433
  446   2HB   LYS  60           HB2      LYS  60   9.140   4.893   4.893
  447   1HG   LYS  60           HG1      LYS  60  10.273   2.635   2.635
  448   2HG   LYS  60           HG2      LYS  60  11.780   3.512   3.512
  449   1HD   LYS  60           HD1      LYS  60   9.401   4.282   4.282
  450   2HD   LYS  60           HD2      LYS  60  10.827   3.449   3.449
  451   1HE   LYS  60           HE1      LYS  60  10.808   6.261   6.261
  452   2HE   LYS  60           HE2      LYS  60  10.947   5.871   5.871
  453   1HZ   LYS  60           HZ1      LYS  60  12.883   4.406   4.406
  454   2HZ   LYS  60           HZ2      LYS  60  12.972   6.018   6.018
  455   3HZ   LYS  60           HZ3      LYS  60  13.098   5.659   5.659
  456    H    LEU  61           HN       LEU  61   7.566   4.123   4.123
  457    HA   LEU  61           HA       LEU  61   6.722   1.549   1.549
  458   1HB   LEU  61           HB1      LEU  61   5.007   3.485   3.485
  459   2HB   LEU  61           HB2      LEU  61   4.480   2.297   2.297
  460    HG   LEU  61           HG       LEU  61   6.088   4.814   4.814
  461   1HD1  LEU  61          HD11      LEU  61   3.383   3.859   3.859
  462   2HD1  LEU  61          HD12      LEU  61   4.169   5.351   5.351
  463   3HD1  LEU  61          HD13      LEU  61   3.710   5.131   5.131
  464   1HD2  LEU  61          HD21      LEU  61   5.479   2.585   2.585
  465   2HD2  LEU  61          HD22      LEU  61   7.067   3.030   3.030
  466   3HD2  LEU  61          HD23      LEU  61   6.177   4.153   4.153
  467    H    LYS  62           HN       LYS  62   6.265   2.904   2.904
  468    HA   LYS  62           HA       LYS  62   5.233   0.575   0.575
  469   1HB   LYS  62           HB1      LYS  62   7.106   2.670   2.670
  470   2HB   LYS  62           HB2      LYS  62   6.193   1.478   1.478
  471   1HG   LYS  62           HG1      LYS  62   4.066   2.407   2.407
  472   2HG   LYS  62           HG2      LYS  62   4.996   3.610   3.610
  473   1HD   LYS  62           HD1      LYS  62   4.085   4.677   4.677
  474   2HD   LYS  62           HD2      LYS  62   5.804   4.497   4.497
  475   1HE   LYS  62           HE1      LYS  62   3.764   2.486   2.486
  476   2HE   LYS  62           HE2      LYS  62   4.268   3.894   3.894
  477   1HZ   LYS  62           HZ1      LYS  62   6.576   2.625   2.625
  478   2HZ   LYS  62           HZ2      LYS  62   5.552   1.424   1.424
  479   3HZ   LYS  62           HZ3      LYS  62   5.986   2.758   2.758
  480    H    GLU  63           HN       GLU  63   8.514   1.680   1.680
  481    HA   GLU  63           HA       GLU  63   9.976  -0.374  -0.374
  482   1HB   GLU  63           HB1      GLU  63  10.474   1.646   1.646
  483   2HB   GLU  63           HB2      GLU  63  11.714   0.462   0.462
  484   1HG   GLU  63           HG1      GLU  63  10.508   2.399   2.399
  485   2HG   GLU  63           HG2      GLU  63  12.069   2.582   2.582
  486    H    LYS  64           HN       LYS  64   8.806  -0.106  -0.106
  487    HA   LYS  64           HA       LYS  64   9.943  -2.483  -2.483
  488   1HB   LYS  64           HB1      LYS  64   8.044  -0.543  -0.543
  489   2HB   LYS  64           HB2      LYS  64   7.192  -2.069  -2.069
  490   1HG   LYS  64           HG1      LYS  64   9.108  -3.059  -3.059
  491   2HG   LYS  64           HG2      LYS  64   9.933  -1.513  -1.513
  492   1HD   LYS  64           HD1      LYS  64   7.144  -1.545  -1.545
  493   2HD   LYS  64           HD2      LYS  64   8.415  -2.232  -2.232
  494   1HE   LYS  64           HE1      LYS  64   8.120   0.118   0.118
  495   2HE   LYS  64           HE2      LYS  64   9.689  -0.067  -0.067
  496   1HZ   LYS  64           HZ1      LYS  64   7.776   0.515   0.515
  497   2HZ   LYS  64           HZ2      LYS  64   7.617   1.622   1.622
  498   3HZ   LYS  64           HZ3      LYS  64   9.115   1.426   1.426
  499    H    TYR  65           HN       TYR  65   6.789  -1.985  -1.985
  500    HA   TYR  65           HA       TYR  65   5.902  -4.671  -4.671
  501   1HB   TYR  65           HB1      TYR  65   4.288  -3.027  -3.027
  502   2HB   TYR  65           HB2      TYR  65   5.352  -2.142  -2.142
  503    HD1  TYR  65           HD1      TYR  65   3.889  -5.629  -5.629
  504    HD2  TYR  65           HD2      TYR  65   4.502  -2.020  -2.020
  505    HE1  TYR  65           HE1      TYR  65   2.728  -6.588  -6.588
  506    HE2  TYR  65           HE2      TYR  65   3.346  -2.981  -2.981
  507    HH   TYR  65           HH       TYR  65   1.381  -5.141  -5.141
  508    H    GLU  66           HN       GLU  66   7.441  -2.849  -2.849
  509    HA   GLU  66           HA       GLU  66   7.746  -4.903  -4.903
  510   1HB   GLU  66           HB1      GLU  66   9.752  -2.746  -2.746
  511   2HB   GLU  66           HB2      GLU  66   9.602  -3.708  -3.708
  512   1HG   GLU  66           HG1      GLU  66   7.072  -2.797  -2.797
  513   2HG   GLU  66           HG2      GLU  66   7.798  -1.535  -1.535
  514    H    LYS  67           HN       LYS  67   9.529  -4.471  -4.471
  515    HA   LYS  67           HA       LYS  67  11.705  -6.260  -6.260
  516   1HB   LYS  67           HB1      LYS  67  11.193  -4.320  -4.320
  517   2HB   LYS  67           HB2      LYS  67  12.126  -5.721  -5.721
  518   1HG   LYS  67           HG1      LYS  67  13.581  -3.920  -3.920
  519   2HG   LYS  67           HG2      LYS  67  13.740  -5.299  -5.299
  520   1HD   LYS  67           HD1      LYS  67  12.240  -4.089  -4.089
  521   2HD   LYS  67           HD2      LYS  67  12.199  -2.720  -2.720
  522   1HE   LYS  67           HE1      LYS  67  14.644  -2.458  -2.458
  523   2HE   LYS  67           HE2      LYS  67  14.745  -3.883  -3.883
  524   1HZ   LYS  67           HZ1      LYS  67  12.879  -2.185  -2.185
  525   2HZ   LYS  67           HZ2      LYS  67  14.223  -1.238  -1.238
  526   3HZ   LYS  67           HZ3      LYS  67  14.425  -2.599  -2.599
  527    H    ASP  68           HN       ASP  68   8.999  -6.218  -6.218
  528    HA   ASP  68           HA       ASP  68   9.484  -8.852  -8.852
  529   1HB   ASP  68           HB1      ASP  68   7.253  -6.839  -6.839
  530   2HB   ASP  68           HB2      ASP  68   7.293  -8.404  -8.404
  531    H    ILE  69           HN       ILE  69   8.055  -7.515  -7.515
  532    HA   ILE  69           HA       ILE  69   6.121  -9.750  -9.750
  533    HB   ILE  69           HB       ILE  69   5.691  -7.206  -7.206
  534   1HG1  ILE  69          HG11      ILE  69   3.976  -8.592  -8.592
  535   2HG1  ILE  69          HG12      ILE  69   4.392  -7.809  -7.809
  536   1HG2  ILE  69          HG21      ILE  69   7.737  -6.877  -6.877
  537   2HG2  ILE  69          HG22      ILE  69   7.205  -7.988  -7.988
  538   3HG2  ILE  69          HG23      ILE  69   6.332  -6.483  -6.483
  539   1HD1  ILE  69          HD11      ILE  69   5.698  -9.832  -9.832
  540   2HD1  ILE  69          HD12      ILE  69   5.219 -10.604 -10.604
  541   3HD1  ILE  69          HD13      ILE  69   4.007 -10.225 -10.225
  542    H    ALA  70           HN       ALA  70   9.016  -8.250  -8.250
  543    HA   ALA  70           HA       ALA  70   9.564 -10.095 -10.095
  544   1HB   ALA  70           HB1      ALA  70  11.564  -8.532  -8.532
  545   2HB   ALA  70           HB2      ALA  70  11.920  -9.280  -9.280
  546   3HB   ALA  70           HB3      ALA  70  10.814  -7.927  -7.927
  547    H    ALA  71           HN       ALA  71   9.944 -10.054 -10.054
  548    HA   ALA  71           HA       ALA  71  11.613 -12.419 -12.419
  549   1HB   ALA  71           HB1      ALA  71   9.997 -10.898 -10.898
  550   2HB   ALA  71           HB2      ALA  71  11.161 -12.164 -12.164
  551   3HB   ALA  71           HB3      ALA  71  11.698 -10.651 -10.651
  552    H    TYR  72           HN       TYR  72   8.236 -11.536 -11.536
  553    HA   TYR  72           HA       TYR  72   7.136 -13.966 -13.966
  554   1HB   TYR  72           HB1      TYR  72   5.816 -11.964 -11.964
  555   2HB   TYR  72           HB2      TYR  72   6.011 -11.842 -11.842
  556    HD1  TYR  72           HD1      TYR  72   4.820 -14.436 -14.436
  557    HD2  TYR  72           HD2      TYR  72   4.171 -12.426 -12.426
  558    HE1  TYR  72           HE1      TYR  72   2.779 -15.745 -15.745
  559    HE2  TYR  72           HE2      TYR  72   2.129 -13.731 -13.731
  560    HH   TYR  72           HH       TYR  72   1.342 -16.176 -16.176
  561    H    ARG  73           HN       ARG  73   7.759 -12.854 -12.854
  562    HA   ARG  73           HA       ARG  73   6.840 -15.289 -15.289
  563   1HB   ARG  73           HB1      ARG  73   8.162 -12.724 -12.724
  564   2HB   ARG  73           HB2      ARG  73   7.757 -14.030 -14.030
  565   1HG   ARG  73           HG1      ARG  73   5.487 -13.352 -13.352
  566   2HG   ARG  73           HG2      ARG  73   6.025 -11.964 -11.964
  567   1HD   ARG  73           HD1      ARG  73   5.579 -14.611 -14.611
  568   2HD   ARG  73           HD2      ARG  73   4.222 -13.546 -13.546
  569    HE   ARG  73           HE       ARG  73   5.336 -11.791 -11.791
  570   1HH1  ARG  73          HH11      ARG  73   8.191 -13.034 -13.034
  571   2HH1  ARG  73          HH12      ARG  73   7.946 -12.034 -12.034
  572   1HH2  ARG  73          HH21      ARG  73   4.955 -14.380 -14.380
  573   2HH2  ARG  73          HH22      ARG  73   6.449 -14.398 -14.398
  574    H    ALA  74           HN       ALA  74   9.699 -14.173 -14.173
  575    HA   ALA  74           HA       ALA  74  11.367 -16.104 -16.104
  576   1HB   ALA  74           HB1      ALA  74  12.084 -13.915 -13.915
  577   2HB   ALA  74           HB2      ALA  74  13.263 -14.911 -14.911
  578   3HB   ALA  74           HB3      ALA  74  12.225 -13.830 -13.830
  579    H    LYS  75           HN       LYS  75   9.333 -16.845 -16.845
  580    HA   LYS  75           HA       LYS  75   8.929 -18.213 -18.213
  581   1HB   LYS  75           HB1      LYS  75  10.035 -19.758 -19.758
  582   2HB   LYS  75           HB2      LYS  75  11.589 -19.401 -19.401
  583   1HG   LYS  75           HG1      LYS  75  10.997 -20.494 -20.494
  584   2HG   LYS  75           HG2      LYS  75   9.300 -20.555 -20.555
  585   1HD   LYS  75           HD1      LYS  75   9.839 -22.132 -22.132
  586   2HD   LYS  75           HD2      LYS  75  11.544 -22.032 -22.032
  587   1HE   LYS  75           HE1      LYS  75  11.134 -23.039 -23.039
  588   2HE   LYS  75           HE2      LYS  75   9.396 -23.031 -23.031
  589   1HZ   LYS  75           HZ1      LYS  75  10.667 -24.320 -24.320
  590   2HZ   LYS  75           HZ2      LYS  75  11.230 -24.989 -24.989
  591   3HZ   LYS  75           HZ3      LYS  75   9.564 -24.950 -24.950
  592    H    GLY  76           HN       GLY  76   9.556 -16.038 -16.038
  593   1HA   GLY  76           HA1      GLY  76  11.945 -15.748 -15.748
  594   2HA   GLY  76           HA2      GLY  76  10.479 -14.774 -14.774
  595    H    LYS  77           HN       LYS  77   8.595 -16.168 -16.168
  596    HA   LYS  77           HA       LYS  77   7.639 -17.068 -17.068
  597   1HB   LYS  77           HB1      LYS  77   9.845 -18.999 -18.999
  598   2HB   LYS  77           HB2      LYS  77   8.863 -19.400 -19.400
  599   1HG   LYS  77           HG1      LYS  77   7.450 -18.471 -18.471
  600   2HG   LYS  77           HG2      LYS  77   8.162 -20.073 -20.073
  601   1HD   LYS  77           HD1      LYS  77   6.853 -20.776 -20.776
  602   2HD   LYS  77           HD2      LYS  77   6.292 -19.143 -19.143
  603   1HE   LYS  77           HE1      LYS  77   5.641 -20.633 -20.633
  604   2HE   LYS  77           HE2      LYS  77   4.609 -20.653 -20.653
  605   1HZ   LYS  77           HZ1      LYS  77   5.249 -17.999 -17.999
  606   2HZ   LYS  77           HZ2      LYS  77   4.805 -18.684 -18.684
  607   3HZ   LYS  77           HZ3      LYS  77   3.746 -18.771 -18.771
  608    HA   PRO  78           HA       PRO  78  10.017 -16.066 -16.066
  609   1HB   PRO  78           HB1      PRO  78   8.928 -17.539 -17.539
  610   2HB   PRO  78           HB2      PRO  78   7.948 -16.349 -16.349
  611   1HG   PRO  78           HG1      PRO  78   8.186 -19.352 -19.352
  612   2HG   PRO  78           HG2      PRO  78   6.709 -18.429 -18.429
  613   1HD   PRO  78           HD1      PRO  78   7.592 -18.909 -18.909
  614   2HD   PRO  78           HD2      PRO  78   6.797 -17.367 -17.367
  615    H    ASP  79           HN       ASP  79  11.519 -17.495 -17.495
  616    HA   ASP  79           HA       ASP  79  13.451 -18.733 -18.733
  617   1HB   ASP  79           HB1      ASP  79  13.818 -17.596 -17.596
  618   2HB   ASP  79           HB2      ASP  79  13.298 -19.104 -19.104
  619    H    ALA  80           HN       ALA  80  11.922 -20.147 -20.147
  620    HA   ALA  80           HA       ALA  80  11.538 -22.766 -22.766
  621   1HB   ALA  80           HB1      ALA  80  10.074 -21.589 -21.589
  622   2HB   ALA  80           HB2      ALA  80   9.742 -23.159 -23.159
  623   3HB   ALA  80           HB3      ALA  80   9.436 -21.695 -21.695
  624    H    ALA  81           HN       ALA  81  13.525 -21.203 -21.203
  625    HA   ALA  81           HA       ALA  81  14.287 -23.651 -23.651
  626   1HB   ALA  81           HB1      ALA  81  13.379 -21.830 -21.830
  627   2HB   ALA  81           HB2      ALA  81  14.580 -20.722 -20.722
  628   3HB   ALA  81           HB3      ALA  81  15.082 -22.089 -22.089
  629   1H1   BME  16           HE1      MER  16  -8.294   8.375   8.375
  630   2H1   BME  16           HE2      MER  16  -9.179   9.528   9.528
  631   1H2   BME  16           HZ1      MER  16  -6.202   9.525   9.525
  632   2H2   BME  16           HZ2      MER  16  -7.318  10.663  10.663
  633    HO1  BME  16           HH       MER  16  -8.514   8.447   8.447