*HEADER    VIRUS/VIRAL PROTEIN                     19-AUG-05   2ARI              
*TITLE     SOLUTION STRUCTURE OF MICELLE-BOUND FUSION DOMAIN OF HIV-1            
*TITLE    2 GP41                                                                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ENVELOPE POLYPROTEIN GP160;                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: 30 N-TERMINAL RESIDUES, TRANSMEMBRANE                      
*COMPND   5 GLYCOPROTEIN (GP41);                                                 
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS TYPE 1;            
*SOURCE   3 ORGANISM_COMMON: VIRUS;                                              
*SOURCE   4 GENE: ENV;                                                           
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET28A(+)                                 
*KEYWDS    HIV, GP41, FUSION, PEPTIDE, DOMAIN, MEMBRANE, PROTEIN,                
*KEYWDS   2 MICELLE, VIRUS                                                       
*EXPDTA    NMR, 30 STRUCTURES                                                    
*AUTHOR    C.P.JARONIEC, J.D.KAUFMAN, S.J.STAHL, M.VIARD, R.BLUMENTHAL,          
*AUTHOR   2 P.T.WINGFIELD, A.BAX                                                 
*REVDAT   1   20-DEC-05 2ARI    0                                                


constraints/0040755007103600000630000000000010301410267013136 5ustar  jaroniecsmmspconstraints/J_hnha.tbl0100644007103600000630000000421210301410145015017 0ustar  jaroniecsmmsp! Table containing 3JHNHA values
!
! No GLY Table
!
! 3V
assign (resid  2 and name c ) (resid  3 and name n )
       (resid  3 and name ca) (resid  3 and name c )      7.5 0.7
! 5I
assign (resid  4 and name c ) (resid  5 and name n )
       (resid  5 and name ca) (resid  5 and name c )      4.3 0.7

! 7A
assign (resid  6 and name c ) (resid  7 and name n )
       (resid  7 and name ca) (resid  7 and name c )      4.1 0.7

! 8L
assign (resid  7 and name c ) (resid  8 and name n )
       (resid  8 and name ca) (resid  8 and name c )      5.3 0.7

! 9F
assign (resid  8 and name c ) (resid  9 and name n )
       (resid  9 and name ca) (resid  9 and name c )      4.7 0.7

! 10L
assign (resid  9 and name c ) (resid 10 and name n )
       (resid 10 and name ca) (resid 10 and name c )      4.1 0.7

! 12F
assign (resid 11 and name c ) (resid 12 and name n )
       (resid 12 and name ca) (resid 12 and name c )      5.3 0.7

! 13L
assign (resid 12 and name c ) (resid 13 and name n )
       (resid 13 and name ca) (resid 13 and name c )      4.6 0.7

! 15A
assign (resid 14 and name c ) (resid 15 and name n )
       (resid 15 and name ca) (resid 15 and name c )      5.9 0.7

! 16A
assign (resid 15 and name c ) (resid 16 and name n )
       (resid 16 and name ca) (resid 16 and name c )      4.9 0.7

! 18S
assign (resid 17 and name c ) (resid 18 and name n )
       (resid 18 and name ca) (resid 18 and name c )      5.9 0.7

! 19T
assign (resid 18 and name c ) (resid 19 and name n )
       (resid 19 and name ca) (resid 19 and name c )      7.1 0.7

! 20M
assign (resid 19 and name c ) (resid 20 and name n )
       (resid 20 and name ca) (resid 20 and name c )      6.4 0.7

! 22A
assign (resid 21 and name c ) (resid 22 and name n )
       (resid 22 and name ca) (resid 22 and name c )      5.8 0.7

! 23A
assign (resid 22 and name c ) (resid 23 and name n )
       (resid 23 and name ca) (resid 23 and name c )      5.7 0.7
! 24S
assign (resid 23 and name c ) (resid 24 and name n )
       (resid 24 and name ca) (resid 24 and name c )      7.0 0.7

! 25M
assign (resid 24 and name c ) (resid 25 and name n )
       (resid 25 and name ca) (resid 25 and name c )      6.7 0.7
constraints/noe.tbl0100644007103600000630000001431610301407473014431 0ustar  jaroniecsmmsp!set echo=false end
!set wrnlev=0 end
!!!Short range NOEs
!CaH(i)-NH(i+1)
assign (resid    2 and  name HA   )(resid    3 and  name HN   ) 2.24 0.34 0.34
assign (resid    3 and  name HA   )(resid    4 and  name HN   ) 2.04 0.31 0.31
assign ((resid   4 and  name HA1) or
        (resid   4 and  name HA2)) (resid    5 and  name HN   ) 2.74 0.41 0.41
assign ((resid   4 and  name HA1) or
        (resid   4 and  name HA2)) (resid    5 and  name HN   ) 2.52 0.38 0.38
assign (resid    5 and  name HA   )(resid    6 and  name HN   ) 4.0 2.2 1.0    !
assign ((resid   6 and  name HA1) or
        (resid   6 and  name HA2)) (resid    7 and  name HN   ) 3.08 0.46 0.46
assign ((resid   6 and  name HA1) or
        (resid   6 and  name HA2)) (resid    7 and  name HN   ) 2.69 0.40 0.40
assign (resid    7 and  name HA   )(resid    8 and  name HN   ) 4.0 2.2 1.0    !
assign (resid    8 and  name HA   )(resid    9 and  name HN   ) 3.15 0.47 0.47
assign (resid    9 and  name HA   )(resid   10 and  name HN   ) 3.61 0.54 0.54
assign (resid   10 and  name HA   )(resid   11 and  name HN   ) 3.05 0.46 0.46
assign (resid   11 and  name HA#  )(resid   12 and  name HN   ) 3.1 0.5 0.5
assign (resid   12 and  name HA   )(resid   13 and  name HN   ) 3.70 0.56 0.56
assign (resid   13 and  name HA   )(resid   14 and  name HN   ) 4.0 2.2 1.0    !
assign (resid   14 and  name HA#  )(resid   15 and  name HN   ) 2.74 0.41 0.41
assign (resid   15 and  name HA   )(resid   16 and  name HN   ) 3.08 0.46 0.46
assign (resid   16 and  name HA   )(resid   17 and  name HN   ) 3.00 0.45 0.45
assign ((resid  17 and  name HA1) or
        (resid  17 and  name HA2)) (resid   18 and  name HN   ) 2.98 0.45 0.45
assign ((resid  17 and  name HA1) or
        (resid  17 and  name HA2)) (resid   18 and  name HN   ) 4.0 2.2 1.0    !
assign (resid   18 and  name HA   )(resid   19 and  name HN   ) 2.80 0.42 0.42
assign (resid   19 and  name HA   )(resid   20 and  name HN   ) 4.0 2.2 1.0    !
assign (resid   20 and  name HA   )(resid   21 and  name HN   ) 2.64 0.40 0.40
assign (resid   21 and  name HA#  )(resid   22 and  name HN   ) 2.95 0.44 0.44
assign (resid   23 and  name HA   )(resid   24 and  name HN   ) 2.44 0.37 0.37
assign (resid   24 and  name HA   )(resid   25 and  name HN   ) 2.67 0.40 0.40
!NH(i)-NH(i+1)
assign (resid    3 and  name HN   )(resid    4 and  name HN   ) 2.84 0.44 0.44
assign (resid    4 and  name HN   )(resid    5 and  name HN   ) 2.79 0.42 0.42
assign (resid    5 and  name HN   )(resid    6 and  name HN   ) 2.67 0.40 0.40
assign (resid    6 and  name HN   )(resid    7 and  name HN   ) 2.45 0.37 0.37
assign (resid    8 and  name HN   )(resid    9 and  name HN   ) 2.60 0.39 0.39
assign (resid    9 and  name HN   )(resid   10 and  name HN   ) 2.77 0.42 0.42
assign (resid   10 and  name HN   )(resid   11 and  name HN   ) 2.74 0.41 0.41
assign (resid   11 and  name HN   )(resid   12 and  name HN   ) 2.78 0.42 0.42
assign (resid   12 and  name HN   )(resid   13 and  name HN   ) 2.71 0.41 0.41
assign (resid   14 and  name HN   )(resid   15 and  name HN   ) 2.70 0.40 0.40
assign (resid   15 and  name HN   )(resid   16 and  name HN   ) 2.46 0.37 0.37
assign (resid   16 and  name HN   )(resid   17 and  name HN   ) 2.74 0.41 0.41
assign (resid   17 and  name HN   )(resid   18 and  name HN   ) 2.70 0.40 0.40
assign (resid   19 and  name HN   )(resid   20 and  name HN   ) 2.52 0.38 0.38
assign (resid   20 and  name HN   )(resid   21 and  name HN   ) 2.38 0.36 0.36
assign (resid   21 and  name HN   )(resid   22 and  name HN   ) 2.68 0.40 0.40
assign (resid   22 and  name HN   )(resid   23 and  name HN   ) 2.44 0.37 0.37
assign (resid   24 and  name HA   )(resid   25 and  name HN   ) 2.35 0.35 0.35
!CaH(i)-NH(i+2)
assign ((resid    4 and  name HA1) or
        (resid    4 and  name HA2))(resid    6 and  name HN   ) 3.57 0.54 0.54
assign (resid   16 and  name HA   )(resid   18 and  name HN   ) 3.83 0.57 0.57
assign ((resid   17 and  name HA1) or
        (resid   17 and  name HA2))(resid   19 and  name HN   ) 3.18 0.48 0.48
assign (resid   19 and  name HA   )(resid   21 and  name HN   ) 3.86 0.58 0.58 !
assign (resid   23 and  name HA   )(resid   25 and  name HN   ) 3.69 0.55 0.55
! CaH(i)-NH(i+3)
assign (resid    5 and  name HA   )(resid    8 and  name HN   ) 2.93 0.44 0.44 !
assign ((resid    6 and  name HA1) or
        (resid    6 and  name HA2))(resid    9 and  name HN   ) 3.64 0.55 0.55
assign (resid    7 and  name HA   )(resid   10 and  name HN   ) 3.07 0.46 0.46 !
assign (resid    8 and  name HA   )(resid   11 and  name HN   ) 3.15 0.47 0.47
assign (resid    9 and  name HA   )(resid   12 and  name HN   ) 3.26 0.49 0.49
assign (resid   10 and  name HA   )(resid   13 and  name HN   ) 3.39 0.51 0.51
assign (resid   12 and  name HA   )(resid   15 and  name HN   ) 3.53 0.53 0.53
assign (resid   13 and  name HA   )(resid   16 and  name HN   ) 3.31 0.50 0.50
assign (resid   15 and  name HA   )(resid   18 and  name HN   ) 3.44 0.52 0.52
assign (resid   16 and  name HA   )(resid   19 and  name HN   ) 3.59 0.54 0.54
assign (resid   20 and  name HA   )(resid   23 and  name HN   ) 3.86 0.58 0.58
!NH(i)-NH(i+2)
assign (resid    5 and  name HN   )(resid    7 and  name HN   ) 3.55 0.53 0.53
assign (resid    6 and  name HN   )(resid    8 and  name HN   ) 3.59 0.54 0.54
!CbH(i)-NH(i+1)
assign (resid    2 and  name HB#  )(resid    3 and  name HN   ) 2.71 0.41 0.41
assign (resid    3 and  name HB   )(resid    4 and  name HN   ) 3.08 0.46 0.46
assign (resid    3 and  name HB   )(resid    4 and  name HN   ) 3.08 0.46 0.46
assign (resid    5 and  name HB   )(resid    6 and  name HN   ) 2.95 0.44 0.44
assign (resid    8 and  name HB#  )(resid    9 and  name HN   ) 3.00 0.45 0.45 !
assign (resid    9 and  name HB#  )(resid   10 and  name HN   ) 2.58 0.39 0.39
assign (resid   10 and  name HB#  )(resid   11 and  name HN   ) 3.19 0.48 0.48
assign (resid   12 and  name HB#  )(resid   13 and  name HN   ) 2.74 0.41 0.41
assign (resid   13 and  name HB#  )(resid   14 and  name HN   ) 3.28 0.49 0.49
assign (resid   16 and  name HB#  )(resid   17 and  name HN   ) 2.62 0.39 0.39
assign (resid   20 and  name HB#  )(resid   21 and  name HN   ) 3.22 0.48 0.48
assign (resid   23 and  name HB#  )(resid   24 and  name HN   ) 2.65 0.40 0.40
assign (resid   24 and  name HB#  )(resid   25 and  name HN   ) 3.36 0.50 0.50
constraints/dihed_30.tbl0100755007103600000630000001246510301407717015236 0ustar  jaroniecsmmsp!!
!! Phi restraints: minimum deviation = 30 degrees

  !!    5 
 assign (resid   4 and name c )   (resid   5 and name n ) 
        (resid   5 and name ca)   (resid   5 and name c )  1.0 -71.0 30.0 2
  !!    6 
 assign (resid   5 and name c )   (resid   6 and name n ) 
        (resid   6 and name ca)   (resid   6 and name c )  1.0 -65.0 30.0 2
  !!    7 
 assign (resid   6 and name c )   (resid   7 and name n ) 
        (resid   7 and name ca)   (resid   7 and name c )  1.0 -65.0 30.0 2
  !!    8 
 assign (resid   7 and name c )   (resid   8 and name n ) 
        (resid   8 and name ca)   (resid   8 and name c )  1.0 -64.0 30.0 2
  !!    9
 assign (resid   8 and name c )   (resid   9 and name n ) 
        (resid   9 and name ca)   (resid   9 and name c )  1.0 -69.0 30.0 2
  !!    10
 assign (resid   9 and name c )   (resid   10 and name n ) 
        (resid   10 and name ca)   (resid   10 and name c )  1.0 -63.0 30.0 2
  !!    11 
 assign (resid   10 and name c )   (resid   11 and name n ) 
        (resid   11 and name ca)   (resid   11 and name c )  1.0 -68.0 30.0 2
  !!    12
 assign (resid   11 and name c )   (resid   12 and name n ) 
        (resid   12 and name ca)   (resid   12 and name c )  1.0 -62.0 30.0 2
  !!    13 
 assign (resid   12 and name c )   (resid   13 and name n ) 
        (resid   13 and name ca)   (resid   13 and name c )  1.0 -65.0 30.0 2
  !!    14
 assign (resid   13 and name c )   (resid   14 and name n ) 
        (resid   14 and name ca)   (resid   14 and name c )  1.0 -70.0 30.0 2
  !!    15
 assign (resid   14 and name c )   (resid   15 and name n ) 
        (resid   15 and name ca)   (resid   15 and name c )  1.0 -69.0 30.0 2
  !!    16 
 assign (resid   15 and name c )   (resid   16 and name n ) 
        (resid   16 and name ca)   (resid   16 and name c )  1.0 -71.0 32.0 2
  !!    17 
 assign (resid   16 and name c )   (resid   17 and name n ) 
        (resid   17 and name ca)   (resid   17 and name c )  1.0 -69.0 30.0 2
  !!    18
 assign (resid   17 and name c )   (resid   18 and name n ) 
        (resid   18 and name ca)   (resid   18 and name c )  1.0 -66.0 30.0 2
  !!    19 
 assign (resid   18 and name c )   (resid   19 and name n ) 
        (resid   19 and name ca)   (resid   19 and name c )  1.0 -61.0 30.0 2
  !!    20 
 assign (resid   19 and name c )   (resid   20 and name n ) 
        (resid   20 and name ca)   (resid   20 and name c )  1.0 -85.0 30.0 2
 !!    21
 assign (resid   20 and name c )   (resid   21 and name n )
        (resid   21 and name ca)   (resid   21 and name c )  1.0 -75.0 40.0 2
 !!    22 
 assign (resid   21 and name c )   (resid   22 and name n ) 
        (resid   22 and name ca)   (resid   22 and name c )  1.0 -76.0 30.0 2
  !!    23 
 assign (resid   22 and name c )   (resid   23 and name n ) 
        (resid   23 and name ca)   (resid   23 and name c )  1.0 -70.0 34.0 2

!!psi restraints
!!5
assign  (resid 5 and name n)   (resid 5 and name ca)
        (resid 5 and name c)   (resid 6 and name n)    1.0 -28.0 50.0 2
!!6
assign  (resid 6 and name n)   (resid 6 and name ca)
        (resid 6 and name c)   (resid 7 and name n)    1.0 -39.0 30.0 2
!!7
assign  (resid 7 and name n)   (resid 7 and name ca)
        (resid 7 and name c)   (resid 8 and name n)    1.0 -40.0 30.0 2
!!8
assign  (resid 8 and name n)   (resid 8 and name ca)
        (resid 8 and name c)   (resid 9 and name n)    1.0 -40.0 30.0 2
!!9
!assign  (resid 9 and name n)   (resid 9 and name ca)
!        (resid 9 and name c)   (resid 10 and name n)    1.0 -43.0 30.0 2
!!10
assign  (resid 10 and name n)   (resid 10 and name ca)
        (resid 10 and name c)   (resid 11 and name n)    1.0 -41.0 30.0 2
!!11
assign  (resid 11 and name n)   (resid 11 and name ca)
        (resid 11 and name c)   (resid 12 and name n)    1.0 -39.0 30.0 2
!!12
assign  (resid 12 and name n)   (resid 12 and name ca)
        (resid 12 and name c)   (resid 13 and name n)    1.0 -41.0 30.0 2
!!13
assign  (resid 13 and name n)   (resid 13 and name ca)
        (resid 13 and name c)   (resid 14 and name n)    1.0 -37.0 30.0 2
!!14
assign  (resid 14 and name n)   (resid 14 and name ca)
        (resid 14 and name c)   (resid 15 and name n)    1.0 -34.0 30.0 2
!!15
assign  (resid 15 and name n)   (resid 15 and name ca)
        (resid 15 and name c)   (resid 16 and name n)    1.0 -36.0 30.0 2
!!16
assign  (resid 16 and name n)   (resid 16 and name ca)
        (resid 16 and name c)   (resid 17 and name n)    1.0 -23.0 56.0 2
!!17 
assign  (resid 17 and name n)   (resid 17 and name ca)
        (resid 17 and name c)   (resid 18 and name n)    1.0 -33.0 30.0 2
!!18
assign  (resid 18 and name n)   (resid 18 and name ca)
        (resid 18 and name c)   (resid 19 and name n)    1.0 -38.0 30.0 2
!!19
assign  (resid 19 and name n)   (resid 19 and name ca)
        (resid 19 and name c)   (resid 20 and name n)    1.0 -44.0 30.0 2
!!20
assign  (resid 20 and name n)   (resid 20 and name ca)
        (resid 20 and name c)   (resid 21 and name n)    1.0 -5.0 46.0 2
!!21
assign  (resid 21 and name n)   (resid 21 and name ca)
        (resid 21 and name c)   (resid 22 and name n)    1.0 -23.0 40.0 2
!!22
assign  (resid 22 and name n)   (resid 22 and name ca)
        (resid 22 and name c)   (resid 23 and name n)    1.0 -21.0 56.0 2
!!23
assign  (resid 23 and name n)   (resid 23 and name ca)
        (resid 23 and name c)   (resid 24 and name n)    1.0 -24.0 60.0 2
constraints/dc_nco.tbl0100644007103600000630000000724510301410470015067 0ustar  jaroniecsmmspassign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     4 and name    C)
       ( resid     5 and name    N)  7.2551  0.0000        

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     5 and name    C)
       ( resid     6 and name    N) -0.9598  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     6 and name    C)
       ( resid     7 and name    N) 23.6166  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     7 and name    C)
       ( resid     8 and name    N) -18.9428  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     8 and name    C)
       ( resid     9 and name    N)  3.2980  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     9 and name    C)
       ( resid    10 and name    N) 16.8920  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    10 and name    C)
       ( resid    11 and name    N) -0.2514  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    11 and name    C)
       ( resid    12 and name    N)  7.1294  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    12 and name    C)
       ( resid    13 and name    N)  3.5302  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    13 and name    C)
       ( resid    14 and name    N) 27.1756  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    14 and name    C)
       ( resid    15 and name    N) -4.4672  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    15 and name    C)
       ( resid    16 and name    N)  1.7904  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    16 and name    C)
       ( resid    17 and name    N) 12.4733  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    17 and name    C)
       ( resid    18 and name    N) 15.0493  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    18 and name    C)
       ( resid    19 and name    N) -2.1307  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    19 and name    C)
       ( resid    20 and name    N)  4.2013  0.0000
constraints/J_hnha_gly.tbl0100644007103600000630000000143310301410032015667 0ustar  jaroniecsmmsp!
! 3JHNHA couplings
! GLY only Table
!

! 4G
assign (resid  4 and name ha1) (resid  4 and name ca)
       (resid  4 and name n ) (resid   4 and name hn)
       (resid  4 and name ha2) (resid  4 and name ca)
       (resid  4 and name n ) (resid   4 and name hn)
   5.0 0.7
   5.8 0.7

! 6G
assign (resid  6 and name ha1) (resid  6 and name ca)
       (resid  6 and name n ) (resid   6 and name hn)
       (resid  6 and name ha2) (resid  6 and name ca)
       (resid  6 and name n ) (resid   6 and name hn)
   5.7 0.7
   3.8 0.7

! 11G
! 13G

! 17G
assign (resid 17 and name ha1) (resid 17 and name ca)
       (resid 17 and name n ) (resid  17 and name hn)
       (resid 17 and name ha2) (resid 17 and name ca)
       (resid 17 and name n ) (resid  17 and name hn)
   5.8 0.7
   4.3 0.7

! 20G
 
constraints/dc_coca.tbl0100644007103600000630000000723710301410432015214 0ustar  jaroniecsmmspassign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     5 and name   CA)
       ( resid     5 and name    C) -20.4489  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     6 and name   CA)
       ( resid     6 and name    C) -11.9367  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     7 and name   CA)
       ( resid     7 and name    C)  8.8557  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     8 and name   CA)
       ( resid     8 and name    C) 23.8301  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     9 and name   CA)
       ( resid     9 and name    C) -23.8276  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    10 and name   CA)
       ( resid    10 and name    C) -3.2775  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    11 and name   CA)
       ( resid    11 and name    C) 26.9506  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    12 and name   CA)
       ( resid    12 and name    C)  7.2992  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    13 and name   CA)
       ( resid    13 and name    C) -32.0400  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    14 and name   CA)
       ( resid    14 and name    C) -0.7423  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    15 and name   CA)
       ( resid    15 and name    C) 22.4154  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    16 and name   CA)
       ( resid    16 and name    C) -34.4574  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    17 and name   CA)
       ( resid    17 and name    C) -18.8989  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    18 and name   CA)
       ( resid    18 and name    C)  6.8196  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    19 and name   CA)
       ( resid    19 and name    C) 13.9138  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    20 and name   CA)
       ( resid    20 and name    C) -30.7872  0.0000
constraints/dc_nh.tbl0100644007103600000630000000723610301410520014711 0ustar  jaroniecsmmspassign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     5 and name    N)
       ( resid     5 and name   HN) -14.6044  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     6 and name    N)
       ( resid     6 and name   HN)  5.1064  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     7 and name    N)
       ( resid     7 and name   HN) -5.4054  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     8 and name    N)
       ( resid     8 and name   HN) -17.9180  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     9 and name    N)
       ( resid     9 and name   HN) -6.7678  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    10 and name    N)
       ( resid    10 and name   HN)  0.4316  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    11 and name    N)
       ( resid    11 and name   HN) -19.9696  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    12 and name    N)
       ( resid    12 and name   HN) -22.7114  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    13 and name    N)
       ( resid    13 and name   HN) -3.3305  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    14 and name    N)
       ( resid    14 and name   HN) -7.3304  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    15 and name    N)
       ( resid    15 and name   HN) -26.4697  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    16 and name    N)
       ( resid    16 and name   HN) -17.1129  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    17 and name    N)
       ( resid    17 and name   HN) -0.6769  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    18 and name    N)
       ( resid    18 and name   HN) -19.1539  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    19 and name    N)
       ( resid    19 and name   HN) -22.4584  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    20 and name    N)
       ( resid    20 and name   HN) -6.0680  0.0000
constraints/dc_cacb.tbl0100644007103600000630000000407010301410353015171 0ustar  jaroniecsmmspassign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     5 and name   CB)
       ( resid     5 and name   CA) -12.5239  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     7 and name   CB)
       ( resid     7 and name   CA) 19.9238  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     9 and name   CB)
       ( resid     9 and name   CA) 11.3474  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    12 and name   CB)
       ( resid    12 and name   CA) -18.4142  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    15 and name   CB)
       ( resid    15 and name   CA) -22.1351  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    16 and name   CB)
       ( resid    16 and name   CA) -14.6992  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    18 and name   CB)
       ( resid    18 and name   CA) 13.8748  0.0000 

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    19 and name   CB)
       ( resid    19 and name   CA) -31.8671  0.0000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    20 and name   CB)
       ( resid    20 and name   CA) -9.7518  0.0000

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    ALA   2           H        ALA   2  -1.712 -24.450  -4.004
    2    HA   ALA   2           HA       ALA   2  -2.634 -22.289  -4.696
    3   1HB   ALA   2          1HB       ALA   2  -4.631 -22.431  -3.188
    4   2HB   ALA   2          2HB       ALA   2  -3.737 -23.566  -2.177
    5   3HB   ALA   2          3HB       ALA   2  -4.140 -23.994  -3.839
    6    H    VAL   3           H        VAL   3  -2.056 -20.204  -4.439
    7    HA   VAL   3           HA       VAL   3  -1.469 -18.182  -3.428
    8    HB   VAL   3           HB       VAL   3  -3.002 -19.182  -1.017
    9   1HG1  VAL   3          1HG1      VAL   3  -2.803 -16.447  -2.323
   10   2HG1  VAL   3          2HG1      VAL   3  -1.919 -16.936  -0.881
   11   3HG1  VAL   3          3HG1      VAL   3  -3.675 -16.823  -0.841
   12   1HG2  VAL   3          1HG2      VAL   3  -4.081 -18.197  -3.675
   13   2HG2  VAL   3          2HG2      VAL   3  -5.051 -18.316  -2.206
   14   3HG2  VAL   3          3HG2      VAL   3  -4.372 -19.768  -2.932
   15    H    GLY   4           H        GLY   4   0.556 -20.031  -3.227
   16   1HA   GLY   4          1HA       GLY   4   1.490 -20.150  -0.407
   17   2HA   GLY   4          2HA       GLY   4   2.292 -20.845  -1.800
   18    H    ILE   5           H        ILE   5   3.413 -19.325  -3.278
   19    HA   ILE   5           HA       ILE   5   5.044 -17.469  -1.800
   20    HB   ILE   5           HB       ILE   5   4.790 -17.657  -4.816
   21   1HG1  ILE   5          1HG1      ILE   5   6.378 -19.379  -2.877
   22   2HG1  ILE   5          2HG1      ILE   5   5.072 -19.922  -3.928
   23   1HG2  ILE   5          1HG2      ILE   5   6.151 -15.784  -3.740
   24   2HG2  ILE   5          2HG2      ILE   5   7.050 -16.831  -4.836
   25   3HG2  ILE   5          3HG2      ILE   5   7.209 -17.039  -3.094
   26   1HD1  ILE   5          1HD1      ILE   5   7.098 -20.545  -5.028
   27   2HD1  ILE   5          2HD1      ILE   5   7.823 -18.963  -4.744
   28   3HD1  ILE   5          3HD1      ILE   5   6.497 -19.132  -5.897
   29    H    GLY   6           H        GLY   6   2.077 -17.173  -3.574
   30   1HA   GLY   6          1HA       GLY   6   2.003 -14.474  -4.313
   31   2HA   GLY   6          2HA       GLY   6   0.586 -15.341  -3.702
   32    H    ALA   7           H        ALA   7   1.976 -15.914  -1.161
   33    HA   ALA   7           HA       ALA   7   1.022 -13.799   0.469
   34   1HB   ALA   7          1HB       ALA   7   1.406 -16.126   1.217
   35   2HB   ALA   7          2HB       ALA   7   2.273 -14.985   2.245
   36   3HB   ALA   7          3HB       ALA   7   3.144 -15.901   1.017
   37    H    LEU   8           H        LEU   8   4.204 -14.375  -0.936
   38    HA   LEU   8           HA       LEU   8   5.574 -12.402   0.725
   39   1HB   LEU   8          1HB       LEU   8   6.547 -13.460  -1.942
   40   2HB   LEU   8          2HB       LEU   8   7.512 -12.842  -0.602
   41    HG   LEU   8           HG       LEU   8   5.926 -15.429  -0.694
   42   1HD1  LEU   8          1HD1      LEU   8   8.214 -15.325  -1.769
   43   2HD1  LEU   8          2HD1      LEU   8   8.086 -16.489  -0.451
   44   3HD1  LEU   8          3HD1      LEU   8   8.876 -14.936  -0.182
   45   1HD2  LEU   8          1HD2      LEU   8   6.950 -15.751   1.652
   46   2HD2  LEU   8          2HD2      LEU   8   5.603 -14.626   1.540
   47   3HD2  LEU   8          3HD2      LEU   8   7.253 -14.012   1.642
   48    H    PHE   9           H        PHE   9   4.355 -12.343  -2.687
   49    HA   PHE   9           HA       PHE   9   5.235  -9.615  -3.085
   50   1HB   PHE   9          1HB       PHE   9   2.905 -11.073  -4.383
   51   2HB   PHE   9          2HB       PHE   9   3.488  -9.482  -4.874
   52    HD1  PHE   9           HD1      PHE   9   5.653  -9.216  -5.999
   53    HD2  PHE   9           HD2      PHE   9   4.254 -13.092  -4.777
   54    HE1  PHE   9           HE1      PHE   9   7.395 -10.287  -7.400
   55    HE2  PHE   9           HE2      PHE   9   5.999 -14.161  -6.180
   56    HZ   PHE   9           HZ       PHE   9   7.568 -12.759  -7.491
   57    H    LEU  10           H        LEU  10   2.095 -11.002  -1.917
   58    HA   LEU  10           HA       LEU  10   0.763  -8.542  -1.625
   59   1HB   LEU  10          1HB       LEU  10   0.047 -11.090  -1.229
   60   2HB   LEU  10          2HB       LEU  10   0.375 -10.701   0.452
   61    HG   LEU  10           HG       LEU  10  -1.587  -9.299  -1.396
   62   1HD1  LEU  10          1HD1      LEU  10  -2.316 -11.480  -0.480
   63   2HD1  LEU  10          2HD1      LEU  10  -3.258 -10.150   0.195
   64   3HD1  LEU  10          3HD1      LEU  10  -1.980 -10.901   1.152
   65   1HD2  LEU  10          1HD2      LEU  10  -0.722  -7.558  -0.024
   66   2HD2  LEU  10          2HD2      LEU  10  -0.610  -8.604   1.392
   67   3HD2  LEU  10          3HD2      LEU  10  -2.187  -8.070   0.807
   68    H    GLY  11           H        GLY  11   2.883 -10.213   0.697
   69   1HA   GLY  11          1HA       GLY  11   2.599  -8.512   2.902
   70   2HA   GLY  11          2HA       GLY  11   4.081  -9.380   2.525
   71    H    PHE  12           H        PHE  12   4.932  -8.061   0.177
   72    HA   PHE  12           HA       PHE  12   5.788  -5.485   1.352
   73   1HB   PHE  12          1HB       PHE  12   7.409  -7.017   0.216
   74   2HB   PHE  12          2HB       PHE  12   6.591  -6.686  -1.310
   75    HD1  PHE  12           HD1      PHE  12   8.784  -5.315   1.307
   76    HD2  PHE  12           HD2      PHE  12   6.658  -4.426  -2.320
   77    HE1  PHE  12           HE1      PHE  12  10.091  -3.223   1.051
   78    HE2  PHE  12           HE2      PHE  12   7.966  -2.336  -2.575
   79    HZ   PHE  12           HZ       PHE  12   9.683  -1.735  -0.889
   80    H    LEU  13           H        LEU  13   3.845  -6.513  -1.465
   81    HA   LEU  13           HA       LEU  13   3.716  -3.916  -2.672
   82   1HB   LEU  13          1HB       LEU  13   2.070  -6.428  -2.816
   83   2HB   LEU  13          2HB       LEU  13   1.354  -4.968  -3.476
   84    HG   LEU  13           HG       LEU  13   2.647  -6.462  -5.119
   85   1HD1  LEU  13          1HD1      LEU  13   2.064  -4.011  -5.493
   86   2HD1  LEU  13          2HD1      LEU  13   3.428  -4.627  -6.418
   87   3HD1  LEU  13          3HD1      LEU  13   3.713  -3.630  -4.997
   88   1HD2  LEU  13          1HD2      LEU  13   4.988  -6.555  -5.109
   89   2HD2  LEU  13          2HD2      LEU  13   4.610  -6.705  -3.399
   90   3HD2  LEU  13          3HD2      LEU  13   5.159  -5.163  -4.044
   91    H    GLY  14           H        GLY  14   2.415  -5.114   0.237
   92   1HA   GLY  14          1HA       GLY  14   0.144  -3.239   0.359
   93   2HA   GLY  14          2HA       GLY  14   0.672  -4.328   1.641
   94    H    ALA  15           H        ALA  15   3.406  -2.881   0.601
   95    HA   ALA  15           HA       ALA  15   3.434  -0.937   2.856
   96   1HB   ALA  15          1HB       ALA  15   5.833  -0.799   2.419
   97   2HB   ALA  15          2HB       ALA  15   5.646  -1.735   0.935
   98   3HB   ALA  15          3HB       ALA  15   5.359  -2.496   2.500
   99    H    ALA  16           H        ALA  16   3.730  -1.126  -0.625
  100    HA   ALA  16           HA       ALA  16   4.385   1.568  -1.201
  101   1HB   ALA  16          1HB       ALA  16   2.895  -0.506  -2.827
  102   2HB   ALA  16          2HB       ALA  16   4.639  -0.253  -2.798
  103   3HB   ALA  16          3HB       ALA  16   3.580   0.980  -3.483
  104    H    GLY  17           H        GLY  17   1.159   0.010  -1.106
  105   1HA   GLY  17          1HA       GLY  17  -0.262   2.397  -1.822
  106   2HA   GLY  17          2HA       GLY  17  -0.968   0.990  -1.043
  107    H    SER  18           H        SER  18   0.613   0.977   1.272
  108    HA   SER  18           HA       SER  18  -0.839   2.741   2.970
  109   1HB   SER  18          1HB       SER  18   1.678   1.136   3.472
  110   2HB   SER  18          2HB       SER  18   0.606   1.780   4.712
  111    HG   SER  18           HG       SER  18   0.319  -0.405   3.053
  112    H    THR  19           H        THR  19   2.236   3.037   1.417
  113    HA   THR  19           HA       THR  19   3.201   5.238   3.147
  114    HB   THR  19           HB       THR  19   4.373   4.072   0.603
  115    HG1  THR  19           HG1      THR  19   4.973   3.493   3.310
  116   1HG2  THR  19          1HG2      THR  19   5.529   5.774   2.825
  117   2HG2  THR  19          2HG2      THR  19   5.284   6.260   1.149
  118   3HG2  THR  19          3HG2      THR  19   6.481   5.028   1.544
  119    H    MET  20           H        MET  20   1.986   4.716  -0.131
  120    HA   MET  20           HA       MET  20   2.304   7.488  -0.960
  121   1HB   MET  20          1HB       MET  20   2.331   5.495  -2.494
  122   2HB   MET  20          2HB       MET  20   0.608   5.290  -2.180
  123   1HG   MET  20          1HG       MET  20   0.116   7.467  -3.126
  124   2HG   MET  20          2HG       MET  20   1.832   7.836  -3.284
  125   1HE   MET  20          1HE       MET  20  -0.746   7.619  -5.606
  126   2HE   MET  20          2HE       MET  20   0.425   7.437  -6.910
  127   3HE   MET  20          3HE       MET  20   0.762   8.542  -5.579
  128    H    GLY  21           H        GLY  21   0.018   5.806   0.925
  129   1HA   GLY  21          1HA       GLY  21  -2.310   7.443   0.251
  130   2HA   GLY  21          2HA       GLY  21  -2.183   6.327   1.612
  131    H    ALA  22           H        ALA  22   0.348   7.603   2.539
  132    HA   ALA  22           HA       ALA  22  -0.850   9.588   4.275
  133   1HB   ALA  22          1HB       ALA  22   1.466   9.901   5.106
  134   2HB   ALA  22          2HB       ALA  22   2.062   8.894   3.788
  135   3HB   ALA  22          3HB       ALA  22   1.026   8.194   5.032
  136    H    ALA  23           H        ALA  23   1.036   9.711   1.301
  137    HA   ALA  23           HA       ALA  23   1.624  12.541   1.440
  138   1HB   ALA  23          1HB       ALA  23   2.165  12.304  -0.964
  139   2HB   ALA  23          2HB       ALA  23   1.456  10.689  -0.958
  140   3HB   ALA  23          3HB       ALA  23   2.907  11.020  -0.011
  141    H    SER  24           H        SER  24  -1.270  10.997   1.219
  142    HA   SER  24           HA       SER  24  -2.571  12.684  -0.798
  143   1HB   SER  24          1HB       SER  24  -4.603  11.554  -0.135
  144   2HB   SER  24          2HB       SER  24  -3.321  10.351  -0.224
  145    HG   SER  24           HG       SER  24  -3.640   9.984   1.811
  146    H    MET  25           H        MET  25  -1.233  14.267   1.102
  147    HA   MET  25           HA       MET  25  -1.567  16.036   2.614
  148   1HB   MET  25          1HB       MET  25  -4.254  15.973   1.205
  149   2HB   MET  25          2HB       MET  25  -3.719  17.284   2.257
  150   1HG   MET  25          1HG       MET  25  -3.218  17.963   0.009
  151   2HG   MET  25          2HG       MET  25  -1.680  17.512   0.742
  152   1HE   MET  25          1HE       MET  25  -1.252  16.440  -2.941
  153   2HE   MET  25          2HE       MET  25  -0.399  17.089  -1.541
  154   3HE   MET  25          3HE       MET  25  -1.852  17.893  -2.129
  155    H    THR  26           H        THR  26  -1.476  14.836   4.578
  156    HA   THR  26           HA       THR  26  -3.757  13.438   5.664
  157    HB   THR  26           HB       THR  26  -2.450  13.384   7.751
  158    HG1  THR  26           HG1      THR  26  -0.378  14.797   6.551
  159   1HG2  THR  26          1HG2      THR  26  -0.501  12.213   6.893
  160   2HG2  THR  26          2HG2      THR  26  -0.665  13.017   5.331
  161   3HG2  THR  26          3HG2      THR  26  -1.882  11.853   5.856
  162    H    LEU  27           H        LEU  27  -3.561  16.594   4.995
  163    HA   LEU  27           HA       LEU  27  -4.245  17.950   7.406
  164   1HB   LEU  27          1HB       LEU  27  -4.856  18.475   4.486
  165   2HB   LEU  27          2HB       LEU  27  -5.477  19.545   5.740
  166    HG   LEU  27           HG       LEU  27  -3.214  20.022   6.517
  167   1HD1  LEU  27          1HD1      LEU  27  -2.037  17.975   6.165
  168   2HD1  LEU  27          2HD1      LEU  27  -1.274  19.133   5.082
  169   3HD1  LEU  27          3HD1      LEU  27  -2.422  17.955   4.443
  170   1HD2  LEU  27          1HD2      LEU  27  -2.379  21.197   4.507
  171   2HD2  LEU  27          2HD2      LEU  27  -4.127  21.367   4.658
  172   3HD2  LEU  27          3HD2      LEU  27  -3.449  20.226   3.496
  173    H    THR  28           H        THR  28  -6.673  17.484   4.846
  174    HA   THR  28           HA       THR  28  -8.452  15.915   6.537
  175    HB   THR  28           HB       THR  28  -9.223  18.797   5.977
  176    HG1  THR  28           HG1      THR  28  -8.228  19.207   7.757
  177   1HG2  THR  28          1HG2      THR  28 -11.096  18.227   7.541
  178   2HG2  THR  28          2HG2      THR  28 -10.556  16.550   7.511
  179   3HG2  THR  28          3HG2      THR  28 -11.143  17.314   6.034
  180    H    VAL  29           H        VAL  29  -7.723  17.672   3.627
  181    HA   VAL  29           HA       VAL  29 -10.102  17.212   2.145
  182    HB   VAL  29           HB       VAL  29  -8.619  17.358   0.131
  183   1HG1  VAL  29          1HG1      VAL  29  -8.107  19.361   2.351
  184   2HG1  VAL  29          2HG1      VAL  29  -9.431  19.407   1.189
  185   3HG1  VAL  29          3HG1      VAL  29  -7.771  19.647   0.644
  186   1HG2  VAL  29          1HG2      VAL  29  -6.665  16.170   1.021
  187   2HG2  VAL  29          2HG2      VAL  29  -6.434  17.420   2.242
  188   3HG2  VAL  29          3HG2      VAL  29  -6.198  17.799   0.537
  189    H    GLN  30           H        GLN  30 -10.722  15.480   0.775
  190    HA   GLN  30           HA       GLN  30  -9.989  12.851   1.689
  191   1HB   GLN  30          1HB       GLN  30 -11.479  13.747  -0.797
  192   2HB   GLN  30          2HB       GLN  30 -11.354  12.072  -0.260
  193   1HG   GLN  30          1HG       GLN  30 -12.468  12.623   1.841
  194   2HG   GLN  30          2HG       GLN  30 -12.514  14.330   1.399
  195   1HE2  GLN  30          1HE2      GLN  30 -14.930  12.904   1.933
  196   2HE2  GLN  30          2HE2      GLN  30 -15.803  12.757   0.485
  197    H    ALA  31           H        ALA  31  -9.970  13.264  -1.773
  198    HA   ALA  31           HA       ALA  31  -7.106  13.357  -2.121
  199   1HB   ALA  31          1HB       ALA  31  -8.462  10.650  -2.330
  200   2HB   ALA  31          2HB       ALA  31  -7.172  11.097  -1.213
  201   3HB   ALA  31          3HB       ALA  31  -6.847  11.001  -2.943
  Start of MODEL    2
    1    H    ALA   2           H        ALA   2   2.010 -16.845   4.133
    2    HA   ALA   2           HA       ALA   2   2.238 -19.762   4.624
    3   1HB   ALA   2          1HB       ALA   2   0.005 -19.524   5.553
    4   2HB   ALA   2          2HB       ALA   2  -0.050 -17.825   5.087
    5   3HB   ALA   2          3HB       ALA   2   1.065 -18.359   6.344
    6    H    VAL   3           H        VAL   3   0.176 -20.807   3.612
    7    HA   VAL   3           HA       VAL   3  -0.979 -21.424   1.698
    8    HB   VAL   3           HB       VAL   3  -0.824 -18.526   0.821
    9   1HG1  VAL   3          1HG1      VAL   3  -2.992 -19.072  -0.227
   10   2HG1  VAL   3          2HG1      VAL   3  -2.857 -20.728   0.366
   11   3HG1  VAL   3          3HG1      VAL   3  -1.710 -20.123  -0.829
   12   1HG2  VAL   3          1HG2      VAL   3  -2.715 -19.869   2.776
   13   2HG2  VAL   3          2HG2      VAL   3  -2.983 -18.274   2.072
   14   3HG2  VAL   3          3HG2      VAL   3  -1.601 -18.549   3.131
   15    H    GLY   4           H        GLY   4   1.391 -18.943   0.666
   16   1HA   GLY   4          1HA       GLY   4   3.178 -20.726  -0.504
   17   2HA   GLY   4          2HA       GLY   4   2.029 -20.333  -1.767
   18    H    ILE   5           H        ILE   5   3.734 -19.403  -2.920
   19    HA   ILE   5           HA       ILE   5   5.404 -17.265  -2.035
   20    HB   ILE   5           HB       ILE   5   6.009 -18.654  -3.924
   21   1HG1  ILE   5          1HG1      ILE   5   6.604 -16.989  -5.595
   22   2HG1  ILE   5          2HG1      ILE   5   5.363 -15.890  -5.007
   23   1HG2  ILE   5          1HG2      ILE   5   3.764 -19.206  -4.725
   24   2HG2  ILE   5          2HG2      ILE   5   4.729 -18.555  -6.047
   25   3HG2  ILE   5          3HG2      ILE   5   3.526 -17.542  -5.255
   26   1HD1  ILE   5          1HD1      ILE   5   6.545 -15.431  -3.024
   27   2HD1  ILE   5          2HD1      ILE   5   7.808 -15.485  -4.249
   28   3HD1  ILE   5          3HD1      ILE   5   7.565 -16.863  -3.176
   29    H    GLY   6           H        GLY   6   2.205 -17.311  -3.505
   30   1HA   GLY   6          1HA       GLY   6   1.929 -14.638  -4.334
   31   2HA   GLY   6          2HA       GLY   6   0.596 -15.578  -3.649
   32    H    ALA   7           H        ALA   7   2.002 -15.987  -1.114
   33    HA   ALA   7           HA       ALA   7   0.982 -13.838   0.429
   34   1HB   ALA   7          1HB       ALA   7   2.243 -14.912   2.258
   35   2HB   ALA   7          2HB       ALA   7   3.163 -15.845   1.078
   36   3HB   ALA   7          3HB       ALA   7   1.431 -16.115   1.261
   37    H    LEU   8           H        LEU   8   4.204 -14.363  -0.900
   38    HA   LEU   8           HA       LEU   8   5.464 -12.279   0.720
   39   1HB   LEU   8          1HB       LEU   8   6.591 -13.359  -1.873
   40   2HB   LEU   8          2HB       LEU   8   7.464 -12.705  -0.492
   41    HG   LEU   8           HG       LEU   8   5.985 -15.351  -0.667
   42   1HD1  LEU   8          1HD1      LEU   8   8.152 -16.318  -0.216
   43   2HD1  LEU   8          2HD1      LEU   8   8.852 -14.735   0.119
   44   3HD1  LEU   8          3HD1      LEU   8   8.366 -15.154  -1.521
   45   1HD2  LEU   8          1HD2      LEU   8   6.785 -15.622   1.763
   46   2HD2  LEU   8          2HD2      LEU   8   5.425 -14.530   1.521
   47   3HD2  LEU   8          3HD2      LEU   8   7.044 -13.876   1.768
   48    H    PHE   9           H        PHE   9   4.277 -12.376  -2.697
   49    HA   PHE   9           HA       PHE   9   5.118  -9.674  -3.230
   50   1HB   PHE   9          1HB       PHE   9   4.014 -11.531  -4.852
   51   2HB   PHE   9          2HB       PHE   9   2.540 -10.652  -4.477
   52    HD1  PHE   9           HD1      PHE   9   6.120  -9.938  -5.394
   53    HD2  PHE   9           HD2      PHE   9   1.990  -8.875  -5.964
   54    HE1  PHE   9           HE1      PHE   9   6.782  -8.252  -7.085
   55    HE2  PHE   9           HE2      PHE   9   2.660  -7.190  -7.652
   56    HZ   PHE   9           HZ       PHE   9   5.054  -6.880  -8.213
   57    H    LEU  10           H        LEU  10   1.989 -10.989  -1.965
   58    HA   LEU  10           HA       LEU  10   0.719  -8.475  -1.678
   59   1HB   LEU  10          1HB       LEU  10   0.422 -10.925   0.079
   60   2HB   LEU  10          2HB       LEU  10  -0.726  -9.595  -0.019
   61    HG   LEU  10           HG       LEU  10   0.071 -11.227  -2.456
   62   1HD1  LEU  10          1HD1      LEU  10  -0.895 -12.750  -0.783
   63   2HD1  LEU  10          2HD1      LEU  10  -2.020 -12.508  -2.120
   64   3HD1  LEU  10          3HD1      LEU  10  -2.280 -11.674  -0.588
   65   1HD2  LEU  10          1HD2      LEU  10  -0.992  -9.173  -3.102
   66   2HD2  LEU  10          2HD2      LEU  10  -2.200  -9.307  -1.827
   67   3HD2  LEU  10          3HD2      LEU  10  -2.247 -10.399  -3.206
   68    H    GLY  11           H        GLY  11   2.792 -10.217   0.626
   69   1HA   GLY  11          1HA       GLY  11   2.496  -8.538   2.850
   70   2HA   GLY  11          2HA       GLY  11   3.970  -9.427   2.487
   71    H    PHE  12           H        PHE  12   4.871  -8.093   0.158
   72    HA   PHE  12           HA       PHE  12   5.773  -5.562   1.386
   73   1HB   PHE  12          1HB       PHE  12   7.355  -7.099   0.205
   74   2HB   PHE  12          2HB       PHE  12   6.538  -6.712  -1.310
   75    HD1  PHE  12           HD1      PHE  12   6.719  -4.474  -2.311
   76    HD2  PHE  12           HD2      PHE  12   8.706  -5.415   1.380
   77    HE1  PHE  12           HE1      PHE  12   8.079  -2.412  -2.516
   78    HE2  PHE  12           HE2      PHE  12  10.066  -3.352   1.173
   79    HZ   PHE  12           HZ       PHE  12   9.751  -1.850  -0.774
   80    H    LEU  13           H        LEU  13   3.790  -6.485  -1.432
   81    HA   LEU  13           HA       LEU  13   3.709  -3.861  -2.587
   82   1HB   LEU  13          1HB       LEU  13   2.030  -6.342  -2.782
   83   2HB   LEU  13          2HB       LEU  13   1.326  -4.859  -3.400
   84    HG   LEU  13           HG       LEU  13   2.597  -6.328  -5.084
   85   1HD1  LEU  13          1HD1      LEU  13   3.389  -4.469  -6.346
   86   2HD1  LEU  13          2HD1      LEU  13   3.673  -3.504  -4.902
   87   3HD1  LEU  13          3HD1      LEU  13   2.025  -3.871  -5.407
   88   1HD2  LEU  13          1HD2      LEU  13   4.572  -6.617  -3.379
   89   2HD2  LEU  13          2HD2      LEU  13   5.127  -5.067  -4.005
   90   3HD2  LEU  13          3HD2      LEU  13   4.938  -6.438  -5.089
   91    H    GLY  14           H        GLY  14   2.419  -5.066   0.317
   92   1HA   GLY  14          1HA       GLY  14   0.155  -3.192   0.469
   93   2HA   GLY  14          2HA       GLY  14   0.710  -4.269   1.750
   94    H    ALA  15           H        ALA  15   3.421  -2.834   0.656
   95    HA   ALA  15           HA       ALA  15   3.484  -0.861   2.884
   96   1HB   ALA  15          1HB       ALA  15   5.420  -2.355   2.617
   97   2HB   ALA  15          2HB       ALA  15   5.892  -0.686   2.302
   98   3HB   ALA  15          3HB       ALA  15   5.638  -1.799   0.958
   99    H    ALA  16           H        ALA  16   3.742  -1.099  -0.598
  100    HA   ALA  16           HA       ALA  16   4.378   1.591  -1.219
  101   1HB   ALA  16          1HB       ALA  16   3.751   0.978  -3.473
  102   2HB   ALA  16          2HB       ALA  16   2.775  -0.366  -2.881
  103   3HB   ALA  16          3HB       ALA  16   4.531  -0.413  -2.720
  104    H    GLY  17           H        GLY  17   1.161   0.011  -1.076
  105   1HA   GLY  17          1HA       GLY  17  -0.280   2.387  -1.797
  106   2HA   GLY  17          2HA       GLY  17  -0.969   0.981  -1.000
  107    H    SER  18           H        SER  18   0.631   0.983   1.292
  108    HA   SER  18           HA       SER  18  -0.794   2.759   3.001
  109   1HB   SER  18          1HB       SER  18   0.619   1.770   4.731
  110   2HB   SER  18          2HB       SER  18   0.106   0.519   3.601
  111    HG   SER  18           HG       SER  18   2.339   0.393   4.010
  112    H    THR  19           H        THR  19   2.270   3.027   1.410
  113    HA   THR  19           HA       THR  19   3.258   5.241   3.112
  114    HB   THR  19           HB       THR  19   4.405   4.055   0.565
  115    HG1  THR  19           HG1      THR  19   4.187   3.063   3.049
  116   1HG2  THR  19          1HG2      THR  19   6.524   5.003   1.480
  117   2HG2  THR  19          2HG2      THR  19   5.595   5.745   2.781
  118   3HG2  THR  19          3HG2      THR  19   5.327   6.244   1.111
  119    H    MET  20           H        MET  20   2.028   4.683  -0.154
  120    HA   MET  20           HA       MET  20   2.338   7.446  -1.017
  121   1HB   MET  20          1HB       MET  20   0.808   5.086  -2.151
  122   2HB   MET  20          2HB       MET  20   1.001   6.632  -2.978
  123   1HG   MET  20          1HG       MET  20   3.418   6.371  -3.011
  124   2HG   MET  20          2HG       MET  20   3.309   4.902  -2.043
  125   1HE   MET  20          1HE       MET  20   4.951   4.142  -4.072
  126   2HE   MET  20          2HE       MET  20   4.619   5.577  -5.039
  127   3HE   MET  20          3HE       MET  20   4.423   3.978  -5.753
  128    H    GLY  21           H        GLY  21   0.586   6.601   1.411
  129   1HA   GLY  21          1HA       GLY  21  -2.132   7.249   0.719
  130   2HA   GLY  21          2HA       GLY  21  -1.457   7.284   2.350
  131    H    ALA  22           H        ALA  22   0.689   9.158   1.025
  132    HA   ALA  22           HA       ALA  22  -0.551  11.628   1.896
  133   1HB   ALA  22          1HB       ALA  22   1.542  12.676   1.034
  134   2HB   ALA  22          2HB       ALA  22   2.012  11.118   0.353
  135   3HB   ALA  22          3HB       ALA  22   1.866  11.309   2.101
  136    H    ALA  23           H        ALA  23   0.587  10.537  -1.325
  137    HA   ALA  23           HA       ALA  23  -0.728  12.730  -2.699
  138   1HB   ALA  23          1HB       ALA  23  -0.086  11.557  -4.737
  139   2HB   ALA  23          2HB       ALA  23   0.254  10.090  -3.819
  140   3HB   ALA  23          3HB       ALA  23   1.261  11.520  -3.601
  141    H    SER  24           H        SER  24  -2.521  11.236  -0.970
  142    HA   SER  24           HA       SER  24  -4.677  10.738  -2.892
  143   1HB   SER  24          1HB       SER  24  -3.474   8.549  -2.833
  144   2HB   SER  24          2HB       SER  24  -3.737   8.482  -1.093
  145    HG   SER  24           HG       SER  24  -6.070   8.932  -1.912
  146    H    MET  25           H        MET  25  -4.630  12.712  -1.062
  147    HA   MET  25           HA       MET  25  -5.761  13.622   0.779
  148   1HB   MET  25          1HB       MET  25  -7.630  11.263   0.395
  149   2HB   MET  25          2HB       MET  25  -8.012  12.824   1.122
  150   1HG   MET  25          1HG       MET  25  -7.505  13.926  -1.056
  151   2HG   MET  25          2HG       MET  25  -7.240  12.335  -1.768
  152   1HE   MET  25          1HE       MET  25  -9.049  12.056  -3.537
  153   2HE   MET  25          2HE       MET  25  -8.972  13.806  -3.337
  154   3HE   MET  25          3HE       MET  25 -10.538  13.006  -3.454
  155    H    THR  26           H        THR  26  -4.403  13.349   2.538
  156    HA   THR  26           HA       THR  26  -3.723  10.893   3.782
  157    HB   THR  26           HB       THR  26  -3.189  12.313   5.785
  158    HG1  THR  26           HG1      THR  26  -3.882  14.549   4.265
  159   1HG2  THR  26          1HG2      THR  26  -2.317  13.322   3.064
  160   2HG2  THR  26          2HG2      THR  26  -1.520  12.091   4.045
  161   3HG2  THR  26          3HG2      THR  26  -1.538  13.770   4.583
  162    H    LEU  27           H        LEU  27  -4.401  10.744   6.345
  163    HA   LEU  27           HA       LEU  27  -7.148   9.867   6.301
  164   1HB   LEU  27          1HB       LEU  27  -5.524  10.394   8.811
  165   2HB   LEU  27          2HB       LEU  27  -6.802   9.203   8.571
  166    HG   LEU  27           HG       LEU  27  -4.054   9.181   7.282
  167   1HD1  LEU  27          1HD1      LEU  27  -3.818   7.078   8.612
  168   2HD1  LEU  27          2HD1      LEU  27  -5.373   7.421   9.372
  169   3HD1  LEU  27          3HD1      LEU  27  -4.010   8.512   9.622
  170   1HD2  LEU  27          1HD2      LEU  27  -6.488   7.403   6.905
  171   2HD2  LEU  27          2HD2      LEU  27  -4.858   6.858   6.507
  172   3HD2  LEU  27          3HD2      LEU  27  -5.553   8.241   5.667
  173    H    THR  28           H        THR  28  -5.783  12.247   8.596
  174    HA   THR  28           HA       THR  28  -7.594  14.356   7.857
  175    HB   THR  28           HB       THR  28  -9.360  13.023   8.786
  176    HG1  THR  28           HG1      THR  28  -8.657  15.280   9.807
  177   1HG2  THR  28          1HG2      THR  28  -9.154  12.058  11.088
  178   2HG2  THR  28          2HG2      THR  28  -7.458  12.541  11.096
  179   3HG2  THR  28          3HG2      THR  28  -8.030  11.346   9.931
  180    H    VAL  29           H        VAL  29  -4.806  13.501   8.979
  181    HA   VAL  29           HA       VAL  29  -4.406  14.751  11.495
  182    HB   VAL  29           HB       VAL  29  -2.023  14.985  10.759
  183   1HG1  VAL  29          1HG1      VAL  29  -3.298  12.334  10.023
  184   2HG1  VAL  29          2HG1      VAL  29  -2.930  12.850  11.669
  185   3HG1  VAL  29          3HG1      VAL  29  -1.624  12.587  10.514
  186   1HG2  VAL  29          1HG2      VAL  29  -2.408  15.538   8.401
  187   2HG2  VAL  29          2HG2      VAL  29  -3.151  13.962   8.131
  188   3HG2  VAL  29          3HG2      VAL  29  -1.436  14.073   8.513
  189    H    GLN  30           H        GLN  30  -2.885  16.829  11.590
  190    HA   GLN  30           HA       GLN  30  -4.460  19.063  10.811
  191   1HB   GLN  30          1HB       GLN  30  -1.487  19.001  11.417
  192   2HB   GLN  30          2HB       GLN  30  -2.521  20.429  11.456
  193   1HG   GLN  30          1HG       GLN  30  -2.963  17.974  13.181
  194   2HG   GLN  30          2HG       GLN  30  -2.115  19.421  13.724
  195   1HE2  GLN  30          1HE2      GLN  30  -3.407  21.486  13.739
  196   2HE2  GLN  30          2HE2      GLN  30  -5.092  21.404  13.928
  197    H    ALA  31           H        ALA  31  -4.577  20.185   8.912
  198    HA   ALA  31           HA       ALA  31  -3.338  19.175   6.534
  199   1HB   ALA  31          1HB       ALA  31  -4.232  21.222   5.462
  200   2HB   ALA  31          2HB       ALA  31  -4.598  21.887   7.054
  201   3HB   ALA  31          3HB       ALA  31  -5.444  20.449   6.482
  Start of MODEL    3
    1    H    ALA   2           H        ALA   2   1.876 -25.395   1.527
    2    HA   ALA   2           HA       ALA   2   4.245 -24.943   0.116
    3   1HB   ALA   2          1HB       ALA   2   2.440 -27.023  -1.155
    4   2HB   ALA   2          2HB       ALA   2   4.027 -27.373  -0.471
    5   3HB   ALA   2          3HB       ALA   2   3.885 -26.306  -1.867
    6    H    VAL   3           H        VAL   3   3.444 -24.150  -2.210
    7    HA   VAL   3           HA       VAL   3   2.190 -22.532  -3.324
    8    HB   VAL   3           HB       VAL   3  -0.169 -23.802  -1.922
    9   1HG1  VAL   3          1HG1      VAL   3   0.140 -22.357  -4.566
   10   2HG1  VAL   3          2HG1      VAL   3  -0.692 -21.747  -3.136
   11   3HG1  VAL   3          3HG1      VAL   3  -1.343 -23.133  -4.009
   12   1HG2  VAL   3          1HG2      VAL   3   1.191 -25.563  -2.937
   13   2HG2  VAL   3          2HG2      VAL   3   1.291 -24.648  -4.441
   14   3HG2  VAL   3          3HG2      VAL   3  -0.257 -25.307  -3.911
   15    H    GLY   4           H        GLY   4   2.702 -20.605  -2.466
   16   1HA   GLY   4          1HA       GLY   4   0.833 -19.092  -1.051
   17   2HA   GLY   4          2HA       GLY   4   1.952 -19.688   0.158
   18    H    ILE   5           H        ILE   5   3.219 -19.021  -3.033
   19    HA   ILE   5           HA       ILE   5   5.085 -17.096  -1.987
   20    HB   ILE   5           HB       ILE   5   4.305 -17.745  -4.849
   21   1HG1  ILE   5          1HG1      ILE   5   6.684 -18.709  -3.219
   22   2HG1  ILE   5          2HG1      ILE   5   5.200 -19.642  -3.407
   23   1HG2  ILE   5          1HG2      ILE   5   6.590 -16.796  -5.347
   24   2HG2  ILE   5          2HG2      ILE   5   6.662 -16.232  -3.679
   25   3HG2  ILE   5          3HG2      ILE   5   5.433 -15.598  -4.773
   26   1HD1  ILE   5          1HD1      ILE   5   6.931 -20.321  -5.051
   27   2HD1  ILE   5          2HD1      ILE   5   6.945 -18.679  -5.694
   28   3HD1  ILE   5          3HD1      ILE   5   5.493 -19.671  -5.841
   29    H    GLY   6           H        GLY   6   1.922 -16.885  -3.459
   30   1HA   GLY   6          1HA       GLY   6   1.833 -14.162  -4.217
   31   2HA   GLY   6          2HA       GLY   6   0.439 -15.048  -3.581
   32    H    ALA   7           H        ALA   7   1.726 -15.684  -1.061
   33    HA   ALA   7           HA       ALA   7   0.913 -13.513   0.577
   34   1HB   ALA   7          1HB       ALA   7   1.175 -15.942   1.230
   35   2HB   ALA   7          2HB       ALA   7   1.906 -14.818   2.373
   36   3HB   ALA   7          3HB       ALA   7   2.923 -15.702   1.236
   37    H    LEU   8           H        LEU   8   4.024 -14.340  -0.822
   38    HA   LEU   8           HA       LEU   8   5.577 -12.511   0.820
   39   1HB   LEU   8          1HB       LEU   8   6.666 -14.458  -0.109
   40   2HB   LEU   8          2HB       LEU   8   6.187 -14.013  -1.742
   41    HG   LEU   8           HG       LEU   8   7.675 -12.091  -1.729
   42   1HD1  LEU   8          1HD1      LEU   8   7.540 -11.239   0.490
   43   2HD1  LEU   8          2HD1      LEU   8   9.203 -11.788   0.332
   44   3HD1  LEU   8          3HD1      LEU   8   8.029 -12.775   1.203
   45   1HD2  LEU   8          1HD2      LEU   8   8.687 -14.256  -2.284
   46   2HD2  LEU   8          2HD2      LEU   8   9.030 -14.551  -0.579
   47   3HD2  LEU   8          3HD2      LEU   8   9.853 -13.244  -1.429
   48    H    PHE   9           H        PHE   9   4.399 -12.407  -2.601
   49    HA   PHE   9           HA       PHE   9   5.451  -9.750  -3.025
   50   1HB   PHE   9          1HB       PHE   9   4.459 -11.408  -4.814
   51   2HB   PHE   9          2HB       PHE   9   2.906 -10.694  -4.397
   52    HD1  PHE   9           HD1      PHE   9   6.424  -9.661  -5.223
   53    HD2  PHE   9           HD2      PHE   9   2.235  -8.774  -5.641
   54    HE1  PHE   9           HE1      PHE   9   6.971  -7.765  -6.721
   55    HE2  PHE   9           HE2      PHE   9   2.790  -6.880  -7.137
   56    HZ   PHE   9           HZ       PHE   9   5.156  -6.375  -7.678
   57    H    LEU  10           H        LEU  10   2.203 -10.922  -1.900
   58    HA   LEU  10           HA       LEU  10   1.006  -8.388  -1.686
   59   1HB   LEU  10          1HB       LEU  10  -0.285 -10.421  -1.416
   60   2HB   LEU  10          2HB       LEU  10   0.651 -10.885  -0.001
   61    HG   LEU  10           HG       LEU  10  -0.268  -9.034   1.290
   62   1HD1  LEU  10          1HD1      LEU  10  -0.486  -7.242  -0.260
   63   2HD1  LEU  10          2HD1      LEU  10  -2.145  -7.645   0.164
   64   3HD1  LEU  10          3HD1      LEU  10  -1.467  -8.202  -1.367
   65   1HD2  LEU  10          1HD2      LEU  10  -2.451 -10.453  -0.268
   66   2HD2  LEU  10          2HD2      LEU  10  -2.635  -9.704   1.318
   67   3HD2  LEU  10          3HD2      LEU  10  -1.597 -11.116   1.124
   68    H    GLY  11           H        GLY  11   3.018 -10.104   0.705
   69   1HA   GLY  11          1HA       GLY  11   2.758  -8.353   2.872
   70   2HA   GLY  11          2HA       GLY  11   4.229  -9.257   2.525
   71    H    PHE  12           H        PHE  12   5.067  -8.020   0.137
   72    HA   PHE  12           HA       PHE  12   5.974  -5.405   1.210
   73   1HB   PHE  12          1HB       PHE  12   6.802  -7.031  -1.208
   74   2HB   PHE  12          2HB       PHE  12   7.455  -5.429  -0.864
   75    HD1  PHE  12           HD1      PHE  12   7.068  -8.872   0.520
   76    HD2  PHE  12           HD2      PHE  12   9.172  -5.134   0.790
   77    HE1  PHE  12           HE1      PHE  12   8.673  -9.887   2.114
   78    HE2  PHE  12           HE2      PHE  12  10.775  -6.153   2.382
   79    HZ   PHE  12           HZ       PHE  12  10.526  -8.528   3.044
   80    H    LEU  13           H        LEU  13   3.995  -6.580  -1.518
   81    HA   LEU  13           HA       LEU  13   3.871  -4.031  -2.843
   82   1HB   LEU  13          1HB       LEU  13   3.064  -6.530  -3.532
   83   2HB   LEU  13          2HB       LEU  13   1.512  -5.894  -3.025
   84    HG   LEU  13           HG       LEU  13   1.764  -5.555  -5.412
   85   1HD1  LEU  13          1HD1      LEU  13   1.247  -3.250  -5.567
   86   2HD1  LEU  13          2HD1      LEU  13   2.252  -2.840  -4.182
   87   3HD1  LEU  13          3HD1      LEU  13   0.740  -3.723  -3.948
   88   1HD2  LEU  13          1HD2      LEU  13   4.442  -5.417  -5.104
   89   2HD2  LEU  13          2HD2      LEU  13   4.111  -3.688  -5.157
   90   3HD2  LEU  13          3HD2      LEU  13   3.624  -4.719  -6.496
   91    H    GLY  14           H        GLY  14   2.407  -5.238   0.026
   92   1HA   GLY  14          1HA       GLY  14   0.093  -3.487   0.058
   93   2HA   GLY  14          2HA       GLY  14   0.752  -4.351   1.447
   94    H    ALA  15           H        ALA  15   3.366  -3.307   1.374
   95    HA   ALA  15           HA       ALA  15   3.194  -0.977   2.941
   96   1HB   ALA  15          1HB       ALA  15   5.625  -0.831   2.546
   97   2HB   ALA  15          2HB       ALA  15   5.472  -1.920   1.166
   98   3HB   ALA  15          3HB       ALA  15   5.145  -2.508   2.796
   99    H    ALA  16           H        ALA  16   3.451  -1.353  -0.547
  100    HA   ALA  16           HA       ALA  16   4.215   1.275  -1.255
  101   1HB   ALA  16          1HB       ALA  16   4.283  -0.637  -2.783
  102   2HB   ALA  16          2HB       ALA  16   3.316   0.664  -3.478
  103   3HB   ALA  16          3HB       ALA  16   2.522  -0.737  -2.757
  104    H    GLY  17           H        GLY  17   0.895  -0.090  -1.071
  105   1HA   GLY  17          1HA       GLY  17  -0.373   2.386  -1.770
  106   2HA   GLY  17          2HA       GLY  17  -1.161   1.023  -0.993
  107    H    SER  18           H        SER  18   0.416   0.904   1.322
  108    HA   SER  18           HA       SER  18  -0.919   2.756   3.021
  109   1HB   SER  18          1HB       SER  18  -0.178   0.489   3.664
  110   2HB   SER  18          2HB       SER  18   1.500   1.001   3.517
  111    HG   SER  18           HG       SER  18   0.253   1.093   5.669
  112    H    THR  19           H        THR  19   2.167   2.856   1.470
  113    HA   THR  19           HA       THR  19   3.256   5.015   3.185
  114    HB   THR  19           HB       THR  19   5.173   4.807   1.472
  115    HG1  THR  19           HG1      THR  19   3.277   3.258   0.356
  116   1HG2  THR  19          1HG2      THR  19   4.279   2.448   3.153
  117   2HG2  THR  19          2HG2      THR  19   5.415   3.719   3.599
  118   3HG2  THR  19          3HG2      THR  19   5.858   2.534   2.372
  119    H    MET  20           H        MET  20   2.011   4.523  -0.090
  120    HA   MET  20           HA       MET  20   2.478   7.272  -0.940
  121   1HB   MET  20          1HB       MET  20   0.809   5.025  -2.111
  122   2HB   MET  20          2HB       MET  20   1.146   6.553  -2.925
  123   1HG   MET  20          1HG       MET  20   3.323   4.692  -1.934
  124   2HG   MET  20          2HG       MET  20   2.682   4.645  -3.576
  125   1HE   MET  20          1HE       MET  20   6.323   6.381  -3.370
  126   2HE   MET  20          2HE       MET  20   5.471   4.912  -3.839
  127   3HE   MET  20          3HE       MET  20   5.645   5.314  -2.133
  128    H    GLY  21           H        GLY  21   0.577   6.359   1.419
  129   1HA   GLY  21          1HA       GLY  21  -2.066   7.185   0.730
  130   2HA   GLY  21          2HA       GLY  21  -1.405   7.185   2.365
  131    H    ALA  22           H        ALA  22   0.796   9.011   1.699
  132    HA   ALA  22           HA       ALA  22  -0.598  11.514   2.127
  133   1HB   ALA  22          1HB       ALA  22   1.657  11.047   3.056
  134   2HB   ALA  22          2HB       ALA  22   1.640  12.518   2.082
  135   3HB   ALA  22          3HB       ALA  22   2.312  11.027   1.418
  136    H    ALA  23           H        ALA  23  -0.166   9.732  -0.640
  137    HA   ALA  23           HA       ALA  23   0.513  11.815  -2.535
  138   1HB   ALA  23          1HB       ALA  23  -1.000   9.228  -2.996
  139   2HB   ALA  23          2HB       ALA  23   0.757   9.382  -3.019
  140   3HB   ALA  23          3HB       ALA  23  -0.218  10.211  -4.234
  141    H    SER  24           H        SER  24  -2.006  11.747  -0.541
  142    HA   SER  24           HA       SER  24  -4.219  12.276  -2.390
  143   1HB   SER  24          1HB       SER  24  -4.000  12.803   0.589
  144   2HB   SER  24          2HB       SER  24  -5.482  12.817  -0.360
  145    HG   SER  24           HG       SER  24  -4.005  10.546  -0.701
  146    H    MET  25           H        MET  25  -2.066  13.943  -3.024
  147    HA   MET  25           HA       MET  25  -1.491  16.200  -3.333
  148   1HB   MET  25          1HB       MET  25  -4.438  16.629  -2.769
  149   2HB   MET  25          2HB       MET  25  -3.368  17.703  -3.672
  150   1HG   MET  25          1HG       MET  25  -3.005  15.906  -5.345
  151   2HG   MET  25          2HG       MET  25  -4.129  14.873  -4.460
  152   1HE   MET  25          1HE       MET  25  -4.872  14.892  -7.136
  153   2HE   MET  25          2HE       MET  25  -3.995  16.356  -7.580
  154   3HE   MET  25          3HE       MET  25  -5.726  16.247  -7.887
  155    H    THR  26           H        THR  26  -0.231  16.279  -1.342
  156    HA   THR  26           HA       THR  26  -1.370  16.976   1.196
  157    HB   THR  26           HB       THR  26   0.919  17.497   1.867
  158    HG1  THR  26           HG1      THR  26   2.194  17.032  -0.423
  159   1HG2  THR  26          1HG2      THR  26   0.265  15.110   1.526
  160   2HG2  THR  26          2HG2      THR  26   1.989  15.392   1.282
  161   3HG2  THR  26          3HG2      THR  26   0.921  15.201  -0.108
  162    H    LEU  27           H        LEU  27  -1.793  18.986   2.101
  163    HA   LEU  27           HA       LEU  27  -2.350  21.193   0.387
  164   1HB   LEU  27          1HB       LEU  27  -2.016  20.928   3.386
  165   2HB   LEU  27          2HB       LEU  27  -2.341  22.497   2.653
  166    HG   LEU  27           HG       LEU  27  -4.415  21.662   1.677
  167   1HD1  LEU  27          1HD1      LEU  27  -3.505  19.010   2.833
  168   2HD1  LEU  27          2HD1      LEU  27  -3.936  19.383   1.162
  169   3HD1  LEU  27          3HD1      LEU  27  -5.188  19.318   2.398
  170   1HD2  LEU  27          1HD2      LEU  27  -5.663  21.247   3.769
  171   2HD2  LEU  27          2HD2      LEU  27  -4.464  22.519   3.995
  172   3HD2  LEU  27          3HD2      LEU  27  -4.151  20.893   4.604
  173    H    THR  28           H        THR  28  -0.470  21.625  -0.867
  174    HA   THR  28           HA       THR  28   2.131  22.076   0.265
  175    HB   THR  28           HB       THR  28   2.653  23.123  -1.917
  176    HG1  THR  28           HG1      THR  28   1.110  23.897  -3.099
  177   1HG2  THR  28          1HG2      THR  28   0.885  20.680  -2.218
  178   2HG2  THR  28          2HG2      THR  28   2.562  20.640  -1.673
  179   3HG2  THR  28          3HG2      THR  28   2.179  21.180  -3.306
  180    H    VAL  29           H        VAL  29   2.477  23.666   1.748
  181    HA   VAL  29           HA       VAL  29   0.845  25.992   2.050
  182    HB   VAL  29           HB       VAL  29   2.700  26.831   3.496
  183   1HG1  VAL  29          1HG1      VAL  29   2.007  23.897   3.846
  184   2HG1  VAL  29          2HG1      VAL  29   1.029  25.260   4.394
  185   3HG1  VAL  29          3HG1      VAL  29   2.613  24.964   5.114
  186   1HG2  VAL  29          1HG2      VAL  29   4.659  25.305   3.826
  187   2HG2  VAL  29          2HG2      VAL  29   4.614  26.013   2.213
  188   3HG2  VAL  29          3HG2      VAL  29   4.102  24.344   2.457
  189    H    GLN  30           H        GLN  30   2.649  28.141   2.182
  190    HA   GLN  30           HA       GLN  30   2.626  29.094  -0.497
  191   1HB   GLN  30          1HB       GLN  30   4.279  29.985   1.890
  192   2HB   GLN  30          2HB       GLN  30   4.184  30.875   0.372
  193   1HG   GLN  30          1HG       GLN  30   2.579  31.850   1.890
  194   2HG   GLN  30          2HG       GLN  30   1.679  30.961   0.663
  195   1HE2  GLN  30          1HE2      GLN  30   0.053  29.681   1.539
  196   2HE2  GLN  30          2HE2      GLN  30   0.089  28.971   3.081
  197    H    ALA  31           H        ALA  31   4.725  29.812  -1.654
  198    HA   ALA  31           HA       ALA  31   6.236  27.508  -2.364
  199   1HB   ALA  31          1HB       ALA  31   6.053  29.414  -3.873
  200   2HB   ALA  31          2HB       ALA  31   7.755  29.130  -3.508
  201   3HB   ALA  31          3HB       ALA  31   6.891  30.448  -2.716
  Start of MODEL    4
    1    H    ALA   2           H        ALA   2   1.956 -23.338  -4.962
    2    HA   ALA   2           HA       ALA   2   2.426 -25.614  -3.113
    3   1HB   ALA   2          1HB       ALA   2   4.190 -25.235  -4.845
    4   2HB   ALA   2          2HB       ALA   2   4.760 -24.915  -3.207
    5   3HB   ALA   2          3HB       ALA   2   4.345 -23.573  -4.276
    6    H    VAL   3           H        VAL   3   1.459 -24.899  -1.245
    7    HA   VAL   3           HA       VAL   3   0.921 -23.503   0.554
    8    HB   VAL   3           HB       VAL   3   3.665 -22.395  -0.127
    9   1HG1  VAL   3          1HG1      VAL   3   2.496 -20.892   1.400
   10   2HG1  VAL   3          2HG1      VAL   3   3.682 -21.814   2.320
   11   3HG1  VAL   3          3HG1      VAL   3   1.975 -22.254   2.391
   12   1HG2  VAL   3          1HG2      VAL   3   4.477 -24.018   1.497
   13   2HG2  VAL   3          2HG2      VAL   3   3.558 -24.859   0.249
   14   3HG2  VAL   3          3HG2      VAL   3   2.832 -24.555   1.828
   15    H    GLY   4           H        GLY   4   2.790 -20.909  -0.820
   16   1HA   GLY   4          1HA       GLY   4   0.938 -19.664  -2.474
   17   2HA   GLY   4          2HA       GLY   4   0.519 -19.134  -0.856
   18    H    ILE   5           H        ILE   5   3.009 -19.005  -3.343
   19    HA   ILE   5           HA       ILE   5   4.859 -17.363  -1.862
   20    HB   ILE   5           HB       ILE   5   4.428 -17.678  -4.855
   21   1HG1  ILE   5          1HG1      ILE   5   6.476 -19.003  -3.041
   22   2HG1  ILE   5          2HG1      ILE   5   4.967 -19.775  -3.524
   23   1HG2  ILE   5          1HG2      ILE   5   5.701 -15.652  -4.372
   24   2HG2  ILE   5          2HG2      ILE   5   6.799 -16.881  -4.990
   25   3HG2  ILE   5          3HG2      ILE   5   6.743 -16.537  -3.263
   26   1HD1  ILE   5          1HD1      ILE   5   6.808 -20.473  -5.002
   27   2HD1  ILE   5          2HD1      ILE   5   7.125 -18.788  -5.414
   28   3HD1  ILE   5          3HD1      ILE   5   5.607 -19.543  -5.899
   29    H    GLY   6           H        GLY   6   1.892 -16.810  -3.559
   30   1HA   GLY   6          1HA       GLY   6   2.011 -14.080  -4.219
   31   2HA   GLY   6          2HA       GLY   6   0.537 -14.881  -3.656
   32    H    ALA   7           H        ALA   7   1.799 -15.650  -1.114
   33    HA   ALA   7           HA       ALA   7   0.981 -13.535   0.573
   34   1HB   ALA   7          1HB       ALA   7   2.961 -15.783   1.073
   35   2HB   ALA   7          2HB       ALA   7   1.211 -15.900   1.257
   36   3HB   ALA   7          3HB       ALA   7   2.140 -14.850   2.325
   37    H    LEU   8           H        LEU   8   4.123 -14.293  -0.803
   38    HA   LEU   8           HA       LEU   8   5.597 -12.410   0.880
   39   1HB   LEU   8          1HB       LEU   8   6.537 -13.540  -1.771
   40   2HB   LEU   8          2HB       LEU   8   7.520 -12.984  -0.417
   41    HG   LEU   8           HG       LEU   8   5.768 -15.460  -0.527
   42   1HD1  LEU   8          1HD1      LEU   8   8.735 -15.164   0.030
   43   2HD1  LEU   8          2HD1      LEU   8   8.074 -15.515  -1.566
   44   3HD1  LEU   8          3HD1      LEU   8   7.846 -16.661  -0.247
   45   1HD2  LEU   8          1HD2      LEU   8   6.729 -15.844   1.835
   46   2HD2  LEU   8          2HD2      LEU   8   5.464 -14.629   1.699
   47   3HD2  LEU   8          3HD2      LEU   8   7.151 -14.130   1.826
   48    H    PHE   9           H        PHE   9   4.413 -12.316  -2.542
   49    HA   PHE   9           HA       PHE   9   5.428  -9.626  -2.932
   50   1HB   PHE   9          1HB       PHE   9   3.097 -11.009  -4.310
   51   2HB   PHE   9          2HB       PHE   9   3.731  -9.427  -4.771
   52    HD1  PHE   9           HD1      PHE   9   4.319 -13.048  -4.835
   53    HD2  PHE   9           HD2      PHE   9   6.034  -9.197  -5.670
   54    HE1  PHE   9           HE1      PHE   9   6.090 -14.129  -6.193
   55    HE2  PHE   9           HE2      PHE   9   7.803 -10.280  -7.027
   56    HZ   PHE   9           HZ       PHE   9   7.832 -12.746  -7.290
   57    H    LEU  10           H        LEU  10   2.161 -10.868  -1.868
   58    HA   LEU  10           HA       LEU  10   0.974  -8.323  -1.618
   59   1HB   LEU  10          1HB       LEU  10   0.532 -11.028  -0.429
   60   2HB   LEU  10          2HB       LEU  10  -0.173  -9.700   0.486
   61    HG   LEU  10           HG       LEU  10  -1.321  -8.933  -1.614
   62   1HD1  LEU  10          1HD1      LEU  10  -1.400 -10.409  -3.544
   63   2HD1  LEU  10          2HD1      LEU  10  -0.385 -11.595  -2.728
   64   3HD1  LEU  10          3HD1      LEU  10   0.287 -10.036  -3.200
   65   1HD2  LEU  10          1HD2      LEU  10  -2.453 -10.383   0.049
   66   2HD2  LEU  10          2HD2      LEU  10  -1.871 -11.808  -0.811
   67   3HD2  LEU  10          3HD2      LEU  10  -3.015 -10.715  -1.590
   68    H    GLY  11           H        GLY  11   2.986 -10.082   0.734
   69   1HA   GLY  11          1HA       GLY  11   2.772  -8.342   2.915
   70   2HA   GLY  11          2HA       GLY  11   4.231  -9.254   2.540
   71    H    PHE  12           H        PHE  12   5.031  -8.021   0.134
   72    HA   PHE  12           HA       PHE  12   5.972  -5.413   1.186
   73   1HB   PHE  12          1HB       PHE  12   7.545  -7.056   0.119
   74   2HB   PHE  12          2HB       PHE  12   6.736  -6.762  -1.417
   75    HD1  PHE  12           HD1      PHE  12   7.011  -4.639  -2.602
   76    HD2  PHE  12           HD2      PHE  12   8.844  -5.270   1.231
   77    HE1  PHE  12           HE1      PHE  12   8.395  -2.609  -2.931
   78    HE2  PHE  12           HE2      PHE  12  10.229  -3.239   0.901
   79    HZ   PHE  12           HZ       PHE  12  10.004  -1.909  -1.180
   80    H    LEU  13           H        LEU  13   3.988  -6.587  -1.543
   81    HA   LEU  13           HA       LEU  13   3.841  -4.036  -2.870
   82   1HB   LEU  13          1HB       LEU  13   2.244  -6.584  -2.950
   83   2HB   LEU  13          2HB       LEU  13   1.520  -5.161  -3.673
   84    HG   LEU  13           HG       LEU  13   2.869  -6.699  -5.235
   85   1HD1  LEU  13          1HD1      LEU  13   2.231  -4.292  -5.733
   86   2HD1  LEU  13          2HD1      LEU  13   3.643  -4.897  -6.591
   87   3HD1  LEU  13          3HD1      LEU  13   3.851  -3.835  -5.205
   88   1HD2  LEU  13          1HD2      LEU  13   5.330  -5.295  -4.176
   89   2HD2  LEU  13          2HD2      LEU  13   5.212  -6.728  -5.191
   90   3HD2  LEU  13          3HD2      LEU  13   4.809  -6.830  -3.483
   91    H    GLY  14           H        GLY  14   2.417  -5.243   0.013
   92   1HA   GLY  14          1HA       GLY  14   0.090  -3.502   0.045
   93   2HA   GLY  14          2HA       GLY  14   0.752  -4.367   1.433
   94    H    ALA  15           H        ALA  15   3.367  -3.322   1.338
   95    HA   ALA  15           HA       ALA  15   3.210  -0.998   2.916
   96   1HB   ALA  15          1HB       ALA  15   5.645  -0.837   2.454
   97   2HB   ALA  15          2HB       ALA  15   5.458  -1.985   1.129
   98   3HB   ALA  15          3HB       ALA  15   5.162  -2.500   2.789
   99    H    ALA  16           H        ALA  16   3.438  -1.357  -0.578
  100    HA   ALA  16           HA       ALA  16   4.200   1.274  -1.274
  101   1HB   ALA  16          1HB       ALA  16   3.195   0.668  -3.493
  102   2HB   ALA  16          2HB       ALA  16   2.556  -0.795  -2.747
  103   3HB   ALA  16          3HB       ALA  16   4.300  -0.549  -2.855
  104    H    GLY  17           H        GLY  17   0.878  -0.093  -1.103
  105   1HA   GLY  17          1HA       GLY  17  -0.391   2.388  -1.778
  106   2HA   GLY  17          2HA       GLY  17  -1.177   1.018  -1.008
  107    H    SER  18           H        SER  18   0.401   0.869   1.294
  108    HA   SER  18           HA       SER  18  -0.913   2.715   3.018
  109   1HB   SER  18          1HB       SER  18   1.488   0.932   3.490
  110   2HB   SER  18          2HB       SER  18   0.474   1.639   4.744
  111    HG   SER  18           HG       SER  18  -0.374  -0.134   2.689
  112    H    THR  19           H        THR  19   2.156   2.801   1.441
  113    HA   THR  19           HA       THR  19   3.293   4.922   3.164
  114    HB   THR  19           HB       THR  19   4.339   3.658   0.610
  115    HG1  THR  19           HG1      THR  19   4.715   2.032   1.856
  116   1HG2  THR  19          1HG2      THR  19   5.410   5.785   1.069
  117   2HG2  THR  19          2HG2      THR  19   6.529   4.493   1.502
  118   3HG2  THR  19          3HG2      THR  19   5.640   5.349   2.763
  119    H    MET  20           H        MET  20   2.018   4.491  -0.108
  120    HA   MET  20           HA       MET  20   2.502   7.246  -0.922
  121   1HB   MET  20          1HB       MET  20   0.814   5.027  -2.117
  122   2HB   MET  20          2HB       MET  20   1.158   6.562  -2.911
  123   1HG   MET  20          1HG       MET  20   3.326   4.671  -1.955
  124   2HG   MET  20          2HG       MET  20   2.678   4.653  -3.594
  125   1HE   MET  20          1HE       MET  20   6.309   6.323  -3.537
  126   2HE   MET  20          2HE       MET  20   5.392   4.880  -3.965
  127   3HE   MET  20          3HE       MET  20   5.697   5.252  -2.270
  128    H    GLY  21           H        GLY  21   0.536   6.225   1.390
  129   1HA   GLY  21          1HA       GLY  21  -2.047   7.248   0.648
  130   2HA   GLY  21          2HA       GLY  21  -1.493   6.983   2.301
  131    H    ALA  22           H        ALA  22   0.909   8.776   1.605
  132    HA   ALA  22           HA       ALA  22  -0.248  11.233   2.617
  133   1HB   ALA  22          1HB       ALA  22   2.491  10.760   1.401
  134   2HB   ALA  22          2HB       ALA  22   2.089  10.521   3.101
  135   3HB   ALA  22          3HB       ALA  22   2.017  12.137   2.395
  136    H    ALA  23           H        ALA  23  -0.085   9.891  -0.485
  137    HA   ALA  23           HA       ALA  23   0.286  12.308  -2.032
  138   1HB   ALA  23          1HB       ALA  23  -0.551  10.971  -3.914
  139   2HB   ALA  23          2HB       ALA  23  -1.113   9.727  -2.796
  140   3HB   ALA  23          3HB       ALA  23   0.613  10.033  -2.977
  141    H    SER  24           H        SER  24  -2.132  11.461   0.046
  142    HA   SER  24           HA       SER  24  -4.441  12.390  -1.506
  143   1HB   SER  24          1HB       SER  24  -4.784  10.760   0.278
  144   2HB   SER  24          2HB       SER  24  -4.074  11.856   1.459
  145    HG   SER  24           HG       SER  24  -5.788  13.261   1.126
  146    H    MET  25           H        MET  25  -2.286  14.267  -1.476
  147    HA   MET  25           HA       MET  25  -1.848  16.533  -1.046
  148   1HB   MET  25          1HB       MET  25  -4.843  16.641  -0.590
  149   2HB   MET  25          2HB       MET  25  -3.794  17.979  -1.064
  150   1HG   MET  25          1HG       MET  25  -3.218  16.728  -3.151
  151   2HG   MET  25          2HG       MET  25  -4.391  15.492  -2.693
  152   1HE   MET  25          1HE       MET  25  -5.675  15.871  -5.043
  153   2HE   MET  25          2HE       MET  25  -4.318  16.950  -5.353
  154   3HE   MET  25          3HE       MET  25  -5.961  17.497  -5.678
  155    H    THR  26           H        THR  26  -1.751  14.680   1.249
  156    HA   THR  26           HA       THR  26  -2.942  15.967   3.551
  157    HB   THR  26           HB       THR  26  -1.672  14.414   4.858
  158    HG1  THR  26           HG1      THR  26  -0.013  13.198   3.444
  159   1HG2  THR  26          1HG2      THR  26  -2.131  13.074   2.180
  160   2HG2  THR  26          2HG2      THR  26  -3.411  13.424   3.341
  161   3HG2  THR  26          3HG2      THR  26  -2.122  12.299   3.764
  162    H    LEU  27           H        LEU  27   0.147  16.271   1.869
  163    HA   LEU  27           HA       LEU  27   1.454  17.848   3.897
  164   1HB   LEU  27          1HB       LEU  27   2.012  18.033   0.921
  165   2HB   LEU  27          2HB       LEU  27   3.139  18.269   2.257
  166    HG   LEU  27           HG       LEU  27   1.839  15.652   1.435
  167   1HD1  LEU  27          1HD1      LEU  27   3.659  16.380  -0.039
  168   2HD1  LEU  27          2HD1      LEU  27   4.177  15.001   0.931
  169   3HD1  LEU  27          3HD1      LEU  27   4.710  16.627   1.356
  170   1HD2  LEU  27          1HD2      LEU  27   3.472  14.723   3.199
  171   2HD2  LEU  27          2HD2      LEU  27   2.054  15.559   3.819
  172   3HD2  LEU  27          3HD2      LEU  27   3.615  16.380   3.789
  173    H    THR  28           H        THR  28  -1.258  18.541   2.128
  174    HA   THR  28           HA       THR  28  -0.840  21.230   1.276
  175    HB   THR  28           HB       THR  28  -3.410  20.023   2.345
  176    HG1  THR  28           HG1      THR  28  -2.146  18.970   0.539
  177   1HG2  THR  28          1HG2      THR  28  -2.821  22.338   0.481
  178   2HG2  THR  28          2HG2      THR  28  -3.565  22.429   2.078
  179   3HG2  THR  28          3HG2      THR  28  -4.429  21.663   0.745
  180    H    VAL  29           H        VAL  29  -1.177  19.852   4.434
  181    HA   VAL  29           HA       VAL  29  -2.199  22.086   5.867
  182    HB   VAL  29           HB       VAL  29  -1.022  21.091   7.834
  183   1HG1  VAL  29          1HG1      VAL  29  -2.455  19.144   6.002
  184   2HG1  VAL  29          2HG1      VAL  29  -3.214  20.232   7.163
  185   3HG1  VAL  29          3HG1      VAL  29  -2.203  18.903   7.732
  186   1HG2  VAL  29          1HG2      VAL  29   1.023  20.332   6.727
  187   2HG2  VAL  29          2HG2      VAL  29   0.097  19.225   5.715
  188   3HG2  VAL  29          3HG2      VAL  29   0.207  18.948   7.451
  189    H    GLN  30           H        GLN  30  -0.244  22.780   7.744
  190    HA   GLN  30           HA       GLN  30   1.156  24.866   6.370
  191   1HB   GLN  30          1HB       GLN  30   1.572  23.670   9.131
  192   2HB   GLN  30          2HB       GLN  30   2.392  25.121   8.556
  193   1HG   GLN  30          1HG       GLN  30   0.455  25.826   9.816
  194   2HG   GLN  30          2HG       GLN  30   0.128  26.140   8.113
  195   1HE2  GLN  30          1HE2      GLN  30  -1.766  25.225   7.269
  196   2HE2  GLN  30          2HE2      GLN  30  -2.681  24.022   8.042
  197    H    ALA  31           H        ALA  31   3.656  25.063   6.629
  198    HA   ALA  31           HA       ALA  31   5.734  24.298   5.854
  199   1HB   ALA  31          1HB       ALA  31   4.910  21.714   7.209
  200   2HB   ALA  31          2HB       ALA  31   5.550  23.114   8.069
  201   3HB   ALA  31          3HB       ALA  31   6.551  22.271   6.886
  Start of MODEL    5
    1    H    ALA   2           H        ALA   2  -2.256 -22.614  -2.561
    2    HA   ALA   2           HA       ALA   2  -4.179 -21.968  -4.727
    3   1HB   ALA   2          1HB       ALA   2  -3.611 -20.452  -2.163
    4   2HB   ALA   2          2HB       ALA   2  -5.048 -21.437  -2.439
    5   3HB   ALA   2          3HB       ALA   2  -4.761 -20.000  -3.422
    6    H    VAL   3           H        VAL   3  -2.850 -21.310  -6.360
    7    HA   VAL   3           HA       VAL   3  -1.071 -20.274  -7.473
    8    HB   VAL   3           HB       VAL   3  -1.407 -18.314  -5.177
    9   1HG1  VAL   3          1HG1      VAL   3  -0.140 -18.053  -7.924
   10   2HG1  VAL   3          2HG1      VAL   3   0.682 -17.898  -6.371
   11   3HG1  VAL   3          3HG1      VAL   3  -0.498 -16.688  -6.867
   12   1HG2  VAL   3          1HG2      VAL   3  -3.484 -18.805  -6.461
   13   2HG2  VAL   3          2HG2      VAL   3  -2.643 -18.358  -7.945
   14   3HG2  VAL   3          3HG2      VAL   3  -2.926 -17.149  -6.694
   15    H    GLY   4           H        GLY   4   0.193 -18.982  -4.498
   16   1HA   GLY   4          1HA       GLY   4   1.772 -21.083  -3.602
   17   2HA   GLY   4          2HA       GLY   4   2.716 -20.311  -4.860
   18    H    ILE   5           H        ILE   5   4.131 -18.904  -4.075
   19    HA   ILE   5           HA       ILE   5   4.034 -17.893  -1.376
   20    HB   ILE   5           HB       ILE   5   6.106 -16.687  -2.081
   21   1HG1  ILE   5          1HG1      ILE   5   5.632 -18.075  -4.738
   22   2HG1  ILE   5          2HG1      ILE   5   5.364 -16.354  -4.466
   23   1HG2  ILE   5          1HG2      ILE   5   7.433 -18.719  -2.395
   24   2HG2  ILE   5          2HG2      ILE   5   5.997 -19.603  -2.909
   25   3HG2  ILE   5          3HG2      ILE   5   6.135 -19.039  -1.245
   26   1HD1  ILE   5          1HD1      ILE   5   7.993 -17.833  -4.162
   27   2HD1  ILE   5          2HD1      ILE   5   7.746 -16.135  -3.753
   28   3HD1  ILE   5          3HD1      ILE   5   7.582 -16.673  -5.425
   29    H    GLY   6           H        GLY   6   1.900 -17.098  -3.394
   30   1HA   GLY   6          1HA       GLY   6   1.970 -14.422  -4.164
   31   2HA   GLY   6          2HA       GLY   6   0.495 -15.206  -3.575
   32    H    ALA   7           H        ALA   7   1.841 -15.808  -1.008
   33    HA   ALA   7           HA       ALA   7   0.954 -13.629   0.588
   34   1HB   ALA   7          1HB       ALA   7   1.241 -15.953   1.389
   35   2HB   ALA   7          2HB       ALA   7   2.170 -14.833   2.386
   36   3HB   ALA   7          3HB       ALA   7   2.986 -15.813   1.168
   37    H    LEU   8           H        LEU   8   4.083 -14.367  -0.847
   38    HA   LEU   8           HA       LEU   8   5.582 -12.455   0.748
   39   1HB   LEU   8          1HB       LEU   8   6.520 -14.524  -0.402
   40   2HB   LEU   8          2HB       LEU   8   6.354 -13.658  -1.923
   41    HG   LEU   8           HG       LEU   8   7.769 -11.772  -0.739
   42   1HD1  LEU   8          1HD1      LEU   8   7.773 -12.633   1.536
   43   2HD1  LEU   8          2HD1      LEU   8   9.411 -12.747   0.907
   44   3HD1  LEU   8          3HD1      LEU   8   8.402 -14.188   0.993
   45   1HD2  LEU   8          1HD2      LEU   8   8.999 -14.430  -1.540
   46   2HD2  LEU   8          2HD2      LEU   8   9.876 -12.905  -1.422
   47   3HD2  LEU   8          3HD2      LEU   8   8.601 -13.098  -2.625
   48    H    PHE   9           H        PHE   9   4.345 -12.398  -2.659
   49    HA   PHE   9           HA       PHE   9   5.316  -9.713  -3.108
   50   1HB   PHE   9          1HB       PHE   9   2.944 -11.127  -4.378
   51   2HB   PHE   9          2HB       PHE   9   3.563  -9.560  -4.899
   52    HD1  PHE   9           HD1      PHE   9   5.764  -9.360  -5.984
   53    HD2  PHE   9           HD2      PHE   9   4.219 -13.185  -4.779
   54    HE1  PHE   9           HE1      PHE   9   7.486 -10.492  -7.364
   55    HE2  PHE   9           HE2      PHE   9   5.940 -14.314  -6.161
   56    HZ   PHE   9           HZ       PHE   9   7.573 -12.969  -7.452
   57    H    LEU  10           H        LEU  10   2.135 -10.961  -1.912
   58    HA   LEU  10           HA       LEU  10   0.897  -8.441  -1.669
   59   1HB   LEU  10          1HB       LEU  10   0.606 -10.894   0.085
   60   2HB   LEU  10          2HB       LEU  10  -0.500  -9.526   0.110
   61    HG   LEU  10           HG       LEU  10   0.086 -11.012  -2.477
   62   1HD1  LEU  10          1HD1      LEU  10  -2.028 -11.683  -0.406
   63   2HD1  LEU  10          2HD1      LEU  10  -0.687 -12.712  -0.908
   64   3HD1  LEU  10          3HD1      LEU  10  -1.983 -12.338  -2.044
   65   1HD2  LEU  10          1HD2      LEU  10  -1.083  -8.910  -2.798
   66   2HD2  LEU  10          2HD2      LEU  10  -2.211  -9.273  -1.496
   67   3HD2  LEU  10          3HD2      LEU  10  -2.265 -10.197  -2.995
   68    H    GLY  11           H        GLY  11   2.963 -10.127   0.683
   69   1HA   GLY  11          1HA       GLY  11   2.702  -8.371   2.850
   70   2HA   GLY  11          2HA       GLY  11   4.166  -9.284   2.502
   71    H    PHE  12           H        PHE  12   5.076  -8.045   0.138
   72    HA   PHE  12           HA       PHE  12   5.970  -5.453   1.249
   73   1HB   PHE  12          1HB       PHE  12   6.783  -6.849  -1.310
   74   2HB   PHE  12          2HB       PHE  12   7.539  -5.404  -0.638
   75    HD1  PHE  12           HD1      PHE  12   7.465  -9.017  -0.541
   76    HD2  PHE  12           HD2      PHE  12   8.508  -5.518   1.727
   77    HE1  PHE  12           HE1      PHE  12   8.902 -10.398   0.933
   78    HE2  PHE  12           HE2      PHE  12   9.945  -6.902   3.198
   79    HZ   PHE  12           HZ       PHE  12  10.141  -9.342   2.802
   80    H    LEU  13           H        LEU  13   4.071  -6.525  -1.585
   81    HA   LEU  13           HA       LEU  13   4.006  -3.922  -2.815
   82   1HB   LEU  13          1HB       LEU  13   2.361  -6.433  -3.063
   83   2HB   LEU  13          2HB       LEU  13   1.757  -4.968  -3.816
   84    HG   LEU  13           HG       LEU  13   3.161  -6.525  -5.299
   85   1HD1  LEU  13          1HD1      LEU  13   4.324  -3.735  -5.122
   86   2HD1  LEU  13          2HD1      LEU  13   2.706  -4.048  -5.745
   87   3HD1  LEU  13          3HD1      LEU  13   4.109  -4.746  -6.546
   88   1HD2  LEU  13          1HD2      LEU  13   5.510  -6.629  -5.068
   89   2HD2  LEU  13          2HD2      LEU  13   4.922  -6.852  -3.425
   90   3HD2  LEU  13          3HD2      LEU  13   5.563  -5.289  -3.925
   91    H    GLY  14           H        GLY  14   2.620  -5.065   0.051
   92   1HA   GLY  14          1HA       GLY  14   0.213  -3.406   0.009
   93   2HA   GLY  14          2HA       GLY  14   0.862  -4.265   1.405
   94    H    ALA  15           H        ALA  15   3.445  -3.169   1.463
   95    HA   ALA  15           HA       ALA  15   3.161  -0.842   3.012
   96   1HB   ALA  15          1HB       ALA  15   5.167  -2.296   2.949
   97   2HB   ALA  15          2HB       ALA  15   5.601  -0.608   2.678
   98   3HB   ALA  15          3HB       ALA  15   5.520  -1.728   1.317
   99    H    ALA  16           H        ALA  16   3.569  -1.220  -0.450
  100    HA   ALA  16           HA       ALA  16   4.262   1.429  -1.157
  101   1HB   ALA  16          1HB       ALA  16   2.746  -0.727  -2.650
  102   2HB   ALA  16          2HB       ALA  16   4.482  -0.419  -2.701
  103   3HB   ALA  16          3HB       ALA  16   3.360   0.746  -3.402
  104    H    GLY  17           H        GLY  17   1.010  -0.069  -0.984
  105   1HA   GLY  17          1HA       GLY  17  -0.369   2.329  -1.759
  106   2HA   GLY  17          2HA       GLY  17  -1.098   0.952  -0.946
  107    H    SER  18           H        SER  18   0.468   0.950   1.360
  108    HA   SER  18           HA       SER  18  -0.931   2.788   3.024
  109   1HB   SER  18          1HB       SER  18   1.529   1.105   3.560
  110   2HB   SER  18          2HB       SER  18   0.483   1.811   4.789
  111    HG   SER  18           HG       SER  18  -0.917   0.278   4.447
  112    H    THR  19           H        THR  19   2.173   2.961   1.488
  113    HA   THR  19           HA       THR  19   3.174   5.166   3.193
  114    HB   THR  19           HB       THR  19   4.354   3.946   0.677
  115    HG1  THR  19           HG1      THR  19   5.642   2.820   2.300
  116   1HG2  THR  19          1HG2      THR  19   5.535   5.597   2.928
  117   2HG2  THR  19          2HG2      THR  19   5.310   6.115   1.258
  118   3HG2  THR  19          3HG2      THR  19   6.472   4.842   1.638
  119    H    MET  20           H        MET  20   2.000   4.615  -0.092
  120    HA   MET  20           HA       MET  20   2.387   7.367  -0.962
  121   1HB   MET  20          1HB       MET  20   0.805   5.057  -2.135
  122   2HB   MET  20          2HB       MET  20   1.133   6.578  -2.964
  123   1HG   MET  20          1HG       MET  20   3.318   4.774  -1.889
  124   2HG   MET  20          2HG       MET  20   2.725   4.697  -3.546
  125   1HE   MET  20          1HE       MET  20   6.327   6.517  -3.234
  126   2HE   MET  20          2HE       MET  20   5.532   4.995  -3.628
  127   3HE   MET  20          3HE       MET  20   5.635   5.518  -1.947
  128    H    GLY  21           H        GLY  21   0.360   6.196   1.280
  129   1HA   GLY  21          1HA       GLY  21  -2.166   7.417   0.419
  130   2HA   GLY  21          2HA       GLY  21  -1.830   6.728   2.008
  131    H    ALA  22           H        ALA  22   0.731   8.678   1.468
  132    HA   ALA  22           HA       ALA  22  -0.196  10.703   3.320
  133   1HB   ALA  22          1HB       ALA  22   2.004  11.763   2.876
  134   2HB   ALA  22          2HB       ALA  22   2.279  10.614   1.566
  135   3HB   ALA  22          3HB       ALA  22   2.168  10.044   3.231
  136    H    ALA  23           H        ALA  23   0.276  10.576  -0.194
  137    HA   ALA  23           HA       ALA  23  -0.280  13.384  -0.627
  138   1HB   ALA  23          1HB       ALA  23  -0.527  11.039  -2.534
  139   2HB   ALA  23          2HB       ALA  23   0.932  12.000  -2.283
  140   3HB   ALA  23          3HB       ALA  23  -0.503  12.742  -2.995
  141    H    SER  24           H        SER  24  -2.218  11.213   0.717
  142    HA   SER  24           HA       SER  24  -4.673  11.571  -0.844
  143   1HB   SER  24          1HB       SER  24  -4.236   9.549   0.563
  144   2HB   SER  24          2HB       SER  24  -4.321  10.566   1.997
  145    HG   SER  24           HG       SER  24  -6.330   9.588   1.528
  146    H    MET  25           H        MET  25  -3.508  14.065  -0.210
  147    HA   MET  25           HA       MET  25  -4.026  16.143   0.745
  148   1HB   MET  25          1HB       MET  25  -6.178  15.525  -0.460
  149   2HB   MET  25          2HB       MET  25  -6.797  14.946   1.085
  150   1HG   MET  25          1HG       MET  25  -7.573  17.205   0.838
  151   2HG   MET  25          2HG       MET  25  -6.273  17.258   2.027
  152   1HE   MET  25          1HE       MET  25  -7.085  19.819   0.994
  153   2HE   MET  25          2HE       MET  25  -5.644  20.608   0.359
  154   3HE   MET  25          3HE       MET  25  -5.548  19.689   1.859
  155    H    THR  26           H        THR  26  -2.795  15.999   2.670
  156    HA   THR  26           HA       THR  26  -3.695  14.579   5.015
  157    HB   THR  26           HB       THR  26  -1.938  15.927   6.183
  158    HG1  THR  26           HG1      THR  26  -0.667  17.125   4.406
  159   1HG2  THR  26          1HG2      THR  26  -1.100  14.772   3.508
  160   2HG2  THR  26          2HG2      THR  26  -1.362  13.843   4.983
  161   3HG2  THR  26          3HG2      THR  26  -0.048  15.016   4.902
  162    H    LEU  27           H        LEU  27  -4.959  15.300   6.712
  163    HA   LEU  27           HA       LEU  27  -6.645  17.617   6.281
  164   1HB   LEU  27          1HB       LEU  27  -6.257  15.709   8.601
  165   2HB   LEU  27          2HB       LEU  27  -7.359  17.074   8.718
  166    HG   LEU  27           HG       LEU  27  -8.443  14.889   8.051
  167   1HD1  LEU  27          1HD1      LEU  27  -9.993  15.871   6.603
  168   2HD1  LEU  27          2HD1      LEU  27  -8.787  16.846   5.774
  169   3HD1  LEU  27          3HD1      LEU  27  -9.299  17.275   7.406
  170   1HD2  LEU  27          1HD2      LEU  27  -6.476  14.197   6.574
  171   2HD2  LEU  27          2HD2      LEU  27  -7.113  15.312   5.363
  172   3HD2  LEU  27          3HD2      LEU  27  -8.081  13.939   5.892
  173    H    THR  28           H        THR  28  -3.505  17.616   6.949
  174    HA   THR  28           HA       THR  28  -2.031  19.078   8.037
  175    HB   THR  28           HB       THR  28  -2.617  21.378   7.919
  176    HG1  THR  28           HG1      THR  28  -4.928  20.472   8.886
  177   1HG2  THR  28          1HG2      THR  28  -4.473  20.047   5.928
  178   2HG2  THR  28          2HG2      THR  28  -2.724  20.148   5.723
  179   3HG2  THR  28          3HG2      THR  28  -3.692  21.620   5.769
  180    H    VAL  29           H        VAL  29  -2.998  21.210   9.924
  181    HA   VAL  29           HA       VAL  29  -2.726  19.788  12.362
  182    HB   VAL  29           HB       VAL  29  -4.131  22.447  11.972
  183   1HG1  VAL  29          1HG1      VAL  29  -3.225  22.862  14.271
  184   2HG1  VAL  29          2HG1      VAL  29  -2.671  21.189  14.315
  185   3HG1  VAL  29          3HG1      VAL  29  -4.396  21.543  14.220
  186   1HG2  VAL  29          1HG2      VAL  29  -1.869  23.419  12.342
  187   2HG2  VAL  29          2HG2      VAL  29  -1.947  22.467  10.860
  188   3HG2  VAL  29          3HG2      VAL  29  -1.186  21.795  12.300
  189    H    GLN  30           H        GLN  30  -4.186  18.712  13.632
  190    HA   GLN  30           HA       GLN  30  -6.781  18.046  12.594
  191   1HB   GLN  30          1HB       GLN  30  -5.738  17.762  15.430
  192   2HB   GLN  30          2HB       GLN  30  -7.133  16.922  14.752
  193   1HG   GLN  30          1HG       GLN  30  -4.315  16.686  13.652
  194   2HG   GLN  30          2HG       GLN  30  -5.036  15.534  14.775
  195   1HE2  GLN  30          1HE2      GLN  30  -4.450  15.912  11.545
  196   2HE2  GLN  30          2HE2      GLN  30  -5.752  15.029  10.907
  197    H    ALA  31           H        ALA  31  -8.849  18.480  13.831
  198    HA   ALA  31           HA       ALA  31  -9.232  21.315  14.141
  199   1HB   ALA  31          1HB       ALA  31 -11.023  19.703  13.453
  200   2HB   ALA  31          2HB       ALA  31 -11.507  20.742  14.793
  201   3HB   ALA  31          3HB       ALA  31 -11.035  19.071  15.100
  Start of MODEL    6
    1    H    ALA   2           H        ALA   2   0.893 -22.379   2.478
    2    HA   ALA   2           HA       ALA   2   3.385 -22.577   2.249
    3   1HB   ALA   2          1HB       ALA   2   4.214 -24.747   1.516
    4   2HB   ALA   2          2HB       ALA   2   2.595 -25.437   1.619
    5   3HB   ALA   2          3HB       ALA   2   3.436 -24.937   3.087
    6    H    VAL   3           H        VAL   3   4.208 -23.205  -0.108
    7    HA   VAL   3           HA       VAL   3   3.979 -22.783  -2.384
    8    HB   VAL   3           HB       VAL   3   1.127 -23.773  -2.084
    9   1HG1  VAL   3          1HG1      VAL   3   1.654 -24.760  -4.357
   10   2HG1  VAL   3          2HG1      VAL   3   3.160 -23.845  -4.337
   11   3HG1  VAL   3          3HG1      VAL   3   1.613 -23.001  -4.321
   12   1HG2  VAL   3          1HG2      VAL   3   2.549 -25.343  -0.888
   13   2HG2  VAL   3          2HG2      VAL   3   3.713 -25.355  -2.212
   14   3HG2  VAL   3          3HG2      VAL   3   2.111 -26.056  -2.439
   15    H    GLY   4           H        GLY   4   2.373 -21.043  -0.107
   16   1HA   GLY   4          1HA       GLY   4   0.798 -19.335  -1.949
   17   2HA   GLY   4          2HA       GLY   4   0.934 -19.149  -0.213
   18    H    ILE   5           H        ILE   5   3.045 -18.927  -3.095
   19    HA   ILE   5           HA       ILE   5   4.914 -17.135  -1.829
   20    HB   ILE   5           HB       ILE   5   5.634 -16.710  -4.224
   21   1HG1  ILE   5          1HG1      ILE   5   3.495 -18.770  -4.857
   22   2HG1  ILE   5          2HG1      ILE   5   3.322 -17.046  -5.180
   23   1HG2  ILE   5          1HG2      ILE   5   6.545 -18.577  -2.843
   24   2HG2  ILE   5          2HG2      ILE   5   6.486 -18.983  -4.557
   25   3HG2  ILE   5          3HG2      ILE   5   5.266 -19.625  -3.457
   26   1HD1  ILE   5          1HD1      ILE   5   5.379 -17.137  -6.582
   27   2HD1  ILE   5          2HD1      ILE   5   4.095 -18.173  -7.202
   28   3HD1  ILE   5          3HD1      ILE   5   5.450 -18.878  -6.320
   29    H    GLY   6           H        GLY   6   1.874 -16.743  -3.480
   30   1HA   GLY   6          1HA       GLY   6   1.899 -14.029  -4.212
   31   2HA   GLY   6          2HA       GLY   6   0.456 -14.856  -3.602
   32    H    ALA   7           H        ALA   7   1.756 -15.527  -1.068
   33    HA   ALA   7           HA       ALA   7   0.955 -13.357   0.577
   34   1HB   ALA   7          1HB       ALA   7   2.082 -14.649   2.354
   35   2HB   ALA   7          2HB       ALA   7   2.919 -15.611   1.135
   36   3HB   ALA   7          3HB       ALA   7   1.167 -15.727   1.301
   37    H    LEU   8           H        LEU   8   4.051 -14.185  -0.860
   38    HA   LEU   8           HA       LEU   8   5.621 -12.356   0.774
   39   1HB   LEU   8          1HB       LEU   8   6.307 -14.516  -0.632
   40   2HB   LEU   8          2HB       LEU   8   6.558 -13.353  -1.925
   41    HG   LEU   8           HG       LEU   8   7.887 -13.364   0.807
   42   1HD1  LEU   8          1HD1      LEU   8   8.777 -14.981  -0.835
   43   2HD1  LEU   8          2HD1      LEU   8   9.939 -13.694  -0.514
   44   3HD1  LEU   8          3HD1      LEU   8   8.992 -13.675  -2.002
   45   1HD2  LEU   8          1HD2      LEU   8   7.902 -11.301  -1.420
   46   2HD2  LEU   8          2HD2      LEU   8   9.214 -11.408  -0.243
   47   3HD2  LEU   8          3HD2      LEU   8   7.577 -11.055   0.296
   48    H    PHE   9           H        PHE   9   4.402 -12.238  -2.642
   49    HA   PHE   9           HA       PHE   9   5.408  -9.550  -3.043
   50   1HB   PHE   9          1HB       PHE   9   3.002 -10.847  -4.372
   51   2HB   PHE   9          2HB       PHE   9   3.778  -9.349  -4.887
   52    HD1  PHE   9           HD1      PHE   9   4.097 -13.016  -4.704
   53    HD2  PHE   9           HD2      PHE   9   6.014  -9.364  -5.915
   54    HE1  PHE   9           HE1      PHE   9   5.750 -14.317  -6.015
   55    HE2  PHE   9           HE2      PHE   9   7.664 -10.668  -7.229
   56    HZ   PHE   9           HZ       PHE   9   7.533 -13.144  -7.278
   57    H    LEU  10           H        LEU  10   2.191 -10.814  -1.899
   58    HA   LEU  10           HA       LEU  10   0.966  -8.295  -1.626
   59   1HB   LEU  10          1HB       LEU  10  -0.311 -10.337  -1.399
   60   2HB   LEU  10          2HB       LEU  10   0.653 -10.847  -0.019
   61    HG   LEU  10           HG       LEU  10  -0.254  -9.057   1.357
   62   1HD1  LEU  10          1HD1      LEU  10  -2.144  -7.624   0.322
   63   2HD1  LEU  10          2HD1      LEU  10  -1.501  -8.122  -1.243
   64   3HD1  LEU  10          3HD1      LEU  10  -0.494  -7.208  -0.123
   65   1HD2  LEU  10          1HD2      LEU  10  -2.477 -10.391  -0.219
   66   2HD2  LEU  10          2HD2      LEU  10  -2.605  -9.741   1.414
   67   3HD2  LEU  10          3HD2      LEU  10  -1.581 -11.143   1.101
   68    H    GLY  11           H        GLY  11   2.970 -10.091   0.712
   69   1HA   GLY  11          1HA       GLY  11   2.764  -8.380   2.918
   70   2HA   GLY  11          2HA       GLY  11   4.214  -9.308   2.540
   71    H    PHE  12           H        PHE  12   5.081  -8.069   0.182
   72    HA   PHE  12           HA       PHE  12   6.018  -5.468   1.259
   73   1HB   PHE  12          1HB       PHE  12   7.626  -7.070   0.224
   74   2HB   PHE  12          2HB       PHE  12   6.797  -6.861  -1.317
   75    HD1  PHE  12           HD1      PHE  12   6.923  -4.736  -2.548
   76    HD2  PHE  12           HD2      PHE  12   8.962  -5.253   1.199
   77    HE1  PHE  12           HE1      PHE  12   8.242  -2.681  -2.981
   78    HE2  PHE  12           HE2      PHE  12  10.279  -3.199   0.765
   79    HZ   PHE  12           HZ       PHE  12   9.921  -1.914  -1.325
   80    H    LEU  13           H        LEU  13   4.069  -6.662  -1.468
   81    HA   LEU  13           HA       LEU  13   3.932  -4.148  -2.840
   82   1HB   LEU  13          1HB       LEU  13   3.307  -6.215  -3.970
   83   2HB   LEU  13          2HB       LEU  13   2.023  -6.505  -2.807
   84    HG   LEU  13           HG       LEU  13   0.789  -4.551  -3.607
   85   1HD1  LEU  13          1HD1      LEU  13   1.721  -3.420  -5.755
   86   2HD1  LEU  13          2HD1      LEU  13   3.279  -4.091  -5.272
   87   3HD1  LEU  13          3HD1      LEU  13   2.439  -2.955  -4.215
   88   1HD2  LEU  13          1HD2      LEU  13   0.337  -5.329  -5.924
   89   2HD2  LEU  13          2HD2      LEU  13   0.444  -6.670  -4.784
   90   3HD2  LEU  13          3HD2      LEU  13   1.797  -6.316  -5.858
   91    H    GLY  14           H        GLY  14   2.477  -5.305   0.044
   92   1HA   GLY  14          1HA       GLY  14   0.136  -3.581   0.030
   93   2HA   GLY  14          2HA       GLY  14   0.783  -4.430   1.434
   94    H    ALA  15           H        ALA  15   3.394  -3.373   1.365
   95    HA   ALA  15           HA       ALA  15   3.209  -1.044   2.928
   96   1HB   ALA  15          1HB       ALA  15   5.180  -2.489   2.867
   97   2HB   ALA  15          2HB       ALA  15   5.658  -0.850   2.423
   98   3HB   ALA  15          3HB       ALA  15   5.461  -2.080   1.174
   99    H    ALA  16           H        ALA  16   3.457  -1.420  -0.560
  100    HA   ALA  16           HA       ALA  16   4.209   1.211  -1.273
  101   1HB   ALA  16          1HB       ALA  16   2.484  -0.754  -2.802
  102   2HB   ALA  16          2HB       ALA  16   4.248  -0.762  -2.769
  103   3HB   ALA  16          3HB       ALA  16   3.385   0.595  -3.494
  104    H    GLY  17           H        GLY  17   0.892  -0.168  -1.095
  105   1HA   GLY  17          1HA       GLY  17  -0.385   2.302  -1.794
  106   2HA   GLY  17          2HA       GLY  17  -1.168   0.936  -1.019
  107    H    SER  18           H        SER  18   0.399   0.816   1.295
  108    HA   SER  18           HA       SER  18  -0.939   2.666   2.995
  109   1HB   SER  18          1HB       SER  18  -0.279   0.459   3.738
  110   2HB   SER  18          2HB       SER  18   1.415   0.808   3.405
  111    HG   SER  18           HG       SER  18   0.085   2.586   5.067
  112    H    THR  19           H        THR  19   2.143   2.762   1.439
  113    HA   THR  19           HA       THR  19   3.250   4.903   3.159
  114    HB   THR  19           HB       THR  19   4.331   3.641   0.619
  115    HG1  THR  19           HG1      THR  19   4.650   2.005   1.871
  116   1HG2  THR  19          1HG2      THR  19   5.603   5.310   2.806
  117   2HG2  THR  19          2HG2      THR  19   5.383   5.775   1.119
  118   3HG2  THR  19          3HG2      THR  19   6.504   4.479   1.537
  119    H    MET  20           H        MET  20   1.997   4.443  -0.117
  120    HA   MET  20           HA       MET  20   2.477   7.196  -0.947
  121   1HB   MET  20          1HB       MET  20   0.825   4.945  -2.130
  122   2HB   MET  20          2HB       MET  20   1.125   6.487  -2.931
  123   1HG   MET  20          1HG       MET  20   3.521   6.076  -2.940
  124   2HG   MET  20          2HG       MET  20   3.310   4.608  -1.986
  125   1HE   MET  20          1HE       MET  20   1.853   6.354  -5.213
  126   2HE   MET  20          2HE       MET  20   2.553   5.292  -6.432
  127   3HE   MET  20          3HE       MET  20   3.609   6.178  -5.337
  128    H    GLY  21           H        GLY  21   0.221   5.800   1.095
  129   1HA   GLY  21          1HA       GLY  21  -2.154   7.268   0.321
  130   2HA   GLY  21          2HA       GLY  21  -1.894   6.478   1.877
  131    H    ALA  22           H        ALA  22   0.710   8.483   1.240
  132    HA   ALA  22           HA       ALA  22  -0.040  10.336   3.339
  133   1HB   ALA  22          1HB       ALA  22   2.094  11.420   2.858
  134   2HB   ALA  22          2HB       ALA  22   2.225  10.547   1.331
  135   3HB   ALA  22          3HB       ALA  22   2.318   9.670   2.858
  136    H    ALA  23           H        ALA  23  -0.044  10.441  -0.195
  137    HA   ALA  23           HA       ALA  23  -0.584  13.279  -0.387
  138   1HB   ALA  23          1HB       ALA  23  -1.148  12.784  -2.728
  139   2HB   ALA  23          2HB       ALA  23  -1.177  11.059  -2.365
  140   3HB   ALA  23          3HB       ALA  23   0.340  11.956  -2.271
  141    H    SER  24           H        SER  24  -2.373  11.090   1.115
  142    HA   SER  24           HA       SER  24  -5.012  11.579  -0.065
  143   1HB   SER  24          1HB       SER  24  -4.472   9.475   1.151
  144   2HB   SER  24          2HB       SER  24  -4.268  10.406   2.632
  145    HG   SER  24           HG       SER  24  -6.624  10.369   1.045
  146    H    MET  25           H        MET  25  -3.638  13.999   0.565
  147    HA   MET  25           HA       MET  25  -3.935  16.028   1.713
  148   1HB   MET  25          1HB       MET  25  -6.717  14.908   2.163
  149   2HB   MET  25          2HB       MET  25  -6.250  16.609   2.188
  150   1HG   MET  25          1HG       MET  25  -5.506  16.376  -0.200
  151   2HG   MET  25          2HG       MET  25  -6.169  14.742  -0.200
  152   1HE   MET  25          1HE       MET  25  -8.428  14.160  -0.782
  153   2HE   MET  25          2HE       MET  25  -9.864  15.031  -0.252
  154   3HE   MET  25          3HE       MET  25  -8.727  14.412   0.942
  155    H    THR  26           H        THR  26  -5.690  16.506   3.976
  156    HA   THR  26           HA       THR  26  -3.935  15.667   6.104
  157    HB   THR  26           HB       THR  26  -5.613  16.703   7.591
  158    HG1  THR  26           HG1      THR  26  -7.536  17.436   6.709
  159   1HG2  THR  26          1HG2      THR  26  -4.053  18.184   6.451
  160   2HG2  THR  26          2HG2      THR  26  -5.635  18.959   6.524
  161   3HG2  THR  26          3HG2      THR  26  -5.085  18.219   5.022
  162    H    LEU  27           H        LEU  27  -3.934  13.333   5.890
  163    HA   LEU  27           HA       LEU  27  -4.677  11.170   6.402
  164   1HB   LEU  27          1HB       LEU  27  -6.679  12.500   8.254
  165   2HB   LEU  27          2HB       LEU  27  -5.895  10.932   8.442
  166    HG   LEU  27           HG       LEU  27  -4.552  13.651   8.611
  167   1HD1  LEU  27          1HD1      LEU  27  -5.087  11.496  10.680
  168   2HD1  LEU  27          2HD1      LEU  27  -5.895  13.061  10.581
  169   3HD1  LEU  27          3HD1      LEU  27  -4.175  12.979  10.967
  170   1HD2  LEU  27          1HD2      LEU  27  -3.434  10.828   8.692
  171   2HD2  LEU  27          2HD2      LEU  27  -2.565  12.203   9.373
  172   3HD2  LEU  27          3HD2      LEU  27  -2.935  12.162   7.652
  173    H    THR  28           H        THR  28  -6.761   9.769   6.447
  174    HA   THR  28           HA       THR  28  -8.265  10.353   4.049
  175    HB   THR  28           HB       THR  28  -9.510   8.303   4.594
  176    HG1  THR  28           HG1      THR  28  -9.452   8.876   6.927
  177   1HG2  THR  28          1HG2      THR  28  -7.633   6.758   4.635
  178   2HG2  THR  28          2HG2      THR  28  -6.578   8.006   5.299
  179   3HG2  THR  28          3HG2      THR  28  -7.198   8.157   3.654
  180    H    VAL  29           H        VAL  29 -10.735  10.358   4.089
  181    HA   VAL  29           HA       VAL  29 -11.656  12.552   5.712
  182    HB   VAL  29           HB       VAL  29 -13.322  10.538   4.172
  183   1HG1  VAL  29          1HG1      VAL  29 -14.885  12.494   4.007
  184   2HG1  VAL  29          2HG1      VAL  29 -13.831  13.378   5.109
  185   3HG1  VAL  29          3HG1      VAL  29 -14.659  11.922   5.658
  186   1HG2  VAL  29          1HG2      VAL  29 -12.022  13.134   3.284
  187   2HG2  VAL  29          2HG2      VAL  29 -13.171  12.201   2.324
  188   3HG2  VAL  29          3HG2      VAL  29 -11.596  11.515   2.728
  189    H    GLN  30           H        GLN  30 -11.332  11.908   7.910
  190    HA   GLN  30           HA       GLN  30 -12.286   9.465   9.035
  191   1HB   GLN  30          1HB       GLN  30 -11.992  12.162  10.394
  192   2HB   GLN  30          2HB       GLN  30 -12.068  10.594  11.199
  193   1HG   GLN  30          1HG       GLN  30 -10.004   9.892  10.070
  194   2HG   GLN  30          2HG       GLN  30  -9.933  11.431   9.214
  195   1HE2  GLN  30          1HE2      GLN  30  -8.058  10.223  11.316
  196   2HE2  GLN  30          2HE2      GLN  30  -7.936  11.424  12.510
  197    H    ALA  31           H        ALA  31 -14.417   9.257   8.014
  198    HA   ALA  31           HA       ALA  31 -16.521  11.164   8.440
  199   1HB   ALA  31          1HB       ALA  31 -16.700   9.461   6.695
  200   2HB   ALA  31          2HB       ALA  31 -18.031   9.269   7.837
  201   3HB   ALA  31          3HB       ALA  31 -16.645   8.180   7.905
  Start of MODEL    7
    1    H    ALA   2           H        ALA   2   0.162 -18.683   3.485
    2    HA   ALA   2           HA       ALA   2   2.758 -19.798   2.718
    3   1HB   ALA   2          1HB       ALA   2   2.395 -20.377   5.145
    4   2HB   ALA   2          2HB       ALA   2   2.415 -21.777   4.074
    5   3HB   ALA   2          3HB       ALA   2   0.881 -21.152   4.680
    6    H    VAL   3           H        VAL   3   1.934 -22.264   2.053
    7    HA   VAL   3           HA       VAL   3   0.780 -23.418   0.387
    8    HB   VAL   3           HB       VAL   3  -1.639 -21.779   1.204
    9   1HG1  VAL   3          1HG1      VAL   3  -2.076 -23.333  -0.615
   10   2HG1  VAL   3          2HG1      VAL   3  -2.778 -24.010   0.848
   11   3HG1  VAL   3          3HG1      VAL   3  -1.250 -24.636   0.236
   12   1HG2  VAL   3          1HG2      VAL   3  -0.315 -24.085   2.670
   13   2HG2  VAL   3          2HG2      VAL   3  -1.955 -23.528   3.003
   14   3HG2  VAL   3          3HG2      VAL   3  -0.587 -22.454   3.282
   15    H    GLY   4           H        GLY   4   1.827 -20.553   0.005
   16   1HA   GLY   4          1HA       GLY   4   1.469 -20.379  -2.755
   17   2HA   GLY   4          2HA       GLY   4   0.251 -19.326  -2.061
   18    H    ILE   5           H        ILE   5   3.100 -19.143  -3.454
   19    HA   ILE   5           HA       ILE   5   4.710 -17.548  -1.673
   20    HB   ILE   5           HB       ILE   5   4.678 -17.762  -4.702
   21   1HG1  ILE   5          1HG1      ILE   5   6.528 -19.080  -2.682
   22   2HG1  ILE   5          2HG1      ILE   5   5.111 -19.880  -3.357
   23   1HG2  ILE   5          1HG2      ILE   5   7.042 -16.912  -4.483
   24   2HG2  ILE   5          2HG2      ILE   5   6.705 -16.576  -2.788
   25   3HG2  ILE   5          3HG2      ILE   5   5.818 -15.722  -4.047
   26   1HD1  ILE   5          1HD1      ILE   5   6.016 -19.588  -5.631
   27   2HD1  ILE   5          2HD1      ILE   5   7.146 -20.483  -4.615
   28   3HD1  ILE   5          3HD1      ILE   5   7.434 -18.779  -4.965
   29    H    GLY   6           H        GLY   6   1.889 -16.958  -3.531
   30   1HA   GLY   6          1HA       GLY   6   2.022 -14.253  -4.237
   31   2HA   GLY   6          2HA       GLY   6   0.536 -15.028  -3.665
   32    H    ALA   7           H        ALA   7   1.855 -15.718  -1.099
   33    HA   ALA   7           HA       ALA   7   0.992 -13.575   0.535
   34   1HB   ALA   7          1HB       ALA   7   1.264 -15.920   1.270
   35   2HB   ALA   7          2HB       ALA   7   2.172 -14.827   2.313
   36   3HB   ALA   7          3HB       ALA   7   3.011 -15.774   1.087
   37    H    LEU   8           H        LEU   8   4.162 -14.302  -0.818
   38    HA   LEU   8           HA       LEU   8   5.580 -12.356   0.849
   39   1HB   LEU   8          1HB       LEU   8   6.590 -13.518  -1.763
   40   2HB   LEU   8          2HB       LEU   8   7.535 -12.913  -0.404
   41    HG   LEU   8           HG       LEU   8   5.872 -15.451  -0.528
   42   1HD1  LEU   8          1HD1      LEU   8   8.786 -15.050   0.221
   43   2HD1  LEU   8          2HD1      LEU   8   8.258 -15.400  -1.423
   44   3HD1  LEU   8          3HD1      LEU   8   7.967 -16.569  -0.137
   45   1HD2  LEU   8          1HD2      LEU   8   7.067 -14.032   1.877
   46   2HD2  LEU   8          2HD2      LEU   8   6.701 -15.758   1.892
   47   3HD2  LEU   8          3HD2      LEU   8   5.407 -14.587   1.660
   48    H    PHE   9           H        PHE   9   4.462 -12.337  -2.595
   49    HA   PHE   9           HA       PHE   9   5.470  -9.655  -3.013
   50   1HB   PHE   9          1HB       PHE   9   4.588 -11.305  -4.842
   51   2HB   PHE   9          2HB       PHE   9   2.990 -10.686  -4.440
   52    HD1  PHE   9           HD1      PHE   9   6.459  -9.440  -5.181
   53    HD2  PHE   9           HD2      PHE   9   2.235  -8.781  -5.663
   54    HE1  PHE   9           HE1      PHE   9   6.925  -7.478  -6.619
   55    HE2  PHE   9           HE2      PHE   9   2.712  -6.821  -7.103
   56    HZ   PHE   9           HZ       PHE   9   5.053  -6.170  -7.580
   57    H    LEU  10           H        LEU  10   2.259 -10.909  -1.886
   58    HA   LEU  10           HA       LEU  10   0.993  -8.392  -1.724
   59   1HB   LEU  10          1HB       LEU  10  -0.267 -10.444  -1.458
   60   2HB   LEU  10          2HB       LEU  10   0.670 -10.894  -0.038
   61    HG   LEU  10           HG       LEU  10  -0.289  -9.061   1.250
   62   1HD1  LEU  10          1HD1      LEU  10  -2.175  -7.696   0.117
   63   2HD1  LEU  10          2HD1      LEU  10  -1.486  -8.241  -1.411
   64   3HD1  LEU  10          3HD1      LEU  10  -0.519  -7.271  -0.301
   65   1HD2  LEU  10          1HD2      LEU  10  -2.646  -9.765   1.260
   66   2HD2  LEU  10          2HD2      LEU  10  -1.586 -11.161   1.070
   67   3HD2  LEU  10          3HD2      LEU  10  -2.441 -10.507  -0.327
   68    H    GLY  11           H        GLY  11   3.006 -10.081   0.680
   69   1HA   GLY  11          1HA       GLY  11   2.720  -8.330   2.847
   70   2HA   GLY  11          2HA       GLY  11   4.197  -9.229   2.512
   71    H    PHE  12           H        PHE  12   5.045  -8.000   0.127
   72    HA   PHE  12           HA       PHE  12   5.950  -5.386   1.192
   73   1HB   PHE  12          1HB       PHE  12   7.560  -6.965   0.130
   74   2HB   PHE  12          2HB       PHE  12   6.705  -6.764  -1.400
   75    HD1  PHE  12           HD1      PHE  12   6.762  -4.620  -2.614
   76    HD2  PHE  12           HD2      PHE  12   8.917  -5.150   1.067
   77    HE1  PHE  12           HE1      PHE  12   8.049  -2.550  -3.068
   78    HE2  PHE  12           HE2      PHE  12  10.204  -3.081   0.609
   79    HZ   PHE  12           HZ       PHE  12   9.770  -1.780  -1.457
   80    H    LEU  13           H        LEU  13   3.951  -6.592  -1.482
   81    HA   LEU  13           HA       LEU  13   3.749  -4.111  -2.890
   82   1HB   LEU  13          1HB       LEU  13   3.017  -6.372  -3.753
   83   2HB   LEU  13          2HB       LEU  13   1.644  -6.285  -2.658
   84    HG   LEU  13           HG       LEU  13   0.988  -4.106  -3.812
   85   1HD1  LEU  13          1HD1      LEU  13   2.929  -3.359  -4.940
   86   2HD1  LEU  13          2HD1      LEU  13   1.926  -3.988  -6.238
   87   3HD1  LEU  13          3HD1      LEU  13   3.266  -4.950  -5.620
   88   1HD2  LEU  13          1HD2      LEU  13   0.085  -5.311  -5.842
   89   2HD2  LEU  13          2HD2      LEU  13  -0.222  -6.133  -4.314
   90   3HD2  LEU  13          3HD2      LEU  13   1.064  -6.701  -5.375
   91    H    GLY  14           H        GLY  14   2.363  -5.245   0.065
   92   1HA   GLY  14          1HA       GLY  14   0.082  -3.463   0.139
   93   2HA   GLY  14          2HA       GLY  14   0.759  -4.327   1.517
   94    H    ALA  15           H        ALA  15   3.376  -3.278   1.430
   95    HA   ALA  15           HA       ALA  15   3.196  -0.939   2.985
   96   1HB   ALA  15          1HB       ALA  15   5.645  -0.747   2.483
   97   2HB   ALA  15          2HB       ALA  15   5.452  -1.988   1.245
   98   3HB   ALA  15          3HB       ALA  15   5.167  -2.382   2.942
   99    H    ALA  16           H        ALA  16   3.489  -1.326  -0.500
  100    HA   ALA  16           HA       ALA  16   4.232   1.308  -1.208
  101   1HB   ALA  16          1HB       ALA  16   4.340  -0.605  -2.730
  102   2HB   ALA  16          2HB       ALA  16   3.360   0.678  -3.440
  103   3HB   ALA  16          3HB       ALA  16   2.581  -0.731  -2.721
  104    H    GLY  17           H        GLY  17   0.932  -0.098  -1.038
  105   1HA   GLY  17          1HA       GLY  17  -0.370   2.353  -1.767
  106   2HA   GLY  17          2HA       GLY  17  -1.141   0.989  -0.970
  107    H    SER  18           H        SER  18   0.446   0.918   1.336
  108    HA   SER  18           HA       SER  18  -0.904   2.772   3.022
  109   1HB   SER  18          1HB       SER  18   0.390   1.707   4.773
  110   2HB   SER  18          2HB       SER  18  -0.083   0.475   3.604
  111    HG   SER  18           HG       SER  18   2.148   1.401   2.692
  112    H    THR  19           H        THR  19   2.176   2.889   1.454
  113    HA   THR  19           HA       THR  19   3.260   5.058   3.157
  114    HB   THR  19           HB       THR  19   4.363   3.806   0.621
  115    HG1  THR  19           HG1      THR  19   4.178   2.225   2.154
  116   1HG2  THR  19          1HG2      THR  19   6.523   4.655   1.559
  117   2HG2  THR  19          2HG2      THR  19   5.608   5.470   2.828
  118   3HG2  THR  19          3HG2      THR  19   5.394   5.946   1.143
  119    H    MET  20           H        MET  20   2.018   4.559  -0.116
  120    HA   MET  20           HA       MET  20   2.473   7.303  -0.977
  121   1HB   MET  20          1HB       MET  20   0.824   5.032  -2.126
  122   2HB   MET  20          2HB       MET  20   1.123   6.562  -2.950
  123   1HG   MET  20          1HG       MET  20   3.524   6.155  -2.937
  124   2HG   MET  20          2HG       MET  20   3.301   4.686  -1.987
  125   1HE   MET  20          1HE       MET  20   4.816   3.489  -3.976
  126   2HE   MET  20          2HE       MET  20   4.856   5.115  -4.652
  127   3HE   MET  20          3HE       MET  20   4.433   3.750  -5.683
  128    H    GLY  21           H        GLY  21   0.752   6.695   1.468
  129   1HA   GLY  21          1HA       GLY  21  -1.974   7.356   0.799
  130   2HA   GLY  21          2HA       GLY  21  -1.262   7.466   2.408
  131    H    ALA  22           H        ALA  22   0.701   9.337   2.129
  132    HA   ALA  22           HA       ALA  22  -0.810  11.803   1.979
  133   1HB   ALA  22          1HB       ALA  22   1.373  12.889   2.404
  134   2HB   ALA  22          2HB       ALA  22   2.185  11.346   2.139
  135   3HB   ALA  22          3HB       ALA  22   1.097  11.547   3.514
  136    H    ALA  23           H        ALA  23   1.512  10.183  -0.154
  137    HA   ALA  23           HA       ALA  23   1.663  12.364  -2.059
  138   1HB   ALA  23          1HB       ALA  23   2.801  10.753  -3.494
  139   2HB   ALA  23          2HB       ALA  23   2.246   9.421  -2.479
  140   3HB   ALA  23          3HB       ALA  23   3.404  10.590  -1.844
  141    H    SER  24           H        SER  24  -1.035  11.041  -1.242
  142    HA   SER  24           HA       SER  24  -2.059   9.948  -3.755
  143   1HB   SER  24          1HB       SER  24  -3.552  10.905  -1.294
  144   2HB   SER  24          2HB       SER  24  -4.222   9.930  -2.600
  145    HG   SER  24           HG       SER  24  -3.575   8.359  -1.335
  146    H    MET  25           H        MET  25  -0.878  12.595  -3.960
  147    HA   MET  25           HA       MET  25  -1.349  14.716  -4.855
  148   1HB   MET  25          1HB       MET  25  -2.214  13.193  -6.651
  149   2HB   MET  25          2HB       MET  25  -3.810  13.294  -5.909
  150   1HG   MET  25          1HG       MET  25  -3.886  15.697  -6.266
  151   2HG   MET  25          2HG       MET  25  -2.226  15.695  -6.864
  152   1HE   MET  25          1HE       MET  25  -2.503  16.617  -9.355
  153   2HE   MET  25          2HE       MET  25  -3.901  17.157  -8.429
  154   3HE   MET  25          3HE       MET  25  -4.125  16.521 -10.056
  155    H    THR  26           H        THR  26  -1.764  15.770  -2.822
  156    HA   THR  26           HA       THR  26  -4.364  15.741  -1.567
  157    HB   THR  26           HB       THR  26  -2.200  17.857  -1.351
  158    HG1  THR  26           HG1      THR  26  -1.560  15.641  -0.906
  159   1HG2  THR  26          1HG2      THR  26  -4.308  18.584  -0.395
  160   2HG2  THR  26          2HG2      THR  26  -3.215  18.159   0.920
  161   3HG2  THR  26          3HG2      THR  26  -4.499  17.047   0.448
  162    H    LEU  27           H        LEU  27  -6.130  16.522  -2.628
  163    HA   LEU  27           HA       LEU  27  -6.262  19.293  -3.423
  164   1HB   LEU  27          1HB       LEU  27  -5.034  18.560  -5.379
  165   2HB   LEU  27          2HB       LEU  27  -6.101  17.178  -5.595
  166    HG   LEU  27           HG       LEU  27  -7.958  18.622  -6.206
  167   1HD1  LEU  27          1HD1      LEU  27  -6.090  20.857  -5.366
  168   2HD1  LEU  27          2HD1      LEU  27  -7.730  20.530  -4.799
  169   3HD1  LEU  27          3HD1      LEU  27  -7.470  21.151  -6.425
  170   1HD2  LEU  27          1HD2      LEU  27  -6.330  18.060  -7.977
  171   2HD2  LEU  27          2HD2      LEU  27  -5.408  19.513  -7.591
  172   3HD2  LEU  27          3HD2      LEU  27  -7.038  19.652  -8.251
  173    H    THR  28           H        THR  28  -7.680  16.062  -4.012
  174    HA   THR  28           HA       THR  28 -10.354  16.906  -4.420
  175    HB   THR  28           HB       THR  28  -9.632  14.596  -4.834
  176    HG1  THR  28           HG1      THR  28 -11.674  15.087  -2.968
  177   1HG2  THR  28          1HG2      THR  28  -8.078  14.497  -2.850
  178   2HG2  THR  28          2HG2      THR  28  -9.105  13.075  -3.036
  179   3HG2  THR  28          3HG2      THR  28  -9.498  14.293  -1.823
  180    H    VAL  29           H        VAL  29 -12.013  17.445  -3.014
  181    HA   VAL  29           HA       VAL  29 -11.319  18.410  -0.395
  182    HB   VAL  29           HB       VAL  29 -14.085  17.792  -1.479
  183   1HG1  VAL  29          1HG1      VAL  29 -13.065  19.660   0.683
  184   2HG1  VAL  29          2HG1      VAL  29 -14.081  18.237   0.914
  185   3HG1  VAL  29          3HG1      VAL  29 -14.722  19.651   0.078
  186   1HG2  VAL  29          1HG2      VAL  29 -12.853  19.223  -3.043
  187   2HG2  VAL  29          2HG2      VAL  29 -12.373  20.288  -1.721
  188   3HG2  VAL  29          3HG2      VAL  29 -14.067  20.178  -2.195
  189    H    GLN  30           H        GLN  30 -10.369  16.525   0.625
  190    HA   GLN  30           HA       GLN  30 -10.410  14.577   1.933
  191   1HB   GLN  30          1HB       GLN  30 -13.292  15.414   2.381
  192   2HB   GLN  30          2HB       GLN  30 -12.337  14.355   3.416
  193   1HG   GLN  30          1HG       GLN  30 -11.623  17.240   2.810
  194   2HG   GLN  30          2HG       GLN  30 -12.459  16.707   4.267
  195   1HE2  GLN  30          1HE2      GLN  30  -9.699  17.916   3.991
  196   2HE2  GLN  30          2HE2      GLN  30  -8.652  16.789   4.707
  197    H    ALA  31           H        ALA  31 -12.619  12.801   2.407
  198    HA   ALA  31           HA       ALA  31 -12.443  11.168   0.044
  199   1HB   ALA  31          1HB       ALA  31 -14.084   9.718   1.196
  200   2HB   ALA  31          2HB       ALA  31 -14.360  10.986   2.390
  201   3HB   ALA  31          3HB       ALA  31 -12.784  10.201   2.287
  Start of MODEL    8
    1    H    ALA   2           H        ALA   2  -4.350 -20.099  -7.061
    2    HA   ALA   2           HA       ALA   2  -4.537 -22.099  -5.480
    3   1HB   ALA   2          1HB       ALA   2  -1.946 -21.223  -6.782
    4   2HB   ALA   2          2HB       ALA   2  -3.235 -22.162  -7.534
    5   3HB   ALA   2          3HB       ALA   2  -2.274 -22.867  -6.235
    6    H    VAL   3           H        VAL   3  -3.212 -19.294  -4.305
    7    HA   VAL   3           HA       VAL   3  -2.205 -18.705  -2.296
    8    HB   VAL   3           HB       VAL   3  -2.883 -21.500  -1.351
    9   1HG1  VAL   3          1HG1      VAL   3  -1.501 -20.053   0.132
   10   2HG1  VAL   3          2HG1      VAL   3  -3.080 -20.421   0.824
   11   3HG1  VAL   3          3HG1      VAL   3  -2.782 -18.842   0.096
   12   1HG2  VAL   3          1HG2      VAL   3  -5.075 -20.516  -0.666
   13   2HG2  VAL   3          2HG2      VAL   3  -4.877 -20.578  -2.418
   14   3HG2  VAL   3          3HG2      VAL   3  -4.662 -19.052  -1.561
   15    H    GLY   4           H        GLY   4  -0.102 -18.532  -1.937
   16   1HA   GLY   4          1HA       GLY   4   1.652 -20.577  -1.229
   17   2HA   GLY   4          2HA       GLY   4   1.834 -20.395  -2.962
   18    H    ILE   5           H        ILE   5   3.443 -19.066  -3.524
   19    HA   ILE   5           HA       ILE   5   4.817 -17.380  -1.624
   20    HB   ILE   5           HB       ILE   5   5.027 -17.550  -4.647
   21   1HG1  ILE   5          1HG1      ILE   5   6.805 -18.741  -2.486
   22   2HG1  ILE   5          2HG1      ILE   5   5.524 -19.644  -3.295
   23   1HG2  ILE   5          1HG2      ILE   5   6.783 -16.213  -2.561
   24   2HG2  ILE   5          2HG2      ILE   5   5.945 -15.435  -3.903
   25   3HG2  ILE   5          3HG2      ILE   5   7.297 -16.515  -4.220
   26   1HD1  ILE   5          1HD1      ILE   5   7.929 -18.363  -4.627
   27   2HD1  ILE   5          2HD1      ILE   5   6.613 -19.165  -5.486
   28   3HD1  ILE   5          3HD1      ILE   5   7.653 -20.092  -4.403
   29    H    GLY   6           H        GLY   6   2.021 -16.981  -3.513
   30   1HA   GLY   6          1HA       GLY   6   1.964 -14.284  -4.255
   31   2HA   GLY   6          2HA       GLY   6   0.540 -15.139  -3.641
   32    H    ALA   7           H        ALA   7   1.922 -15.727  -1.111
   33    HA   ALA   7           HA       ALA   7   1.014 -13.590   0.528
   34   1HB   ALA   7          1HB       ALA   7   3.076 -15.758   1.056
   35   2HB   ALA   7          2HB       ALA   7   1.336 -15.927   1.280
   36   3HB   ALA   7          3HB       ALA   7   2.251 -14.813   2.296
   37    H    LEU   8           H        LEU   8   4.149 -14.252  -0.936
   38    HA   LEU   8           HA       LEU   8   5.626 -12.359   0.705
   39   1HB   LEU   8          1HB       LEU   8   6.794 -14.241  -0.261
   40   2HB   LEU   8          2HB       LEU   8   6.278 -13.796  -1.883
   41    HG   LEU   8           HG       LEU   8   7.672 -11.805  -1.854
   42   1HD1  LEU   8          1HD1      LEU   8   7.523 -10.989   0.376
   43   2HD1  LEU   8          2HD1      LEU   8   9.208 -11.463   0.197
   44   3HD1  LEU   8          3HD1      LEU   8   8.084 -12.513   1.064
   45   1HD2  LEU   8          1HD2      LEU   8   9.181 -14.189  -0.737
   46   2HD2  LEU   8          2HD2      LEU   8   9.897 -12.850  -1.633
   47   3HD2  LEU   8          3HD2      LEU   8   8.765 -13.941  -2.432
   48    H    PHE   9           H        PHE   9   4.420 -12.261  -2.714
   49    HA   PHE   9           HA       PHE   9   5.345  -9.546  -3.084
   50   1HB   PHE   9          1HB       PHE   9   4.474 -11.174  -4.932
   51   2HB   PHE   9          2HB       PHE   9   2.865 -10.623  -4.478
   52    HD1  PHE   9           HD1      PHE   9   6.269  -9.241  -5.274
   53    HD2  PHE   9           HD2      PHE   9   2.014  -8.711  -5.624
   54    HE1  PHE   9           HE1      PHE   9   6.631  -7.227  -6.670
   55    HE2  PHE   9           HE2      PHE   9   2.385  -6.697  -7.022
   56    HZ   PHE   9           HZ       PHE   9   4.691  -5.955  -7.543
   57    H    LEU  10           H        LEU  10   2.198 -10.910  -1.931
   58    HA   LEU  10           HA       LEU  10   0.870  -8.435  -1.673
   59   1HB   LEU  10          1HB       LEU  10  -0.335 -10.525  -1.472
   60   2HB   LEU  10          2HB       LEU  10   0.627 -11.003  -0.077
   61    HG   LEU  10           HG       LEU  10  -0.367  -9.246   1.287
   62   1HD1  LEU  10          1HD1      LEU  10  -0.656  -7.405  -0.193
   63   2HD1  LEU  10          2HD1      LEU  10  -2.296  -7.886   0.222
   64   3HD1  LEU  10          3HD1      LEU  10  -1.607  -8.358  -1.333
   65   1HD2  LEU  10          1HD2      LEU  10  -2.726  -9.994   1.254
   66   2HD2  LEU  10          2HD2      LEU  10  -1.618 -11.353   1.075
   67   3HD2  LEU  10          3HD2      LEU  10  -2.469 -10.719  -0.332
   68    H    GLY  11           H        GLY  11   2.930 -10.157   0.671
   69   1HA   GLY  11          1HA       GLY  11   2.617  -8.484   2.893
   70   2HA   GLY  11          2HA       GLY  11   4.110  -9.343   2.525
   71    H    PHE  12           H        PHE  12   4.968  -8.024   0.204
   72    HA   PHE  12           HA       PHE  12   5.794  -5.427   1.359
   73   1HB   PHE  12          1HB       PHE  12   7.448  -6.932   0.252
   74   2HB   PHE  12          2HB       PHE  12   6.605  -6.685  -1.275
   75    HD1  PHE  12           HD1      PHE  12   6.656  -4.505  -2.417
   76    HD2  PHE  12           HD2      PHE  12   8.729  -5.115   1.298
   77    HE1  PHE  12           HE1      PHE  12   7.906  -2.394  -2.765
   78    HE2  PHE  12           HE2      PHE  12   9.979  -3.003   0.945
   79    HZ   PHE  12           HZ       PHE  12   9.568  -1.643  -1.085
   80    H    LEU  13           H        LEU  13   3.839  -6.582  -1.369
   81    HA   LEU  13           HA       LEU  13   3.598  -4.085  -2.725
   82   1HB   LEU  13          1HB       LEU  13   2.835  -6.327  -3.602
   83   2HB   LEU  13          2HB       LEU  13   1.495  -6.260  -2.467
   84    HG   LEU  13           HG       LEU  13   0.796  -4.070  -3.565
   85   1HD1  LEU  13          1HD1      LEU  13   3.034  -4.864  -5.446
   86   2HD1  LEU  13          2HD1      LEU  13   2.704  -3.289  -4.728
   87   3HD1  LEU  13          3HD1      LEU  13   1.672  -3.897  -6.012
   88   1HD2  LEU  13          1HD2      LEU  13  -0.408  -6.100  -4.074
   89   2HD2  LEU  13          2HD2      LEU  13   0.855  -6.632  -5.185
   90   3HD2  LEU  13          3HD2      LEU  13  -0.151  -5.242  -5.593
   91    H    GLY  14           H        GLY  14   2.293  -5.251   0.248
   92   1HA   GLY  14          1HA       GLY  14   0.090  -3.315   0.407
   93   2HA   GLY  14          2HA       GLY  14   0.617  -4.402   1.689
   94    H    ALA  15           H        ALA  15   3.361  -2.991   0.611
   95    HA   ALA  15           HA       ALA  15   3.422  -1.033   2.854
   96   1HB   ALA  15          1HB       ALA  15   5.595  -1.940   0.933
   97   2HB   ALA  15          2HB       ALA  15   5.345  -2.561   2.564
   98   3HB   ALA  15          3HB       ALA  15   5.832  -0.884   2.324
   99    H    ALA  16           H        ALA  16   3.715  -1.245  -0.630
  100    HA   ALA  16           HA       ALA  16   4.377   1.444  -1.221
  101   1HB   ALA  16          1HB       ALA  16   4.599  -0.432  -2.789
  102   2HB   ALA  16          2HB       ALA  16   3.620   0.851  -3.497
  103   3HB   ALA  16          3HB       ALA  16   2.845  -0.596  -2.854
  104    H    GLY  17           H        GLY  17   1.144  -0.103  -1.126
  105   1HA   GLY  17          1HA       GLY  17  -0.265   2.289  -1.849
  106   2HA   GLY  17          2HA       GLY  17  -0.979   0.887  -1.067
  107    H    SER  18           H        SER  18   0.597   0.869   1.248
  108    HA   SER  18           HA       SER  18  -0.845   2.646   2.942
  109   1HB   SER  18          1HB       SER  18  -0.026   0.447   3.635
  110   2HB   SER  18          2HB       SER  18   1.638   0.972   3.401
  111    HG   SER  18           HG       SER  18   0.057   1.280   5.533
  112    H    THR  19           H        THR  19   2.238   2.917   1.393
  113    HA   THR  19           HA       THR  19   3.216   5.110   3.127
  114    HB   THR  19           HB       THR  19   4.387   3.938   0.585
  115    HG1  THR  19           HG1      THR  19   5.120   2.382   1.783
  116   1HG2  THR  19          1HG2      THR  19   6.502   4.867   1.543
  117   2HG2  THR  19          2HG2      THR  19   5.548   5.620   2.823
  118   3HG2  THR  19          3HG2      THR  19   5.319   6.114   1.144
  119    H    MET  20           H        MET  20   2.019   4.599  -0.162
  120    HA   MET  20           HA       MET  20   2.363   7.373  -0.981
  121   1HB   MET  20          1HB       MET  20   0.837   5.041  -2.176
  122   2HB   MET  20          2HB       MET  20   1.057   6.598  -2.976
  123   1HG   MET  20          1HG       MET  20   3.496   6.313  -2.897
  124   2HG   MET  20          2HG       MET  20   3.300   4.776  -2.056
  125   1HE   MET  20          1HE       MET  20   4.995   4.151  -3.978
  126   2HE   MET  20          2HE       MET  20   4.773   5.563  -5.008
  127   3HE   MET  20          3HE       MET  20   4.564   3.949  -5.682
  128    H    GLY  21           H        GLY  21   0.366   6.150   1.258
  129   1HA   GLY  21          1HA       GLY  21  -2.177   7.364   0.429
  130   2HA   GLY  21          2HA       GLY  21  -1.831   6.638   1.999
  131    H    ALA  22           H        ALA  22   0.730   8.472   1.842
  132    HA   ALA  22           HA       ALA  22  -0.365  10.564   3.519
  133   1HB   ALA  22          1HB       ALA  22   1.938  11.465   3.490
  134   2HB   ALA  22          2HB       ALA  22   2.362  10.328   2.209
  135   3HB   ALA  22          3HB       ALA  22   1.936   9.731   3.813
  136    H    ALA  23           H        ALA  23   0.487  10.314   0.110
  137    HA   ALA  23           HA       ALA  23   0.388  13.153  -0.432
  138   1HB   ALA  23          1HB       ALA  23   1.509  11.522  -1.936
  139   2HB   ALA  23          2HB       ALA  23   0.300  12.481  -2.790
  140   3HB   ALA  23          3HB       ALA  23  -0.065  10.822  -2.317
  141    H    SER  24           H        SER  24  -1.966  11.277   0.734
  142    HA   SER  24           HA       SER  24  -4.190  12.008  -1.033
  143   1HB   SER  24          1HB       SER  24  -4.246  10.917   1.796
  144   2HB   SER  24          2HB       SER  24  -5.594  10.953   0.663
  145    HG   SER  24           HG       SER  24  -4.198   8.954   0.883
  146    H    MET  25           H        MET  25  -3.619  14.383  -0.926
  147    HA   MET  25           HA       MET  25  -3.997  16.550  -0.114
  148   1HB   MET  25          1HB       MET  25  -6.344  15.669  -0.296
  149   2HB   MET  25          2HB       MET  25  -6.255  15.206   1.402
  150   1HG   MET  25          1HG       MET  25  -5.884  17.524   2.059
  151   2HG   MET  25          2HG       MET  25  -5.832  18.025   0.369
  152   1HE   MET  25          1HE       MET  25  -7.352  19.660   1.827
  153   2HE   MET  25          2HE       MET  25  -9.082  19.629   1.494
  154   3HE   MET  25          3HE       MET  25  -7.938  19.717   0.158
  155    H    THR  26           H        THR  26  -2.235  17.016   1.194
  156    HA   THR  26           HA       THR  26  -2.687  17.083   4.072
  157    HB   THR  26           HB       THR  26  -0.436  15.328   3.039
  158    HG1  THR  26           HG1      THR  26  -1.707  13.672   3.383
  159   1HG2  THR  26          1HG2      THR  26  -0.290  14.715   5.473
  160   2HG2  THR  26          2HG2      THR  26  -1.446  16.000   5.817
  161   3HG2  THR  26          3HG2      THR  26   0.134  16.391   5.136
  162    H    LEU  27           H        LEU  27  -0.911  17.836   1.222
  163    HA   LEU  27           HA       LEU  27   0.134  20.259   2.393
  164   1HB   LEU  27          1HB       LEU  27   1.787  18.811   3.398
  165   2HB   LEU  27          2HB       LEU  27   2.044  17.956   1.882
  166    HG   LEU  27           HG       LEU  27   3.100  19.893   0.880
  167   1HD1  LEU  27          1HD1      LEU  27   3.453  21.972   2.366
  168   2HD1  LEU  27          2HD1      LEU  27   2.162  21.327   3.381
  169   3HD1  LEU  27          3HD1      LEU  27   1.840  21.744   1.697
  170   1HD2  LEU  27          1HD2      LEU  27   4.092  19.480   3.719
  171   2HD2  LEU  27          2HD2      LEU  27   5.032  20.179   2.401
  172   3HD2  LEU  27          3HD2      LEU  27   4.520  18.494   2.321
  173    H    THR  28           H        THR  28   0.870  17.884  -0.194
  174    HA   THR  28           HA       THR  28   1.603  19.824  -2.153
  175    HB   THR  28           HB       THR  28   1.228  18.031  -3.792
  176    HG1  THR  28           HG1      THR  28   0.064  16.286  -3.298
  177   1HG2  THR  28          1HG2      THR  28   2.350  16.966  -1.185
  178   2HG2  THR  28          2HG2      THR  28   3.242  17.940  -2.354
  179   3HG2  THR  28          3HG2      THR  28   2.685  16.326  -2.794
  180    H    VAL  29           H        VAL  29   0.351  21.252  -3.261
  181    HA   VAL  29           HA       VAL  29  -2.418  21.602  -2.739
  182    HB   VAL  29           HB       VAL  29  -0.934  22.479  -5.237
  183   1HG1  VAL  29          1HG1      VAL  29  -3.348  23.580  -3.764
  184   2HG1  VAL  29          2HG1      VAL  29  -3.360  22.802  -5.346
  185   3HG1  VAL  29          3HG1      VAL  29  -2.564  24.362  -5.137
  186   1HG2  VAL  29          1HG2      VAL  29  -1.131  23.778  -2.502
  187   2HG2  VAL  29          2HG2      VAL  29  -0.455  24.549  -3.936
  188   3HG2  VAL  29          3HG2      VAL  29   0.332  23.130  -3.244
  189    H    GLN  30           H        GLN  30  -4.272  20.957  -3.888
  190    HA   GLN  30           HA       GLN  30  -4.095  18.443  -5.302
  191   1HB   GLN  30          1HB       GLN  30  -6.538  18.765  -5.675
  192   2HB   GLN  30          2HB       GLN  30  -6.080  18.993  -3.988
  193   1HG   GLN  30          1HG       GLN  30  -5.979  21.466  -4.405
  194   2HG   GLN  30          2HG       GLN  30  -6.594  21.176  -6.033
  195   1HE2  GLN  30          1HE2      GLN  30  -7.944  22.641  -3.788
  196   2HE2  GLN  30          2HE2      GLN  30  -9.412  21.827  -3.534
  197    H    ALA  31           H        ALA  31  -3.054  21.289  -6.370
  198    HA   ALA  31           HA       ALA  31  -4.381  21.590  -8.917
  199   1HB   ALA  31          1HB       ALA  31  -1.625  22.475  -8.009
  200   2HB   ALA  31          2HB       ALA  31  -3.104  23.432  -7.925
  201   3HB   ALA  31          3HB       ALA  31  -2.417  23.005  -9.493
  Start of MODEL    9
    1    H    ALA   2           H        ALA   2  -4.566 -20.706  -4.036
    2    HA   ALA   2           HA       ALA   2  -5.281 -22.996  -3.124
    3   1HB   ALA   2          1HB       ALA   2  -3.715 -23.688  -5.624
    4   2HB   ALA   2          2HB       ALA   2  -5.388 -24.124  -5.282
    5   3HB   ALA   2          3HB       ALA   2  -4.081 -24.825  -4.328
    6    H    VAL   3           H        VAL   3  -3.839 -21.005  -2.182
    7    HA   VAL   3           HA       VAL   3  -1.943 -20.452  -0.963
    8    HB   VAL   3           HB       VAL   3  -1.100 -23.349  -1.296
    9   1HG1  VAL   3          1HG1      VAL   3  -0.704 -21.357   0.954
   10   2HG1  VAL   3          2HG1      VAL   3   0.514 -21.769  -0.253
   11   3HG1  VAL   3          3HG1      VAL   3  -0.055 -22.995   0.880
   12   1HG2  VAL   3          1HG2      VAL   3  -3.077 -22.124   0.652
   13   2HG2  VAL   3          2HG2      VAL   3  -2.422 -23.756   0.781
   14   3HG2  VAL   3          3HG2      VAL   3  -3.442 -23.322  -0.590
   15    H    GLY   4           H        GLY   4   0.183 -19.816  -1.295
   16   1HA   GLY   4          1HA       GLY   4   1.998 -20.823  -3.152
   17   2HA   GLY   4          2HA       GLY   4   1.075 -19.605  -4.012
   18    H    ILE   5           H        ILE   5   3.559 -18.951  -3.916
   19    HA   ILE   5           HA       ILE   5   4.510 -17.631  -1.529
   20    HB   ILE   5           HB       ILE   5   6.196 -16.649  -3.124
   21   1HG1  ILE   5          1HG1      ILE   5   4.755 -18.366  -5.172
   22   2HG1  ILE   5          2HG1      ILE   5   4.620 -16.609  -5.090
   23   1HG2  ILE   5          1HG2      ILE   5   6.518 -18.854  -2.002
   24   2HG2  ILE   5          2HG2      ILE   5   7.292 -18.789  -3.583
   25   3HG2  ILE   5          3HG2      ILE   5   5.761 -19.640  -3.386
   26   1HD1  ILE   5          1HD1      ILE   5   7.095 -16.443  -5.348
   27   2HD1  ILE   5          2HD1      ILE   5   6.317 -17.204  -6.735
   28   3HD1  ILE   5          3HD1      ILE   5   7.162 -18.194  -5.546
   29    H    GLY   6           H        GLY   6   2.006 -16.932  -3.535
   30   1HA   GLY   6          1HA       GLY   6   2.059 -14.226  -4.194
   31   2HA   GLY   6          2HA       GLY   6   0.592 -15.041  -3.632
   32    H    ALA   7           H        ALA   7   1.948 -15.725  -1.087
   33    HA   ALA   7           HA       ALA   7   1.047 -13.610   0.583
   34   1HB   ALA   7          1HB       ALA   7   1.356 -15.957   1.305
   35   2HB   ALA   7          2HB       ALA   7   2.276 -14.865   2.338
   36   3HB   ALA   7          3HB       ALA   7   3.098 -15.795   1.086
   37    H    LEU   8           H        LEU   8   4.176 -14.274  -0.882
   38    HA   LEU   8           HA       LEU   8   5.664 -12.400   0.772
   39   1HB   LEU   8          1HB       LEU   8   6.824 -14.280  -0.209
   40   2HB   LEU   8          2HB       LEU   8   6.303 -13.826  -1.827
   41    HG   LEU   8           HG       LEU   8   7.703 -11.839  -1.796
   42   1HD1  LEU   8          1HD1      LEU   8   9.247 -11.510   0.254
   43   2HD1  LEU   8          2HD1      LEU   8   8.122 -12.560   1.119
   44   3HD1  LEU   8          3HD1      LEU   8   7.562 -11.032   0.438
   45   1HD2  LEU   8          1HD2      LEU   8   9.219 -14.223  -0.685
   46   2HD2  LEU   8          2HD2      LEU   8   9.922 -12.890  -1.600
   47   3HD2  LEU   8          3HD2      LEU   8   8.781 -13.987  -2.377
   48    H    PHE   9           H        PHE   9   4.452 -12.281  -2.645
   49    HA   PHE   9           HA       PHE   9   5.364  -9.558  -3.007
   50   1HB   PHE   9          1HB       PHE   9   3.023 -10.939  -4.365
   51   2HB   PHE   9          2HB       PHE   9   3.717  -9.394  -4.853
   52    HD1  PHE   9           HD1      PHE   9   4.230 -13.040  -4.742
   53    HD2  PHE   9           HD2      PHE   9   5.961  -9.269  -5.861
   54    HE1  PHE   9           HE1      PHE   9   5.956 -14.224  -6.072
   55    HE2  PHE   9           HE2      PHE   9   7.685 -10.456  -7.191
   56    HZ   PHE   9           HZ       PHE   9   7.682 -12.933  -7.296
   57    H    LEU  10           H        LEU  10   2.189 -10.933  -1.909
   58    HA   LEU  10           HA       LEU  10   0.865  -8.470  -1.643
   59   1HB   LEU  10          1HB       LEU  10  -0.323 -10.568  -1.408
   60   2HB   LEU  10          2HB       LEU  10   0.644 -11.017  -0.008
   61    HG   LEU  10           HG       LEU  10  -0.359  -9.246   1.330
   62   1HD1  LEU  10          1HD1      LEU  10  -1.612  -8.409  -1.301
   63   2HD1  LEU  10          2HD1      LEU  10  -0.667  -7.431  -0.178
   64   3HD1  LEU  10          3HD1      LEU  10  -2.302  -7.920   0.248
   65   1HD2  LEU  10          1HD2      LEU  10  -1.590 -11.383   1.122
   66   2HD2  LEU  10          2HD2      LEU  10  -2.475 -10.735  -0.259
   67   3HD2  LEU  10          3HD2      LEU  10  -2.697 -10.026   1.342
   68    H    GLY  11           H        GLY  11   2.956 -10.135   0.709
   69   1HA   GLY  11          1HA       GLY  11   2.634  -8.427   2.903
   70   2HA   GLY  11          2HA       GLY  11   4.132  -9.277   2.544
   71    H    PHE  12           H        PHE  12   4.932  -7.985   0.168
   72    HA   PHE  12           HA       PHE  12   5.772  -5.373   1.277
   73   1HB   PHE  12          1HB       PHE  12   7.411  -6.895   0.175
   74   2HB   PHE  12          2HB       PHE  12   6.558  -6.659  -1.351
   75    HD1  PHE  12           HD1      PHE  12   8.713  -5.077   1.190
   76    HD2  PHE  12           HD2      PHE  12   6.600  -4.486  -2.506
   77    HE1  PHE  12           HE1      PHE  12   9.966  -2.973   0.808
   78    HE2  PHE  12           HE2      PHE  12   7.855  -2.382  -2.886
   79    HZ   PHE  12           HZ       PHE  12   9.538  -1.625  -1.230
   80    H    LEU  13           H        LEU  13   3.812  -6.528  -1.478
   81    HA   LEU  13           HA       LEU  13   3.611  -3.989  -2.771
   82   1HB   LEU  13          1HB       LEU  13   2.766  -6.475  -3.425
   83   2HB   LEU  13          2HB       LEU  13   1.244  -5.858  -2.819
   84    HG   LEU  13           HG       LEU  13   1.296  -5.495  -5.196
   85   1HD1  LEU  13          1HD1      LEU  13   1.958  -2.794  -4.018
   86   2HD1  LEU  13          2HD1      LEU  13   0.439  -3.634  -3.686
   87   3HD1  LEU  13          3HD1      LEU  13   0.852  -3.171  -5.335
   88   1HD2  LEU  13          1HD2      LEU  13   3.053  -4.608  -6.442
   89   2HD2  LEU  13          2HD2      LEU  13   3.945  -5.492  -5.213
   90   3HD2  LEU  13          3HD2      LEU  13   3.756  -3.744  -5.080
   91    H    GLY  14           H        GLY  14   2.254  -5.219   0.141
   92   1HA   GLY  14          1HA       GLY  14   0.046  -3.287   0.301
   93   2HA   GLY  14          2HA       GLY  14   0.556  -4.398   1.572
   94    H    ALA  15           H        ALA  15   3.313  -2.985   0.541
   95    HA   ALA  15           HA       ALA  15   3.368  -1.059   2.811
   96   1HB   ALA  15          1HB       ALA  15   5.773  -0.945   2.364
   97   2HB   ALA  15          2HB       ALA  15   5.568  -1.891   0.889
   98   3HB   ALA  15          3HB       ALA  15   5.275  -2.634   2.461
   99    H    ALA  16           H        ALA  16   3.679  -1.231  -0.670
  100    HA   ALA  16           HA       ALA  16   4.360   1.458  -1.230
  101   1HB   ALA  16          1HB       ALA  16   4.490  -0.530  -2.764
  102   2HB   ALA  16          2HB       ALA  16   3.764   0.897  -3.502
  103   3HB   ALA  16          3HB       ALA  16   2.740  -0.430  -2.955
  104    H    GLY  17           H        GLY  17   1.118  -0.074  -1.146
  105   1HA   GLY  17          1HA       GLY  17  -0.279   2.334  -1.840
  106   2HA   GLY  17          2HA       GLY  17  -0.998   0.926  -1.074
  107    H    SER  18           H        SER  18   0.570   0.861   1.232
  108    HA   SER  18           HA       SER  18  -0.843   2.630   2.957
  109   1HB   SER  18          1HB       SER  18   0.501   1.572   4.686
  110   2HB   SER  18          2HB       SER  18   0.023   0.355   3.506
  111    HG   SER  18           HG       SER  18   2.183   0.087   3.793
  112    H    THR  19           H        THR  19   2.246   2.881   1.413
  113    HA   THR  19           HA       THR  19   3.243   5.040   3.178
  114    HB   THR  19           HB       THR  19   4.415   3.894   0.624
  115    HG1  THR  19           HG1      THR  19   4.082   2.365   2.346
  116   1HG2  THR  19          1HG2      THR  19   6.532   4.786   1.595
  117   2HG2  THR  19          2HG2      THR  19   5.593   5.510   2.901
  118   3HG2  THR  19          3HG2      THR  19   5.360   6.054   1.239
  119    H    MET  20           H        MET  20   2.062   4.575  -0.120
  120    HA   MET  20           HA       MET  20   2.426   7.354  -0.911
  121   1HB   MET  20          1HB       MET  20   0.853   5.069  -2.140
  122   2HB   MET  20          2HB       MET  20   1.158   6.616  -2.928
  123   1HG   MET  20          1HG       MET  20   3.369   4.801  -1.924
  124   2HG   MET  20          2HG       MET  20   2.762   4.769  -3.578
  125   1HE   MET  20          1HE       MET  20   5.687   5.322  -2.337
  126   2HE   MET  20          2HE       MET  20   6.332   6.555  -3.417
  127   3HE   MET  20          3HE       MET  20   5.456   5.179  -4.085
  128    H    GLY  21           H        GLY  21   0.579   6.390   1.435
  129   1HA   GLY  21          1HA       GLY  21  -2.088   7.241   0.657
  130   2HA   GLY  21          2HA       GLY  21  -1.525   6.983   2.311
  131    H    ALA  22           H        ALA  22   0.738   8.820   2.074
  132    HA   ALA  22           HA       ALA  22  -0.637  11.279   2.761
  133   1HB   ALA  22          1HB       ALA  22   1.498  10.651   3.818
  134   2HB   ALA  22          2HB       ALA  22   1.643  12.206   2.999
  135   3HB   ALA  22          3HB       ALA  22   2.308  10.753   2.254
  136    H    ALA  23           H        ALA  23   1.431  10.299   0.014
  137    HA   ALA  23           HA       ALA  23   1.136  12.820  -1.373
  138   1HB   ALA  23          1HB       ALA  23   1.875  10.090  -2.466
  139   2HB   ALA  23          2HB       ALA  23   3.015  11.261  -1.804
  140   3HB   ALA  23          3HB       ALA  23   2.128  11.633  -3.283
  141    H    SER  24           H        SER  24  -1.167  10.657  -0.632
  142    HA   SER  24           HA       SER  24  -2.528  10.414  -3.218
  143   1HB   SER  24          1HB       SER  24  -4.224   9.249  -2.015
  144   2HB   SER  24          2HB       SER  24  -2.715   8.798  -1.223
  145    HG   SER  24           HG       SER  24  -4.229   9.409   0.324
  146    H    MET  25           H        MET  25  -2.127  13.000  -3.183
  147    HA   MET  25           HA       MET  25  -3.114  15.131  -3.129
  148   1HB   MET  25          1HB       MET  25  -5.679  13.512  -3.110
  149   2HB   MET  25          2HB       MET  25  -5.490  15.179  -3.650
  150   1HG   MET  25          1HG       MET  25  -3.956  14.437  -5.431
  151   2HG   MET  25          2HG       MET  25  -4.138  12.767  -4.897
  152   1HE   MET  25          1HE       MET  25  -7.459  11.581  -6.045
  153   2HE   MET  25          2HE       MET  25  -6.761  11.840  -4.449
  154   3HE   MET  25          3HE       MET  25  -5.755  11.211  -5.752
  155    H    THR  26           H        THR  26  -2.468  15.772  -1.021
  156    HA   THR  26           HA       THR  26  -3.690  14.971   1.409
  157    HB   THR  26           HB       THR  26  -1.621  16.193   1.500
  158    HG1  THR  26           HG1      THR  26  -2.185  17.764   2.979
  159   1HG2  THR  26          1HG2      THR  26  -1.838  17.460  -0.576
  160   2HG2  THR  26          2HG2      THR  26  -1.498  18.566   0.753
  161   3HG2  THR  26          3HG2      THR  26  -3.138  18.427   0.121
  162    H    LEU  27           H        LEU  27  -5.452  15.787   2.573
  163    HA   LEU  27           HA       LEU  27  -7.601  16.948   1.032
  164   1HB   LEU  27          1HB       LEU  27  -7.470  16.871   4.063
  165   2HB   LEU  27          2HB       LEU  27  -8.898  16.790   3.032
  166    HG   LEU  27           HG       LEU  27  -6.742  14.669   3.299
  167   1HD1  LEU  27          1HD1      LEU  27  -9.660  14.767   4.121
  168   2HD1  LEU  27          2HD1      LEU  27  -8.266  14.737   5.201
  169   3HD1  LEU  27          3HD1      LEU  27  -8.643  13.328   4.208
  170   1HD2  LEU  27          1HD2      LEU  27  -8.400  13.333   1.855
  171   2HD2  LEU  27          2HD2      LEU  27  -7.485  14.585   1.020
  172   3HD2  LEU  27          3HD2      LEU  27  -9.165  14.878   1.478
  173    H    THR  28           H        THR  28  -5.826  18.261   3.863
  174    HA   THR  28           HA       THR  28  -6.847  20.917   3.539
  175    HB   THR  28           HB       THR  28  -4.962  21.573   5.036
  176    HG1  THR  28           HG1      THR  28  -3.267  20.369   4.897
  177   1HG2  THR  28          1HG2      THR  28  -6.394  19.014   5.803
  178   2HG2  THR  28          2HG2      THR  28  -7.025  20.649   5.997
  179   3HG2  THR  28          3HG2      THR  28  -5.624  20.129   6.932
  180    H    VAL  29           H        VAL  29  -5.355  22.828   3.022
  181    HA   VAL  29           HA       VAL  29  -4.405  22.603   0.339
  182    HB   VAL  29           HB       VAL  29  -3.647  24.711   2.385
  183   1HG1  VAL  29          1HG1      VAL  29  -3.744  24.692  -0.647
  184   2HG1  VAL  29          2HG1      VAL  29  -2.305  24.838   0.361
  185   3HG1  VAL  29          3HG1      VAL  29  -3.492  26.141   0.328
  186   1HG2  VAL  29          1HG2      VAL  29  -6.084  24.444   2.284
  187   2HG2  VAL  29          2HG2      VAL  29  -6.037  24.528   0.522
  188   3HG2  VAL  29          3HG2      VAL  29  -5.613  25.945   1.483
  189    H    GLN  30           H        GLN  30  -2.201  22.703  -0.445
  190    HA   GLN  30           HA       GLN  30  -0.389  20.930   0.822
  191   1HB   GLN  30          1HB       GLN  30   0.254  23.154  -1.139
  192   2HB   GLN  30          2HB       GLN  30   1.277  21.763  -0.784
  193   1HG   GLN  30          1HG       GLN  30  -0.446  20.241  -1.623
  194   2HG   GLN  30          2HG       GLN  30  -1.531  21.600  -1.914
  195   1HE2  GLN  30          1HE2      GLN  30   1.117  19.776  -3.236
  196   2HE2  GLN  30          2HE2      GLN  30   1.336  20.714  -4.634
  197    H    ALA  31           H        ALA  31  -1.224  24.055   1.742
  198    HA   ALA  31           HA       ALA  31   1.317  25.037   2.673
  199   1HB   ALA  31          1HB       ALA  31  -1.465  25.649   3.718
  200   2HB   ALA  31          2HB       ALA  31  -0.680  26.485   2.378
  201   3HB   ALA  31          3HB       ALA  31  -0.016  26.611   4.007
  Start of MODEL   10
    1    H    ALA   2           H        ALA   2  -1.354 -23.921   1.729
    2    HA   ALA   2           HA       ALA   2   0.903 -24.496   1.069
    3   1HB   ALA   2          1HB       ALA   2   0.265 -26.241  -0.612
    4   2HB   ALA   2          2HB       ALA   2  -1.310 -25.463  -0.765
    5   3HB   ALA   2          3HB       ALA   2  -0.827 -26.183   0.771
    6    H    VAL   3           H        VAL   3   2.598 -23.884  -0.183
    7    HA   VAL   3           HA       VAL   3   3.793 -22.774  -1.860
    8    HB   VAL   3           HB       VAL   3   1.539 -23.578  -3.719
    9   1HG1  VAL   3          1HG1      VAL   3   4.561 -23.416  -4.028
   10   2HG1  VAL   3          2HG1      VAL   3   3.380 -22.332  -4.758
   11   3HG1  VAL   3          3HG1      VAL   3   3.460 -24.015  -5.265
   12   1HG2  VAL   3          1HG2      VAL   3   2.722 -25.803  -3.886
   13   2HG2  VAL   3          2HG2      VAL   3   1.925 -25.531  -2.340
   14   3HG2  VAL   3          3HG2      VAL   3   3.672 -25.340  -2.474
   15    H    GLY   4           H        GLY   4   1.983 -21.174  -0.346
   16   1HA   GLY   4          1HA       GLY   4   0.620 -19.346  -2.230
   17   2HA   GLY   4          2HA       GLY   4   0.649 -19.208  -0.485
   18    H    ILE   5           H        ILE   5   2.904 -18.971  -3.248
   19    HA   ILE   5           HA       ILE   5   4.801 -17.318  -1.849
   20    HB   ILE   5           HB       ILE   5   5.328 -18.653  -3.873
   21   1HG1  ILE   5          1HG1      ILE   5   5.705 -15.673  -4.300
   22   2HG1  ILE   5          2HG1      ILE   5   6.702 -16.669  -3.241
   23   1HG2  ILE   5          1HG2      ILE   5   3.751 -16.555  -5.391
   24   2HG2  ILE   5          2HG2      ILE   5   3.132 -18.164  -5.017
   25   3HG2  ILE   5          3HG2      ILE   5   4.544 -17.982  -6.055
   26   1HD1  ILE   5          1HD1      ILE   5   7.848 -16.464  -5.363
   27   2HD1  ILE   5          2HD1      ILE   5   6.401 -16.950  -6.242
   28   3HD1  ILE   5          3HD1      ILE   5   7.249 -18.117  -5.226
   29    H    GLY   6           H        GLY   6   1.833 -16.742  -3.560
   30   1HA   GLY   6          1HA       GLY   6   1.974 -14.016  -4.214
   31   2HA   GLY   6          2HA       GLY   6   0.490 -14.800  -3.653
   32    H    ALA   7           H        ALA   7   1.751 -15.577  -1.114
   33    HA   ALA   7           HA       ALA   7   0.960 -13.451   0.578
   34   1HB   ALA   7          1HB       ALA   7   2.884 -15.746   1.074
   35   2HB   ALA   7          2HB       ALA   7   1.132 -15.823   1.255
   36   3HB   ALA   7          3HB       ALA   7   2.083 -14.798   2.329
   37    H    LEU   8           H        LEU   8   4.097 -14.270  -0.794
   38    HA   LEU   8           HA       LEU   8   5.601 -12.437   0.918
   39   1HB   LEU   8          1HB       LEU   8   6.531 -13.567  -1.737
   40   2HB   LEU   8          2HB       LEU   8   7.519 -13.043  -0.373
   41    HG   LEU   8           HG       LEU   8   5.704 -15.473  -0.499
   42   1HD1  LEU   8          1HD1      LEU   8   7.753 -16.732  -0.240
   43   2HD1  LEU   8          2HD1      LEU   8   8.683 -15.260   0.037
   44   3HD1  LEU   8          3HD1      LEU   8   8.001 -15.583  -1.556
   45   1HD2  LEU   8          1HD2      LEU   8   6.679 -15.896   1.854
   46   2HD2  LEU   8          2HD2      LEU   8   5.438 -14.654   1.734
   47   3HD2  LEU   8          3HD2      LEU   8   7.136 -14.191   1.852
   48    H    PHE   9           H        PHE   9   4.473 -12.286  -2.520
   49    HA   PHE   9           HA       PHE   9   5.550  -9.617  -2.871
   50   1HB   PHE   9          1HB       PHE   9   3.198 -10.923  -4.283
   51   2HB   PHE   9          2HB       PHE   9   3.886  -9.362  -4.727
   52    HD1  PHE   9           HD1      PHE   9   4.386 -13.003  -4.760
   53    HD2  PHE   9           HD2      PHE   9   6.178  -9.197  -5.646
   54    HE1  PHE   9           HE1      PHE   9   6.136 -14.137  -6.101
   55    HE2  PHE   9           HE2      PHE   9   7.925 -10.335  -6.988
   56    HZ   PHE   9           HZ       PHE   9   7.904 -12.803  -7.215
   57    H    LEU  10           H        LEU  10   2.275 -10.814  -1.823
   58    HA   LEU  10           HA       LEU  10   1.060  -8.301  -1.596
   59   1HB   LEU  10          1HB       LEU  10  -0.206 -10.344  -1.290
   60   2HB   LEU  10          2HB       LEU  10   0.755 -10.786   0.115
   61    HG   LEU  10           HG       LEU  10  -0.168  -8.938   1.405
   62   1HD1  LEU  10          1HD1      LEU  10  -2.069  -7.573   0.295
   63   2HD1  LEU  10          2HD1      LEU  10  -1.407  -8.132  -1.239
   64   3HD1  LEU  10          3HD1      LEU  10  -0.418  -7.160  -0.152
   65   1HD2  LEU  10          1HD2      LEU  10  -1.478 -11.044   1.246
   66   2HD2  LEU  10          2HD2      LEU  10  -2.372 -10.366  -0.114
   67   3HD2  LEU  10          3HD2      LEU  10  -2.516  -9.639   1.485
   68    H    GLY  11           H        GLY  11   3.110  -9.975   0.794
   69   1HA   GLY  11          1HA       GLY  11   2.881  -8.200   2.941
   70   2HA   GLY  11          2HA       GLY  11   4.359  -9.085   2.570
   71    H    PHE  12           H        PHE  12   5.093  -7.892   0.138
   72    HA   PHE  12           HA       PHE  12   5.983  -5.226   1.093
   73   1HB   PHE  12          1HB       PHE  12   6.768  -6.814  -1.365
   74   2HB   PHE  12          2HB       PHE  12   7.487  -5.282  -0.868
   75    HD1  PHE  12           HD1      PHE  12   7.539  -8.870  -0.397
   76    HD2  PHE  12           HD2      PHE  12   8.560  -5.122   1.443
   77    HE1  PHE  12           HE1      PHE  12   9.078 -10.047   1.150
   78    HE2  PHE  12           HE2      PHE  12  10.099  -6.302   2.987
   79    HZ   PHE  12           HZ       PHE  12  10.357  -8.763   2.843
   80    H    LEU  13           H        LEU  13   4.010  -6.582  -1.548
   81    HA   LEU  13           HA       LEU  13   3.769  -4.120  -3.000
   82   1HB   LEU  13          1HB       LEU  13   3.050  -6.656  -3.559
   83   2HB   LEU  13          2HB       LEU  13   1.493  -6.104  -2.979
   84    HG   LEU  13           HG       LEU  13   1.514  -5.821  -5.362
   85   1HD1  LEU  13          1HD1      LEU  13   0.978  -3.528  -5.598
   86   2HD1  LEU  13          2HD1      LEU  13   2.091  -3.045  -4.321
   87   3HD1  LEU  13          3HD1      LEU  13   0.609  -3.922  -3.920
   88   1HD2  LEU  13          1HD2      LEU  13   3.225  -4.895  -6.657
   89   2HD2  LEU  13          2HD2      LEU  13   4.147  -5.744  -5.423
   90   3HD2  LEU  13          3HD2      LEU  13   3.928  -3.998  -5.317
   91    H    GLY  14           H        GLY  14   2.266  -5.337  -0.119
   92   1HA   GLY  14          1HA       GLY  14  -0.008  -3.538  -0.097
   93   2HA   GLY  14          2HA       GLY  14   0.608  -4.433   1.293
   94    H    ALA  15           H        ALA  15   3.245  -3.441   1.274
   95    HA   ALA  15           HA       ALA  15   3.095  -1.135   2.876
   96   1HB   ALA  15          1HB       ALA  15   5.373  -2.096   1.113
   97   2HB   ALA  15          2HB       ALA  15   5.024  -2.686   2.738
   98   3HB   ALA  15          3HB       ALA  15   5.534  -1.016   2.499
   99    H    ALA  16           H        ALA  16   3.379  -1.453  -0.613
  100    HA   ALA  16           HA       ALA  16   4.194   1.173  -1.270
  101   1HB   ALA  16          1HB       ALA  16   3.447   0.613  -3.506
  102   2HB   ALA  16          2HB       ALA  16   2.406  -0.665  -2.878
  103   3HB   ALA  16          3HB       ALA  16   4.159  -0.826  -2.775
  104    H    GLY  17           H        GLY  17   0.853  -0.136  -1.116
  105   1HA   GLY  17          1HA       GLY  17  -0.373   2.372  -1.781
  106   2HA   GLY  17          2HA       GLY  17  -1.185   1.009  -1.027
  107    H    SER  18           H        SER  18   0.375   0.820   1.286
  108    HA   SER  18           HA       SER  18  -0.928   2.666   3.015
  109   1HB   SER  18          1HB       SER  18  -0.266   0.395   3.657
  110   2HB   SER  18          2HB       SER  18   1.431   0.819   3.456
  111    HG   SER  18           HG       SER  18  -0.103   1.137   5.590
  112    H    THR  19           H        THR  19   2.171   2.733   1.482
  113    HA   THR  19           HA       THR  19   3.284   4.843   3.244
  114    HB   THR  19           HB       THR  19   5.213   4.631   1.550
  115    HG1  THR  19           HG1      THR  19   3.778   2.320   0.788
  116   1HG2  THR  19          1HG2      THR  19   4.256   2.250   3.162
  117   2HG2  THR  19          2HG2      THR  19   5.406   3.491   3.656
  118   3HG2  THR  19          3HG2      THR  19   5.849   2.328   2.405
  119    H    MET  20           H        MET  20   2.061   4.426  -0.052
  120    HA   MET  20           HA       MET  20   2.580   7.178  -0.850
  121   1HB   MET  20          1HB       MET  20   0.886   4.982  -2.074
  122   2HB   MET  20          2HB       MET  20   1.248   6.519  -2.857
  123   1HG   MET  20          1HG       MET  20   3.391   4.605  -1.889
  124   2HG   MET  20          2HG       MET  20   2.760   4.602  -3.536
  125   1HE   MET  20          1HE       MET  20   5.330   4.678  -3.830
  126   2HE   MET  20          2HE       MET  20   5.933   5.308  -2.300
  127   3HE   MET  20          3HE       MET  20   6.308   6.151  -3.800
  128    H    GLY  21           H        GLY  21  -0.159   5.384   0.442
  129   1HA   GLY  21          1HA       GLY  21  -2.102   7.497  -0.013
  130   2HA   GLY  21          2HA       GLY  21  -2.324   6.097   1.038
  131    H    ALA  22           H        ALA  22  -0.184   6.435   2.805
  132    HA   ALA  22           HA       ALA  22  -1.251   8.469   4.568
  133   1HB   ALA  22          1HB       ALA  22   0.633   7.831   6.046
  134   2HB   ALA  22          2HB       ALA  22   1.325   6.873   4.738
  135   3HB   ALA  22          3HB       ALA  22  -0.223   6.413   5.446
  136    H    ALA  23           H        ALA  23   0.649   8.759   1.871
  137    HA   ALA  23           HA       ALA  23   2.627  10.665   2.783
  138   1HB   ALA  23          1HB       ALA  23   1.468  10.315   0.002
  139   2HB   ALA  23          2HB       ALA  23   2.811   9.374   0.650
  140   3HB   ALA  23          3HB       ALA  23   2.987  11.113   0.410
  141    H    SER  24           H        SER  24  -0.592  10.919   2.917
  142    HA   SER  24           HA       SER  24  -0.988  13.586   1.765
  143   1HB   SER  24          1HB       SER  24  -3.217  13.433   2.751
  144   2HB   SER  24          2HB       SER  24  -2.829  11.913   1.950
  145    HG   SER  24           HG       SER  24  -3.549  11.323   3.922
  146    H    MET  25           H        MET  25   1.152  13.248   3.775
  147    HA   MET  25           HA       MET  25   1.977  14.322   5.691
  148   1HB   MET  25          1HB       MET  25   1.414  16.273   4.199
  149   2HB   MET  25          2HB       MET  25  -0.146  16.381   5.014
  150   1HG   MET  25          1HG       MET  25   0.968  16.753   7.163
  151   2HG   MET  25          2HG       MET  25   2.547  16.555   6.402
  152   1HE   MET  25          1HE       MET  25   0.932  19.224   8.052
  153   2HE   MET  25          2HE       MET  25   2.138  20.333   7.403
  154   3HE   MET  25          3HE       MET  25   2.627  18.729   7.941
  155    H    THR  26           H        THR  26   0.890  12.499   6.921
  156    HA   THR  26           HA       THR  26  -1.665  12.952   8.197
  157    HB   THR  26           HB       THR  26  -1.040  11.030   9.611
  158    HG1  THR  26           HG1      THR  26   0.979  10.607   9.928
  159   1HG2  THR  26          1HG2      THR  26  -1.856  10.619   7.317
  160   2HG2  THR  26          2HG2      THR  26  -0.687   9.392   7.808
  161   3HG2  THR  26          3HG2      THR  26  -0.199  10.690   6.719
  162    H    LEU  27           H        LEU  27  -2.085  14.212   9.953
  163    HA   LEU  27           HA       LEU  27  -0.018  15.814  11.163
  164   1HB   LEU  27          1HB       LEU  27  -2.742  15.281  12.392
  165   2HB   LEU  27          2HB       LEU  27  -1.750  16.734  12.529
  166    HG   LEU  27           HG       LEU  27  -3.140  15.730  10.025
  167   1HD1  LEU  27          1HD1      LEU  27  -3.574  18.194  11.740
  168   2HD1  LEU  27          2HD1      LEU  27  -4.623  16.779  11.698
  169   3HD1  LEU  27          3HD1      LEU  27  -4.461  17.797  10.268
  170   1HD2  LEU  27          1HD2      LEU  27  -2.343  18.007   9.127
  171   2HD2  LEU  27          2HD2      LEU  27  -1.106  16.767   9.291
  172   3HD2  LEU  27          3HD2      LEU  27  -1.233  18.047  10.498
  173    H    THR  28           H        THR  28  -1.190  12.630  11.781
  174    HA   THR  28           HA       THR  28   0.836  12.145  13.770
  175    HB   THR  28           HB       THR  28  -0.566  13.325  15.316
  176    HG1  THR  28           HG1      THR  28  -0.052  11.604  16.436
  177   1HG2  THR  28          1HG2      THR  28  -2.984  12.736  15.562
  178   2HG2  THR  28          2HG2      THR  28  -2.838  11.700  14.143
  179   3HG2  THR  28          3HG2      THR  28  -2.601  13.442  13.992
  180    H    VAL  29           H        VAL  29   1.100   9.917  14.066
  181    HA   VAL  29           HA       VAL  29  -0.209   8.189  12.157
  182    HB   VAL  29           HB       VAL  29   1.062   6.376  13.280
  183   1HG1  VAL  29          1HG1      VAL  29   2.672   8.916  12.876
  184   2HG1  VAL  29          2HG1      VAL  29   2.136   7.842  11.584
  185   3HG1  VAL  29          3HG1      VAL  29   3.292   7.268  12.787
  186   1HG2  VAL  29          1HG2      VAL  29   2.613   7.070  15.150
  187   2HG2  VAL  29          2HG2      VAL  29   0.909   7.085  15.598
  188   3HG2  VAL  29          3HG2      VAL  29   1.740   8.599  15.237
  189    H    GLN  30           H        GLN  30  -1.911   6.778  12.454
  190    HA   GLN  30           HA       GLN  30  -3.630   7.191  14.784
  191   1HB   GLN  30          1HB       GLN  30  -3.857   5.209  12.495
  192   2HB   GLN  30          2HB       GLN  30  -5.128   5.593  13.658
  193   1HG   GLN  30          1HG       GLN  30  -5.184   7.909  12.898
  194   2HG   GLN  30          2HG       GLN  30  -3.830   7.613  11.806
  195   1HE2  GLN  30          1HE2      GLN  30  -4.661   7.555   9.711
  196   2HE2  GLN  30          2HE2      GLN  30  -6.063   6.720   9.245
  197    H    ALA  31           H        ALA  31  -3.763   5.887  16.573
  198    HA   ALA  31           HA       ALA  31  -3.002   3.102  16.577
  199   1HB   ALA  31          1HB       ALA  31  -1.075   5.093  17.815
  200   2HB   ALA  31          2HB       ALA  31  -0.733   3.972  16.497
  201   3HB   ALA  31          3HB       ALA  31  -1.039   3.356  18.121
  Start of MODEL   11
    1    H    ALA   2           H        ALA   2   0.108 -22.529  -5.287
    2    HA   ALA   2           HA       ALA   2   1.231 -24.976  -4.109
    3   1HB   ALA   2          1HB       ALA   2   2.437 -22.696  -5.704
    4   2HB   ALA   2          2HB       ALA   2   1.829 -24.195  -6.408
    5   3HB   ALA   2          3HB       ALA   2   3.213 -24.231  -5.317
    6    H    VAL   3           H        VAL   3   1.523 -24.718  -1.923
    7    HA   VAL   3           HA       VAL   3   2.185 -23.762   0.108
    8    HB   VAL   3           HB       VAL   3   4.194 -22.402  -1.718
    9   1HG1  VAL   3          1HG1      VAL   3   5.609 -22.459   0.367
   10   2HG1  VAL   3          2HG1      VAL   3   4.184 -22.983   1.262
   11   3HG1  VAL   3          3HG1      VAL   3   4.213 -21.392   0.505
   12   1HG2  VAL   3          1HG2      VAL   3   4.130 -24.857  -1.982
   13   2HG2  VAL   3          2HG2      VAL   3   4.311 -25.044  -0.238
   14   3HG2  VAL   3          3HG2      VAL   3   5.618 -24.338  -1.190
   15    H    GLY   4           H        GLY   4   3.289 -20.836  -1.355
   16   1HA   GLY   4          1HA       GLY   4   0.962 -19.332  -1.559
   17   2HA   GLY   4          2HA       GLY   4   1.409 -19.242   0.135
   18    H    ILE   5           H        ILE   5   3.191 -19.005  -2.989
   19    HA   ILE   5           HA       ILE   5   5.102 -17.137  -1.923
   20    HB   ILE   5           HB       ILE   5   5.515 -18.587  -3.891
   21   1HG1  ILE   5          1HG1      ILE   5   5.629 -15.637  -4.590
   22   2HG1  ILE   5          2HG1      ILE   5   6.788 -16.456  -3.541
   23   1HG2  ILE   5          1HG2      ILE   5   3.185 -18.333  -4.828
   24   2HG2  ILE   5          2HG2      ILE   5   4.469 -18.139  -6.020
   25   3HG2  ILE   5          3HG2      ILE   5   3.644 -16.720  -5.377
   26   1HD1  ILE   5          1HD1      ILE   5   6.245 -17.062  -6.464
   27   2HD1  ILE   5          2HD1      ILE   5   7.284 -18.042  -5.426
   28   3HD1  ILE   5          3HD1      ILE   5   7.717 -16.369  -5.782
   29    H    GLY   6           H        GLY   6   1.969 -16.856  -3.430
   30   1HA   GLY   6          1HA       GLY   6   1.922 -14.134  -4.182
   31   2HA   GLY   6          2HA       GLY   6   0.511 -15.001  -3.556
   32    H    ALA   7           H        ALA   7   1.788 -15.643  -1.020
   33    HA   ALA   7           HA       ALA   7   0.967 -13.470   0.604
   34   1HB   ALA   7          1HB       ALA   7   1.247 -15.871   1.301
   35   2HB   ALA   7          2HB       ALA   7   2.024 -14.737   2.405
   36   3HB   ALA   7          3HB       ALA   7   2.996 -15.646   1.248
   37    H    LEU   8           H        LEU   8   4.071 -14.271  -0.811
   38    HA   LEU   8           HA       LEU   8   5.613 -12.392   0.791
   39   1HB   LEU   8          1HB       LEU   8   6.727 -14.335  -0.124
   40   2HB   LEU   8          2HB       LEU   8   6.226 -13.921  -1.757
   41    HG   LEU   8           HG       LEU   8   7.675 -11.971  -1.782
   42   1HD1  LEU   8          1HD1      LEU   8   8.069 -12.611   1.154
   43   2HD1  LEU   8          2HD1      LEU   8   7.552 -11.090   0.425
   44   3HD1  LEU   8          3HD1      LEU   8   9.222 -11.618   0.262
   45   1HD2  LEU   8          1HD2      LEU   8   9.118 -14.364  -0.596
   46   2HD2  LEU   8          2HD2      LEU   8   9.869 -13.073  -1.535
   47   3HD2  LEU   8          3HD2      LEU   8   8.704 -14.155  -2.299
   48    H    PHE   9           H        PHE   9   4.379 -12.364  -2.615
   49    HA   PHE   9           HA       PHE   9   5.377  -9.692  -3.091
   50   1HB   PHE   9          1HB       PHE   9   4.427 -11.368  -4.864
   51   2HB   PHE   9          2HB       PHE   9   2.847 -10.735  -4.421
   52    HD1  PHE   9           HD1      PHE   9   6.294  -9.529  -5.308
   53    HD2  PHE   9           HD2      PHE   9   2.061  -8.844  -5.640
   54    HE1  PHE   9           HE1      PHE   9   6.720  -7.606  -6.811
   55    HE2  PHE   9           HE2      PHE   9   2.493  -6.922  -7.143
   56    HZ   PHE   9           HZ       PHE   9   4.821  -6.302  -7.727
   57    H    LEU  10           H        LEU  10   2.118 -10.893  -1.975
   58    HA   LEU  10           HA       LEU  10   0.965  -8.321  -1.747
   59   1HB   LEU  10          1HB       LEU  10   0.458 -11.021  -0.553
   60   2HB   LEU  10          2HB       LEU  10  -0.280  -9.667   0.294
   61    HG   LEU  10           HG       LEU  10  -1.322  -8.942  -1.872
   62   1HD1  LEU  10          1HD1      LEU  10  -0.361 -11.635  -2.886
   63   2HD1  LEU  10          2HD1      LEU  10   0.355 -10.093  -3.354
   64   3HD1  LEU  10          3HD1      LEU  10  -1.316 -10.452  -3.775
   65   1HD2  LEU  10          1HD2      LEU  10  -1.917 -11.784  -0.990
   66   2HD2  LEU  10          2HD2      LEU  10  -3.010 -10.750  -1.911
   67   3HD2  LEU  10          3HD2      LEU  10  -2.571 -10.318  -0.258
   68    H    GLY  11           H        GLY  11   2.902 -10.136   0.625
   69   1HA   GLY  11          1HA       GLY  11   2.656  -8.412   2.821
   70   2HA   GLY  11          2HA       GLY  11   4.110  -9.344   2.477
   71    H    PHE  12           H        PHE  12   4.980  -8.099   0.095
   72    HA   PHE  12           HA       PHE  12   5.967  -5.539   1.209
   73   1HB   PHE  12          1HB       PHE  12   7.520  -7.155   0.115
   74   2HB   PHE  12          2HB       PHE  12   6.686  -6.874  -1.412
   75    HD1  PHE  12           HD1      PHE  12   6.865  -4.716  -2.579
   76    HD2  PHE  12           HD2      PHE  12   8.909  -5.404   1.140
   77    HE1  PHE  12           HE1      PHE  12   8.237  -2.686  -2.956
   78    HE2  PHE  12           HE2      PHE  12  10.282  -3.375   0.758
   79    HZ   PHE  12           HZ       PHE  12   9.946  -2.016  -1.289
   80    H    LEU  13           H        LEU  13   3.944  -6.590  -1.536
   81    HA   LEU  13           HA       LEU  13   3.883  -4.010  -2.801
   82   1HB   LEU  13          1HB       LEU  13   3.018  -6.476  -3.545
   83   2HB   LEU  13          2HB       LEU  13   1.480  -5.808  -3.034
   84    HG   LEU  13           HG       LEU  13   1.755  -5.430  -5.412
   85   1HD1  LEU  13          1HD1      LEU  13   2.308  -2.756  -4.119
   86   2HD1  LEU  13          2HD1      LEU  13   0.769  -3.601  -3.926
   87   3HD1  LEU  13          3HD1      LEU  13   1.309  -3.105  -5.527
   88   1HD2  LEU  13          1HD2      LEU  13   4.434  -5.372  -5.089
   89   2HD2  LEU  13          2HD2      LEU  13   4.151  -3.634  -5.107
   90   3HD2  LEU  13          3HD2      LEU  13   3.643  -4.621  -6.471
   91    H    GLY  14           H        GLY  14   2.411  -5.222   0.054
   92   1HA   GLY  14          1HA       GLY  14   0.113  -3.460   0.113
   93   2HA   GLY  14          2HA       GLY  14   0.785  -4.322   1.496
   94    H    ALA  15           H        ALA  15   3.397  -3.286   1.402
   95    HA   ALA  15           HA       ALA  15   3.242  -0.946   2.957
   96   1HB   ALA  15          1HB       ALA  15   5.668  -0.807   2.548
   97   2HB   ALA  15          2HB       ALA  15   5.507  -1.890   1.167
   98   3HB   ALA  15          3HB       ALA  15   5.191  -2.486   2.796
   99    H    ALA  16           H        ALA  16   3.463  -1.347  -0.529
  100    HA   ALA  16           HA       ALA  16   4.215   1.279  -1.262
  101   1HB   ALA  16          1HB       ALA  16   3.253   0.645  -3.473
  102   2HB   ALA  16          2HB       ALA  16   2.551  -0.787  -2.720
  103   3HB   ALA  16          3HB       ALA  16   4.303  -0.602  -2.799
  104    H    GLY  17           H        GLY  17   0.898  -0.102  -1.061
  105   1HA   GLY  17          1HA       GLY  17  -0.382   2.368  -1.761
  106   2HA   GLY  17          2HA       GLY  17  -1.161   1.002  -0.980
  107    H    SER  18           H        SER  18   0.411   0.876   1.324
  108    HA   SER  18           HA       SER  18  -0.908   2.731   3.032
  109   1HB   SER  18          1HB       SER  18  -0.185   0.463   3.679
  110   2HB   SER  18          2HB       SER  18   1.499   0.950   3.506
  111    HG   SER  18           HG       SER  18  -0.047   2.600   5.086
  112    H    THR  19           H        THR  19   2.166   2.810   1.459
  113    HA   THR  19           HA       THR  19   3.288   4.955   3.165
  114    HB   THR  19           HB       THR  19   4.351   3.654   0.634
  115    HG1  THR  19           HG1      THR  19   4.236   2.874   3.257
  116   1HG2  THR  19          1HG2      THR  19   5.637   5.390   2.760
  117   2HG2  THR  19          2HG2      THR  19   5.412   5.795   1.058
  118   3HG2  THR  19          3HG2      THR  19   6.534   4.515   1.520
  119    H    MET  20           H        MET  20   2.022   4.478  -0.104
  120    HA   MET  20           HA       MET  20   2.502   7.226  -0.943
  121   1HB   MET  20          1HB       MET  20   2.425   5.189  -2.452
  122   2HB   MET  20          2HB       MET  20   0.682   5.154  -2.202
  123   1HG   MET  20          1HG       MET  20   1.057   6.364  -4.243
  124   2HG   MET  20          2HG       MET  20   0.628   7.564  -3.028
  125   1HE   MET  20          1HE       MET  20   3.109   9.686  -4.942
  126   2HE   MET  20          2HE       MET  20   1.561   9.588  -4.108
  127   3HE   MET  20          3HE       MET  20   1.843   8.605  -5.541
  128    H    GLY  21           H        GLY  21  -0.210   5.401   0.370
  129   1HA   GLY  21          1HA       GLY  21  -2.189   7.474  -0.103
  130   2HA   GLY  21          2HA       GLY  21  -2.385   6.084   0.963
  131    H    ALA  22           H        ALA  22  -0.174   6.527   2.677
  132    HA   ALA  22           HA       ALA  22  -1.310   8.499   4.469
  133   1HB   ALA  22          1HB       ALA  22  -0.124   6.519   5.320
  134   2HB   ALA  22          2HB       ALA  22   0.661   7.994   5.884
  135   3HB   ALA  22          3HB       ALA  22   1.367   7.072   4.555
  136    H    ALA  23           H        ALA  23   1.222   8.540   2.051
  137    HA   ALA  23           HA       ALA  23   2.496  10.975   2.962
  138   1HB   ALA  23          1HB       ALA  23   3.557  10.985   0.740
  139   2HB   ALA  23          2HB       ALA  23   2.433   9.740   0.193
  140   3HB   ALA  23          3HB       ALA  23   3.617   9.369   1.445
  141    H    SER  24           H        SER  24  -0.557  10.472   1.853
  142    HA   SER  24           HA       SER  24  -0.973  13.317   1.295
  143   1HB   SER  24          1HB       SER  24  -0.213  12.427  -0.919
  144   2HB   SER  24          2HB       SER  24  -1.557  11.289  -0.887
  145    HG   SER  24           HG       SER  24  -1.568  13.788  -1.716
  146    H    MET  25           H        MET  25  -1.892  11.176   3.139
  147    HA   MET  25           HA       MET  25  -3.892  10.385   4.084
  148   1HB   MET  25          1HB       MET  25  -4.890  12.923   2.748
  149   2HB   MET  25          2HB       MET  25  -5.809  11.992   3.929
  150   1HG   MET  25          1HG       MET  25  -4.743  13.760   5.147
  151   2HG   MET  25          2HG       MET  25  -3.841  12.294   5.525
  152   1HE   MET  25          1HE       MET  25  -1.442  15.508   5.305
  153   2HE   MET  25          2HE       MET  25  -2.370  14.478   6.392
  154   3HE   MET  25          3HE       MET  25  -3.200  15.686   5.414
  155    H    THR  26           H        THR  26  -6.388  10.016   3.421
  156    HA   THR  26           HA       THR  26  -6.282   8.358   0.987
  157    HB   THR  26           HB       THR  26  -8.508   7.609   1.683
  158    HG1  THR  26           HG1      THR  26  -8.603   8.994   4.009
  159   1HG2  THR  26          1HG2      THR  26  -6.495   6.678   2.817
  160   2HG2  THR  26          2HG2      THR  26  -7.920   6.670   3.856
  161   3HG2  THR  26          3HG2      THR  26  -6.674   7.897   4.079
  162    H    LEU  27           H        LEU  27  -6.676   9.301  -0.959
  163    HA   LEU  27           HA       LEU  27  -9.097  10.834  -1.410
  164   1HB   LEU  27          1HB       LEU  27  -7.657  12.860  -2.338
  165   2HB   LEU  27          2HB       LEU  27  -8.037  12.779  -0.621
  166    HG   LEU  27           HG       LEU  27  -5.853  11.829  -0.121
  167   1HD1  LEU  27          1HD1      LEU  27  -4.148  11.733  -2.049
  168   2HD1  LEU  27          2HD1      LEU  27  -5.534  11.792  -3.136
  169   3HD1  LEU  27          3HD1      LEU  27  -5.353  10.450  -2.001
  170   1HD2  LEU  27          1HD2      LEU  27  -5.726  14.236  -1.963
  171   2HD2  LEU  27          2HD2      LEU  27  -4.433  13.749  -0.870
  172   3HD2  LEU  27          3HD2      LEU  27  -5.989  14.260  -0.219
  173    H    THR  28           H        THR  28  -6.856   8.720  -2.385
  174    HA   THR  28           HA       THR  28  -6.399   9.447  -5.137
  175    HB   THR  28           HB       THR  28  -5.673   7.142  -5.424
  176    HG1  THR  28           HG1      THR  28  -7.405   6.178  -4.291
  177   1HG2  THR  28          1HG2      THR  28  -4.211   8.681  -4.128
  178   2HG2  THR  28          2HG2      THR  28  -4.024   7.000  -3.625
  179   3HG2  THR  28          3HG2      THR  28  -4.972   8.116  -2.639
  180    H    VAL  29           H        VAL  29  -7.965   9.591  -6.663
  181    HA   VAL  29           HA       VAL  29 -10.630   8.588  -6.277
  182    HB   VAL  29           HB       VAL  29  -9.299   9.380  -8.886
  183   1HG1  VAL  29          1HG1      VAL  29 -12.191   9.269  -7.975
  184   2HG1  VAL  29          2HG1      VAL  29 -11.440   8.264  -9.212
  185   3HG1  VAL  29          3HG1      VAL  29 -11.654   9.992  -9.491
  186   1HG2  VAL  29          1HG2      VAL  29  -9.027  11.157  -7.227
  187   2HG2  VAL  29          2HG2      VAL  29 -10.735  11.051  -6.799
  188   3HG2  VAL  29          3HG2      VAL  29 -10.261  11.630  -8.396
  189    H    GLN  30           H        GLN  30 -11.487   6.612  -6.797
  190    HA   GLN  30           HA       GLN  30  -9.810   4.394  -7.396
  191   1HB   GLN  30          1HB       GLN  30 -12.123   4.319  -6.341
  192   2HB   GLN  30          2HB       GLN  30 -12.790   4.568  -7.952
  193   1HG   GLN  30          1HG       GLN  30 -12.791   2.194  -7.559
  194   2HG   GLN  30          2HG       GLN  30 -11.489   2.516  -8.702
  195   1HE2  GLN  30          1HE2      GLN  30  -9.992   0.884  -8.115
  196   2HE2  GLN  30          2HE2      GLN  30  -9.330   0.728  -6.560
  197    H    ALA  31           H        ALA  31 -12.166   6.064  -9.523
  198    HA   ALA  31           HA       ALA  31 -10.401   5.951 -11.805
  199   1HB   ALA  31          1HB       ALA  31 -11.791   4.352 -13.150
  200   2HB   ALA  31          2HB       ALA  31 -12.678   3.948 -11.681
  201   3HB   ALA  31          3HB       ALA  31 -10.958   3.579 -11.801
  Start of MODEL   12
    1    H    ALA   2           H        ALA   2   5.035 -22.922   0.715
    2    HA   ALA   2           HA       ALA   2   3.195 -23.940   1.353
    3   1HB   ALA   2          1HB       ALA   2   3.238 -22.032   3.712
    4   2HB   ALA   2          2HB       ALA   2   4.062 -23.589   3.642
    5   3HB   ALA   2          3HB       ALA   2   2.299 -23.521   3.611
    6    H    VAL   3           H        VAL   3   0.971 -23.782   0.998
    7    HA   VAL   3           HA       VAL   3  -1.027 -22.866   0.257
    8    HB   VAL   3           HB       VAL   3  -0.138 -20.240   1.486
    9   1HG1  VAL   3          1HG1      VAL   3  -2.854 -21.501   1.032
   10   2HG1  VAL   3          2HG1      VAL   3  -2.170 -20.165   0.106
   11   3HG1  VAL   3          3HG1      VAL   3  -2.565 -19.947   1.811
   12   1HG2  VAL   3          1HG2      VAL   3   0.174 -21.975   3.171
   13   2HG2  VAL   3          2HG2      VAL   3  -1.398 -22.672   2.790
   14   3HG2  VAL   3          3HG2      VAL   3  -1.298 -21.083   3.547
   15    H    GLY   4           H        GLY   4   1.517 -20.403  -0.119
   16   1HA   GLY   4          1HA       GLY   4   1.786 -20.595  -2.872
   17   2HA   GLY   4          2HA       GLY   4   0.488 -19.438  -2.629
   18    H    ILE   5           H        ILE   5   3.303 -19.140  -3.632
   19    HA   ILE   5           HA       ILE   5   4.804 -17.605  -1.710
   20    HB   ILE   5           HB       ILE   5   5.727 -18.740  -3.759
   21   1HG1  ILE   5          1HG1      ILE   5   6.250 -15.757  -3.560
   22   2HG1  ILE   5          2HG1      ILE   5   6.989 -16.994  -2.544
   23   1HG2  ILE   5          1HG2      ILE   5   4.609 -16.354  -5.257
   24   2HG2  ILE   5          2HG2      ILE   5   3.850 -17.945  -5.267
   25   3HG2  ILE   5          3HG2      ILE   5   5.470 -17.737  -5.930
   26   1HD1  ILE   5          1HD1      ILE   5   7.883 -18.070  -4.654
   27   2HD1  ILE   5          2HD1      ILE   5   8.560 -16.481  -4.299
   28   3HD1  ILE   5          3HD1      ILE   5   7.315 -16.651  -5.537
   29    H    GLY   6           H        GLY   6   2.046 -17.004  -3.607
   30   1HA   GLY   6          1HA       GLY   6   2.102 -14.289  -4.253
   31   2HA   GLY   6          2HA       GLY   6   0.636 -15.112  -3.697
   32    H    ALA   7           H        ALA   7   1.987 -15.804  -1.141
   33    HA   ALA   7           HA       ALA   7   1.054 -13.718   0.527
   34   1HB   ALA   7          1HB       ALA   7   1.414 -16.059   1.235
   35   2HB   ALA   7          2HB       ALA   7   2.293 -14.947   2.284
   36   3HB   ALA   7          3HB       ALA   7   3.153 -15.849   1.038
   37    H    LEU   8           H        LEU   8   4.236 -14.317  -0.862
   38    HA   LEU   8           HA       LEU   8   5.602 -12.334   0.803
   39   1HB   LEU   8          1HB       LEU   8   6.611 -13.432  -1.836
   40   2HB   LEU   8          2HB       LEU   8   7.555 -12.806  -0.486
   41    HG   LEU   8           HG       LEU   8   5.972 -15.393  -0.597
   42   1HD1  LEU   8          1HD1      LEU   8   8.899 -14.914   0.042
   43   2HD1  LEU   8          2HD1      LEU   8   8.315 -15.267  -1.583
   44   3HD1  LEU   8          3HD1      LEU   8   8.111 -16.455  -0.296
   45   1HD2  LEU   8          1HD2      LEU   8   5.564 -14.564   1.616
   46   2HD2  LEU   8          2HD2      LEU   8   7.214 -13.963   1.776
   47   3HD2  LEU   8          3HD2      LEU   8   6.902 -15.700   1.787
   48    H    PHE   9           H        PHE   9   4.438 -12.347  -2.622
   49    HA   PHE   9           HA       PHE   9   5.321  -9.637  -3.079
   50   1HB   PHE   9          1HB       PHE   9   4.439 -11.314  -4.866
   51   2HB   PHE   9          2HB       PHE   9   2.829 -10.792  -4.390
   52    HD1  PHE   9           HD1      PHE   9   6.161  -9.475  -5.478
   53    HD2  PHE   9           HD2      PHE   9   1.915  -8.816  -5.384
   54    HE1  PHE   9           HE1      PHE   9   6.433  -7.502  -6.953
   55    HE2  PHE   9           HE2      PHE   9   2.192  -6.843  -6.859
   56    HZ   PHE   9           HZ       PHE   9   4.450  -6.187  -7.643
   57    H    LEU  10           H        LEU  10   2.158 -10.980  -1.919
   58    HA   LEU  10           HA       LEU  10   0.842  -8.501  -1.683
   59   1HB   LEU  10          1HB       LEU  10  -0.363 -10.588  -1.448
   60   2HB   LEU  10          2HB       LEU  10   0.591 -11.038  -0.042
   61    HG   LEU  10           HG       LEU  10  -0.407  -9.251   1.282
   62   1HD1  LEU  10          1HD1      LEU  10  -2.336  -7.921   0.181
   63   2HD1  LEU  10          2HD1      LEU  10  -1.639  -8.424  -1.360
   64   3HD1  LEU  10          3HD1      LEU  10  -0.695  -7.443  -0.238
   65   1HD2  LEU  10          1HD2      LEU  10  -1.647 -11.382   1.079
   66   2HD2  LEU  10          2HD2      LEU  10  -2.525 -10.734  -0.306
   67   3HD2  LEU  10          3HD2      LEU  10  -2.745 -10.018   1.290
   68    H    GLY  11           H        GLY  11   2.916 -10.175   0.676
   69   1HA   GLY  11          1HA       GLY  11   2.581  -8.468   2.871
   70   2HA   GLY  11          2HA       GLY  11   4.078  -9.330   2.527
   71    H    PHE  12           H        PHE  12   4.910  -8.023   0.160
   72    HA   PHE  12           HA       PHE  12   5.780  -5.443   1.312
   73   1HB   PHE  12          1HB       PHE  12   6.536  -6.763  -1.306
   74   2HB   PHE  12          2HB       PHE  12   7.292  -5.325  -0.619
   75    HD1  PHE  12           HD1      PHE  12   7.441  -8.899  -0.737
   76    HD2  PHE  12           HD2      PHE  12   8.171  -5.533   1.837
   77    HE1  PHE  12           HE1      PHE  12   8.943 -10.289   0.660
   78    HE2  PHE  12           HE2      PHE  12   9.674  -6.928   3.229
   79    HZ   PHE  12           HZ       PHE  12  10.060  -9.304   2.641
   80    H    LEU  13           H        LEU  13   3.775  -6.505  -1.442
   81    HA   LEU  13           HA       LEU  13   3.622  -3.934  -2.684
   82   1HB   LEU  13          1HB       LEU  13   2.720  -6.402  -3.374
   83   2HB   LEU  13          2HB       LEU  13   1.210  -5.739  -2.783
   84    HG   LEU  13           HG       LEU  13   1.348  -5.360  -5.170
   85   1HD1  LEU  13          1HD1      LEU  13   1.977  -2.686  -3.915
   86   2HD1  LEU  13          2HD1      LEU  13   0.451  -3.528  -3.632
   87   3HD1  LEU  13          3HD1      LEU  13   0.898  -3.036  -5.263
   88   1HD2  LEU  13          1HD2      LEU  13   3.175  -4.558  -6.336
   89   2HD2  LEU  13          2HD2      LEU  13   4.041  -5.305  -5.003
   90   3HD2  LEU  13          3HD2      LEU  13   3.761  -3.567  -5.005
   91    H    GLY  14           H        GLY  14   2.281  -5.165   0.228
   92   1HA   GLY  14          1HA       GLY  14   0.071  -3.241   0.406
   93   2HA   GLY  14          2HA       GLY  14   0.606  -4.337   1.679
   94    H    ALA  15           H        ALA  15   3.339  -2.926   0.600
   95    HA   ALA  15           HA       ALA  15   3.422  -0.973   2.845
   96   1HB   ALA  15          1HB       ALA  15   5.829  -0.833   2.295
   97   2HB   ALA  15          2HB       ALA  15   5.576  -1.893   0.910
   98   3HB   ALA  15          3HB       ALA  15   5.337  -2.508   2.546
   99    H    ALA  16           H        ALA  16   3.686  -1.184  -0.641
  100    HA   ALA  16           HA       ALA  16   4.354   1.502  -1.235
  101   1HB   ALA  16          1HB       ALA  16   3.515   0.909  -3.508
  102   2HB   ALA  16          2HB       ALA  16   2.837  -0.575  -2.836
  103   3HB   ALA  16          3HB       ALA  16   4.584  -0.321  -2.832
  104    H    GLY  17           H        GLY  17   1.117  -0.040  -1.117
  105   1HA   GLY  17          1HA       GLY  17  -0.292   2.359  -1.818
  106   2HA   GLY  17          2HA       GLY  17  -1.001   0.955  -1.036
  107    H    SER  18           H        SER  18   0.586   0.914   1.260
  108    HA   SER  18           HA       SER  18  -0.822   2.694   2.978
  109   1HB   SER  18          1HB       SER  18  -0.062   0.519   3.713
  110   2HB   SER  18          2HB       SER  18   1.611   0.935   3.358
  111    HG   SER  18           HG       SER  18   0.534   1.193   5.630
  112    H    THR  19           H        THR  19   2.250   2.938   1.401
  113    HA   THR  19           HA       THR  19   3.260   5.122   3.127
  114    HB   THR  19           HB       THR  19   4.400   3.940   0.574
  115    HG1  THR  19           HG1      THR  19   5.723   2.799   2.130
  116   1HG2  THR  19          1HG2      THR  19   5.352   6.109   1.126
  117   2HG2  THR  19          2HG2      THR  19   6.529   4.855   1.510
  118   3HG2  THR  19          3HG2      THR  19   5.596   5.612   2.800
  119    H    MET  20           H        MET  20   2.039   4.611  -0.152
  120    HA   MET  20           HA       MET  20   2.375   7.386  -0.976
  121   1HB   MET  20          1HB       MET  20   0.840   5.054  -2.162
  122   2HB   MET  20          2HB       MET  20   1.063   6.610  -2.963
  123   1HG   MET  20          1HG       MET  20   3.485   6.318  -2.947
  124   2HG   MET  20          2HG       MET  20   3.326   4.819  -2.030
  125   1HE   MET  20          1HE       MET  20   4.541   5.743  -5.160
  126   2HE   MET  20          2HE       MET  20   4.490   4.099  -5.791
  127   3HE   MET  20          3HE       MET  20   5.040   4.386  -4.142
  128    H    GLY  21           H        GLY  21   0.744   6.801   1.470
  129   1HA   GLY  21          1HA       GLY  21  -2.023   7.033   1.095
  130   2HA   GLY  21          2HA       GLY  21  -1.166   7.746   2.461
  131    H    ALA  22           H        ALA  22   0.444   9.582   0.917
  132    HA   ALA  22           HA       ALA  22  -1.462  11.749   0.646
  133   1HB   ALA  22          1HB       ALA  22   0.867  12.139   1.372
  134   2HB   ALA  22          2HB       ALA  22   0.496  13.068  -0.082
  135   3HB   ALA  22          3HB       ALA  22   1.449  11.588  -0.200
  136    H    ALA  23           H        ALA  23   0.863  10.563  -1.800
  137    HA   ALA  23           HA       ALA  23  -0.770  11.552  -3.988
  138   1HB   ALA  23          1HB       ALA  23   0.891  10.401  -5.418
  139   2HB   ALA  23          2HB       ALA  23   1.577   9.633  -3.988
  140   3HB   ALA  23          3HB       ALA  23   1.678  11.383  -4.182
  141    H    SER  24           H        SER  24  -2.201   9.719  -2.262
  142    HA   SER  24           HA       SER  24  -2.383   7.134  -3.609
  143   1HB   SER  24          1HB       SER  24  -4.351   6.809  -2.106
  144   2HB   SER  24          2HB       SER  24  -2.896   7.274  -1.233
  145    HG   SER  24           HG       SER  24  -3.944   8.960  -0.581
  146    H    MET  25           H        MET  25  -4.670   9.832  -3.219
  147    HA   MET  25           HA       MET  25  -6.500  10.480  -4.548
  148   1HB   MET  25          1HB       MET  25  -4.588   9.568  -6.721
  149   2HB   MET  25          2HB       MET  25  -6.006  10.587  -6.971
  150   1HG   MET  25          1HG       MET  25  -5.053  12.278  -5.435
  151   2HG   MET  25          2HG       MET  25  -3.623  11.269  -5.225
  152   1HE   MET  25          1HE       MET  25  -2.674  14.427  -7.380
  153   2HE   MET  25          2HE       MET  25  -3.007  13.847  -5.750
  154   3HE   MET  25          3HE       MET  25  -4.323  14.470  -6.740
  155    H    THR  26           H        THR  26  -7.573   8.464  -3.585
  156    HA   THR  26           HA       THR  26  -7.748   6.005  -4.983
  157    HB   THR  26           HB       THR  26  -8.709   5.958  -2.828
  158    HG1  THR  26           HG1      THR  26 -11.117   6.377  -4.156
  159   1HG2  THR  26          1HG2      THR  26  -8.941   8.304  -2.381
  160   2HG2  THR  26          2HG2      THR  26 -10.539   7.594  -2.177
  161   3HG2  THR  26          3HG2      THR  26 -10.157   8.492  -3.642
  162    H    LEU  27           H        LEU  27  -8.508   5.605  -6.987
  163    HA   LEU  27           HA       LEU  27  -9.913   7.618  -8.526
  164   1HB   LEU  27          1HB       LEU  27  -9.738   4.669  -9.219
  165   2HB   LEU  27          2HB       LEU  27  -9.862   6.039 -10.322
  166    HG   LEU  27           HG       LEU  27  -7.490   5.369  -8.551
  167   1HD1  LEU  27          1HD1      LEU  27  -6.358   5.033 -10.752
  168   2HD1  LEU  27          2HD1      LEU  27  -7.909   5.282 -11.553
  169   3HD1  LEU  27          3HD1      LEU  27  -7.680   3.897 -10.486
  170   1HD2  LEU  27          1HD2      LEU  27  -6.415   7.255  -9.939
  171   2HD2  LEU  27          2HD2      LEU  27  -7.561   7.759  -8.702
  172   3HD2  LEU  27          3HD2      LEU  27  -8.057   7.714 -10.396
  173    H    THR  28           H        THR  28 -10.946   4.364  -7.424
  174    HA   THR  28           HA       THR  28 -13.528   5.324  -6.550
  175    HB   THR  28           HB       THR  28 -13.927   5.482  -8.973
  176    HG1  THR  28           HG1      THR  28 -15.824   4.691  -8.621
  177   1HG2  THR  28          1HG2      THR  28 -13.727   3.571 -10.431
  178   2HG2  THR  28          2HG2      THR  28 -13.336   2.514  -9.077
  179   3HG2  THR  28          3HG2      THR  28 -12.191   3.755  -9.585
  180    H    VAL  29           H        VAL  29 -14.829   2.740  -7.280
  181    HA   VAL  29           HA       VAL  29 -13.965   1.212  -5.004
  182    HB   VAL  29           HB       VAL  29 -15.501  -0.542  -5.901
  183   1HG1  VAL  29          1HG1      VAL  29 -17.542   0.821  -5.747
  184   2HG1  VAL  29          2HG1      VAL  29 -16.596   2.284  -6.020
  185   3HG1  VAL  29          3HG1      VAL  29 -16.361   1.343  -4.547
  186   1HG2  VAL  29          1HG2      VAL  29 -16.803   0.039  -7.961
  187   2HG2  VAL  29          2HG2      VAL  29 -15.095  -0.250  -8.293
  188   3HG2  VAL  29          3HG2      VAL  29 -15.715   1.401  -8.227
  189    H    GLN  30           H        GLN  30 -12.626  -0.595  -4.896
  190    HA   GLN  30           HA       GLN  30 -10.608  -0.884  -6.926
  191   1HB   GLN  30          1HB       GLN  30 -10.346  -1.411  -4.453
  192   2HB   GLN  30          2HB       GLN  30 -11.284  -2.876  -4.735
  193   1HG   GLN  30          1HG       GLN  30  -8.965  -3.499  -4.873
  194   2HG   GLN  30          2HG       GLN  30  -9.584  -3.498  -6.523
  195   1HE2  GLN  30          1HE2      GLN  30  -8.052  -1.164  -4.223
  196   2HE2  GLN  30          2HE2      GLN  30  -7.080  -0.423  -5.400
  197    H    ALA  31           H        ALA  31 -13.257  -3.071  -5.904
  198    HA   ALA  31           HA       ALA  31 -13.837  -3.856  -8.623
  199   1HB   ALA  31          1HB       ALA  31 -13.113  -6.245  -8.380
  200   2HB   ALA  31          2HB       ALA  31 -12.277  -5.800  -6.893
  201   3HB   ALA  31          3HB       ALA  31 -11.761  -5.115  -8.435
  Start of MODEL   13
    1    H    ALA   2           H        ALA   2   5.330 -23.080  -1.552
    2    HA   ALA   2           HA       ALA   2   4.966 -24.776   0.742
    3   1HB   ALA   2          1HB       ALA   2   6.296 -22.909   1.733
    4   2HB   ALA   2          2HB       ALA   2   4.637 -22.948   2.329
    5   3HB   ALA   2          3HB       ALA   2   5.106 -21.769   1.104
    6    H    VAL   3           H        VAL   3   3.980 -23.660  -1.992
    7    HA   VAL   3           HA       VAL   3   1.916 -23.216  -2.992
    8    HB   VAL   3           HB       VAL   3   0.696 -24.326  -0.455
    9   1HG1  VAL   3          1HG1      VAL   3  -0.099 -24.454  -3.384
   10   2HG1  VAL   3          2HG1      VAL   3  -0.894 -23.497  -2.137
   11   3HG1  VAL   3          3HG1      VAL   3  -0.958 -25.256  -2.070
   12   1HG2  VAL   3          1HG2      VAL   3   0.987 -26.575  -1.544
   13   2HG2  VAL   3          2HG2      VAL   3   2.507 -25.831  -1.051
   14   3HG2  VAL   3          3HG2      VAL   3   2.022 -25.805  -2.747
   15    H    GLY   4           H        GLY   4   2.878 -20.960  -2.051
   16   1HA   GLY   4          1HA       GLY   4   0.657 -19.306  -1.660
   17   2HA   GLY   4          2HA       GLY   4   1.297 -19.609  -0.059
   18    H    ILE   5           H        ILE   5   3.082 -19.116  -3.125
   19    HA   ILE   5           HA       ILE   5   4.953 -17.318  -1.871
   20    HB   ILE   5           HB       ILE   5   5.661 -16.894  -4.268
   21   1HG1  ILE   5          1HG1      ILE   5   3.520 -18.955  -4.890
   22   2HG1  ILE   5          2HG1      ILE   5   3.345 -17.232  -5.213
   23   1HG2  ILE   5          1HG2      ILE   5   6.513 -19.166  -4.605
   24   2HG2  ILE   5          2HG2      ILE   5   5.301 -19.807  -3.498
   25   3HG2  ILE   5          3HG2      ILE   5   6.581 -18.757  -2.892
   26   1HD1  ILE   5          1HD1      ILE   5   5.467 -19.066  -6.363
   27   2HD1  ILE   5          2HD1      ILE   5   5.399 -17.323  -6.624
   28   3HD1  ILE   5          3HD1      ILE   5   4.110 -18.359  -7.238
   29    H    GLY   6           H        GLY   6   1.906 -16.931  -3.511
   30   1HA   GLY   6          1HA       GLY   6   1.929 -14.216  -4.238
   31   2HA   GLY   6          2HA       GLY   6   0.487 -15.046  -3.634
   32    H    ALA   7           H        ALA   7   1.790 -15.714  -1.093
   33    HA   ALA   7           HA       ALA   7   0.959 -13.558   0.550
   34   1HB   ALA   7          1HB       ALA   7   2.109 -14.834   2.328
   35   2HB   ALA   7          2HB       ALA   7   2.948 -15.787   1.105
   36   3HB   ALA   7          3HB       ALA   7   1.198 -15.919   1.277
   37    H    LEU   8           H        LEU   8   4.084 -14.341  -0.851
   38    HA   LEU   8           HA       LEU   8   5.601 -12.461   0.792
   39   1HB   LEU   8          1HB       LEU   8   6.458 -13.630  -1.871
   40   2HB   LEU   8          2HB       LEU   8   7.486 -13.069  -0.553
   41    HG   LEU   8           HG       LEU   8   5.640 -15.477  -0.488
   42   1HD1  LEU   8          1HD1      LEU   8   8.659 -15.197  -0.515
   43   2HD1  LEU   8          2HD1      LEU   8   7.654 -15.867  -1.801
   44   3HD1  LEU   8          3HD1      LEU   8   7.798 -16.715  -0.261
   45   1HD2  LEU   8          1HD2      LEU   8   5.652 -14.622   1.738
   46   2HD2  LEU   8          2HD2      LEU   8   7.352 -14.162   1.645
   47   3HD2  LEU   8          3HD2      LEU   8   6.899 -15.864   1.744
   48    H    PHE   9           H        PHE   9   4.406 -12.392  -2.622
   49    HA   PHE   9           HA       PHE   9   5.434  -9.725  -3.058
   50   1HB   PHE   9          1HB       PHE   9   4.471 -11.377  -4.850
   51   2HB   PHE   9          2HB       PHE   9   2.899 -10.721  -4.413
   52    HD1  PHE   9           HD1      PHE   9   2.152  -8.809  -5.625
   53    HD2  PHE   9           HD2      PHE   9   6.371  -9.565  -5.265
   54    HE1  PHE   9           HE1      PHE   9   2.628  -6.883  -7.110
   55    HE2  PHE   9           HE2      PHE   9   6.839  -7.636  -6.748
   56    HZ   PHE   9           HZ       PHE   9   4.970  -6.297  -7.670
   57    H    LEU  10           H        LEU  10   2.196 -10.925  -1.926
   58    HA   LEU  10           HA       LEU  10   0.991  -8.392  -1.707
   59   1HB   LEU  10          1HB       LEU  10  -0.302 -10.425  -1.456
   60   2HB   LEU  10          2HB       LEU  10   0.629 -10.903  -0.043
   61    HG   LEU  10           HG       LEU  10  -0.294  -9.062   1.261
   62   1HD1  LEU  10          1HD1      LEU  10  -2.166  -7.664   0.140
   63   2HD1  LEU  10          2HD1      LEU  10  -1.483  -8.206  -1.393
   64   3HD1  LEU  10          3HD1      LEU  10  -0.506  -7.258  -0.274
   65   1HD2  LEU  10          1HD2      LEU  10  -2.670  -9.725   1.261
   66   2HD2  LEU  10          2HD2      LEU  10  -1.625 -11.136   1.089
   67   3HD2  LEU  10          3HD2      LEU  10  -2.461 -10.482  -0.319
   68    H    GLY  11           H        GLY  11   2.988 -10.127   0.678
   69   1HA   GLY  11          1HA       GLY  11   2.718  -8.386   2.853
   70   2HA   GLY  11          2HA       GLY  11   4.185  -9.300   2.516
   71    H    PHE  12           H        PHE  12   5.040  -8.056   0.128
   72    HA   PHE  12           HA       PHE  12   5.994  -5.480   1.234
   73   1HB   PHE  12          1HB       PHE  12   7.566  -7.080   0.145
   74   2HB   PHE  12          2HB       PHE  12   6.730  -6.815  -1.383
   75    HD1  PHE  12           HD1      PHE  12   8.928  -5.306   1.168
   76    HD2  PHE  12           HD2      PHE  12   6.893  -4.665  -2.562
   77    HE1  PHE  12           HE1      PHE  12  10.278  -3.262   0.782
   78    HE2  PHE  12           HE2      PHE  12   8.245  -2.621  -2.946
   79    HZ   PHE  12           HZ       PHE  12   9.937  -1.919  -1.275
   80    H    LEU  13           H        LEU  13   3.986  -6.561  -1.511
   81    HA   LEU  13           HA       LEU  13   3.899  -3.990  -2.786
   82   1HB   LEU  13          1HB       LEU  13   3.050  -6.468  -3.509
   83   2HB   LEU  13          2HB       LEU  13   1.508  -5.806  -3.002
   84    HG   LEU  13           HG       LEU  13   1.779  -5.446  -5.383
   85   1HD1  LEU  13          1HD1      LEU  13   0.779  -3.614  -3.910
   86   2HD1  LEU  13          2HD1      LEU  13   1.315  -3.125  -5.516
   87   3HD1  LEU  13          3HD1      LEU  13   2.312  -2.759  -4.110
   88   1HD2  LEU  13          1HD2      LEU  13   3.662  -4.640  -6.449
   89   2HD2  LEU  13          2HD2      LEU  13   4.459  -5.363  -5.059
   90   3HD2  LEU  13          3HD2      LEU  13   4.159  -3.627  -5.098
   91    H    GLY  14           H        GLY  14   2.441  -5.199   0.077
   92   1HA   GLY  14          1HA       GLY  14   0.129  -3.455   0.132
   93   2HA   GLY  14          2HA       GLY  14   0.808  -4.308   1.517
   94    H    ALA  15           H        ALA  15   3.412  -3.243   1.416
   95    HA   ALA  15           HA       ALA  15   3.233  -0.907   2.970
   96   1HB   ALA  15          1HB       ALA  15   5.194  -2.424   2.824
   97   2HB   ALA  15          2HB       ALA  15   5.659  -0.743   2.561
   98   3HB   ALA  15          3HB       ALA  15   5.508  -1.842   1.189
   99    H    ALA  16           H        ALA  16   3.475  -1.297  -0.517
  100    HA   ALA  16           HA       ALA  16   4.213   1.335  -1.238
  101   1HB   ALA  16          1HB       ALA  16   4.297  -0.585  -2.757
  102   2HB   ALA  16          2HB       ALA  16   3.325   0.708  -3.459
  103   3HB   ALA  16          3HB       ALA  16   2.537  -0.694  -2.734
  104    H    GLY  17           H        GLY  17   0.905  -0.064  -1.061
  105   1HA   GLY  17          1HA       GLY  17  -0.388   2.396  -1.767
  106   2HA   GLY  17          2HA       GLY  17  -1.162   1.027  -0.985
  107    H    SER  18           H        SER  18   0.411   0.920   1.324
  108    HA   SER  18           HA       SER  18  -0.930   2.770   3.023
  109   1HB   SER  18          1HB       SER  18   1.492   1.020   3.521
  110   2HB   SER  18          2HB       SER  18   0.466   1.729   4.764
  111    HG   SER  18           HG       SER  18  -0.097  -0.448   4.233
  112    H    THR  19           H        THR  19   2.143   2.875   1.452
  113    HA   THR  19           HA       THR  19   3.246   5.032   3.156
  114    HB   THR  19           HB       THR  19   4.326   3.753   0.622
  115    HG1  THR  19           HG1      THR  19   5.128   3.222   3.269
  116   1HG2  THR  19          1HG2      THR  19   5.597   5.458   2.780
  117   2HG2  THR  19          2HG2      THR  19   5.367   5.898   1.089
  118   3HG2  THR  19          3HG2      THR  19   6.496   4.615   1.520
  119    H    MET  20           H        MET  20   1.995   4.542  -0.119
  120    HA   MET  20           HA       MET  20   2.448   7.296  -0.959
  121   1HB   MET  20          1HB       MET  20   0.805   5.044  -2.155
  122   2HB   MET  20          2HB       MET  20   1.149   6.575  -2.960
  123   1HG   MET  20          1HG       MET  20   3.317   4.713  -1.947
  124   2HG   MET  20          2HG       MET  20   2.699   4.674  -3.598
  125   1HE   MET  20          1HE       MET  20   5.408   4.805  -3.570
  126   2HE   MET  20          2HE       MET  20   5.769   5.594  -2.037
  127   3HE   MET  20          3HE       MET  20   6.300   6.333  -3.545
  128    H    GLY  21           H        GLY  21   0.125   5.787   0.977
  129   1HA   GLY  21          1HA       GLY  21  -2.268   7.133   0.235
  130   2HA   GLY  21          2HA       GLY  21  -1.916   6.538   1.857
  131    H    ALA  22           H        ALA  22   0.597   8.282   1.827
  132    HA   ALA  22           HA       ALA  22  -0.604  10.583   3.116
  133   1HB   ALA  22          1HB       ALA  22   1.733  11.391   3.300
  134   2HB   ALA  22          2HB       ALA  22   2.257  10.089   2.233
  135   3HB   ALA  22          3HB       ALA  22   1.587   9.711   3.819
  136    H    ALA  23           H        ALA  23   0.080   9.820  -0.141
  137    HA   ALA  23           HA       ALA  23   0.665  12.487  -1.099
  138   1HB   ALA  23          1HB       ALA  23  -0.518  10.136  -2.604
  139   2HB   ALA  23          2HB       ALA  23   1.208  10.423  -2.383
  140   3HB   ALA  23          3HB       ALA  23   0.238  11.558  -3.322
  141    H    SER  24           H        SER  24  -2.159  11.019   0.054
  142    HA   SER  24           HA       SER  24  -3.755  13.381  -0.600
  143   1HB   SER  24          1HB       SER  24  -4.461  10.689  -1.805
  144   2HB   SER  24          2HB       SER  24  -5.543  12.078  -1.766
  145    HG   SER  24           HG       SER  24  -4.569  12.599  -3.554
  146    H    MET  25           H        MET  25  -2.808  11.407   1.602
  147    HA   MET  25           HA       MET  25  -3.680  10.515   3.593
  148   1HB   MET  25          1HB       MET  25  -4.294  12.975   3.737
  149   2HB   MET  25          2HB       MET  25  -5.895  12.540   3.143
  150   1HG   MET  25          1HG       MET  25  -6.126  10.952   5.062
  151   2HG   MET  25          2HG       MET  25  -4.575  11.517   5.678
  152   1HE   MET  25          1HE       MET  25  -4.586  13.520   7.566
  153   2HE   MET  25          2HE       MET  25  -5.013  15.033   6.771
  154   3HE   MET  25          3HE       MET  25  -3.983  13.871   5.941
  155    H    THR  26           H        THR  26  -4.213   8.606   2.025
  156    HA   THR  26           HA       THR  26  -6.977   8.203   1.261
  157    HB   THR  26           HB       THR  26  -6.242   5.826   0.916
  158    HG1  THR  26           HG1      THR  26  -3.863   6.892   2.017
  159   1HG2  THR  26          1HG2      THR  26  -5.956   7.411  -0.897
  160   2HG2  THR  26          2HG2      THR  26  -4.526   6.381  -0.825
  161   3HG2  THR  26          3HG2      THR  26  -4.464   8.021  -0.179
  162    H    LEU  27           H        LEU  27  -8.634   7.547   2.548
  163    HA   LEU  27           HA       LEU  27  -8.271   7.153   5.375
  164   1HB   LEU  27          1HB       LEU  27 -10.590   6.720   3.473
  165   2HB   LEU  27          2HB       LEU  27 -10.726   6.274   5.172
  166    HG   LEU  27           HG       LEU  27 -10.250   8.567   5.858
  167   1HD1  LEU  27          1HD1      LEU  27 -10.157  10.346   4.004
  168   2HD1  LEU  27          2HD1      LEU  27  -9.835   9.020   2.889
  169   3HD1  LEU  27          3HD1      LEU  27  -8.715   9.356   4.208
  170   1HD2  LEU  27          1HD2      LEU  27 -12.585   7.921   5.274
  171   2HD2  LEU  27          2HD2      LEU  27 -12.315   8.506   3.633
  172   3HD2  LEU  27          3HD2      LEU  27 -12.278   9.635   4.988
  173    H    THR  28           H        THR  28  -9.355   4.820   2.870
  174    HA   THR  28           HA       THR  28  -7.621   2.727   3.914
  175    HB   THR  28           HB       THR  28 -10.612   2.397   4.307
  176    HG1  THR  28           HG1      THR  28 -10.256   3.357   6.120
  177   1HG2  THR  28          1HG2      THR  28  -9.497   0.295   3.831
  178   2HG2  THR  28          2HG2      THR  28  -9.866   0.356   5.554
  179   3HG2  THR  28          3HG2      THR  28  -8.223   0.665   4.991
  180    H    VAL  29           H        VAL  29 -10.868   2.671   2.407
  181    HA   VAL  29           HA       VAL  29 -10.048   0.808   0.378
  182    HB   VAL  29           HB       VAL  29 -12.229   1.390  -0.697
  183   1HG1  VAL  29          1HG1      VAL  29 -12.145  -0.287   1.095
  184   2HG1  VAL  29          2HG1      VAL  29 -13.636   0.647   1.207
  185   3HG1  VAL  29          3HG1      VAL  29 -12.301   0.981   2.309
  186   1HG2  VAL  29          1HG2      VAL  29 -13.708   2.988   0.537
  187   2HG2  VAL  29          2HG2      VAL  29 -12.300   3.780  -0.173
  188   3HG2  VAL  29          3HG2      VAL  29 -12.337   3.429   1.554
  189    H    GLN  30           H        GLN  30 -10.147   1.342  -2.011
  190    HA   GLN  30           HA       GLN  30  -9.760   4.060  -2.901
  191   1HB   GLN  30          1HB       GLN  30  -7.337   3.786  -3.551
  192   2HB   GLN  30          2HB       GLN  30  -7.602   3.890  -1.812
  193   1HG   GLN  30          1HG       GLN  30  -7.511   1.430  -1.640
  194   2HG   GLN  30          2HG       GLN  30  -7.246   1.318  -3.381
  195   1HE2  GLN  30          1HE2      GLN  30  -5.196   2.316  -4.229
  196   2HE2  GLN  30          2HE2      GLN  30  -3.851   2.439  -3.201
  197    H    ALA  31           H        ALA  31  -9.432   4.141  -5.231
  198    HA   ALA  31           HA       ALA  31 -10.695   1.974  -6.632
  199   1HB   ALA  31          1HB       ALA  31 -10.039   3.240  -8.681
  200   2HB   ALA  31          2HB       ALA  31  -9.069   4.313  -7.674
  201   3HB   ALA  31          3HB       ALA  31 -10.820   4.264  -7.477
  Start of MODEL   14
    1    H    ALA   2           H        ALA   2  -3.159 -18.995   2.639
    2    HA   ALA   2           HA       ALA   2  -4.209 -18.754   0.722
    3   1HB   ALA   2          1HB       ALA   2  -4.290 -16.371   1.487
    4   2HB   ALA   2          2HB       ALA   2  -4.318 -16.533  -0.269
    5   3HB   ALA   2          3HB       ALA   2  -2.828 -16.060   0.548
    6    H    VAL   3           H        VAL   3  -3.664 -19.911  -1.046
    7    HA   VAL   3           HA       VAL   3  -2.418 -20.775  -2.817
    8    HB   VAL   3           HB       VAL   3  -1.306 -17.956  -2.981
    9   1HG1  VAL   3          1HG1      VAL   3  -0.234 -19.719  -4.415
   10   2HG1  VAL   3          2HG1      VAL   3  -1.045 -18.459  -5.343
   11   3HG1  VAL   3          3HG1      VAL   3  -1.815 -20.031  -5.131
   12   1HG2  VAL   3          1HG2      VAL   3  -3.235 -17.559  -4.509
   13   2HG2  VAL   3          2HG2      VAL   3  -3.735 -17.861  -2.846
   14   3HG2  VAL   3          3HG2      VAL   3  -3.880 -19.135  -4.056
   15    H    GLY   4           H        GLY   4   0.109 -18.479  -1.952
   16   1HA   GLY   4          1HA       GLY   4   1.591 -19.976  -0.145
   17   2HA   GLY   4          2HA       GLY   4   2.083 -20.566  -1.722
   18    H    ILE   5           H        ILE   5   3.233 -19.171  -3.118
   19    HA   ILE   5           HA       ILE   5   4.963 -17.283  -1.810
   20    HB   ILE   5           HB       ILE   5   4.549 -17.514  -4.801
   21   1HG1  ILE   5          1HG1      ILE   5   4.716 -19.798  -4.028
   22   2HG1  ILE   5          2HG1      ILE   5   6.282 -19.351  -4.695
   23   1HG2  ILE   5          1HG2      ILE   5   6.085 -15.754  -3.890
   24   2HG2  ILE   5          2HG2      ILE   5   6.905 -16.939  -4.907
   25   3HG2  ILE   5          3HG2      ILE   5   7.047 -17.036  -3.152
   26   1HD1  ILE   5          1HD1      ILE   5   6.777 -20.465  -2.653
   27   2HD1  ILE   5          2HD1      ILE   5   5.500 -19.615  -1.785
   28   3HD1  ILE   5          3HD1      ILE   5   6.956 -18.751  -2.276
   29    H    GLY   6           H        GLY   6   1.920 -17.005  -3.472
   30   1HA   GLY   6          1HA       GLY   6   1.866 -14.300  -4.237
   31   2HA   GLY   6          2HA       GLY   6   0.452 -15.154  -3.600
   32    H    ALA   7           H        ALA   7   1.801 -15.767  -1.083
   33    HA   ALA   7           HA       ALA   7   0.960 -13.613   0.560
   34   1HB   ALA   7          1HB       ALA   7   2.962 -15.835   1.088
   35   2HB   ALA   7          2HB       ALA   7   1.215 -15.960   1.298
   36   3HB   ALA   7          3HB       ALA   7   2.152 -14.876   2.326
   37    H    LEU   8           H        LEU   8   4.095 -14.364  -0.863
   38    HA   LEU   8           HA       LEU   8   5.586 -12.464   0.784
   39   1HB   LEU   8          1HB       LEU   8   6.209 -14.159  -1.636
   40   2HB   LEU   8          2HB       LEU   8   7.341 -12.896  -1.157
   41    HG   LEU   8           HG       LEU   8   7.556 -13.885   1.070
   42   1HD1  LEU   8          1HD1      LEU   8   5.366 -14.804   1.444
   43   2HD1  LEU   8          2HD1      LEU   8   6.487 -16.160   1.460
   44   3HD1  LEU   8          3HD1      LEU   8   5.497 -15.855   0.034
   45   1HD2  LEU   8          1HD2      LEU   8   7.858 -15.880  -1.197
   46   2HD2  LEU   8          2HD2      LEU   8   8.610 -16.051   0.388
   47   3HD2  LEU   8          3HD2      LEU   8   9.064 -14.709  -0.662
   48    H    PHE   9           H        PHE   9   4.396 -12.396  -2.643
   49    HA   PHE   9           HA       PHE   9   5.379  -9.704  -3.053
   50   1HB   PHE   9          1HB       PHE   9   2.994 -11.037  -4.380
   51   2HB   PHE   9          2HB       PHE   9   3.734  -9.522  -4.898
   52    HD1  PHE   9           HD1      PHE   9   5.940  -9.489  -5.969
   53    HD2  PHE   9           HD2      PHE   9   4.167 -13.183  -4.668
   54    HE1  PHE   9           HE1      PHE   9   7.616 -10.758  -7.283
   55    HE2  PHE   9           HE2      PHE   9   5.846 -14.448  -5.982
   56    HZ   PHE   9           HZ       PHE   9   7.569 -13.237  -7.290
   57    H    LEU  10           H        LEU  10   2.168 -10.971  -1.927
   58    HA   LEU  10           HA       LEU  10   0.918  -8.465  -1.690
   59   1HB   LEU  10          1HB       LEU  10  -0.332 -10.521  -1.417
   60   2HB   LEU  10          2HB       LEU  10   0.632 -10.980  -0.020
   61    HG   LEU  10           HG       LEU  10  -0.308  -9.162   1.301
   62   1HD1  LEU  10          1HD1      LEU  10  -1.557  -8.327  -1.332
   63   2HD1  LEU  10          2HD1      LEU  10  -0.574  -7.361  -0.232
   64   3HD1  LEU  10          3HD1      LEU  10  -2.218  -7.793   0.216
   65   1HD2  LEU  10          1HD2      LEU  10  -2.486 -10.600  -0.246
   66   2HD2  LEU  10          2HD2      LEU  10  -2.659  -9.878   1.353
   67   3HD2  LEU  10          3HD2      LEU  10  -1.600 -11.269   1.122
   68    H    GLY  11           H        GLY  11   2.973 -10.162   0.668
   69   1HA   GLY  11          1HA       GLY  11   2.715  -8.424   2.846
   70   2HA   GLY  11          2HA       GLY  11   4.178  -9.335   2.493
   71    H    PHE  12           H        PHE  12   5.053  -8.073   0.117
   72    HA   PHE  12           HA       PHE  12   5.967  -5.494   1.248
   73   1HB   PHE  12          1HB       PHE  12   7.550  -7.121   0.150
   74   2HB   PHE  12          2HB       PHE  12   6.783  -6.742  -1.390
   75    HD1  PHE  12           HD1      PHE  12   9.041  -5.537   1.234
   76    HD2  PHE  12           HD2      PHE  12   6.904  -4.433  -2.326
   77    HE1  PHE  12           HE1      PHE  12  10.442  -3.503   1.021
   78    HE2  PHE  12           HE2      PHE  12   8.307  -2.401  -2.538
   79    HZ   PHE  12           HZ       PHE  12  10.077  -1.936  -0.865
   80    H    LEU  13           H        LEU  13   4.039  -6.562  -1.563
   81    HA   LEU  13           HA       LEU  13   3.956  -3.970  -2.812
   82   1HB   LEU  13          1HB       LEU  13   2.316  -6.487  -2.999
   83   2HB   LEU  13          2HB       LEU  13   1.655  -5.031  -3.723
   84    HG   LEU  13           HG       LEU  13   3.018  -6.566  -5.267
   85   1HD1  LEU  13          1HD1      LEU  13   2.495  -4.107  -5.703
   86   2HD1  LEU  13          2HD1      LEU  13   3.888  -4.766  -6.550
   87   3HD1  LEU  13          3HD1      LEU  13   4.125  -3.752  -5.134
   88   1HD2  LEU  13          1HD2      LEU  13   5.471  -5.285  -4.043
   89   2HD2  LEU  13          2HD2      LEU  13   5.363  -6.662  -5.133
   90   3HD2  LEU  13          3HD2      LEU  13   4.871  -6.834  -3.454
   91    H    GLY  14           H        GLY  14   2.552  -5.157   0.053
   92   1HA   GLY  14          1HA       GLY  14   0.183  -3.466   0.070
   93   2HA   GLY  14          2HA       GLY  14   0.856  -4.318   1.460
   94    H    ALA  15           H        ALA  15   3.451  -3.220   1.398
   95    HA   ALA  15           HA       ALA  15   3.223  -0.897   2.968
   96   1HB   ALA  15          1HB       ALA  15   5.652  -0.702   2.592
   97   2HB   ALA  15          2HB       ALA  15   5.531  -1.791   1.210
   98   3HB   ALA  15          3HB       ALA  15   5.205  -2.389   2.837
   99    H    ALA  16           H        ALA  16   3.523  -1.253  -0.517
  100    HA   ALA  16           HA       ALA  16   4.243   1.394  -1.205
  101   1HB   ALA  16          1HB       ALA  16   2.649  -0.690  -2.715
  102   2HB   ALA  16          2HB       ALA  16   4.396  -0.459  -2.764
  103   3HB   ALA  16          3HB       ALA  16   3.326   0.767  -3.442
  104    H    GLY  17           H        GLY  17   0.954  -0.043  -1.061
  105   1HA   GLY  17          1HA       GLY  17  -0.367   2.403  -1.775
  106   2HA   GLY  17          2HA       GLY  17  -1.129   1.025  -0.996
  107    H    SER  18           H        SER  18   0.442   0.944   1.320
  108    HA   SER  18           HA       SER  18  -0.938   2.771   3.013
  109   1HB   SER  18          1HB       SER  18  -0.188   0.543   3.702
  110   2HB   SER  18          2HB       SER  18   1.492   1.023   3.481
  111    HG   SER  18           HG       SER  18   0.014   2.713   5.068
  112    H    THR  19           H        THR  19   2.146   2.933   1.462
  113    HA   THR  19           HA       THR  19   3.207   5.094   3.186
  114    HB   THR  19           HB       THR  19   4.320   3.866   0.643
  115    HG1  THR  19           HG1      THR  19   3.912   2.553   2.682
  116   1HG2  THR  19          1HG2      THR  19   5.327   6.015   1.163
  117   2HG2  THR  19          2HG2      THR  19   6.473   4.738   1.577
  118   3HG2  THR  19          3HG2      THR  19   5.552   5.542   2.847
  119    H    MET  20           H        MET  20   1.967   4.619  -0.093
  120    HA   MET  20           HA       MET  20   2.401   7.375  -0.923
  121   1HB   MET  20          1HB       MET  20   0.781   5.094  -2.092
  122   2HB   MET  20          2HB       MET  20   1.031   6.643  -2.897
  123   1HG   MET  20          1HG       MET  20   3.315   4.877  -1.967
  124   2HG   MET  20          2HG       MET  20   2.637   4.804  -3.593
  125   1HE   MET  20          1HE       MET  20   5.264   5.019  -3.743
  126   2HE   MET  20          2HE       MET  20   5.897   6.540  -4.370
  127   3HE   MET  20          3HE       MET  20   4.570   5.736  -5.205
  128    H    GLY  21           H        GLY  21   0.040   5.789   0.955
  129   1HA   GLY  21          1HA       GLY  21  -2.185   7.596   0.286
  130   2HA   GLY  21          2HA       GLY  21  -2.178   6.378   1.562
  131    H    ALA  22           H        ALA  22   0.612   8.285   1.677
  132    HA   ALA  22           HA       ALA  22  -0.155   9.460   4.212
  133   1HB   ALA  22          1HB       ALA  22   2.049  10.612   4.050
  134   2HB   ALA  22          2HB       ALA  22   2.222  10.001   2.405
  135   3HB   ALA  22          3HB       ALA  22   2.177   8.877   3.763
  136    H    ALA  23           H        ALA  23  -0.085  10.593   0.877
  137    HA   ALA  23           HA       ALA  23  -0.409  13.395   1.507
  138   1HB   ALA  23          1HB       ALA  23   0.419  12.809  -0.676
  139   2HB   ALA  23          2HB       ALA  23  -1.170  13.538  -0.906
  140   3HB   ALA  23          3HB       ALA  23  -0.982  11.786  -0.992
  141    H    SER  24           H        SER  24  -2.818  11.660  -0.374
  142    HA   SER  24           HA       SER  24  -4.915  11.959   1.646
  143   1HB   SER  24          1HB       SER  24  -4.961  14.238   0.878
  144   2HB   SER  24          2HB       SER  24  -4.818  13.739  -0.805
  145    HG   SER  24           HG       SER  24  -7.003  14.287   0.201
  146    H    MET  25           H        MET  25  -3.517  10.204  -0.549
  147    HA   MET  25           HA       MET  25  -4.161   8.459  -1.982
  148   1HB   MET  25          1HB       MET  25  -5.288   7.833   0.211
  149   2HB   MET  25          2HB       MET  25  -6.765   8.557  -0.423
  150   1HG   MET  25          1HG       MET  25  -6.895   6.207  -0.899
  151   2HG   MET  25          2HG       MET  25  -6.528   7.001  -2.429
  152   1HE   MET  25          1HE       MET  25  -5.863   3.715  -1.544
  153   2HE   MET  25          2HE       MET  25  -4.657   3.723  -2.829
  154   3HE   MET  25          3HE       MET  25  -6.162   4.613  -3.038
  155    H    THR  26           H        THR  26  -4.274  10.338  -3.626
  156    HA   THR  26           HA       THR  26  -6.644  10.008  -5.228
  157    HB   THR  26           HB       THR  26  -7.729  11.511  -3.703
  158    HG1  THR  26           HG1      THR  26  -6.727  13.139  -5.790
  159   1HG2  THR  26          1HG2      THR  26  -5.224  13.198  -3.956
  160   2HG2  THR  26          2HG2      THR  26  -5.780  12.343  -2.516
  161   3HG2  THR  26          3HG2      THR  26  -6.695  13.719  -3.135
  162    H    LEU  27           H        LEU  27  -3.475  10.866  -4.764
  163    HA   LEU  27           HA       LEU  27  -2.992  12.811  -6.777
  164   1HB   LEU  27          1HB       LEU  27  -1.245  12.230  -5.207
  165   2HB   LEU  27          2HB       LEU  27  -1.269  10.548  -5.720
  166    HG   LEU  27           HG       LEU  27  -0.344  11.120  -7.890
  167   1HD1  LEU  27          1HD1      LEU  27  -1.370  13.195  -8.454
  168   2HD1  LEU  27          2HD1      LEU  27   0.337  13.581  -8.281
  169   3HD1  LEU  27          3HD1      LEU  27  -0.791  13.979  -6.984
  170   1HD2  LEU  27          1HD2      LEU  27   1.136  12.643  -5.723
  171   2HD2  LEU  27          2HD2      LEU  27   1.838  11.992  -7.204
  172   3HD2  LEU  27          3HD2      LEU  27   1.220  10.899  -5.965
  173    H    THR  28           H        THR  28  -2.956   9.239  -6.976
  174    HA   THR  28           HA       THR  28  -2.462   9.172  -9.815
  175    HB   THR  28           HB       THR  28  -3.027   6.815  -9.666
  176    HG1  THR  28           HG1      THR  28  -4.224   7.638  -7.245
  177   1HG2  THR  28          1HG2      THR  28  -1.552   6.134  -7.821
  178   2HG2  THR  28          2HG2      THR  28  -1.688   7.742  -7.109
  179   3HG2  THR  28          3HG2      THR  28  -0.882   7.531  -8.664
  180    H    VAL  29           H        VAL  29  -4.195  10.996 -10.101
  181    HA   VAL  29           HA       VAL  29  -6.975  10.384  -9.943
  182    HB   VAL  29           HB       VAL  29  -7.246  12.224 -11.617
  183   1HG1  VAL  29          1HG1      VAL  29  -6.986  12.708  -9.203
  184   2HG1  VAL  29          2HG1      VAL  29  -6.270  13.979 -10.194
  185   3HG1  VAL  29          3HG1      VAL  29  -5.236  12.781  -9.412
  186   1HG2  VAL  29          1HG2      VAL  29  -5.267  11.786 -12.995
  187   2HG2  VAL  29          2HG2      VAL  29  -4.210  12.121 -11.625
  188   3HG2  VAL  29          3HG2      VAL  29  -5.171  13.417 -12.332
  189    H    GLN  30           H        GLN  30  -4.636   8.912 -11.803
  190    HA   GLN  30           HA       GLN  30  -6.007   8.567 -14.305
  191   1HB   GLN  30          1HB       GLN  30  -4.016   6.715 -12.955
  192   2HB   GLN  30          2HB       GLN  30  -4.457   6.692 -14.662
  193   1HG   GLN  30          1HG       GLN  30  -3.232   9.088 -13.260
  194   2HG   GLN  30          2HG       GLN  30  -2.308   7.912 -14.195
  195   1HE2  GLN  30          1HE2      GLN  30  -3.516   7.504 -16.506
  196   2HE2  GLN  30          2HE2      GLN  30  -3.915   8.935 -17.326
  197    H    ALA  31           H        ALA  31  -7.579   7.100 -14.893
  198    HA   ALA  31           HA       ALA  31  -9.160   5.849 -12.850
  199   1HB   ALA  31          1HB       ALA  31  -9.094   5.321 -15.838
  200   2HB   ALA  31          2HB       ALA  31 -10.106   6.516 -15.025
  201   3HB   ALA  31          3HB       ALA  31 -10.367   4.795 -14.736
  Start of MODEL   15
    1    H    ALA   2           H        ALA   2  -5.926 -22.655   0.195
    2    HA   ALA   2           HA       ALA   2  -4.241 -20.814   1.088
    3   1HB   ALA   2          1HB       ALA   2  -4.418 -23.734   1.894
    4   2HB   ALA   2          2HB       ALA   2  -5.417 -22.412   2.500
    5   3HB   ALA   2          3HB       ALA   2  -3.698 -22.469   2.892
    6    H    VAL   3           H        VAL   3  -1.961 -21.106   1.965
    7    HA   VAL   3           HA       VAL   3   0.312 -21.330   1.566
    8    HB   VAL   3           HB       VAL   3  -0.376 -23.829  -0.002
    9   1HG1  VAL   3          1HG1      VAL   3   1.801 -24.585   0.796
   10   2HG1  VAL   3          2HG1      VAL   3   1.994 -23.109   1.741
   11   3HG1  VAL   3          3HG1      VAL   3   1.982 -23.032  -0.020
   12   1HG2  VAL   3          1HG2      VAL   3  -0.160 -23.435   2.998
   13   2HG2  VAL   3          2HG2      VAL   3  -0.211 -25.006   2.198
   14   3HG2  VAL   3          3HG2      VAL   3  -1.602 -23.926   2.109
   15    H    GLY   4           H        GLY   4   1.436 -20.139   0.197
   16   1HA   GLY   4          1HA       GLY   4   1.795 -20.570  -2.526
   17   2HA   GLY   4          2HA       GLY   4   0.488 -19.404  -2.415
   18    H    ILE   5           H        ILE   5   3.267 -19.106  -3.415
   19    HA   ILE   5           HA       ILE   5   4.763 -17.470  -1.564
   20    HB   ILE   5           HB       ILE   5   4.938 -17.405  -4.589
   21   1HG1  ILE   5          1HG1      ILE   5   4.953 -19.748  -3.999
   22   2HG1  ILE   5          2HG1      ILE   5   6.615 -19.272  -4.326
   23   1HG2  ILE   5          1HG2      ILE   5   7.341 -16.988  -4.105
   24   2HG2  ILE   5          2HG2      ILE   5   6.973 -16.992  -2.381
   25   3HG2  ILE   5          3HG2      ILE   5   6.294 -15.743  -3.425
   26   1HD1  ILE   5          1HD1      ILE   5   5.308 -19.796  -1.651
   27   2HD1  ILE   5          2HD1      ILE   5   6.813 -18.885  -1.769
   28   3HD1  ILE   5          3HD1      ILE   5   6.744 -20.552  -2.334
   29    H    GLY   6           H        GLY   6   1.960 -16.991  -3.430
   30   1HA   GLY   6          1HA       GLY   6   1.999 -14.293  -4.187
   31   2HA   GLY   6          2HA       GLY   6   0.544 -15.108  -3.590
   32    H    ALA   7           H        ALA   7   1.859 -15.737  -1.034
   33    HA   ALA   7           HA       ALA   7   0.996 -13.569   0.579
   34   1HB   ALA   7          1HB       ALA   7   1.262 -15.903   1.358
   35   2HB   ALA   7          2HB       ALA   7   2.195 -14.799   2.370
   36   3HB   ALA   7          3HB       ALA   7   3.008 -15.774   1.146
   37    H    LEU   8           H        LEU   8   4.111 -14.323  -0.852
   38    HA   LEU   8           HA       LEU   8   5.626 -12.423   0.751
   39   1HB   LEU   8          1HB       LEU   8   6.765 -14.351  -0.164
   40   2HB   LEU   8          2HB       LEU   8   6.257 -13.941  -1.797
   41    HG   LEU   8           HG       LEU   8   7.684 -11.974  -1.820
   42   1HD1  LEU   8          1HD1      LEU   8   7.549 -11.099   0.390
   43   2HD1  LEU   8          2HD1      LEU   8   9.225 -11.606   0.223
   44   3HD1  LEU   8          3HD1      LEU   8   8.085 -12.614   1.116
   45   1HD2  LEU   8          1HD2      LEU   8   8.721 -14.175  -2.318
   46   2HD2  LEU   8          2HD2      LEU   8   9.183 -14.323  -0.623
   47   3HD2  LEU   8          3HD2      LEU   8   9.880 -13.045  -1.618
   48    H    PHE   9           H        PHE   9   4.408 -12.402  -2.662
   49    HA   PHE   9           HA       PHE   9   5.380  -9.725  -3.140
   50   1HB   PHE   9          1HB       PHE   9   4.443 -11.397  -4.910
   51   2HB   PHE   9          2HB       PHE   9   2.852 -10.802  -4.448
   52    HD1  PHE   9           HD1      PHE   9   6.260  -9.526  -5.380
   53    HD2  PHE   9           HD2      PHE   9   2.011  -8.907  -5.627
   54    HE1  PHE   9           HE1      PHE   9   6.626  -7.583  -6.873
   55    HE2  PHE   9           HE2      PHE   9   2.384  -6.965  -7.119
   56    HZ   PHE   9           HZ       PHE   9   4.690  -6.304  -7.742
   57    H    LEU  10           H        LEU  10   2.162 -10.951  -1.984
   58    HA   LEU  10           HA       LEU  10   0.947  -8.411  -1.763
   59   1HB   LEU  10          1HB       LEU  10   0.579 -10.865  -0.024
   60   2HB   LEU  10          2HB       LEU  10  -0.516  -9.488  -0.043
   61    HG   LEU  10           HG       LEU  10   0.143 -10.982  -2.607
   62   1HD1  LEU  10          1HD1      LEU  10  -2.047 -11.651  -0.616
   63   2HD1  LEU  10          2HD1      LEU  10  -0.672 -12.673  -1.037
   64   3HD1  LEU  10          3HD1      LEU  10  -1.914 -12.325  -2.241
   65   1HD2  LEU  10          1HD2      LEU  10  -2.202  -9.270  -1.688
   66   2HD2  LEU  10          2HD2      LEU  10  -2.175 -10.164  -3.207
   67   3HD2  LEU  10          3HD2      LEU  10  -1.021  -8.867  -2.933
   68    H    GLY  11           H        GLY  11   2.939 -10.150   0.613
   69   1HA   GLY  11          1HA       GLY  11   2.643  -8.417   2.794
   70   2HA   GLY  11          2HA       GLY  11   4.112  -9.330   2.468
   71    H    PHE  12           H        PHE  12   4.996  -8.074   0.091
   72    HA   PHE  12           HA       PHE  12   5.941  -5.507   1.224
   73   1HB   PHE  12          1HB       PHE  12   7.518  -7.096   0.124
   74   2HB   PHE  12          2HB       PHE  12   6.689  -6.813  -1.405
   75    HD1  PHE  12           HD1      PHE  12   8.895  -5.348   1.159
   76    HD2  PHE  12           HD2      PHE  12   6.838  -4.635  -2.546
   77    HE1  PHE  12           HE1      PHE  12  10.248  -3.301   0.801
   78    HE2  PHE  12           HE2      PHE  12   8.193  -2.589  -2.902
   79    HZ   PHE  12           HZ       PHE  12   9.897  -1.922  -1.230
   80    H    LEU  13           H        LEU  13   3.953  -6.550  -1.552
   81    HA   LEU  13           HA       LEU  13   3.886  -3.967  -2.801
   82   1HB   LEU  13          1HB       LEU  13   3.021  -6.433  -3.545
   83   2HB   LEU  13          2HB       LEU  13   1.483  -5.765  -3.036
   84    HG   LEU  13           HG       LEU  13   1.756  -5.390  -5.413
   85   1HD1  LEU  13          1HD1      LEU  13   2.310  -2.719  -4.117
   86   2HD1  LEU  13          2HD1      LEU  13   0.767  -3.561  -3.944
   87   3HD1  LEU  13          3HD1      LEU  13   1.327  -3.062  -5.538
   88   1HD2  LEU  13          1HD2      LEU  13   4.424  -5.353  -5.120
   89   2HD2  LEU  13          2HD2      LEU  13   4.167  -3.610  -5.093
   90   3HD2  LEU  13          3HD2      LEU  13   3.636  -4.558  -6.477
   91    H    GLY  14           H        GLY  14   2.460  -5.159   0.073
   92   1HA   GLY  14          1HA       GLY  14   0.138  -3.423   0.131
   93   2HA   GLY  14          2HA       GLY  14   0.819  -4.285   1.510
   94    H    ALA  15           H        ALA  15   3.421  -3.215   1.446
   95    HA   ALA  15           HA       ALA  15   3.215  -0.881   3.003
   96   1HB   ALA  15          1HB       ALA  15   5.486  -1.911   1.270
   97   2HB   ALA  15          2HB       ALA  15   5.200  -2.305   2.966
   98   3HB   ALA  15          3HB       ALA  15   5.666  -0.666   2.508
   99    H    ALA  16           H        ALA  16   3.518  -1.266  -0.479
  100    HA   ALA  16           HA       ALA  16   4.238   1.374  -1.191
  101   1HB   ALA  16          1HB       ALA  16   2.561  -0.616  -2.739
  102   2HB   ALA  16          2HB       ALA  16   4.323  -0.611  -2.674
  103   3HB   ALA  16          3HB       ALA  16   3.464   0.737  -3.420
  104    H    GLY  17           H        GLY  17   0.951  -0.067  -1.029
  105   1HA   GLY  17          1HA       GLY  17  -0.377   2.368  -1.758
  106   2HA   GLY  17          2HA       GLY  17  -1.133   0.996  -0.963
  107    H    SER  18           H        SER  18   0.447   0.933   1.340
  108    HA   SER  18           HA       SER  18  -0.912   2.777   3.032
  109   1HB   SER  18          1HB       SER  18  -0.209   0.574   3.773
  110   2HB   SER  18          2HB       SER  18   1.478   0.968   3.459
  111    HG   SER  18           HG       SER  18   0.483   2.866   5.007
  112    H    THR  19           H        THR  19   2.170   2.908   1.465
  113    HA   THR  19           HA       THR  19   3.245   5.076   3.172
  114    HB   THR  19           HB       THR  19   4.355   3.836   0.634
  115    HG1  THR  19           HG1      THR  19   4.143   2.922   3.186
  116   1HG2  THR  19          1HG2      THR  19   5.598   5.479   2.855
  117   2HG2  THR  19          2HG2      THR  19   5.375   5.978   1.177
  118   3HG2  THR  19          3HG2      THR  19   6.509   4.684   1.571
  119    H    MET  20           H        MET  20   2.021   4.574  -0.107
  120    HA   MET  20           HA       MET  20   2.456   7.326  -0.958
  121   1HB   MET  20          1HB       MET  20   0.842   5.040  -2.126
  122   2HB   MET  20          2HB       MET  20   1.125   6.578  -2.942
  123   1HG   MET  20          1HG       MET  20   3.535   6.198  -2.908
  124   2HG   MET  20          2HG       MET  20   3.316   4.715  -1.979
  125   1HE   MET  20          1HE       MET  20   4.697   3.245  -3.902
  126   2HE   MET  20          2HE       MET  20   4.992   4.918  -4.363
  127   3HE   MET  20          3HE       MET  20   4.522   3.745  -5.589
  128    H    GLY  21           H        GLY  21   0.507   6.313   1.360
  129   1HA   GLY  21          1HA       GLY  21  -2.079   7.381   0.548
  130   2HA   GLY  21          2HA       GLY  21  -1.608   6.947   2.191
  131    H    ALA  22           H        ALA  22   0.841   8.699   1.945
  132    HA   ALA  22           HA       ALA  22  -0.349  11.103   3.028
  133   1HB   ALA  22          1HB       ALA  22   2.495  10.585   2.107
  134   2HB   ALA  22          2HB       ALA  22   1.878  10.302   3.735
  135   3HB   ALA  22          3HB       ALA  22   1.970  11.945   3.098
  136    H    ALA  23           H        ALA  23   1.168  10.284  -0.087
  137    HA   ALA  23           HA       ALA  23   0.937  12.967  -1.162
  138   1HB   ALA  23          1HB       ALA  23   2.538  11.269  -2.037
  139   2HB   ALA  23          2HB       ALA  23   1.503  11.928  -3.302
  140   3HB   ALA  23          3HB       ALA  23   1.174  10.328  -2.637
  141    H    SER  24           H        SER  24  -1.465  11.135  -0.147
  142    HA   SER  24           HA       SER  24  -3.421  12.329  -1.978
  143   1HB   SER  24          1HB       SER  24  -2.719  10.242  -3.173
  144   2HB   SER  24          2HB       SER  24  -3.231   9.308  -1.770
  145    HG   SER  24           HG       SER  24  -5.106   9.360  -2.722
  146    H    MET  25           H        MET  25  -2.953  12.656   0.781
  147    HA   MET  25           HA       MET  25  -4.034  12.557   2.865
  148   1HB   MET  25          1HB       MET  25  -6.388  12.172   0.992
  149   2HB   MET  25          2HB       MET  25  -6.531  12.545   2.708
  150   1HG   MET  25          1HG       MET  25  -5.316  14.640   2.392
  151   2HG   MET  25          2HG       MET  25  -5.049  14.257   0.692
  152   1HE   MET  25          1HE       MET  25  -7.564  17.223   0.667
  153   2HE   MET  25          2HE       MET  25  -6.161  16.548  -0.157
  154   3HE   MET  25          3HE       MET  25  -6.084  16.876   1.572
  155    H    THR  26           H        THR  26  -6.527  10.434   1.674
  156    HA   THR  26           HA       THR  26  -5.205   7.947   2.408
  157    HB   THR  26           HB       THR  26  -7.416   8.898   4.262
  158    HG1  THR  26           HG1      THR  26  -5.951   9.815   5.427
  159   1HG2  THR  26          1HG2      THR  26  -7.187   6.467   4.083
  160   2HG2  THR  26          2HG2      THR  26  -6.594   7.006   5.653
  161   3HG2  THR  26          3HG2      THR  26  -5.453   6.588   4.375
  162    H    LEU  27           H        LEU  27  -6.243   8.112   0.081
  163    HA   LEU  27           HA       LEU  27  -9.133   7.752  -0.077
  164   1HB   LEU  27          1HB       LEU  27  -7.119   6.962  -2.204
  165   2HB   LEU  27          2HB       LEU  27  -8.795   7.460  -2.424
  166    HG   LEU  27           HG       LEU  27  -6.501   9.210  -1.482
  167   1HD1  LEU  27          1HD1      LEU  27  -6.442   8.779  -3.874
  168   2HD1  LEU  27          2HD1      LEU  27  -7.013  10.426  -3.609
  169   3HD1  LEU  27          3HD1      LEU  27  -8.160   9.152  -4.020
  170   1HD2  LEU  27          1HD2      LEU  27  -8.295  11.044  -1.735
  171   2HD2  LEU  27          2HD2      LEU  27  -8.445  10.002  -0.326
  172   3HD2  LEU  27          3HD2      LEU  27  -9.483   9.738  -1.728
  173    H    THR  28           H        THR  28  -9.394   5.561  -1.792
  174    HA   THR  28           HA       THR  28  -8.109   3.186  -0.795
  175    HB   THR  28           HB       THR  28  -9.361   3.502   1.229
  176    HG1  THR  28           HG1      THR  28 -11.245   1.863   0.237
  177   1HG2  THR  28          1HG2      THR  28 -10.929   5.191   0.459
  178   2HG2  THR  28          2HG2      THR  28 -11.837   3.850   1.158
  179   3HG2  THR  28          3HG2      THR  28 -11.724   4.022  -0.593
  180    H    VAL  29           H        VAL  29  -8.665   1.400  -2.083
  181    HA   VAL  29           HA       VAL  29  -9.948   1.971  -4.592
  182    HB   VAL  29           HB       VAL  29  -9.747  -0.489  -4.979
  183   1HG1  VAL  29          1HG1      VAL  29  -7.330   0.888  -3.770
  184   2HG1  VAL  29          2HG1      VAL  29  -7.842   0.964  -5.455
  185   3HG1  VAL  29          3HG1      VAL  29  -7.263  -0.556  -4.777
  186   1HG2  VAL  29          1HG2      VAL  29  -8.764  -0.458  -2.104
  187   2HG2  VAL  29          2HG2      VAL  29  -8.595  -1.824  -3.204
  188   3HG2  VAL  29          3HG2      VAL  29 -10.199  -1.286  -2.710
  189    H    GLN  30           H        GLN  30 -11.639  -0.099  -5.165
  190    HA   GLN  30           HA       GLN  30 -13.649  -0.545  -3.128
  191   1HB   GLN  30          1HB       GLN  30 -14.009   1.893  -3.691
  192   2HB   GLN  30          2HB       GLN  30 -14.399   1.398  -5.338
  193   1HG   GLN  30          1HG       GLN  30 -16.232  -0.023  -4.472
  194   2HG   GLN  30          2HG       GLN  30 -15.850   0.499  -2.830
  195   1HE2  GLN  30          1HE2      GLN  30 -15.194   3.298  -3.881
  196   2HE2  GLN  30          2HE2      GLN  30 -16.709   4.012  -4.149
  197    H    ALA  31           H        ALA  31 -13.493  -0.050  -6.680
  198    HA   ALA  31           HA       ALA  31 -15.241  -2.248  -7.268
  199   1HB   ALA  31          1HB       ALA  31 -14.773  -0.421  -8.877
  200   2HB   ALA  31          2HB       ALA  31 -14.430  -2.002  -9.581
  201   3HB   ALA  31          3HB       ALA  31 -13.108  -0.982  -9.017
  Start of MODEL   16
    1    H    ALA   2           H        ALA   2   0.245 -26.636  -2.930
    2    HA   ALA   2           HA       ALA   2   1.163 -24.393  -4.046
    3   1HB   ALA   2          1HB       ALA   2  -0.585 -25.802  -4.994
    4   2HB   ALA   2          2HB       ALA   2  -1.170 -24.140  -4.928
    5   3HB   ALA   2          3HB       ALA   2  -1.711 -25.313  -3.727
    6    H    VAL   3           H        VAL   3  -0.038 -22.220  -4.209
    7    HA   VAL   3           HA       VAL   3  -0.544 -20.178  -3.220
    8    HB   VAL   3           HB       VAL   3  -1.909 -21.797  -1.057
    9   1HG1  VAL   3          1HG1      VAL   3  -2.556 -19.102  -2.279
   10   2HG1  VAL   3          2HG1      VAL   3  -1.715 -19.329  -0.744
   11   3HG1  VAL   3          3HG1      VAL   3  -3.386 -19.864  -0.923
   12   1HG2  VAL   3          1HG2      VAL   3  -2.895 -21.047  -3.825
   13   2HG2  VAL   3          2HG2      VAL   3  -3.917 -21.692  -2.542
   14   3HG2  VAL   3          3HG2      VAL   3  -2.624 -22.680  -3.220
   15    H    GLY   4           H        GLY   4   1.103 -19.122  -2.378
   16   1HA   GLY   4          1HA       GLY   4   1.710 -19.003   0.343
   17   2HA   GLY   4          2HA       GLY   4   2.871 -20.126  -0.338
   18    H    ILE   5           H        ILE   5   3.396 -18.930  -2.815
   19    HA   ILE   5           HA       ILE   5   5.222 -16.853  -2.064
   20    HB   ILE   5           HB       ILE   5   4.231 -17.464  -4.861
   21   1HG1  ILE   5          1HG1      ILE   5   4.773 -19.603  -3.870
   22   2HG1  ILE   5          2HG1      ILE   5   6.106 -19.147  -4.925
   23   1HG2  ILE   5          1HG2      ILE   5   6.900 -16.501  -3.792
   24   2HG2  ILE   5          2HG2      ILE   5   5.707 -15.510  -4.631
   25   3HG2  ILE   5          3HG2      ILE   5   6.527 -16.814  -5.487
   26   1HD1  ILE   5          1HD1      ILE   5   6.005 -19.104  -1.905
   27   2HD1  ILE   5          2HD1      ILE   5   7.209 -18.163  -2.788
   28   3HD1  ILE   5          3HD1      ILE   5   7.165 -19.917  -2.954
   29    H    GLY   6           H        GLY   6   1.953 -16.821  -3.365
   30   1HA   GLY   6          1HA       GLY   6   1.756 -14.106  -4.158
   31   2HA   GLY   6          2HA       GLY   6   0.409 -15.032  -3.478
   32    H    ALA   7           H        ALA   7   1.718 -15.609  -0.979
   33    HA   ALA   7           HA       ALA   7   0.917 -13.417   0.639
   34   1HB   ALA   7          1HB       ALA   7   2.956 -15.549   1.385
   35   2HB   ALA   7          2HB       ALA   7   1.231 -15.888   1.260
   36   3HB   ALA   7          3HB       ALA   7   1.814 -14.720   2.444
   37    H    LEU   8           H        LEU   8   4.026 -14.262  -0.770
   38    HA   LEU   8           HA       LEU   8   5.581 -12.390   0.840
   39   1HB   LEU   8          1HB       LEU   8   6.143 -14.084  -1.604
   40   2HB   LEU   8          2HB       LEU   8   7.326 -12.902  -1.050
   41    HG   LEU   8           HG       LEU   8   7.469 -13.984   1.125
   42   1HD1  LEU   8          1HD1      LEU   8   5.230 -15.726   0.059
   43   2HD1  LEU   8          2HD1      LEU   8   5.237 -14.745   1.523
   44   3HD1  LEU   8          3HD1      LEU   8   6.223 -16.202   1.438
   45   1HD2  LEU   8          1HD2      LEU   8   8.864 -14.877  -0.710
   46   2HD2  LEU   8          2HD2      LEU   8   7.583 -16.012  -1.133
   47   3HD2  LEU   8          3HD2      LEU   8   8.413 -16.155   0.416
   48    H    PHE   9           H        PHE   9   4.412 -12.370  -2.590
   49    HA   PHE   9           HA       PHE   9   5.435  -9.701  -3.038
   50   1HB   PHE   9          1HB       PHE   9   4.491 -11.390  -4.826
   51   2HB   PHE   9          2HB       PHE   9   2.926 -10.690  -4.441
   52    HD1  PHE   9           HD1      PHE   9   6.441  -9.681  -5.283
   53    HD2  PHE   9           HD2      PHE   9   2.260  -8.735  -5.641
   54    HE1  PHE   9           HE1      PHE   9   6.994  -7.789  -6.786
   55    HE2  PHE   9           HE2      PHE   9   2.821  -6.846  -7.142
   56    HZ   PHE   9           HZ       PHE   9   5.185  -6.372  -7.716
   57    H    LEU  10           H        LEU  10   2.181 -10.913  -1.949
   58    HA   LEU  10           HA       LEU  10   0.969  -8.377  -1.763
   59   1HB   LEU  10          1HB       LEU  10  -0.330 -10.409  -1.521
   60   2HB   LEU  10          2HB       LEU  10   0.589 -10.886  -0.099
   61    HG   LEU  10           HG       LEU  10  -0.346  -9.048   1.197
   62   1HD1  LEU  10          1HD1      LEU  10  -1.509  -8.188  -1.468
   63   2HD1  LEU  10          2HD1      LEU  10  -0.536  -7.242  -0.342
   64   3HD1  LEU  10          3HD1      LEU  10  -2.200  -7.641   0.061
   65   1HD2  LEU  10          1HD2      LEU  10  -2.712  -9.714   1.188
   66   2HD2  LEU  10          2HD2      LEU  10  -1.677 -11.127   0.988
   67   3HD2  LEU  10          3HD2      LEU  10  -2.514 -10.443  -0.406
   68    H    GLY  11           H        GLY  11   2.943 -10.119   0.635
   69   1HA   GLY  11          1HA       GLY  11   2.676  -8.372   2.809
   70   2HA   GLY  11          2HA       GLY  11   4.138  -9.298   2.479
   71    H    PHE  12           H        PHE  12   4.996  -8.070   0.081
   72    HA   PHE  12           HA       PHE  12   5.965  -5.491   1.167
   73   1HB   PHE  12          1HB       PHE  12   7.533  -7.106   0.094
   74   2HB   PHE  12          2HB       PHE  12   6.699  -6.853  -1.437
   75    HD1  PHE  12           HD1      PHE  12   6.885  -4.724  -2.646
   76    HD2  PHE  12           HD2      PHE  12   8.883  -5.318   1.113
   77    HE1  PHE  12           HE1      PHE  12   8.244  -2.689  -3.046
   78    HE2  PHE  12           HE2      PHE  12  10.241  -3.282   0.710
   79    HZ   PHE  12           HZ       PHE  12   9.922  -1.968  -1.368
   80    H    LEU  13           H        LEU  13   3.958  -6.596  -1.572
   81    HA   LEU  13           HA       LEU  13   3.875  -4.030  -2.863
   82   1HB   LEU  13          1HB       LEU  13   3.038  -6.509  -3.589
   83   2HB   LEU  13          2HB       LEU  13   1.492  -5.858  -3.084
   84    HG   LEU  13           HG       LEU  13   1.761  -5.494  -5.463
   85   1HD1  LEU  13          1HD1      LEU  13   1.290  -3.175  -5.596
   86   2HD1  LEU  13          2HD1      LEU  13   2.287  -2.803  -4.193
   87   3HD1  LEU  13          3HD1      LEU  13   0.757  -3.664  -3.987
   88   1HD2  LEU  13          1HD2      LEU  13   3.638  -4.668  -6.529
   89   2HD2  LEU  13          2HD2      LEU  13   4.437  -5.408  -5.149
   90   3HD2  LEU  13          3HD2      LEU  13   4.141  -3.671  -5.168
   91    H    GLY  14           H        GLY  14   2.397  -5.245  -0.010
   92   1HA   GLY  14          1HA       GLY  14   0.096  -3.481   0.034
   93   2HA   GLY  14          2HA       GLY  14   0.750  -4.356   1.418
   94    H    ALA  15           H        ALA  15   3.368  -3.333   1.367
   95    HA   ALA  15           HA       ALA  15   3.206  -1.005   2.933
   96   1HB   ALA  15          1HB       ALA  15   5.644  -0.850   2.505
   97   2HB   ALA  15          2HB       ALA  15   5.474  -1.986   1.167
   98   3HB   ALA  15          3HB       ALA  15   5.158  -2.517   2.818
   99    H    ALA  16           H        ALA  16   3.463  -1.386  -0.550
  100    HA   ALA  16           HA       ALA  16   4.228   1.240  -1.265
  101   1HB   ALA  16          1HB       ALA  16   2.538  -0.779  -2.760
  102   2HB   ALA  16          2HB       ALA  16   4.299  -0.672  -2.790
  103   3HB   ALA  16          3HB       ALA  16   3.324   0.623  -3.486
  104    H    GLY  17           H        GLY  17   0.912  -0.130  -1.062
  105   1HA   GLY  17          1HA       GLY  17  -0.365   2.344  -1.760
  106   2HA   GLY  17          2HA       GLY  17  -1.147   0.977  -0.983
  107    H    SER  18           H        SER  18   0.424   0.846   1.324
  108    HA   SER  18           HA       SER  18  -0.902   2.695   3.033
  109   1HB   SER  18          1HB       SER  18   0.342   1.577   4.771
  110   2HB   SER  18          2HB       SER  18  -0.087   0.369   3.563
  111    HG   SER  18           HG       SER  18   2.094   0.179   4.088
  112    H    THR  19           H        THR  19   2.190   2.784   1.486
  113    HA   THR  19           HA       THR  19   3.277   4.942   3.208
  114    HB   THR  19           HB       THR  19   5.200   4.731   1.506
  115    HG1  THR  19           HG1      THR  19   4.929   3.420  -0.098
  116   1HG2  THR  19          1HG2      THR  19   4.293   2.371   3.178
  117   2HG2  THR  19          2HG2      THR  19   5.436   3.635   3.628
  118   3HG2  THR  19          3HG2      THR  19   5.874   2.448   2.400
  119    H    MET  20           H        MET  20   2.037   4.443  -0.065
  120    HA   MET  20           HA       MET  20   2.504   7.190  -0.915
  121   1HB   MET  20          1HB       MET  20   2.441   5.153  -2.418
  122   2HB   MET  20          2HB       MET  20   0.700   5.091  -2.158
  123   1HG   MET  20          1HG       MET  20   2.047   7.604  -3.194
  124   2HG   MET  20          2HG       MET  20   1.529   6.318  -4.278
  125   1HE   MET  20          1HE       MET  20   0.351   8.430  -5.322
  126   2HE   MET  20          2HE       MET  20   0.527   9.535  -3.960
  127   3HE   MET  20          3HE       MET  20  -1.070   9.235  -4.641
  128    H    GLY  21           H        GLY  21  -0.182   5.360   0.426
  129   1HA   GLY  21          1HA       GLY  21  -2.188   7.403  -0.054
  130   2HA   GLY  21          2HA       GLY  21  -2.357   6.026   1.038
  131    H    ALA  22           H        ALA  22   0.491   7.620   1.770
  132    HA   ALA  22           HA       ALA  22  -0.547   8.587   4.297
  133   1HB   ALA  22          1HB       ALA  22   1.798   7.788   3.972
  134   2HB   ALA  22          2HB       ALA  22   1.722   9.401   4.681
  135   3HB   ALA  22          3HB       ALA  22   2.112   9.206   2.972
  136    H    ALA  23           H        ALA  23   0.365  10.121   1.229
  137    HA   ALA  23           HA       ALA  23  -0.038  12.832   2.191
  138   1HB   ALA  23          1HB       ALA  23   1.386  12.254   0.220
  139   2HB   ALA  23          2HB       ALA  23   0.161  13.466  -0.155
  140   3HB   ALA  23          3HB       ALA  23  -0.073  11.792  -0.657
  141    H    SER  24           H        SER  24  -2.252  10.659   2.330
  142    HA   SER  24           HA       SER  24  -4.461  12.500   1.737
  143   1HB   SER  24          1HB       SER  24  -4.195   9.873   0.239
  144   2HB   SER  24          2HB       SER  24  -5.637  10.885   0.252
  145    HG   SER  24           HG       SER  24  -4.294  11.307  -1.557
  146    H    MET  25           H        MET  25  -3.769  11.643   4.190
  147    HA   MET  25           HA       MET  25  -4.556  10.525   6.086
  148   1HB   MET  25          1HB       MET  25  -6.685  11.596   5.092
  149   2HB   MET  25          2HB       MET  25  -7.078   9.993   4.480
  150   1HG   MET  25          1HG       MET  25  -7.009   9.090   6.775
  151   2HG   MET  25          2HG       MET  25  -6.565  10.679   7.394
  152   1HE   MET  25          1HE       MET  25  -8.563  10.955   9.056
  153   2HE   MET  25          2HE       MET  25  -8.754   9.247   8.673
  154   3HE   MET  25          3HE       MET  25 -10.165  10.302   8.691
  155    H    THR  26           H        THR  26  -6.758   8.288   5.074
  156    HA   THR  26           HA       THR  26  -5.110   6.257   3.888
  157    HB   THR  26           HB       THR  26  -3.901   6.097   5.936
  158    HG1  THR  26           HG1      THR  26  -5.719   4.210   5.302
  159   1HG2  THR  26          1HG2      THR  26  -5.104   5.947   8.138
  160   2HG2  THR  26          2HG2      THR  26  -6.600   6.335   7.292
  161   3HG2  THR  26          3HG2      THR  26  -5.283   7.505   7.336
  162    H    LEU  27           H        LEU  27  -7.437   6.724   2.946
  163    HA   LEU  27           HA       LEU  27  -9.712   5.615   4.317
  164   1HB   LEU  27          1HB       LEU  27  -9.406   5.768   1.302
  165   2HB   LEU  27          2HB       LEU  27 -10.887   5.882   2.252
  166    HG   LEU  27           HG       LEU  27  -8.630   7.912   2.182
  167   1HD1  LEU  27          1HD1      LEU  27 -10.319   9.356   1.136
  168   2HD1  LEU  27          2HD1      LEU  27 -11.511   8.060   1.241
  169   3HD1  LEU  27          3HD1      LEU  27 -10.104   7.884   0.191
  170   1HD2  LEU  27          1HD2      LEU  27 -10.325   9.276   3.565
  171   2HD2  LEU  27          2HD2      LEU  27  -9.506   7.969   4.412
  172   3HD2  LEU  27          3HD2      LEU  27 -11.164   7.750   3.850
  173    H    THR  28           H        THR  28 -10.748   3.568   3.937
  174    HA   THR  28           HA       THR  28  -9.001   1.327   3.852
  175    HB   THR  28           HB       THR  28 -11.070  -0.022   3.605
  176    HG1  THR  28           HG1      THR  28 -12.019   1.632   2.168
  177   1HG2  THR  28          1HG2      THR  28 -10.477   0.805   5.824
  178   2HG2  THR  28          2HG2      THR  28 -12.229   0.855   5.626
  179   3HG2  THR  28          3HG2      THR  28 -11.284   2.338   5.494
  180    H    VAL  29           H        VAL  29  -9.118  -0.444   2.155
  181    HA   VAL  29           HA       VAL  29  -8.366   0.592  -0.405
  182    HB   VAL  29           HB       VAL  29  -9.287  -2.224   0.247
  183   1HG1  VAL  29          1HG1      VAL  29  -7.511  -1.066  -1.922
  184   2HG1  VAL  29          2HG1      VAL  29  -9.089  -1.820  -2.146
  185   3HG1  VAL  29          3HG1      VAL  29  -7.715  -2.791  -1.620
  186   1HG2  VAL  29          1HG2      VAL  29  -6.847  -2.647   0.618
  187   2HG2  VAL  29          2HG2      VAL  29  -7.539  -1.549   1.811
  188   3HG2  VAL  29          3HG2      VAL  29  -6.561  -0.911   0.490
  189    H    GLN  30           H        GLN  30  -9.633   1.193  -2.101
  190    HA   GLN  30           HA       GLN  30 -12.493   1.237  -1.893
  191   1HB   GLN  30          1HB       GLN  30 -10.661   1.592  -4.287
  192   2HB   GLN  30          2HB       GLN  30 -12.398   1.886  -4.327
  193   1HG   GLN  30          1HG       GLN  30 -11.305   4.006  -3.942
  194   2HG   GLN  30          2HG       GLN  30 -12.089   3.531  -2.438
  195   1HE2  GLN  30          1HE2      GLN  30  -8.969   2.412  -3.857
  196   2HE2  GLN  30          2HE2      GLN  30  -8.027   2.871  -2.522
  197    H    ALA  31           H        ALA  31 -10.880  -0.285  -4.665
  198    HA   ALA  31           HA       ALA  31 -12.963  -2.240  -4.972
  199   1HB   ALA  31          1HB       ALA  31 -11.496  -3.246  -6.656
  200   2HB   ALA  31          2HB       ALA  31 -10.127  -2.310  -6.052
  201   3HB   ALA  31          3HB       ALA  31 -11.483  -1.491  -6.828
  Start of MODEL   17
    1    H    ALA   2           H        ALA   2   1.175 -17.939   3.744
    2    HA   ALA   2           HA       ALA   2   0.960 -20.129   2.873
    3   1HB   ALA   2          1HB       ALA   2  -1.115 -20.796   3.942
    4   2HB   ALA   2          2HB       ALA   2  -1.763 -19.162   3.793
    5   3HB   ALA   2          3HB       ALA   2  -0.410 -19.479   4.878
    6    H    VAL   3           H        VAL   3  -0.893 -21.590   1.841
    7    HA   VAL   3           HA       VAL   3  -2.009 -22.224  -0.090
    8    HB   VAL   3           HB       VAL   3  -2.678 -19.297  -0.502
    9   1HG1  VAL   3          1HG1      VAL   3  -4.106 -21.875  -1.212
   10   2HG1  VAL   3          2HG1      VAL   3  -3.271 -20.811  -2.344
   11   3HG1  VAL   3          3HG1      VAL   3  -4.723 -20.250  -1.514
   12   1HG2  VAL   3          1HG2      VAL   3  -3.217 -19.857   1.811
   13   2HG2  VAL   3          2HG2      VAL   3  -3.982 -21.361   1.302
   14   3HG2  VAL   3          3HG2      VAL   3  -4.713 -19.813   0.877
   15    H    GLY   4           H        GLY   4   0.388 -19.734  -0.298
   16   1HA   GLY   4          1HA       GLY   4   1.741 -20.886  -2.425
   17   2HA   GLY   4          2HA       GLY   4   0.680 -19.691  -3.149
   18    H    ILE   5           H        ILE   5   3.224 -19.214  -3.550
   19    HA   ILE   5           HA       ILE   5   4.596 -17.706  -1.509
   20    HB   ILE   5           HB       ILE   5   5.031 -17.480  -4.505
   21   1HG1  ILE   5          1HG1      ILE   5   6.020 -19.642  -2.605
   22   2HG1  ILE   5          2HG1      ILE   5   4.901 -19.876  -3.945
   23   1HG2  ILE   5          1HG2      ILE   5   6.273 -15.965  -2.883
   24   2HG2  ILE   5          2HG2      ILE   5   7.307 -16.963  -3.897
   25   3HG2  ILE   5          3HG2      ILE   5   7.022 -17.415  -2.216
   26   1HD1  ILE   5          1HD1      ILE   5   7.823 -19.111  -4.106
   27   2HD1  ILE   5          2HD1      ILE   5   6.726 -18.995  -5.483
   28   3HD1  ILE   5          3HD1      ILE   5   7.049 -20.562  -4.742
   29    H    GLY   6           H        GLY   6   1.928 -17.071  -3.492
   30   1HA   GLY   6          1HA       GLY   6   2.050 -14.379  -4.207
   31   2HA   GLY   6          2HA       GLY   6   0.562 -15.151  -3.636
   32    H    ALA   7           H        ALA   7   1.900 -15.802  -1.061
   33    HA   ALA   7           HA       ALA   7   1.009 -13.648   0.549
   34   1HB   ALA   7          1HB       ALA   7   3.053 -15.818   1.124
   35   2HB   ALA   7          2HB       ALA   7   1.308 -15.979   1.320
   36   3HB   ALA   7          3HB       ALA   7   2.209 -14.861   2.343
   37    H    LEU   8           H        LEU   8   4.174 -14.352  -0.831
   38    HA   LEU   8           HA       LEU   8   5.592 -12.381   0.799
   39   1HB   LEU   8          1HB       LEU   8   6.559 -13.554  -1.823
   40   2HB   LEU   8          2HB       LEU   8   7.528 -12.922  -0.494
   41    HG   LEU   8           HG       LEU   8   5.881 -15.470  -0.535
   42   1HD1  LEU   8          1HD1      LEU   8   8.826 -15.023   0.045
   43   2HD1  LEU   8          2HD1      LEU   8   8.201 -15.451  -1.546
   44   3HD1  LEU   8          3HD1      LEU   8   8.010 -16.567  -0.193
   45   1HD2  LEU   8          1HD2      LEU   8   7.176 -14.017   1.796
   46   2HD2  LEU   8          2HD2      LEU   8   6.826 -15.747   1.848
   47   3HD2  LEU   8          3HD2      LEU   8   5.512 -14.590   1.662
   48    H    PHE   9           H        PHE   9   4.443 -12.411  -2.636
   49    HA   PHE   9           HA       PHE   9   5.405  -9.732  -3.117
   50   1HB   PHE   9          1HB       PHE   9   4.489 -11.411  -4.888
   51   2HB   PHE   9          2HB       PHE   9   2.892 -10.825  -4.438
   52    HD1  PHE   9           HD1      PHE   9   2.047  -8.936  -5.626
   53    HD2  PHE   9           HD2      PHE   9   6.297  -9.535  -5.351
   54    HE1  PHE   9           HE1      PHE   9   2.421  -6.997  -7.122
   55    HE2  PHE   9           HE2      PHE   9   6.664  -7.593  -6.845
   56    HZ   PHE   9           HZ       PHE   9   4.729  -6.325  -7.733
   57    H    LEU  10           H        LEU  10   2.201 -10.973  -1.960
   58    HA   LEU  10           HA       LEU  10   0.952  -8.454  -1.774
   59   1HB   LEU  10          1HB       LEU  10  -0.313 -10.504  -1.516
   60   2HB   LEU  10          2HB       LEU  10   0.617 -10.957  -0.093
   61    HG   LEU  10           HG       LEU  10  -0.341  -9.122   1.192
   62   1HD1  LEU  10          1HD1      LEU  10  -1.528  -8.303  -1.476
   63   2HD1  LEU  10          2HD1      LEU  10  -0.568  -7.331  -0.360
   64   3HD1  LEU  10          3HD1      LEU  10  -2.224  -7.757   0.051
   65   1HD2  LEU  10          1HD2      LEU  10  -2.491 -10.565  -0.391
   66   2HD2  LEU  10          2HD2      LEU  10  -2.698  -9.825   1.195
   67   3HD2  LEU  10          3HD2      LEU  10  -1.640 -11.223   1.006
   68    H    GLY  11           H        GLY  11   2.968 -10.142   0.624
   69   1HA   GLY  11          1HA       GLY  11   2.664  -8.396   2.792
   70   2HA   GLY  11          2HA       GLY  11   4.140  -9.299   2.467
   71    H    PHE  12           H        PHE  12   5.027  -8.050   0.091
   72    HA   PHE  12           HA       PHE  12   5.943  -5.469   1.212
   73   1HB   PHE  12          1HB       PHE  12   6.707  -6.826  -1.386
   74   2HB   PHE  12          2HB       PHE  12   7.498  -5.422  -0.670
   75    HD1  PHE  12           HD1      PHE  12   8.333  -5.673   1.790
   76    HD2  PHE  12           HD2      PHE  12   7.504  -9.002  -0.800
   77    HE1  PHE  12           HE1      PHE  12   9.749  -7.132   3.208
   78    HE2  PHE  12           HE2      PHE  12   8.920 -10.457   0.619
   79    HZ   PHE  12           HZ       PHE  12  10.043  -9.524   2.624
   80    H    LEU  13           H        LEU  13   3.975  -6.536  -1.567
   81    HA   LEU  13           HA       LEU  13   3.895  -3.959  -2.825
   82   1HB   LEU  13          1HB       LEU  13   3.048  -6.434  -3.561
   83   2HB   LEU  13          2HB       LEU  13   1.503  -5.771  -3.060
   84    HG   LEU  13           HG       LEU  13   1.783  -5.408  -5.439
   85   1HD1  LEU  13          1HD1      LEU  13   1.338  -3.081  -5.576
   86   2HD1  LEU  13          2HD1      LEU  13   2.312  -2.727  -4.152
   87   3HD1  LEU  13          3HD1      LEU  13   0.774  -3.579  -3.982
   88   1HD2  LEU  13          1HD2      LEU  13   4.451  -5.349  -5.134
   89   2HD2  LEU  13          2HD2      LEU  13   4.179  -3.608  -5.118
   90   3HD2  LEU  13          3HD2      LEU  13   3.662  -4.566  -6.497
   91    H    GLY  14           H        GLY  14   2.479  -5.139   0.054
   92   1HA   GLY  14          1HA       GLY  14   0.143  -3.417   0.099
   93   2HA   GLY  14          2HA       GLY  14   0.822  -4.278   1.480
   94    H    ALA  15           H        ALA  15   3.415  -3.193   1.448
   95    HA   ALA  15           HA       ALA  15   3.181  -0.859   3.002
   96   1HB   ALA  15          1HB       ALA  15   5.171  -2.301   2.953
   97   2HB   ALA  15          2HB       ALA  15   5.627  -0.640   2.577
   98   3HB   ALA  15          3HB       ALA  15   5.489  -1.831   1.283
   99    H    ALA  16           H        ALA  16   3.533  -1.239  -0.475
  100    HA   ALA  16           HA       ALA  16   4.249   1.402  -1.179
  101   1HB   ALA  16          1HB       ALA  16   2.560  -0.551  -2.759
  102   2HB   ALA  16          2HB       ALA  16   4.318  -0.622  -2.642
  103   3HB   ALA  16          3HB       ALA  16   3.540   0.762  -3.411
  104    H    GLY  17           H        GLY  17   0.972  -0.043  -1.003
  105   1HA   GLY  17          1HA       GLY  17  -0.369   2.383  -1.745
  106   2HA   GLY  17          2HA       GLY  17  -1.118   1.011  -0.941
  107    H    SER  18           H        SER  18   0.467   0.976   1.366
  108    HA   SER  18           HA       SER  18  -0.913   2.814   3.044
  109   1HB   SER  18          1HB       SER  18   0.411   1.783   4.801
  110   2HB   SER  18          2HB       SER  18  -0.071   0.540   3.649
  111    HG   SER  18           HG       SER  18   2.257   1.772   2.956
  112    H    THR  19           H        THR  19   2.183   2.978   1.497
  113    HA   THR  19           HA       THR  19   3.200   5.181   3.203
  114    HB   THR  19           HB       THR  19   5.140   5.018   1.529
  115    HG1  THR  19           HG1      THR  19   3.940   4.058  -0.142
  116   1HG2  THR  19          1HG2      THR  19   4.275   2.614   3.161
  117   2HG2  THR  19          2HG2      THR  19   5.365   3.912   3.651
  118   3HG2  THR  19          3HG2      THR  19   5.868   2.756   2.417
  119    H    MET  20           H        MET  20   2.007   4.631  -0.080
  120    HA   MET  20           HA       MET  20   2.415   7.379  -0.955
  121   1HB   MET  20          1HB       MET  20   0.793   5.088  -2.110
  122   2HB   MET  20          2HB       MET  20   1.115   6.609  -2.940
  123   1HG   MET  20          1HG       MET  20   3.304   4.783  -1.906
  124   2HG   MET  20          2HG       MET  20   2.685   4.716  -3.555
  125   1HE   MET  20          1HE       MET  20   2.374   6.680  -4.980
  126   2HE   MET  20          2HE       MET  20   3.979   6.168  -5.488
  127   3HE   MET  20          3HE       MET  20   3.645   7.879  -5.245
  128    H    GLY  21           H        GLY  21   0.554   6.502   1.423
  129   1HA   GLY  21          1HA       GLY  21  -2.098   7.366   0.646
  130   2HA   GLY  21          2HA       GLY  21  -1.517   7.189   2.302
  131    H    ALA  22           H        ALA  22   0.763   9.061   0.946
  132    HA   ALA  22           HA       ALA  22  -0.191  11.477   2.233
  133   1HB   ALA  22          1HB       ALA  22   2.132  11.028   0.331
  134   2HB   ALA  22          2HB       ALA  22   2.207  10.984   2.093
  135   3HB   ALA  22          3HB       ALA  22   1.858  12.501   1.263
  136    H    ALA  23           H        ALA  23  -0.277  10.221  -1.040
  137    HA   ALA  23           HA       ALA  23  -0.892  12.734  -2.336
  138   1HB   ALA  23          1HB       ALA  23  -1.566  11.336  -4.239
  139   2HB   ALA  23          2HB       ALA  23  -1.549   9.905  -3.207
  140   3HB   ALA  23          3HB       ALA  23  -0.044  10.751  -3.566
  141    H    SER  24           H        SER  24  -2.556  11.244  -0.002
  142    HA   SER  24           HA       SER  24  -5.263  11.304  -1.123
  143   1HB   SER  24          1HB       SER  24  -4.603   9.776   0.741
  144   2HB   SER  24          2HB       SER  24  -4.373  11.182   1.774
  145    HG   SER  24           HG       SER  24  -6.722  11.488   0.691
  146    H    MET  25           H        MET  25  -4.075  13.756  -1.615
  147    HA   MET  25           HA       MET  25  -4.350  16.066  -1.294
  148   1HB   MET  25          1HB       MET  25  -6.926  15.199   0.052
  149   2HB   MET  25          2HB       MET  25  -6.593  16.764  -0.691
  150   1HG   MET  25          1HG       MET  25  -6.253  15.600  -2.880
  151   2HG   MET  25          2HG       MET  25  -6.736  14.088  -2.110
  152   1HE   MET  25          1HE       MET  25  -8.196  14.405  -4.402
  153   2HE   MET  25          2HE       MET  25  -8.017  16.145  -4.614
  154   3HE   MET  25          3HE       MET  25  -9.628  15.437  -4.511
  155    H    THR  26           H        THR  26  -5.090  17.721   0.598
  156    HA   THR  26           HA       THR  26  -3.236  17.270   2.757
  157    HB   THR  26           HB       THR  26  -4.216  19.358   3.705
  158    HG1  THR  26           HG1      THR  26  -6.197  19.729   3.178
  159   1HG2  THR  26          1HG2      THR  26  -3.694  19.417   0.719
  160   2HG2  THR  26          2HG2      THR  26  -2.467  19.497   1.985
  161   3HG2  THR  26          3HG2      THR  26  -3.625  20.814   1.794
  162    H    LEU  27           H        LEU  27  -6.491  18.299   3.578
  163    HA   LEU  27           HA       LEU  27  -6.582  16.566   5.866
  164   1HB   LEU  27          1HB       LEU  27  -7.838  18.629   5.896
  165   2HB   LEU  27          2HB       LEU  27  -8.716  18.181   4.440
  166    HG   LEU  27           HG       LEU  27  -9.919  16.432   5.610
  167   1HD1  LEU  27          1HD1      LEU  27  -8.300  15.483   7.080
  168   2HD1  LEU  27          2HD1      LEU  27  -9.516  16.182   8.144
  169   3HD1  LEU  27          3HD1      LEU  27  -7.992  17.029   7.872
  170   1HD2  LEU  27          1HD2      LEU  27  -9.804  18.900   7.374
  171   2HD2  LEU  27          2HD2      LEU  27 -11.147  17.763   7.252
  172   3HD2  LEU  27          3HD2      LEU  27 -10.723  18.780   5.872
  173    H    THR  28           H        THR  28  -6.819  14.386   5.727
  174    HA   THR  28           HA       THR  28  -7.795  13.055   3.365
  175    HB   THR  28           HB       THR  28  -7.590  11.012   4.659
  176    HG1  THR  28           HG1      THR  28  -7.615  11.011   6.806
  177   1HG2  THR  28          1HG2      THR  28  -5.492  12.148   3.970
  178   2HG2  THR  28          2HG2      THR  28  -5.288  11.233   5.464
  179   3HG2  THR  28          3HG2      THR  28  -5.459  12.987   5.521
  180    H    VAL  29           H        VAL  29  -9.853  12.342   2.880
  181    HA   VAL  29           HA       VAL  29 -12.089  13.499   4.266
  182    HB   VAL  29           HB       VAL  29 -13.461  12.032   2.780
  183   1HG1  VAL  29          1HG1      VAL  29 -11.135  13.396   1.391
  184   2HG1  VAL  29          2HG1      VAL  29 -12.574  14.216   1.996
  185   3HG1  VAL  29          3HG1      VAL  29 -12.711  13.051   0.679
  186   1HG2  VAL  29          1HG2      VAL  29 -12.025  10.053   2.738
  187   2HG2  VAL  29          2HG2      VAL  29 -10.730  10.975   1.974
  188   3HG2  VAL  29          3HG2      VAL  29 -12.223  10.657   1.094
  189    H    GLN  30           H        GLN  30 -13.819  12.278   5.366
  190    HA   GLN  30           HA       GLN  30 -12.800  10.539   7.403
  191   1HB   GLN  30          1HB       GLN  30 -15.672  10.907   6.491
  192   2HB   GLN  30          2HB       GLN  30 -15.156  10.217   8.029
  193   1HG   GLN  30          1HG       GLN  30 -14.466  13.027   7.116
  194   2HG   GLN  30          2HG       GLN  30 -15.816  12.640   8.181
  195   1HE2  GLN  30          1HE2      GLN  30 -12.870  13.921   8.452
  196   2HE2  GLN  30          2HE2      GLN  30 -12.346  13.245   9.917
  197    H    ALA  31           H        ALA  31 -12.929   8.281   7.608
  198    HA   ALA  31           HA       ALA  31 -12.844   6.754   5.170
  199   1HB   ALA  31          1HB       ALA  31 -13.211   5.741   8.006
  200   2HB   ALA  31          2HB       ALA  31 -11.651   6.117   7.275
  201   3HB   ALA  31          3HB       ALA  31 -12.636   4.807   6.625
  Start of MODEL   18
    1    H    ALA   2           H        ALA   2   0.790 -18.523   3.163
    2    HA   ALA   2           HA       ALA   2   2.578 -20.732   2.357
    3   1HB   ALA   2          1HB       ALA   2   0.260 -20.903   4.304
    4   2HB   ALA   2          2HB       ALA   2   1.958 -20.950   4.780
    5   3HB   ALA   2          3HB       ALA   2   1.288 -22.231   3.769
    6    H    VAL   3           H        VAL   3   0.876 -22.526   1.595
    7    HA   VAL   3           HA       VAL   3  -0.669 -23.125  -0.032
    8    HB   VAL   3           HB       VAL   3  -2.176 -20.595   0.699
    9   1HG1  VAL   3          1HG1      VAL   3  -4.145 -22.089   0.244
   10   2HG1  VAL   3          2HG1      VAL   3  -3.022 -23.330  -0.309
   11   3HG1  VAL   3          3HG1      VAL   3  -3.142 -21.799  -1.174
   12   1HG2  VAL   3          1HG2      VAL   3  -3.277 -22.024   2.451
   13   2HG2  VAL   3          2HG2      VAL   3  -1.579 -21.693   2.789
   14   3HG2  VAL   3          3HG2      VAL   3  -2.059 -23.262   2.143
   15    H    GLY   4           H        GLY   4   1.175 -20.379  -0.255
   16   1HA   GLY   4          1HA       GLY   4   1.470 -20.426  -3.005
   17   2HA   GLY   4          2HA       GLY   4   0.203 -19.247  -2.715
   18    H    ILE   5           H        ILE   5   3.098 -19.036  -3.619
   19    HA   ILE   5           HA       ILE   5   4.533 -17.582  -1.575
   20    HB   ILE   5           HB       ILE   5   5.939 -16.839  -3.545
   21   1HG1  ILE   5          1HG1      ILE   5   4.084 -18.661  -5.112
   22   2HG1  ILE   5          2HG1      ILE   5   4.019 -16.903  -5.183
   23   1HG2  ILE   5          1HG2      ILE   5   6.840 -19.077  -3.976
   24   2HG2  ILE   5          2HG2      ILE   5   5.344 -19.811  -3.402
   25   3HG2  ILE   5          3HG2      ILE   5   6.386 -18.938  -2.277
   26   1HD1  ILE   5          1HD1      ILE   5   5.363 -17.746  -7.042
   27   2HD1  ILE   5          2HD1      ILE   5   6.394 -18.635  -5.921
   28   3HD1  ILE   5          3HD1      ILE   5   6.399 -16.873  -5.913
   29    H    GLY   6           H        GLY   6   1.868 -16.881  -3.527
   30   1HA   GLY   6          1HA       GLY   6   2.030 -14.173  -4.189
   31   2HA   GLY   6          2HA       GLY   6   0.529 -14.937  -3.641
   32    H    ALA   7           H        ALA   7   1.817 -15.679  -1.079
   33    HA   ALA   7           HA       ALA   7   0.984 -13.534   0.583
   34   1HB   ALA   7          1HB       ALA   7   2.944 -15.797   1.103
   35   2HB   ALA   7          2HB       ALA   7   1.194 -15.892   1.303
   36   3HB   ALA   7          3HB       ALA   7   2.146 -14.837   2.348
   37    H    LEU   8           H        LEU   8   4.105 -14.317  -0.834
   38    HA   LEU   8           HA       LEU   8   5.635 -12.476   0.835
   39   1HB   LEU   8          1HB       LEU   8   6.483 -13.601  -1.849
   40   2HB   LEU   8          2HB       LEU   8   7.512 -13.089  -0.512
   41    HG   LEU   8           HG       LEU   8   5.638 -15.476  -0.529
   42   1HD1  LEU   8          1HD1      LEU   8   7.736 -16.764  -0.362
   43   2HD1  LEU   8          2HD1      LEU   8   8.662 -15.266  -0.427
   44   3HD1  LEU   8          3HD1      LEU   8   7.715 -15.779  -1.824
   45   1HD2  LEU   8          1HD2      LEU   8   7.336 -14.244   1.665
   46   2HD2  LEU   8          2HD2      LEU   8   6.841 -15.936   1.712
   47   3HD2  LEU   8          3HD2      LEU   8   5.625 -14.666   1.718
   48    H    PHE   9           H        PHE   9   4.459 -12.336  -2.592
   49    HA   PHE   9           HA       PHE   9   5.495  -9.658  -2.960
   50   1HB   PHE   9          1HB       PHE   9   3.087 -10.913  -4.325
   51   2HB   PHE   9          2HB       PHE   9   3.896  -9.428  -4.828
   52    HD1  PHE   9           HD1      PHE   9   4.169 -13.103  -4.611
   53    HD2  PHE   9           HD2      PHE   9   6.122  -9.484  -5.861
   54    HE1  PHE   9           HE1      PHE   9   5.811 -14.433  -5.909
   55    HE2  PHE   9           HE2      PHE   9   7.762 -10.817  -7.157
   56    HZ   PHE   9           HZ       PHE   9   7.606 -13.292  -7.181
   57    H    LEU  10           H        LEU  10   2.257 -10.883  -1.869
   58    HA   LEU  10           HA       LEU  10   1.018  -8.378  -1.644
   59   1HB   LEU  10          1HB       LEU  10  -0.230 -10.433  -1.344
   60   2HB   LEU  10          2HB       LEU  10   0.730 -10.869   0.063
   61    HG   LEU  10           HG       LEU  10  -0.213  -9.029   1.353
   62   1HD1  LEU  10          1HD1      LEU  10  -2.123  -7.680   0.239
   63   2HD1  LEU  10          2HD1      LEU  10  -1.453  -8.233  -1.295
   64   3HD1  LEU  10          3HD1      LEU  10  -0.475  -7.251  -0.206
   65   1HD2  LEU  10          1HD2      LEU  10  -2.592  -9.721   1.365
   66   2HD2  LEU  10          2HD2      LEU  10  -1.513 -11.112   1.257
   67   3HD2  LEU  10          3HD2      LEU  10  -2.354 -10.536  -0.182
   68    H    GLY  11           H        GLY  11   3.079 -10.041   0.742
   69   1HA   GLY  11          1HA       GLY  11   2.821  -8.280   2.898
   70   2HA   GLY  11          2HA       GLY  11   4.303  -9.160   2.536
   71    H    PHE  12           H        PHE  12   5.090  -7.937   0.130
   72    HA   PHE  12           HA       PHE  12   5.963  -5.293   1.150
   73   1HB   PHE  12          1HB       PHE  12   6.769  -6.807  -1.347
   74   2HB   PHE  12          2HB       PHE  12   7.487  -5.295  -0.792
   75    HD1  PHE  12           HD1      PHE  12   8.561  -5.209   1.512
   76    HD2  PHE  12           HD2      PHE  12   7.497  -8.899  -0.415
   77    HE1  PHE  12           HE1      PHE  12  10.080  -6.445   3.033
   78    HE2  PHE  12           HE2      PHE  12   9.016 -10.132   1.107
   79    HZ   PHE  12           HZ       PHE  12  10.308  -8.905   2.831
   80    H    LEU  13           H        LEU  13   4.017  -6.558  -1.559
   81    HA   LEU  13           HA       LEU  13   3.825  -4.056  -2.943
   82   1HB   LEU  13          1HB       LEU  13   3.071  -6.577  -3.563
   83   2HB   LEU  13          2HB       LEU  13   1.513  -5.990  -3.024
   84    HG   LEU  13           HG       LEU  13   1.635  -5.683  -5.406
   85   1HD1  LEU  13          1HD1      LEU  13   0.683  -3.806  -3.974
   86   2HD1  LEU  13          2HD1      LEU  13   1.136  -3.374  -5.622
   87   3HD1  LEU  13          3HD1      LEU  13   2.188  -2.935  -4.279
   88   1HD2  LEU  13          1HD2      LEU  13   4.049  -3.868  -5.250
   89   2HD2  LEU  13          2HD2      LEU  13   3.410  -4.772  -6.615
   90   3HD2  LEU  13          3HD2      LEU  13   4.279  -5.616  -5.341
   91    H    GLY  14           H        GLY  14   2.362  -5.260  -0.061
   92   1HA   GLY  14          1HA       GLY  14   0.053  -3.499  -0.038
   93   2HA   GLY  14          2HA       GLY  14   0.690  -4.383   1.348
   94    H    ALA  15           H        ALA  15   3.310  -3.340   1.331
   95    HA   ALA  15           HA       ALA  15   3.111  -1.029   2.923
   96   1HB   ALA  15          1HB       ALA  15   5.419  -1.955   1.180
   97   2HB   ALA  15          2HB       ALA  15   5.067  -2.548   2.804
   98   3HB   ALA  15          3HB       ALA  15   5.550  -0.869   2.563
   99    H    ALA  16           H        ALA  16   3.452  -1.355  -0.563
  100    HA   ALA  16           HA       ALA  16   4.224   1.284  -1.221
  101   1HB   ALA  16          1HB       ALA  16   4.297  -0.648  -2.754
  102   2HB   ALA  16          2HB       ALA  16   3.416   0.703  -3.469
  103   3HB   ALA  16          3HB       ALA  16   2.536  -0.671  -2.802
  104    H    GLY  17           H        GLY  17   0.912  -0.090  -1.087
  105   1HA   GLY  17          1HA       GLY  17  -0.365   2.382  -1.784
  106   2HA   GLY  17          2HA       GLY  17  -1.151   1.012  -1.017
  107    H    SER  18           H        SER  18   0.415   0.888   1.302
  108    HA   SER  18           HA       SER  18  -0.937   2.722   3.007
  109   1HB   SER  18          1HB       SER  18   1.471   0.957   3.504
  110   2HB   SER  18          2HB       SER  18   0.443   1.660   4.749
  111    HG   SER  18           HG       SER  18   0.095  -0.593   3.393
  112    H    THR  19           H        THR  19   2.170   2.849   1.481
  113    HA   THR  19           HA       THR  19   3.231   4.987   3.242
  114    HB   THR  19           HB       THR  19   5.172   4.814   1.561
  115    HG1  THR  19           HG1      THR  19   4.686   3.749  -0.161
  116   1HG2  THR  19          1HG2      THR  19   4.254   2.408   3.160
  117   2HG2  THR  19          2HG2      THR  19   5.372   3.673   3.667
  118   3HG2  THR  19          3HG2      THR  19   5.849   2.524   2.417
  119    H    MET  20           H        MET  20   2.033   4.545  -0.057
  120    HA   MET  20           HA       MET  20   2.515   7.300  -0.865
  121   1HB   MET  20          1HB       MET  20   2.451   5.321  -2.414
  122   2HB   MET  20          2HB       MET  20   0.717   5.207  -2.122
  123   1HG   MET  20          1HG       MET  20   0.349   7.409  -3.058
  124   2HG   MET  20          2HG       MET  20   2.083   7.695  -3.186
  125   1HE   MET  20          1HE       MET  20   1.012   7.434  -6.883
  126   2HE   MET  20          2HE       MET  20   1.740   8.411  -5.609
  127   3HE   MET  20          3HE       MET  20   0.014   8.060  -5.564
  128    H    GLY  21           H        GLY  21   0.115   5.743   0.983
  129   1HA   GLY  21          1HA       GLY  21  -2.150   7.398   0.272
  130   2HA   GLY  21          2HA       GLY  21  -2.002   6.436   1.744
  131    H    ALA  22           H        ALA  22   0.660   7.866   2.251
  132    HA   ALA  22           HA       ALA  22  -0.429   9.953   3.944
  133   1HB   ALA  22          1HB       ALA  22   2.452   9.403   3.165
  134   2HB   ALA  22          2HB       ALA  22   1.612   8.668   4.531
  135   3HB   ALA  22          3HB       ALA  22   1.915  10.405   4.514
  136    H    ALA  23           H        ALA  23   1.699  10.037   1.059
  137    HA   ALA  23           HA       ALA  23   1.592  12.919   0.846
  138   1HB   ALA  23          1HB       ALA  23   2.289  10.851  -1.258
  139   2HB   ALA  23          2HB       ALA  23   3.430  11.573  -0.125
  140   3HB   ALA  23          3HB       ALA  23   2.649  12.575  -1.348
  141    H    SER  24           H        SER  24  -0.784  10.681   0.400
  142    HA   SER  24           HA       SER  24  -2.014  11.766  -2.031
  143   1HB   SER  24          1HB       SER  24  -3.234   9.999   0.109
  144   2HB   SER  24          2HB       SER  24  -3.859  10.265  -1.516
  145    HG   SER  24           HG       SER  24  -1.220   9.387  -1.213
  146    H    MET  25           H        MET  25  -1.434  13.762  -0.052
  147    HA   MET  25           HA       MET  25  -2.455  15.533   1.109
  148   1HB   MET  25          1HB       MET  25  -4.731  14.822  -0.768
  149   2HB   MET  25          2HB       MET  25  -4.542  16.350   0.092
  150   1HG   MET  25          1HG       MET  25  -2.467  16.816  -1.096
  151   2HG   MET  25          2HG       MET  25  -2.523  15.236  -1.876
  152   1HE   MET  25          1HE       MET  25  -4.827  18.361  -1.186
  153   2HE   MET  25          2HE       MET  25  -4.908  19.006  -2.823
  154   3HE   MET  25          3HE       MET  25  -3.347  18.852  -2.023
  155    H    THR  26           H        THR  26  -4.827  16.088   2.155
  156    HA   THR  26           HA       THR  26  -5.165  14.130   4.244
  157    HB   THR  26           HB       THR  26  -6.961  15.577   5.038
  158    HG1  THR  26           HG1      THR  26  -7.459  15.939   2.574
  159   1HG2  THR  26          1HG2      THR  26  -4.646  16.351   5.375
  160   2HG2  THR  26          2HG2      THR  26  -5.738  17.716   5.141
  161   3HG2  THR  26          3HG2      THR  26  -4.697  17.182   3.821
  162    H    LEU  27           H        LEU  27  -7.893  13.869   4.610
  163    HA   LEU  27           HA       LEU  27  -8.529  11.731   2.780
  164   1HB   LEU  27          1HB       LEU  27 -10.529  13.140   4.574
  165   2HB   LEU  27          2HB       LEU  27 -10.533  11.456   4.053
  166    HG   LEU  27           HG       LEU  27  -8.544  12.756   5.944
  167   1HD1  LEU  27          1HD1      LEU  27 -10.719  12.310   6.964
  168   2HD1  LEU  27          2HD1      LEU  27  -9.535  11.152   7.571
  169   3HD1  LEU  27          3HD1      LEU  27 -10.699  10.659   6.341
  170   1HD2  LEU  27          1HD2      LEU  27  -7.313  11.108   4.710
  171   2HD2  LEU  27          2HD2      LEU  27  -8.663   9.974   4.730
  172   3HD2  LEU  27          3HD2      LEU  27  -7.774  10.316   6.213
  173    H    THR  28           H        THR  28  -8.631  12.522   0.659
  174    HA   THR  28           HA       THR  28  -9.966  14.905  -0.151
  175    HB   THR  28           HB       THR  28  -9.640  12.356  -1.764
  176    HG1  THR  28           HG1      THR  28  -7.736  13.701  -2.473
  177   1HG2  THR  28          1HG2      THR  28 -11.118  13.955  -2.835
  178   2HG2  THR  28          2HG2      THR  28  -9.562  13.987  -3.663
  179   3HG2  THR  28          3HG2      THR  28  -9.983  15.269  -2.526
  180    H    VAL  29           H        VAL  29 -11.151  11.579  -0.751
  181    HA   VAL  29           HA       VAL  29 -13.347  10.771  -0.911
  182    HB   VAL  29           HB       VAL  29 -13.881  12.825   1.257
  183   1HG1  VAL  29          1HG1      VAL  29 -15.905  11.789   0.371
  184   2HG1  VAL  29          2HG1      VAL  29 -15.565  11.125   1.969
  185   3HG1  VAL  29          3HG1      VAL  29 -15.184  10.186   0.526
  186   1HG2  VAL  29          1HG2      VAL  29 -12.767  10.007   1.423
  187   2HG2  VAL  29          2HG2      VAL  29 -13.310  10.950   2.812
  188   3HG2  VAL  29          3HG2      VAL  29 -11.926  11.494   1.862
  189    H    GLN  30           H        GLN  30 -13.589  11.751  -3.061
  190    HA   GLN  30           HA       GLN  30 -15.921  13.455  -3.229
  191   1HB   GLN  30          1HB       GLN  30 -14.130  15.139  -2.689
  192   2HB   GLN  30          2HB       GLN  30 -13.303  14.666  -4.173
  193   1HG   GLN  30          1HG       GLN  30 -15.218  15.352  -5.515
  194   2HG   GLN  30          2HG       GLN  30 -16.153  15.699  -4.059
  195   1HE2  GLN  30          1HE2      GLN  30 -14.893  17.332  -2.504
  196   2HE2  GLN  30          2HE2      GLN  30 -14.179  18.660  -3.284
  197    H    ALA  31           H        ALA  31 -16.286  11.376  -4.434
  198    HA   ALA  31           HA       ALA  31 -16.001  11.798  -7.275
  199   1HB   ALA  31          1HB       ALA  31 -14.613   9.762  -7.726
  200   2HB   ALA  31          2HB       ALA  31 -14.296   9.639  -5.995
  201   3HB   ALA  31          3HB       ALA  31 -13.716  11.038  -6.901
  Start of MODEL   19
    1    H    ALA   2           H        ALA   2  -2.295 -21.072  -4.530
    2    HA   ALA   2           HA       ALA   2  -0.898 -23.204  -4.088
    3   1HB   ALA   2          1HB       ALA   2   0.535 -22.579  -5.952
    4   2HB   ALA   2          2HB       ALA   2   0.231 -20.868  -5.658
    5   3HB   ALA   2          3HB       ALA   2  -1.073 -21.911  -6.227
    6    H    VAL   3           H        VAL   3   0.496 -23.793  -2.497
    7    HA   VAL   3           HA       VAL   3   2.208 -23.680  -0.906
    8    HB   VAL   3           HB       VAL   3   3.423 -21.956  -3.090
    9   1HG1  VAL   3          1HG1      VAL   3   4.660 -21.633  -1.018
   10   2HG1  VAL   3          2HG1      VAL   3   5.589 -22.721  -2.047
   11   3HG1  VAL   3          3HG1      VAL   3   4.650 -23.366  -0.699
   12   1HG2  VAL   3          1HG2      VAL   3   3.724 -24.909  -2.481
   13   2HG2  VAL   3          2HG2      VAL   3   4.464 -24.036  -3.822
   14   3HG2  VAL   3          3HG2      VAL   3   2.714 -24.250  -3.767
   15    H    GLY   4           H        GLY   4   2.999 -20.466  -2.015
   16   1HA   GLY   4          1HA       GLY   4   1.327 -18.912  -0.428
   17   2HA   GLY   4          2HA       GLY   4   2.660 -19.350   0.621
   18    H    ILE   5           H        ILE   5   3.418 -18.905  -2.776
   19    HA   ILE   5           HA       ILE   5   5.288 -16.827  -2.150
   20    HB   ILE   5           HB       ILE   5   4.151 -17.738  -4.811
   21   1HG1  ILE   5          1HG1      ILE   5   6.792 -18.441  -3.479
   22   2HG1  ILE   5          2HG1      ILE   5   5.356 -19.458  -3.372
   23   1HG2  ILE   5          1HG2      ILE   5   6.300 -16.728  -5.700
   24   2HG2  ILE   5          2HG2      ILE   5   6.539 -15.999  -4.113
   25   3HG2  ILE   5          3HG2      ILE   5   5.143 -15.549  -5.092
   26   1HD1  ILE   5          1HD1      ILE   5   6.703 -18.616  -5.956
   27   2HD1  ILE   5          2HD1      ILE   5   5.299 -19.674  -5.816
   28   3HD1  ILE   5          3HD1      ILE   5   6.862 -20.198  -5.194
   29    H    GLY   6           H        GLY   6   1.978 -16.809  -3.382
   30   1HA   GLY   6          1HA       GLY   6   1.775 -14.089  -4.166
   31   2HA   GLY   6          2HA       GLY   6   0.433 -15.026  -3.495
   32    H    ALA   7           H        ALA   7   1.721 -15.610  -0.989
   33    HA   ALA   7           HA       ALA   7   0.911 -13.419   0.626
   34   1HB   ALA   7          1HB       ALA   7   1.234 -15.898   1.237
   35   2HB   ALA   7          2HB       ALA   7   1.783 -14.730   2.435
   36   3HB   ALA   7          3HB       ALA   7   2.953 -15.539   1.395
   37    H    LEU   8           H        LEU   8   4.015 -14.258  -0.782
   38    HA   LEU   8           HA       LEU   8   5.579 -12.418   0.840
   39   1HB   LEU   8          1HB       LEU   8   6.665 -14.369  -0.092
   40   2HB   LEU   8          2HB       LEU   8   6.174 -13.929  -1.723
   41    HG   LEU   8           HG       LEU   8   7.658 -12.006  -1.727
   42   1HD1  LEU   8          1HD1      LEU   8   7.535 -11.139   0.488
   43   2HD1  LEU   8          2HD1      LEU   8   9.198 -11.690   0.327
   44   3HD1  LEU   8          3HD1      LEU   8   8.026 -12.673   1.208
   45   1HD2  LEU   8          1HD2      LEU   8   9.025 -14.456  -0.571
   46   2HD2  LEU   8          2HD2      LEU   8   9.841 -13.152  -1.431
   47   3HD2  LEU   8          3HD2      LEU   8   8.674 -14.169  -2.277
   48    H    PHE   9           H        PHE   9   4.384 -12.329  -2.581
   49    HA   PHE   9           HA       PHE   9   5.401  -9.632  -2.966
   50   1HB   PHE   9          1HB       PHE   9   3.163 -11.110  -4.399
   51   2HB   PHE   9          2HB       PHE   9   3.654  -9.469  -4.821
   52    HD1  PHE   9           HD1      PHE   9   5.864  -9.020  -5.805
   53    HD2  PHE   9           HD2      PHE   9   4.629 -13.026  -4.856
   54    HE1  PHE   9           HE1      PHE   9   7.727  -9.919  -7.172
   55    HE2  PHE   9           HE2      PHE   9   6.493 -13.921  -6.228
   56    HZ   PHE   9           HZ       PHE   9   8.039 -12.369  -7.384
   57    H    LEU  10           H        LEU  10   2.140 -10.909  -1.916
   58    HA   LEU  10           HA       LEU  10   0.910  -8.391  -1.705
   59   1HB   LEU  10          1HB       LEU  10  -0.364 -10.433  -1.443
   60   2HB   LEU  10          2HB       LEU  10   0.579 -10.902  -0.035
   61    HG   LEU  10           HG       LEU  10  -0.352  -9.075   1.277
   62   1HD1  LEU  10          1HD1      LEU  10  -0.580  -7.268  -0.255
   63   2HD1  LEU  10          2HD1      LEU  10  -2.236  -7.682   0.170
   64   3HD1  LEU  10          3HD1      LEU  10  -1.561  -8.221  -1.369
   65   1HD2  LEU  10          1HD2      LEU  10  -2.716  -9.760   1.300
   66   2HD2  LEU  10          2HD2      LEU  10  -1.671 -11.164   1.085
   67   3HD2  LEU  10          3HD2      LEU  10  -2.531 -10.486  -0.297
   68    H    GLY  11           H        GLY  11   2.919 -10.113   0.675
   69   1HA   GLY  11          1HA       GLY  11   2.677  -8.353   2.841
   70   2HA   GLY  11          2HA       GLY  11   4.131  -9.286   2.502
   71    H    PHE  12           H        PHE  12   4.976  -8.069   0.087
   72    HA   PHE  12           HA       PHE  12   5.944  -5.481   1.156
   73   1HB   PHE  12          1HB       PHE  12   7.491  -7.155   0.075
   74   2HB   PHE  12          2HB       PHE  12   6.707  -6.803  -1.463
   75    HD1  PHE  12           HD1      PHE  12   7.069  -4.670  -2.602
   76    HD2  PHE  12           HD2      PHE  12   8.799  -5.417   1.260
   77    HE1  PHE  12           HE1      PHE  12   8.508  -2.669  -2.859
   78    HE2  PHE  12           HE2      PHE  12  10.237  -3.414   1.001
   79    HZ   PHE  12           HZ       PHE  12  10.092  -2.041  -1.058
   80    H    LEU  13           H        LEU  13   3.961  -6.608  -1.595
   81    HA   LEU  13           HA       LEU  13   3.861  -4.038  -2.893
   82   1HB   LEU  13          1HB       LEU  13   2.236  -6.565  -3.032
   83   2HB   LEU  13          2HB       LEU  13   1.550  -5.124  -3.756
   84    HG   LEU  13           HG       LEU  13   2.910  -6.667  -5.304
   85   1HD1  LEU  13          1HD1      LEU  13   3.743  -4.865  -6.624
   86   2HD1  LEU  13          2HD1      LEU  13   3.938  -3.819  -5.222
   87   3HD1  LEU  13          3HD1      LEU  13   2.324  -4.243  -5.788
   88   1HD2  LEU  13          1HD2      LEU  13   4.808  -6.856  -3.519
   89   2HD2  LEU  13          2HD2      LEU  13   5.365  -5.315  -4.163
   90   3HD2  LEU  13          3HD2      LEU  13   5.255  -6.722  -5.214
   91    H    GLY  14           H        GLY  14   2.431  -5.234  -0.023
   92   1HA   GLY  14          1HA       GLY  14   0.101  -3.487  -0.004
   93   2HA   GLY  14          2HA       GLY  14   0.747  -4.367   1.383
   94    H    ALA  15           H        ALA  15   3.366  -3.351   1.344
   95    HA   ALA  15           HA       ALA  15   3.209  -1.029   2.920
   96   1HB   ALA  15          1HB       ALA  15   5.471  -2.012   1.147
   97   2HB   ALA  15          2HB       ALA  15   5.159  -2.539   2.800
   98   3HB   ALA  15          3HB       ALA  15   5.649  -0.875   2.484
   99    H    ALA  16           H        ALA  16   3.456  -1.396  -0.563
  100    HA   ALA  16           HA       ALA  16   4.227   1.229  -1.271
  101   1HB   ALA  16          1HB       ALA  16   4.197  -0.811  -2.734
  102   2HB   ALA  16          2HB       ALA  16   3.487   0.618  -3.489
  103   3HB   ALA  16          3HB       ALA  16   2.444  -0.647  -2.837
  104    H    GLY  17           H        GLY  17   0.907  -0.133  -1.060
  105   1HA   GLY  17          1HA       GLY  17  -0.363   2.348  -1.750
  106   2HA   GLY  17          2HA       GLY  17  -1.147   0.981  -0.974
  107    H    SER  18           H        SER  18   0.428   0.843   1.332
  108    HA   SER  18           HA       SER  18  -0.890   2.692   3.045
  109   1HB   SER  18          1HB       SER  18  -0.160   0.415   3.672
  110   2HB   SER  18          2HB       SER  18   1.521   0.920   3.527
  111    HG   SER  18           HG       SER  18  -0.452   1.849   5.342
  112    H    THR  19           H        THR  19   2.194   2.778   1.488
  113    HA   THR  19           HA       THR  19   3.293   4.931   3.206
  114    HB   THR  19           HB       THR  19   5.212   4.715   1.499
  115    HG1  THR  19           HG1      THR  19   3.971   2.297   0.807
  116   1HG2  THR  19          1HG2      THR  19   4.302   2.357   3.173
  117   2HG2  THR  19          2HG2      THR  19   5.447   3.621   3.622
  118   3HG2  THR  19          3HG2      THR  19   5.883   2.434   2.394
  119    H    MET  20           H        MET  20   2.047   4.437  -0.067
  120    HA   MET  20           HA       MET  20   2.518   7.188  -0.912
  121   1HB   MET  20          1HB       MET  20   2.494   5.234  -2.465
  122   2HB   MET  20          2HB       MET  20   0.771   5.041  -2.147
  123   1HG   MET  20          1HG       MET  20   0.302   7.246  -3.056
  124   2HG   MET  20          2HG       MET  20   2.023   7.581  -3.232
  125   1HE   MET  20          1HE       MET  20  -0.617   4.776  -4.088
  126   2HE   MET  20          2HE       MET  20  -0.694   4.999  -5.832
  127   3HE   MET  20          3HE       MET  20  -1.121   6.332  -4.763
  128    H    GLY  21           H        GLY  21  -0.182   5.351   0.395
  129   1HA   GLY  21          1HA       GLY  21  -2.187   7.382  -0.105
  130   2HA   GLY  21          2HA       GLY  21  -2.359   6.015   0.994
  131    H    ALA  22           H        ALA  22   0.191   6.846   2.394
  132    HA   ALA  22           HA       ALA  22  -1.062   8.499   4.416
  133   1HB   ALA  22          1HB       ALA  22   1.863   7.784   4.040
  134   2HB   ALA  22          2HB       ALA  22   0.690   6.829   4.947
  135   3HB   ALA  22          3HB       ALA  22   1.140   8.440   5.509
  136    H    ALA  23           H        ALA  23   1.655   9.114   2.156
  137    HA   ALA  23           HA       ALA  23   1.794  11.925   2.824
  138   1HB   ALA  23          1HB       ALA  23   3.310  12.084   0.896
  139   2HB   ALA  23          2HB       ALA  23   2.824  10.472   0.370
  140   3HB   ALA  23          3HB       ALA  23   3.716  10.675   1.879
  141    H    SER  24           H        SER  24   0.011  10.044   0.473
  142    HA   SER  24           HA       SER  24  -0.831  12.374  -1.097
  143   1HB   SER  24          1HB       SER  24  -1.985   9.573  -1.061
  144   2HB   SER  24          2HB       SER  24  -2.228  10.793  -2.306
  145    HG   SER  24           HG       SER  24  -0.411  10.188  -3.148
  146    H    MET  25           H        MET  25  -1.406  12.974   1.507
  147    HA   MET  25           HA       MET  25  -3.145  13.577   2.964
  148   1HB   MET  25          1HB       MET  25  -4.820  13.432   0.441
  149   2HB   MET  25          2HB       MET  25  -5.157  14.387   1.885
  150   1HG   MET  25          1HG       MET  25  -3.062  15.663   1.509
  151   2HG   MET  25          2HG       MET  25  -2.782  14.741   0.032
  152   1HE   MET  25          1HE       MET  25  -2.574  17.495  -0.555
  153   2HE   MET  25          2HE       MET  25  -3.745  17.826  -1.829
  154   3HE   MET  25          3HE       MET  25  -2.845  16.311  -1.842
  155    H    THR  26           H        THR  26  -5.999  12.805   2.451
  156    HA   THR  26           HA       THR  26  -6.100  10.439   4.014
  157    HB   THR  26           HB       THR  26  -8.484  10.313   3.292
  158    HG1  THR  26           HG1      THR  26  -8.736  12.505   1.930
  159   1HG2  THR  26          1HG2      THR  26  -9.112  12.601   4.085
  160   2HG2  THR  26          2HG2      THR  26  -7.417  13.070   3.955
  161   3HG2  THR  26          3HG2      THR  26  -7.902  11.825   5.105
  162    H    LEU  27           H        LEU  27  -6.841   8.274   3.335
  163    HA   LEU  27           HA       LEU  27  -5.349   7.293   1.060
  164   1HB   LEU  27          1HB       LEU  27  -7.365   6.053   2.954
  165   2HB   LEU  27          2HB       LEU  27  -6.720   5.138   1.593
  166    HG   LEU  27           HG       LEU  27  -4.445   5.418   2.418
  167   1HD1  LEU  27          1HD1      LEU  27  -4.440   7.584   3.415
  168   2HD1  LEU  27          2HD1      LEU  27  -4.167   6.472   4.751
  169   3HD1  LEU  27          3HD1      LEU  27  -5.766   7.177   4.505
  170   1HD2  LEU  27          1HD2      LEU  27  -6.395   4.543   4.573
  171   2HD2  LEU  27          2HD2      LEU  27  -4.673   4.166   4.568
  172   3HD2  LEU  27          3HD2      LEU  27  -5.719   3.527   3.300
  173    H    THR  28           H        THR  28  -6.007   7.221  -1.035
  174    HA   THR  28           HA       THR  28  -8.570   8.273  -1.838
  175    HB   THR  28           HB       THR  28  -7.874   7.533  -4.118
  176    HG1  THR  28           HG1      THR  28  -5.514   6.626  -2.864
  177   1HG2  THR  28          1HG2      THR  28  -7.080   9.682  -3.153
  178   2HG2  THR  28          2HG2      THR  28  -5.907   8.978  -4.267
  179   3HG2  THR  28          3HG2      THR  28  -5.658   8.849  -2.525
  180    H    VAL  29           H        VAL  29  -9.953   6.800  -0.533
  181    HA   VAL  29           HA       VAL  29 -10.050   3.977  -1.025
  182    HB   VAL  29           HB       VAL  29 -12.343   4.129  -0.027
  183   1HG1  VAL  29          1HG1      VAL  29 -10.339   3.969   1.405
  184   2HG1  VAL  29          2HG1      VAL  29 -11.581   4.961   2.168
  185   3HG1  VAL  29          3HG1      VAL  29 -10.192   5.726   1.397
  186   1HG2  VAL  29          1HG2      VAL  29 -13.016   6.296  -0.960
  187   2HG2  VAL  29          2HG2      VAL  29 -11.728   7.104  -0.067
  188   3HG2  VAL  29          3HG2      VAL  29 -13.073   6.366   0.801
  189    H    GLN  30           H        GLN  30 -10.725   6.516  -3.088
  190    HA   GLN  30           HA       GLN  30 -13.079   5.569  -4.432
  191   1HB   GLN  30          1HB       GLN  30 -10.766   7.176  -5.560
  192   2HB   GLN  30          2HB       GLN  30 -12.371   7.033  -6.276
  193   1HG   GLN  30          1HG       GLN  30 -11.842   8.153  -3.506
  194   2HG   GLN  30          2HG       GLN  30 -12.048   9.145  -4.949
  195   1HE2  GLN  30          1HE2      GLN  30 -13.749   7.659  -2.395
  196   2HE2  GLN  30          2HE2      GLN  30 -15.312   7.777  -3.050
  197    H    ALA  31           H        ALA  31 -13.252   4.274  -6.319
  198    HA   ALA  31           HA       ALA  31 -10.957   3.146  -7.660
  199   1HB   ALA  31          1HB       ALA  31 -11.312   0.790  -6.886
  200   2HB   ALA  31          2HB       ALA  31 -12.420   1.400  -5.656
  201   3HB   ALA  31          3HB       ALA  31 -10.715   1.852  -5.611
  Start of MODEL   20
    1    H    ALA   2           H        ALA   2   5.318 -21.691   3.379
    2    HA   ALA   2           HA       ALA   2   6.395 -21.323   0.673
    3   1HB   ALA   2          1HB       ALA   2   5.639 -23.787   2.272
    4   2HB   ALA   2          2HB       ALA   2   7.249 -23.068   2.263
    5   3HB   ALA   2          3HB       ALA   2   6.577 -23.745   0.779
    6    H    VAL   3           H        VAL   3   5.204 -23.082  -0.803
    7    HA   VAL   3           HA       VAL   3   3.325 -23.595  -2.056
    8    HB   VAL   3           HB       VAL   3   1.694 -23.103   0.452
    9   1HG1  VAL   3          1HG1      VAL   3   1.314 -24.910  -1.950
   10   2HG1  VAL   3          2HG1      VAL   3   0.410 -23.433  -1.616
   11   3HG1  VAL   3          3HG1      VAL   3   0.242 -24.830  -0.553
   12   1HG2  VAL   3          1HG2      VAL   3   3.576 -24.586   0.996
   13   2HG2  VAL   3          2HG2      VAL   3   3.219 -25.577  -0.418
   14   3HG2  VAL   3          3HG2      VAL   3   2.077 -25.512   0.924
   15    H    GLY   4           H        GLY   4   2.232 -21.001   0.159
   16   1HA   GLY   4          1HA       GLY   4   0.992 -19.592  -2.145
   17   2HA   GLY   4          2HA       GLY   4   0.814 -19.183  -0.453
   18    H    ILE   5           H        ILE   5   3.138 -19.047  -3.128
   19    HA   ILE   5           HA       ILE   5   4.984 -17.292  -1.775
   20    HB   ILE   5           HB       ILE   5   5.565 -18.660  -3.765
   21   1HG1  ILE   5          1HG1      ILE   5   5.837 -15.683  -4.282
   22   2HG1  ILE   5          2HG1      ILE   5   6.850 -16.593  -3.160
   23   1HG2  ILE   5          1HG2      ILE   5   3.920 -16.655  -5.335
   24   2HG2  ILE   5          2HG2      ILE   5   3.359 -18.278  -4.928
   25   3HG2  ILE   5          3HG2      ILE   5   4.770 -18.066  -5.964
   26   1HD1  ILE   5          1HD1      ILE   5   6.615 -17.030  -6.150
   27   2HD1  ILE   5          2HD1      ILE   5   7.508 -18.092  -5.063
   28   3HD1  ILE   5          3HD1      ILE   5   8.020 -16.419  -5.279
   29    H    GLY   6           H        GLY   6   1.978 -16.891  -3.449
   30   1HA   GLY   6          1HA       GLY   6   2.008 -14.173  -4.184
   31   2HA   GLY   6          2HA       GLY   6   0.561 -15.004  -3.596
   32    H    ALA   7           H        ALA   7   1.815 -15.677  -1.041
   33    HA   ALA   7           HA       ALA   7   0.980 -13.519   0.591
   34   1HB   ALA   7          1HB       ALA   7   2.156 -14.786   2.375
   35   2HB   ALA   7          2HB       ALA   7   2.962 -15.755   1.142
   36   3HB   ALA   7          3HB       ALA   7   1.214 -15.864   1.346
   37    H    LEU   8           H        LEU   8   4.086 -14.304  -0.819
   38    HA   LEU   8           HA       LEU   8   5.618 -12.420   0.795
   39   1HB   LEU   8          1HB       LEU   8   6.355 -14.597  -0.559
   40   2HB   LEU   8          2HB       LEU   8   6.595 -13.455  -1.874
   41    HG   LEU   8           HG       LEU   8   7.898 -13.384   0.869
   42   1HD1  LEU   8          1HD1      LEU   8   9.971 -13.695  -0.436
   43   2HD1  LEU   8          2HD1      LEU   8   9.025 -13.751  -1.924
   44   3HD1  LEU   8          3HD1      LEU   8   8.841 -15.020  -0.714
   45   1HD2  LEU   8          1HD2      LEU   8   7.888 -11.367  -1.398
   46   2HD2  LEU   8          2HD2      LEU   8   9.201 -11.429  -0.220
   47   3HD2  LEU   8          3HD2      LEU   8   7.559 -11.094   0.313
   48    H    PHE   9           H        PHE   9   4.405 -12.401  -2.621
   49    HA   PHE   9           HA       PHE   9   5.386  -9.727  -3.105
   50   1HB   PHE   9          1HB       PHE   9   4.449 -11.405  -4.873
   51   2HB   PHE   9          2HB       PHE   9   2.863 -10.795  -4.424
   52    HD1  PHE   9           HD1      PHE   9   6.286  -9.545  -5.329
   53    HD2  PHE   9           HD2      PHE   9   2.043  -8.909  -5.631
   54    HE1  PHE   9           HE1      PHE   9   6.679  -7.614  -6.832
   55    HE2  PHE   9           HE2      PHE   9   2.442  -6.980  -7.133
   56    HZ   PHE   9           HZ       PHE   9   4.758  -6.333  -7.735
   57    H    LEU  10           H        LEU  10   2.132 -10.933  -1.981
   58    HA   LEU  10           HA       LEU  10   0.970  -8.362  -1.768
   59   1HB   LEU  10          1HB       LEU  10   0.466 -11.056  -0.560
   60   2HB   LEU  10          2HB       LEU  10  -0.275  -9.697   0.279
   61    HG   LEU  10           HG       LEU  10  -1.316  -8.987  -1.895
   62   1HD1  LEU  10          1HD1      LEU  10  -1.308 -10.515  -3.784
   63   2HD1  LEU  10          2HD1      LEU  10  -0.343 -11.685  -2.886
   64   3HD1  LEU  10          3HD1      LEU  10   0.363 -10.144  -3.367
   65   1HD2  LEU  10          1HD2      LEU  10  -1.908 -11.823  -0.991
   66   2HD2  LEU  10          2HD2      LEU  10  -3.000 -10.801  -1.925
   67   3HD2  LEU  10          3HD2      LEU  10  -2.568 -10.351  -0.275
   68    H    GLY  11           H        GLY  11   2.912 -10.156   0.615
   69   1HA   GLY  11          1HA       GLY  11   2.656  -8.426   2.804
   70   2HA   GLY  11          2HA       GLY  11   4.114  -9.354   2.463
   71    H    PHE  12           H        PHE  12   4.983  -8.108   0.081
   72    HA   PHE  12           HA       PHE  12   5.959  -5.544   1.196
   73   1HB   PHE  12          1HB       PHE  12   7.519  -7.153   0.100
   74   2HB   PHE  12          2HB       PHE  12   6.681  -6.878  -1.427
   75    HD1  PHE  12           HD1      PHE  12   6.849  -4.722  -2.597
   76    HD2  PHE  12           HD2      PHE  12   8.903  -5.394   1.117
   77    HE1  PHE  12           HE1      PHE  12   8.212  -2.686  -2.982
   78    HE2  PHE  12           HE2      PHE  12  10.266  -3.360   0.730
   79    HZ   PHE  12           HZ       PHE  12   9.921  -2.007  -1.318
   80    H    LEU  13           H        LEU  13   3.939  -6.597  -1.551
   81    HA   LEU  13           HA       LEU  13   3.873  -4.017  -2.814
   82   1HB   LEU  13          1HB       LEU  13   3.012  -6.485  -3.556
   83   2HB   LEU  13          2HB       LEU  13   1.473  -5.819  -3.044
   84    HG   LEU  13           HG       LEU  13   1.745  -5.445  -5.423
   85   1HD1  LEU  13          1HD1      LEU  13   1.291  -3.122  -5.544
   86   2HD1  LEU  13          2HD1      LEU  13   2.285  -2.768  -4.134
   87   3HD1  LEU  13          3HD1      LEU  13   0.750  -3.620  -3.943
   88   1HD2  LEU  13          1HD2      LEU  13   4.136  -3.642  -5.115
   89   2HD2  LEU  13          2HD2      LEU  13   3.626  -4.621  -6.484
   90   3HD2  LEU  13          3HD2      LEU  13   4.419  -5.383  -5.111
   91    H    GLY  14           H        GLY  14   2.416  -5.219   0.050
   92   1HA   GLY  14          1HA       GLY  14   0.110  -3.466   0.105
   93   2HA   GLY  14          2HA       GLY  14   0.784  -4.325   1.489
   94    H    ALA  15           H        ALA  15   3.392  -3.277   1.402
   95    HA   ALA  15           HA       ALA  15   3.221  -0.941   2.959
   96   1HB   ALA  15          1HB       ALA  15   5.187  -2.400   2.889
   97   2HB   ALA  15          2HB       ALA  15   5.667  -0.759   2.459
   98   3HB   ALA  15          3HB       ALA  15   5.468  -1.978   1.201
   99    H    ALA  16           H        ALA  16   3.467  -1.328  -0.529
  100    HA   ALA  16           HA       ALA  16   4.224   1.299  -1.246
  101   1HB   ALA  16          1HB       ALA  16   3.244   0.672  -3.462
  102   2HB   ALA  16          2HB       ALA  16   2.572  -0.774  -2.708
  103   3HB   ALA  16          3HB       ALA  16   4.321  -0.558  -2.798
  104    H    GLY  17           H        GLY  17   0.910  -0.072  -1.039
  105   1HA   GLY  17          1HA       GLY  17  -0.370   2.396  -1.743
  106   2HA   GLY  17          2HA       GLY  17  -1.150   1.036  -0.956
  107    H    SER  18           H        SER  18   0.435   0.932   1.354
  108    HA   SER  18           HA       SER  18  -0.902   2.787   3.047
  109   1HB   SER  18          1HB       SER  18   1.523   1.048   3.557
  110   2HB   SER  18          2HB       SER  18   0.487   1.756   4.793
  111    HG   SER  18           HG       SER  18  -0.601  -0.029   4.545
  112    H    THR  19           H        THR  19   2.177   2.894   1.484
  113    HA   THR  19           HA       THR  19   3.262   5.068   3.185
  114    HB   THR  19           HB       THR  19   5.177   4.860   1.475
  115    HG1  THR  19           HG1      THR  19   4.811   2.542   0.547
  116   1HG2  THR  19          1HG2      THR  19   5.421   3.773   3.601
  117   2HG2  THR  19          2HG2      THR  19   5.870   2.590   2.375
  118   3HG2  THR  19          3HG2      THR  19   4.291   2.495   3.152
  119    H    MET  20           H        MET  20   2.014   4.554  -0.087
  120    HA   MET  20           HA       MET  20   2.470   7.298  -0.951
  121   1HB   MET  20          1HB       MET  20   0.831   5.025  -2.106
  122   2HB   MET  20          2HB       MET  20   1.119   6.561  -2.926
  123   1HG   MET  20          1HG       MET  20   3.518   6.164  -2.935
  124   2HG   MET  20          2HG       MET  20   3.316   4.702  -1.971
  125   1HE   MET  20          1HE       MET  20   4.563   5.408  -5.153
  126   2HE   MET  20          2HE       MET  20   4.435   3.722  -5.646
  127   3HE   MET  20          3HE       MET  20   4.980   4.117  -4.018
  128    H    GLY  21           H        GLY  21  -0.190   5.503   0.472
  129   1HA   GLY  21          1HA       GLY  21  -2.234   7.470  -0.078
  130   2HA   GLY  21          2HA       GLY  21  -2.341   6.190   1.131
  131    H    ALA  22           H        ALA  22   0.438   7.509   1.998
  132    HA   ALA  22           HA       ALA  22  -0.707   8.984   4.212
  133   1HB   ALA  22          1HB       ALA  22   2.160   8.836   3.227
  134   2HB   ALA  22          2HB       ALA  22   1.426   7.773   4.428
  135   3HB   ALA  22          3HB       ALA  22   1.648   9.486   4.785
  136    H    ALA  23           H        ALA  23   0.480   9.841   1.038
  137    HA   ALA  23           HA       ALA  23   0.862  12.657   1.577
  138   1HB   ALA  23          1HB       ALA  23   1.931  11.601  -0.353
  139   2HB   ALA  23          2HB       ALA  23   0.846  12.879  -0.901
  140   3HB   ALA  23          3HB       ALA  23   0.353  11.191  -1.024
  141    H    SER  24           H        SER  24  -1.764  10.828   0.028
  142    HA   SER  24           HA       SER  24  -3.761  12.701   1.082
  143   1HB   SER  24          1HB       SER  24  -3.374  12.471  -1.920
  144   2HB   SER  24          2HB       SER  24  -4.619  13.407  -1.097
  145    HG   SER  24           HG       SER  24  -2.715  14.452  -0.031
  146    H    MET  25           H        MET  25  -3.186   9.870   1.277
  147    HA   MET  25           HA       MET  25  -4.288   7.800   1.132
  148   1HB   MET  25          1HB       MET  25  -6.745   9.519   0.676
  149   2HB   MET  25          2HB       MET  25  -6.696   7.883   1.334
  150   1HG   MET  25          1HG       MET  25  -5.358   8.721   3.255
  151   2HG   MET  25          2HG       MET  25  -5.499  10.358   2.612
  152   1HE   MET  25          1HE       MET  25  -7.822  10.394   5.717
  153   2HE   MET  25          2HE       MET  25  -6.416  11.088   4.917
  154   3HE   MET  25          3HE       MET  25  -6.348   9.436   5.527
  155    H    THR  26           H        THR  26  -6.739   7.345  -0.478
  156    HA   THR  26           HA       THR  26  -5.493   6.558  -2.932
  157    HB   THR  26           HB       THR  26  -7.809   6.078  -3.693
  158    HG1  THR  26           HG1      THR  26  -8.449   7.405  -1.271
  159   1HG2  THR  26          1HG2      THR  26  -6.598   4.503  -2.197
  160   2HG2  THR  26          2HG2      THR  26  -8.343   4.449  -1.950
  161   3HG2  THR  26          3HG2      THR  26  -7.316   5.309  -0.803
  162    H    LEU  27           H        LEU  27  -4.902   7.877  -4.578
  163    HA   LEU  27           HA       LEU  27  -5.717  10.642  -4.718
  164   1HB   LEU  27          1HB       LEU  27  -4.528   9.057  -7.016
  165   2HB   LEU  27          2HB       LEU  27  -4.347  10.776  -6.671
  166    HG   LEU  27           HG       LEU  27  -3.211   8.482  -5.039
  167   1HD1  LEU  27          1HD1      LEU  27  -1.869  10.652  -6.683
  168   2HD1  LEU  27          2HD1      LEU  27  -2.048   8.968  -7.175
  169   3HD1  LEU  27          3HD1      LEU  27  -1.049   9.377  -5.779
  170   1HD2  LEU  27          1HD2      LEU  27  -2.041  10.426  -3.821
  171   2HD2  LEU  27          2HD2      LEU  27  -3.753  10.213  -3.470
  172   3HD2  LEU  27          3HD2      LEU  27  -3.234  11.486  -4.578
  173    H    THR  28           H        THR  28  -6.338  11.132  -7.363
  174    HA   THR  28           HA       THR  28  -8.428   9.443  -8.397
  175    HB   THR  28           HB       THR  28  -9.761  10.160  -6.533
  176    HG1  THR  28           HG1      THR  28 -10.786  12.098  -8.083
  177   1HG2  THR  28          1HG2      THR  28  -8.756  12.943  -7.192
  178   2HG2  THR  28          2HG2      THR  28  -8.386  12.001  -5.748
  179   3HG2  THR  28          3HG2      THR  28 -10.024  12.596  -6.016
  180    H    VAL  29           H        VAL  29  -6.264  11.939  -8.605
  181    HA   VAL  29           HA       VAL  29  -7.427  13.737 -10.473
  182    HB   VAL  29           HB       VAL  29  -4.533  12.826 -10.384
  183   1HG1  VAL  29          1HG1      VAL  29  -5.043  14.158 -12.357
  184   2HG1  VAL  29          2HG1      VAL  29  -4.145  15.160 -11.218
  185   3HG1  VAL  29          3HG1      VAL  29  -5.891  15.351 -11.374
  186   1HG2  VAL  29          1HG2      VAL  29  -4.235  14.757  -8.834
  187   2HG2  VAL  29          2HG2      VAL  29  -5.283  13.512  -8.153
  188   3HG2  VAL  29          3HG2      VAL  29  -5.985  14.985  -8.820
  189    H    GLN  30           H        GLN  30  -7.460  13.722 -12.762
  190    HA   GLN  30           HA       GLN  30  -7.905  11.212 -14.027
  191   1HB   GLN  30          1HB       GLN  30  -7.749  12.532 -16.168
  192   2HB   GLN  30          2HB       GLN  30  -8.846  13.231 -14.979
  193   1HG   GLN  30          1HG       GLN  30  -7.068  14.789 -14.253
  194   2HG   GLN  30          2HG       GLN  30  -5.976  14.097 -15.454
  195   1HE2  GLN  30          1HE2      GLN  30  -8.603  16.340 -14.977
  196   2HE2  GLN  30          2HE2      GLN  30  -8.752  16.823 -16.597
  197    H    ALA  31           H        ALA  31  -6.444  11.199 -16.387
  198    HA   ALA  31           HA       ALA  31  -3.599  11.453 -15.957
  199   1HB   ALA  31          1HB       ALA  31  -3.916   9.537 -14.482
  200   2HB   ALA  31          2HB       ALA  31  -3.094   9.000 -15.948
  201   3HB   ALA  31          3HB       ALA  31  -4.817   8.683 -15.736
  Start of MODEL   21
    1    H    ALA   2           H        ALA   2  -4.296 -19.667  -1.729
    2    HA   ALA   2           HA       ALA   2  -2.826 -21.870  -1.957
    3   1HB   ALA   2          1HB       ALA   2  -4.487 -20.955  -3.577
    4   2HB   ALA   2          2HB       ALA   2  -3.032 -21.555  -4.373
    5   3HB   ALA   2          3HB       ALA   2  -3.264 -19.821  -4.150
    6    H    VAL   3           H        VAL   3  -0.697 -22.351  -1.891
    7    HA   VAL   3           HA       VAL   3   1.612 -22.160  -2.044
    8    HB   VAL   3           HB       VAL   3   1.152 -19.973  -4.100
    9   1HG1  VAL   3          1HG1      VAL   3   3.257 -22.148  -3.932
   10   2HG1  VAL   3          2HG1      VAL   3   3.483 -20.515  -3.311
   11   3HG1  VAL   3          3HG1      VAL   3   3.229 -20.772  -5.035
   12   1HG2  VAL   3          1HG2      VAL   3   1.076 -21.857  -5.770
   13   2HG2  VAL   3          2HG2      VAL   3  -0.337 -21.797  -4.718
   14   3HG2  VAL   3          3HG2      VAL   3   0.932 -22.984  -4.421
   15    H    GLY   4           H        GLY   4   3.298 -20.882  -1.162
   16   1HA   GLY   4          1HA       GLY   4   2.351 -18.638   0.517
   17   2HA   GLY   4          2HA       GLY   4   3.921 -19.403   0.594
   18    H    ILE   5           H        ILE   5   3.835 -18.862  -2.591
   19    HA   ILE   5           HA       ILE   5   5.552 -16.595  -2.443
   20    HB   ILE   5           HB       ILE   5   5.617 -18.343  -4.202
   21   1HG1  ILE   5          1HG1      ILE   5   5.152 -15.556  -5.309
   22   2HG1  ILE   5          2HG1      ILE   5   6.641 -16.077  -4.520
   23   1HG2  ILE   5          1HG2      ILE   5   3.095 -18.440  -4.468
   24   2HG2  ILE   5          2HG2      ILE   5   3.999 -18.391  -5.980
   25   3HG2  ILE   5          3HG2      ILE   5   3.205 -16.935  -5.383
   26   1HD1  ILE   5          1HD1      ILE   5   6.931 -16.288  -6.921
   27   2HD1  ILE   5          2HD1      ILE   5   5.442 -17.221  -7.058
   28   3HD1  ILE   5          3HD1      ILE   5   6.839 -17.905  -6.226
   29    H    GLY   6           H        GLY   6   2.121 -16.874  -3.347
   30   1HA   GLY   6          1HA       GLY   6   1.728 -14.168  -4.175
   31   2HA   GLY   6          2HA       GLY   6   0.469 -15.191  -3.474
   32    H    ALA   7           H        ALA   7   1.705 -15.702  -0.979
   33    HA   ALA   7           HA       ALA   7   0.864 -13.511   0.612
   34   1HB   ALA   7          1HB       ALA   7   2.912 -15.633   1.365
   35   2HB   ALA   7          2HB       ALA   7   1.181 -15.951   1.282
   36   3HB   ALA   7          3HB       ALA   7   1.806 -14.779   2.439
   37    H    LEU   8           H        LEU   8   3.979 -14.329  -0.763
   38    HA   LEU   8           HA       LEU   8   5.518 -12.438   0.827
   39   1HB   LEU   8          1HB       LEU   8   6.630 -14.393  -0.064
   40   2HB   LEU   8          2HB       LEU   8   6.137 -13.989  -1.704
   41    HG   LEU   8           HG       LEU   8   7.593 -12.045  -1.738
   42   1HD1  LEU   8          1HD1      LEU   8   7.461 -11.144   0.462
   43   2HD1  LEU   8          2HD1      LEU   8   9.130 -11.679   0.311
   44   3HD1  LEU   8          3HD1      LEU   8   7.967 -12.661   1.206
   45   1HD2  LEU   8          1HD2      LEU   8   8.632 -14.217  -2.243
   46   2HD2  LEU   8          2HD2      LEU   8   9.005 -14.447  -0.536
   47   3HD2  LEU   8          3HD2      LEU   8   9.788 -13.153  -1.441
   48    H    PHE   9           H        PHE   9   4.289 -12.441  -2.576
   49    HA   PHE   9           HA       PHE   9   5.300  -9.778  -3.082
   50   1HB   PHE   9          1HB       PHE   9   4.350 -11.464  -4.841
   51   2HB   PHE   9          2HB       PHE   9   2.768 -10.832  -4.399
   52    HD1  PHE   9           HD1      PHE   9   1.975  -8.938  -5.615
   53    HD2  PHE   9           HD2      PHE   9   6.208  -9.632  -5.307
   54    HE1  PHE   9           HE1      PHE   9   2.403  -7.019  -7.123
   55    HE2  PHE   9           HE2      PHE   9   6.630  -7.711  -6.817
   56    HZ   PHE   9           HZ       PHE   9   4.729  -6.405  -7.724
   57    H    LEU  10           H        LEU  10   2.058 -10.970  -1.919
   58    HA   LEU  10           HA       LEU  10   0.878  -8.412  -1.721
   59   1HB   LEU  10          1HB       LEU  10   0.484 -10.852   0.032
   60   2HB   LEU  10          2HB       LEU  10  -0.594  -9.461   0.010
   61    HG   LEU  10           HG       LEU  10   0.036 -10.964  -2.555
   62   1HD1  LEU  10          1HD1      LEU  10  -0.779 -12.647  -0.960
   63   2HD1  LEU  10          2HD1      LEU  10  -2.003 -12.314  -2.185
   64   3HD1  LEU  10          3HD1      LEU  10  -2.162 -11.624  -0.570
   65   1HD2  LEU  10          1HD2      LEU  10  -2.304  -9.258  -1.617
   66   2HD2  LEU  10          2HD2      LEU  10  -2.273 -10.132  -3.145
   67   3HD2  LEU  10          3HD2      LEU  10  -1.121  -8.836  -2.853
   68    H    GLY  11           H        GLY  11   2.851 -10.170   0.659
   69   1HA   GLY  11          1HA       GLY  11   2.599  -8.410   2.825
   70   2HA   GLY  11          2HA       GLY  11   4.050  -9.355   2.502
   71    H    PHE  12           H        PHE  12   4.920  -8.144   0.089
   72    HA   PHE  12           HA       PHE  12   5.930  -5.582   1.179
   73   1HB   PHE  12          1HB       PHE  12   7.461  -7.218   0.078
   74   2HB   PHE  12          2HB       PHE  12   6.621  -6.929  -1.445
   75    HD1  PHE  12           HD1      PHE  12   8.837  -5.458   1.119
   76    HD2  PHE  12           HD2      PHE  12   6.848  -4.796  -2.633
   77    HE1  PHE  12           HE1      PHE  12  10.226  -3.440   0.737
   78    HE2  PHE  12           HE2      PHE  12   8.238  -2.780  -3.013
   79    HZ   PHE  12           HZ       PHE  12   9.926  -2.100  -1.329
   80    H    LEU  13           H        LEU  13   3.877  -6.632  -1.544
   81    HA   LEU  13           HA       LEU  13   3.827  -4.059  -2.821
   82   1HB   LEU  13          1HB       LEU  13   2.938  -6.525  -3.544
   83   2HB   LEU  13          2HB       LEU  13   1.409  -5.837  -3.034
   84    HG   LEU  13           HG       LEU  13   1.684  -5.485  -5.417
   85   1HD1  LEU  13          1HD1      LEU  13   1.263  -3.154  -5.553
   86   2HD1  LEU  13          2HD1      LEU  13   2.257  -2.807  -4.141
   87   3HD1  LEU  13          3HD1      LEU  13   0.709  -3.637  -3.950
   88   1HD2  LEU  13          1HD2      LEU  13   3.574  -4.696  -6.484
   89   2HD2  LEU  13          2HD2      LEU  13   4.361  -5.449  -5.103
   90   3HD2  LEU  13          3HD2      LEU  13   4.097  -3.707  -5.126
   91    H    GLY  14           H        GLY  14   2.403  -5.221   0.066
   92   1HA   GLY  14          1HA       GLY  14   0.101  -3.457   0.129
   93   2HA   GLY  14          2HA       GLY  14   0.785  -4.313   1.512
   94    H    ALA  15           H        ALA  15   3.396  -3.290   1.412
   95    HA   ALA  15           HA       ALA  15   3.256  -0.938   2.946
   96   1HB   ALA  15          1HB       ALA  15   5.209  -2.440   2.837
   97   2HB   ALA  15          2HB       ALA  15   5.691  -0.783   2.466
   98   3HB   ALA  15          3HB       ALA  15   5.495  -1.957   1.164
   99    H    ALA  16           H        ALA  16   3.461  -1.365  -0.535
  100    HA   ALA  16           HA       ALA  16   4.220   1.250  -1.296
  101   1HB   ALA  16          1HB       ALA  16   4.250  -0.702  -2.786
  102   2HB   ALA  16          2HB       ALA  16   3.303   0.604  -3.494
  103   3HB   ALA  16          3HB       ALA  16   2.489  -0.769  -2.746
  104    H    GLY  17           H        GLY  17   0.906  -0.108  -1.016
  105   1HA   GLY  17          1HA       GLY  17  -0.379   2.358  -1.732
  106   2HA   GLY  17          2HA       GLY  17  -1.150   1.006  -0.922
  107    H    SER  18           H        SER  18   0.461   0.914   1.364
  108    HA   SER  18           HA       SER  18  -0.838   2.788   3.065
  109   1HB   SER  18          1HB       SER  18  -0.098   0.523   3.713
  110   2HB   SER  18          2HB       SER  18   1.581   1.029   3.540
  111    HG   SER  18           HG       SER  18  -0.345   2.168   5.294
  112    H    THR  19           H        THR  19   2.234   2.860   1.471
  113    HA   THR  19           HA       THR  19   3.342   5.036   3.154
  114    HB   THR  19           HB       THR  19   5.247   4.808   1.440
  115    HG1  THR  19           HG1      THR  19   5.067   3.318  -0.066
  116   1HG2  THR  19          1HG2      THR  19   5.489   3.722   3.570
  117   2HG2  THR  19          2HG2      THR  19   5.925   2.533   2.343
  118   3HG2  THR  19          3HG2      THR  19   4.347   2.453   3.125
  119    H    MET  20           H        MET  20   2.063   4.509  -0.099
  120    HA   MET  20           HA       MET  20   2.531   7.249  -0.984
  121   1HB   MET  20          1HB       MET  20   0.888   4.972  -2.130
  122   2HB   MET  20          2HB       MET  20   1.184   6.503  -2.955
  123   1HG   MET  20          1HG       MET  20   3.584   6.101  -2.947
  124   2HG   MET  20          2HG       MET  20   3.369   4.637  -1.988
  125   1HE   MET  20          1HE       MET  20   4.934   3.567  -3.971
  126   2HE   MET  20          2HE       MET  20   4.866   5.134  -4.774
  127   3HE   MET  20          3HE       MET  20   4.492   3.671  -5.681
  128    H    GLY  21           H        GLY  21   0.256   5.832   1.046
  129   1HA   GLY  21          1HA       GLY  21  -2.117   7.277   0.263
  130   2HA   GLY  21          2HA       GLY  21  -1.848   6.524   1.835
  131    H    ALA  22           H        ALA  22   0.080   7.805   3.055
  132    HA   ALA  22           HA       ALA  22  -1.002  10.438   3.588
  133   1HB   ALA  22          1HB       ALA  22   0.114   9.041   5.320
  134   2HB   ALA  22          2HB       ALA  22   0.840  10.642   5.184
  135   3HB   ALA  22          3HB       ALA  22   1.644   9.245   4.467
  136    H    ALA  23           H        ALA  23   1.083   9.282   1.194
  137    HA   ALA  23           HA       ALA  23   2.857  11.560   0.963
  138   1HB   ALA  23          1HB       ALA  23   2.001   9.587  -1.175
  139   2HB   ALA  23          2HB       ALA  23   3.334   9.328  -0.048
  140   3HB   ALA  23          3HB       ALA  23   3.418  10.636  -1.229
  141    H    SER  24           H        SER  24  -0.417  11.332   0.576
  142    HA   SER  24           HA       SER  24  -0.725  13.017  -1.808
  143   1HB   SER  24          1HB       SER  24  -3.120  13.073  -1.106
  144   2HB   SER  24          2HB       SER  24  -2.489  11.435  -1.241
  145    HG   SER  24           HG       SER  24  -3.611  11.680   0.704
  146    H    MET  25           H        MET  25   1.026  14.319  -0.151
  147    HA   MET  25           HA       MET  25   1.391  16.319   1.025
  148   1HB   MET  25          1HB       MET  25  -1.154  17.007  -0.478
  149   2HB   MET  25          2HB       MET  25  -0.129  18.185   0.342
  150   1HG   MET  25          1HG       MET  25   1.773  17.539  -1.079
  151   2HG   MET  25          2HG       MET  25   0.768  16.338  -1.889
  152   1HE   MET  25          1HE       MET  25   2.392  18.547  -3.412
  153   2HE   MET  25          2HE       MET  25   1.211  18.999  -4.640
  154   3HE   MET  25          3HE       MET  25   1.376  17.310  -4.166
  155    H    THR  26           H        THR  26  -2.068  16.889   1.134
  156    HA   THR  26           HA       THR  26  -2.546  15.692   3.710
  157    HB   THR  26           HB       THR  26  -1.098  17.375   4.622
  158    HG1  THR  26           HG1      THR  26  -2.522  17.949   6.038
  159   1HG2  THR  26          1HG2      THR  26  -1.458  19.794   4.089
  160   2HG2  THR  26          2HG2      THR  26  -2.632  19.308   2.864
  161   3HG2  THR  26          3HG2      THR  26  -0.939  18.846   2.696
  162    H    LEU  27           H        LEU  27  -3.502  17.185   0.906
  163    HA   LEU  27           HA       LEU  27  -6.314  16.882   1.533
  164   1HB   LEU  27          1HB       LEU  27  -5.490  19.199   2.527
  165   2HB   LEU  27          2HB       LEU  27  -5.566  19.742   0.856
  166    HG   LEU  27           HG       LEU  27  -7.838  18.586   2.509
  167   1HD1  LEU  27          1HD1      LEU  27  -8.828  20.805   2.211
  168   2HD1  LEU  27          2HD1      LEU  27  -7.453  21.308   1.228
  169   3HD1  LEU  27          3HD1      LEU  27  -7.230  20.955   2.941
  170   1HD2  LEU  27          1HD2      LEU  27  -7.661  19.268  -0.445
  171   2HD2  LEU  27          2HD2      LEU  27  -9.203  19.199   0.410
  172   3HD2  LEU  27          3HD2      LEU  27  -8.199  17.759   0.293
  173    H    THR  28           H        THR  28  -4.337  18.942  -0.648
  174    HA   THR  28           HA       THR  28  -5.933  18.370  -2.959
  175    HB   THR  28           HB       THR  28  -4.008  19.303  -4.234
  176    HG1  THR  28           HG1      THR  28  -2.788  18.778  -1.797
  177   1HG2  THR  28          1HG2      THR  28  -3.986  21.517  -3.112
  178   2HG2  THR  28          2HG2      THR  28  -4.711  20.781  -1.682
  179   3HG2  THR  28          3HG2      THR  28  -5.612  20.837  -3.197
  180    H    VAL  29           H        VAL  29  -6.163  16.311  -3.704
  181    HA   VAL  29           HA       VAL  29  -4.227  14.228  -3.284
  182    HB   VAL  29           HB       VAL  29  -5.599  12.955  -4.943
  183   1HG1  VAL  29          1HG1      VAL  29  -6.271  12.999  -2.591
  184   2HG1  VAL  29          2HG1      VAL  29  -7.704  13.036  -3.618
  185   3HG1  VAL  29          3HG1      VAL  29  -7.135  14.515  -2.844
  186   1HG2  VAL  29          1HG2      VAL  29  -7.064  15.606  -5.170
  187   2HG2  VAL  29          2HG2      VAL  29  -7.658  14.075  -5.809
  188   3HG2  VAL  29          3HG2      VAL  29  -6.182  14.787  -6.458
  189    H    GLN  30           H        GLN  30  -4.165  16.866  -5.354
  190    HA   GLN  30           HA       GLN  30  -3.018  15.709  -7.719
  191   1HB   GLN  30          1HB       GLN  30  -2.690  18.483  -6.534
  192   2HB   GLN  30          2HB       GLN  30  -2.192  18.017  -8.162
  193   1HG   GLN  30          1HG       GLN  30  -4.512  17.417  -8.715
  194   2HG   GLN  30          2HG       GLN  30  -5.021  17.850  -7.081
  195   1HE2  GLN  30          1HE2      GLN  30  -4.436  20.223  -6.442
  196   2HE2  GLN  30          2HE2      GLN  30  -4.597  21.397  -7.657
  197    H    ALA  31           H        ALA  31  -0.749  15.727  -8.348
  198    HA   ALA  31           HA       ALA  31   1.352  16.332  -6.461
  199   1HB   ALA  31          1HB       ALA  31   0.566  14.324  -5.330
  200   2HB   ALA  31          2HB       ALA  31   2.103  13.964  -6.118
  201   3HB   ALA  31          3HB       ALA  31   0.591  13.420  -6.844
  Start of MODEL   22
    1    H    ALA   2           H        ALA   2   6.367 -22.662  -1.102
    2    HA   ALA   2           HA       ALA   2   5.864 -21.958  -3.916
    3   1HB   ALA   2          1HB       ALA   2   5.842 -24.733  -2.693
    4   2HB   ALA   2          2HB       ALA   2   6.877 -24.178  -4.008
    5   3HB   ALA   2          3HB       ALA   2   5.137 -24.324  -4.256
    6    H    VAL   3           H        VAL   3   3.557 -22.304  -4.353
    7    HA   VAL   3           HA       VAL   3   1.306 -22.068  -3.864
    8    HB   VAL   3           HB       VAL   3   1.907 -23.257  -1.143
    9   1HG1  VAL   3          1HG1      VAL   3  -0.406 -24.098  -1.366
   10   2HG1  VAL   3          2HG1      VAL   3  -0.549 -23.268  -2.915
   11   3HG1  VAL   3          3HG1      VAL   3  -0.349 -22.336  -1.432
   12   1HG2  VAL   3          1HG2      VAL   3   2.901 -24.703  -2.843
   13   2HG2  VAL   3          2HG2      VAL   3   1.429 -24.622  -3.809
   14   3HG2  VAL   3          3HG2      VAL   3   1.416 -25.446  -2.249
   15    H    GLY   4           H        GLY   4   3.267 -21.204  -1.007
   16   1HA   GLY   4          1HA       GLY   4   1.395 -18.985  -0.376
   17   2HA   GLY   4          2HA       GLY   4   2.783 -19.479   0.567
   18    H    ILE   5           H        ILE   5   3.464 -19.032  -2.807
   19    HA   ILE   5           HA       ILE   5   5.326 -16.934  -2.227
   20    HB   ILE   5           HB       ILE   5   4.162 -17.877  -4.865
   21   1HG1  ILE   5          1HG1      ILE   5   6.831 -18.548  -3.570
   22   2HG1  ILE   5          2HG1      ILE   5   5.403 -19.570  -3.414
   23   1HG2  ILE   5          1HG2      ILE   5   5.135 -15.685  -5.182
   24   2HG2  ILE   5          2HG2      ILE   5   6.294 -16.863  -5.788
   25   3HG2  ILE   5          3HG2      ILE   5   6.544 -16.112  -4.213
   26   1HD1  ILE   5          1HD1      ILE   5   6.612 -18.747  -6.071
   27   2HD1  ILE   5          2HD1      ILE   5   5.304 -19.903  -5.816
   28   3HD1  ILE   5          3HD1      ILE   5   6.936 -20.283  -5.266
   29    H    GLY   6           H        GLY   6   2.004 -16.940  -3.417
   30   1HA   GLY   6          1HA       GLY   6   1.786 -14.222  -4.217
   31   2HA   GLY   6          2HA       GLY   6   0.451 -15.165  -3.546
   32    H    ALA   7           H        ALA   7   1.728 -15.728  -1.026
   33    HA   ALA   7           HA       ALA   7   0.889 -13.541   0.573
   34   1HB   ALA   7          1HB       ALA   7   1.232 -15.991   1.221
   35   2HB   ALA   7          2HB       ALA   7   1.812 -14.811   2.394
   36   3HB   ALA   7          3HB       ALA   7   2.956 -15.637   1.338
   37    H    LEU   8           H        LEU   8   4.013 -14.339  -0.797
   38    HA   LEU   8           HA       LEU   8   5.533 -12.436   0.810
   39   1HB   LEU   8          1HB       LEU   8   6.373 -13.662  -1.833
   40   2HB   LEU   8          2HB       LEU   8   7.413 -13.051  -0.547
   41    HG   LEU   8           HG       LEU   8   5.576 -15.462  -0.357
   42   1HD1  LEU   8          1HD1      LEU   8   7.598 -15.796  -1.755
   43   2HD1  LEU   8          2HD1      LEU   8   7.668 -16.742  -0.269
   44   3HD1  LEU   8          3HD1      LEU   8   8.602 -15.254  -0.411
   45   1HD2  LEU   8          1HD2      LEU   8   6.936 -15.780   1.833
   46   2HD2  LEU   8          2HD2      LEU   8   5.680 -14.550   1.842
   47   3HD2  LEU   8          3HD2      LEU   8   7.369 -14.078   1.664
   48    H    PHE   9           H        PHE   9   4.323 -12.410  -2.600
   49    HA   PHE   9           HA       PHE   9   5.359  -9.755  -3.073
   50   1HB   PHE   9          1HB       PHE   9   4.383 -11.417  -4.845
   51   2HB   PHE   9          2HB       PHE   9   2.814 -10.758  -4.401
   52    HD1  PHE   9           HD1      PHE   9   6.279  -9.603  -5.287
   53    HD2  PHE   9           HD2      PHE   9   2.056  -8.855  -5.621
   54    HE1  PHE   9           HE1      PHE   9   6.732  -7.683  -6.784
   55    HE2  PHE   9           HE2      PHE   9   2.517  -6.937  -7.117
   56    HZ   PHE   9           HZ       PHE   9   4.854  -6.350  -7.699
   57    H    LEU  10           H        LEU  10   2.118 -10.922  -1.917
   58    HA   LEU  10           HA       LEU  10   0.943  -8.364  -1.698
   59   1HB   LEU  10          1HB       LEU  10   0.556 -10.809   0.049
   60   2HB   LEU  10          2HB       LEU  10  -0.522  -9.418   0.034
   61    HG   LEU  10           HG       LEU  10   0.102 -10.923  -2.530
   62   1HD1  LEU  10          1HD1      LEU  10  -2.075 -11.572  -0.519
   63   2HD1  LEU  10          2HD1      LEU  10  -0.720 -12.609  -0.962
   64   3HD1  LEU  10          3HD1      LEU  10  -1.972 -12.240  -2.149
   65   1HD2  LEU  10          1HD2      LEU  10  -2.215  -9.184  -1.597
   66   2HD2  LEU  10          2HD2      LEU  10  -2.213 -10.081  -3.113
   67   3HD2  LEU  10          3HD2      LEU  10  -1.040  -8.797  -2.853
   68    H    GLY  11           H        GLY  11   2.924 -10.127   0.676
   69   1HA   GLY  11          1HA       GLY  11   2.672  -8.381   2.849
   70   2HA   GLY  11          2HA       GLY  11   4.128  -9.313   2.515
   71    H    PHE  12           H        PHE  12   4.996  -8.084   0.121
   72    HA   PHE  12           HA       PHE  12   5.975  -5.512   1.217
   73   1HB   PHE  12          1HB       PHE  12   6.708  -6.959  -1.338
   74   2HB   PHE  12          2HB       PHE  12   7.501  -5.513  -0.715
   75    HD1  PHE  12           HD1      PHE  12   8.374  -5.620   1.743
   76    HD2  PHE  12           HD2      PHE  12   7.527  -9.095  -0.643
   77    HE1  PHE  12           HE1      PHE  12   9.819  -6.990   3.218
   78    HE2  PHE  12           HE2      PHE  12   8.973 -10.459   0.836
   79    HZ   PHE  12           HZ       PHE  12  10.118  -9.408   2.766
   80    H    LEU  13           H        LEU  13   3.949  -6.584  -1.517
   81    HA   LEU  13           HA       LEU  13   3.888  -4.011  -2.796
   82   1HB   LEU  13          1HB       LEU  13   3.017  -6.480  -3.523
   83   2HB   LEU  13          2HB       LEU  13   1.481  -5.806  -3.017
   84    HG   LEU  13           HG       LEU  13   1.756  -5.445  -5.397
   85   1HD1  LEU  13          1HD1      LEU  13   1.323  -3.119  -5.532
   86   2HD1  LEU  13          2HD1      LEU  13   2.316  -2.766  -4.122
   87   3HD1  LEU  13          3HD1      LEU  13   0.773  -3.604  -3.929
   88   1HD2  LEU  13          1HD2      LEU  13   3.645  -4.648  -6.463
   89   2HD2  LEU  13          2HD2      LEU  13   4.432  -5.397  -5.081
   90   3HD2  LEU  13          3HD2      LEU  13   4.160  -3.657  -5.103
   91    H    GLY  14           H        GLY  14   2.433  -5.199   0.075
   92   1HA   GLY  14          1HA       GLY  14   0.130  -3.439   0.129
   93   2HA   GLY  14          2HA       GLY  14   0.806  -4.294   1.513
   94    H    ALA  15           H        ALA  15   3.416  -3.258   1.422
   95    HA   ALA  15           HA       ALA  15   3.258  -0.916   2.967
   96   1HB   ALA  15          1HB       ALA  15   5.517  -1.880   1.179
   97   2HB   ALA  15          2HB       ALA  15   5.213  -2.432   2.826
   98   3HB   ALA  15          3HB       ALA  15   5.687  -0.760   2.529
   99    H    ALA  16           H        ALA  16   3.464  -1.327  -0.515
  100    HA   ALA  16           HA       ALA  16   4.209   1.296  -1.265
  101   1HB   ALA  16          1HB       ALA  16   2.436  -0.619  -2.794
  102   2HB   ALA  16          2HB       ALA  16   4.191  -0.760  -2.702
  103   3HB   ALA  16          3HB       ALA  16   3.459   0.649  -3.469
  104    H    GLY  17           H        GLY  17   0.899  -0.092  -1.034
  105   1HA   GLY  17          1HA       GLY  17  -0.393   2.368  -1.750
  106   2HA   GLY  17          2HA       GLY  17  -1.164   1.005  -0.953
  107    H    SER  18           H        SER  18   0.422   0.908   1.346
  108    HA   SER  18           HA       SER  18  -0.897   2.775   3.042
  109   1HB   SER  18          1HB       SER  18  -0.163   0.513   3.701
  110   2HB   SER  18          2HB       SER  18   1.518   1.008   3.526
  111    HG   SER  18           HG       SER  18   0.455   1.115   5.704
  112    H    THR  19           H        THR  19   2.171   2.848   1.459
  113    HA   THR  19           HA       THR  19   3.295   5.008   3.146
  114    HB   THR  19           HB       THR  19   4.355   3.700   0.620
  115    HG1  THR  19           HG1      THR  19   3.978   2.372   2.576
  116   1HG2  THR  19          1HG2      THR  19   5.412   5.843   1.046
  117   2HG2  THR  19          2HG2      THR  19   6.536   4.562   1.500
  118   3HG2  THR  19          3HG2      THR  19   5.641   5.432   2.746
  119    H    MET  20           H        MET  20   2.027   4.503  -0.117
  120    HA   MET  20           HA       MET  20   2.491   7.254  -0.974
  121   1HB   MET  20          1HB       MET  20   0.856   4.998  -2.171
  122   2HB   MET  20          2HB       MET  20   1.209   6.524  -2.981
  123   1HG   MET  20          1HG       MET  20   3.364   4.659  -1.942
  124   2HG   MET  20          2HG       MET  20   2.759   4.618  -3.597
  125   1HE   MET  20          1HE       MET  20   6.403   6.364  -3.257
  126   2HE   MET  20          2HE       MET  20   5.581   4.868  -3.698
  127   3HE   MET  20          3HE       MET  20   5.685   5.343  -2.005
  128    H    GLY  21           H        GLY  21  -0.174   5.434   0.399
  129   1HA   GLY  21          1HA       GLY  21  -2.272   7.285  -0.199
  130   2HA   GLY  21          2HA       GLY  21  -2.299   6.118   1.124
  131    H    ALA  22           H        ALA  22   0.469   7.875   1.534
  132    HA   ALA  22           HA       ALA  22  -0.598   9.300   3.819
  133   1HB   ALA  22          1HB       ALA  22   1.672  10.207   4.039
  134   2HB   ALA  22          2HB       ALA  22   2.076   9.633   2.420
  135   3HB   ALA  22          3HB       ALA  22   1.744   8.476   3.710
  136    H    ALA  23           H        ALA  23   0.736  10.405   0.685
  137    HA   ALA  23           HA       ALA  23  -0.032  13.168   1.144
  138   1HB   ALA  23          1HB       ALA  23   0.654  13.519  -1.168
  139   2HB   ALA  23          2HB       ALA  23   0.640  11.781  -1.465
  140   3HB   ALA  23          3HB       ALA  23   1.830  12.477  -0.367
  141    H    SER  24           H        SER  24  -2.147  10.937   1.189
  142    HA   SER  24           HA       SER  24  -4.210  12.473  -0.223
  143   1HB   SER  24          1HB       SER  24  -3.309  11.073  -2.052
  144   2HB   SER  24          2HB       SER  24  -3.583   9.629  -1.082
  145    HG   SER  24           HG       SER  24  -5.786  11.214  -1.221
  146    H    MET  25           H        MET  25  -3.739  11.739   2.516
  147    HA   MET  25           HA       MET  25  -4.855  10.807   4.360
  148   1HB   MET  25          1HB       MET  25  -7.218  10.815   2.460
  149   2HB   MET  25          2HB       MET  25  -7.277  10.839   4.223
  150   1HG   MET  25          1HG       MET  25  -6.103  13.022   4.221
  151   2HG   MET  25          2HG       MET  25  -6.094  13.003   2.457
  152   1HE   MET  25          1HE       MET  25  -7.061  15.401   2.935
  153   2HE   MET  25          2HE       MET  25  -7.439  15.194   4.643
  154   3HE   MET  25          3HE       MET  25  -8.691  15.739   3.532
  155    H    THR  26           H        THR  26  -6.485   8.875   4.923
  156    HA   THR  26           HA       THR  26  -5.226   6.462   3.898
  157    HB   THR  26           HB       THR  26  -6.856   5.302   5.385
  158    HG1  THR  26           HG1      THR  26  -8.483   6.997   4.999
  159   1HG2  THR  26          1HG2      THR  26  -6.065   6.352   7.507
  160   2HG2  THR  26          2HG2      THR  26  -5.448   7.712   6.566
  161   3HG2  THR  26          3HG2      THR  26  -4.763   6.102   6.343
  162    H    LEU  27           H        LEU  27  -8.526   7.827   3.673
  163    HA   LEU  27           HA       LEU  27  -9.516   5.759   1.937
  164   1HB   LEU  27          1HB       LEU  27 -10.540   8.615   1.992
  165   2HB   LEU  27          2HB       LEU  27 -11.446   7.142   1.650
  166    HG   LEU  27           HG       LEU  27 -10.250   7.945   4.323
  167   1HD1  LEU  27          1HD1      LEU  27 -13.126   7.611   3.417
  168   2HD1  LEU  27          2HD1      LEU  27 -12.308   9.154   3.657
  169   3HD1  LEU  27          3HD1      LEU  27 -12.596   8.087   5.030
  170   1HD2  LEU  27          1HD2      LEU  27 -11.579   5.880   5.106
  171   2HD2  LEU  27          2HD2      LEU  27 -10.095   5.556   4.221
  172   3HD2  LEU  27          3HD2      LEU  27 -11.653   5.411   3.407
  173    H    THR  28           H        THR  28  -8.381   5.372   0.074
  174    HA   THR  28           HA       THR  28  -7.065   7.422  -1.462
  175    HB   THR  28           HB       THR  28  -6.276   5.168  -1.702
  176    HG1  THR  28           HG1      THR  28  -6.077   6.113  -3.634
  177   1HG2  THR  28          1HG2      THR  28  -9.133   4.511  -2.473
  178   2HG2  THR  28          2HG2      THR  28  -8.251   3.930  -1.063
  179   3HG2  THR  28          3HG2      THR  28  -7.780   3.397  -2.675
  180    H    VAL  29           H        VAL  29  -7.683   7.978  -3.743
  181    HA   VAL  29           HA       VAL  29 -10.386   8.954  -3.845
  182    HB   VAL  29           HB       VAL  29  -9.816   9.576  -6.195
  183   1HG1  VAL  29          1HG1      VAL  29  -7.907  11.061  -5.598
  184   2HG1  VAL  29          2HG1      VAL  29  -7.688  10.143  -4.110
  185   3HG1  VAL  29          3HG1      VAL  29  -9.170  11.065  -4.367
  186   1HG2  VAL  29          1HG2      VAL  29  -8.446   7.647  -6.805
  187   2HG2  VAL  29          2HG2      VAL  29  -7.266   8.053  -5.560
  188   3HG2  VAL  29          3HG2      VAL  29  -7.474   9.110  -6.955
  189    H    GLN  30           H        GLN  30 -12.176   8.144  -4.951
  190    HA   GLN  30           HA       GLN  30 -12.298   5.301  -5.374
  191   1HB   GLN  30          1HB       GLN  30 -14.260   6.739  -4.757
  192   2HB   GLN  30          2HB       GLN  30 -14.223   7.417  -6.385
  193   1HG   GLN  30          1HG       GLN  30 -14.624   5.223  -7.362
  194   2HG   GLN  30          2HG       GLN  30 -14.516   4.461  -5.773
  195   1HE2  GLN  30          1HE2      GLN  30 -16.287   7.359  -7.019
  196   2HE2  GLN  30          2HE2      GLN  30 -17.791   6.883  -6.394
  197    H    ALA  31           H        ALA  31 -12.940   7.844  -7.814
  198    HA   ALA  31           HA       ALA  31 -12.441   6.088 -10.026
  199   1HB   ALA  31          1HB       ALA  31 -12.521   8.096 -11.400
  200   2HB   ALA  31          2HB       ALA  31 -12.256   9.116  -9.985
  201   3HB   ALA  31          3HB       ALA  31 -13.763   8.216 -10.153
  Start of MODEL   23
    1    H    ALA   2           H        ALA   2  -2.679 -15.402  -5.820
    2    HA   ALA   2           HA       ALA   2  -1.760 -16.587  -7.433
    3   1HB   ALA   2          1HB       ALA   2   0.269 -15.155  -7.136
    4   2HB   ALA   2          2HB       ALA   2   0.657 -16.793  -7.663
    5   3HB   ALA   2          3HB       ALA   2   0.885 -16.333  -5.976
    6    H    VAL   3           H        VAL   3  -2.523 -17.611  -4.664
    7    HA   VAL   3           HA       VAL   3  -2.817 -19.677  -3.652
    8    HB   VAL   3           HB       VAL   3  -1.609 -20.902  -6.145
    9   1HG1  VAL   3          1HG1      VAL   3  -1.947 -22.442  -4.266
   10   2HG1  VAL   3          2HG1      VAL   3  -3.108 -22.776  -5.550
   11   3HG1  VAL   3          3HG1      VAL   3  -3.618 -21.898  -4.108
   12   1HG2  VAL   3          1HG2      VAL   3  -3.965 -20.990  -6.968
   13   2HG2  VAL   3          2HG2      VAL   3  -3.367 -19.337  -6.816
   14   3HG2  VAL   3          3HG2      VAL   3  -4.451 -19.999  -5.592
   15    H    GLY   4           H        GLY   4   0.350 -19.360  -5.242
   16   1HA   GLY   4          1HA       GLY   4   1.600 -21.110  -3.197
   17   2HA   GLY   4          2HA       GLY   4   2.389 -20.398  -4.585
   18    H    ILE   5           H        ILE   5   3.908 -19.015  -4.022
   19    HA   ILE   5           HA       ILE   5   4.126 -17.871  -1.384
   20    HB   ILE   5           HB       ILE   5   6.127 -16.743  -2.382
   21   1HG1  ILE   5          1HG1      ILE   5   5.351 -18.281  -4.879
   22   2HG1  ILE   5          2HG1      ILE   5   5.129 -16.541  -4.689
   23   1HG2  ILE   5          1HG2      ILE   5   6.223 -19.035  -1.406
   24   2HG2  ILE   5          2HG2      ILE   5   7.381 -18.820  -2.717
   25   3HG2  ILE   5          3HG2      ILE   5   5.881 -19.701  -3.001
   26   1HD1  ILE   5          1HD1      ILE   5   7.761 -18.041  -4.579
   27   2HD1  ILE   5          2HD1      ILE   5   7.578 -16.318  -4.252
   28   3HD1  ILE   5          3HD1      ILE   5   7.226 -16.951  -5.859
   29    H    GLY   6           H        GLY   6   1.892 -17.101  -3.421
   30   1HA   GLY   6          1HA       GLY   6   1.993 -14.423  -4.180
   31   2HA   GLY   6          2HA       GLY   6   0.509 -15.192  -3.593
   32    H    ALA   7           H        ALA   7   1.874 -15.805  -1.023
   33    HA   ALA   7           HA       ALA   7   0.985 -13.640   0.579
   34   1HB   ALA   7          1HB       ALA   7   1.289 -15.967   1.361
   35   2HB   ALA   7          2HB       ALA   7   2.196 -14.842   2.373
   36   3HB   ALA   7          3HB       ALA   7   3.033 -15.806   1.156
   37    H    LEU   8           H        LEU   8   4.154 -14.354  -0.800
   38    HA   LEU   8           HA       LEU   8   5.571 -12.368   0.812
   39   1HB   LEU   8          1HB       LEU   8   6.521 -13.584  -1.797
   40   2HB   LEU   8          2HB       LEU   8   7.503 -12.923  -0.493
   41    HG   LEU   8           HG       LEU   8   5.806 -15.437  -0.395
   42   1HD1  LEU   8          1HD1      LEU   8   7.925 -16.590  -0.176
   43   2HD1  LEU   8          2HD1      LEU   8   8.800 -15.062  -0.069
   44   3HD1  LEU   8          3HD1      LEU   8   8.032 -15.534  -1.585
   45   1HD2  LEU   8          1HD2      LEU   8   6.954 -15.662   1.917
   46   2HD2  LEU   8          2HD2      LEU   8   5.628 -14.513   1.797
   47   3HD2  LEU   8          3HD2      LEU   8   7.296 -13.935   1.782
   48    H    PHE   9           H        PHE   9   4.421 -12.428  -2.619
   49    HA   PHE   9           HA       PHE   9   5.379  -9.752  -3.126
   50   1HB   PHE   9          1HB       PHE   9   4.461 -11.443  -4.882
   51   2HB   PHE   9          2HB       PHE   9   2.863 -10.865  -4.427
   52    HD1  PHE   9           HD1      PHE   9   2.000  -8.981  -5.611
   53    HD2  PHE   9           HD2      PHE   9   6.253  -9.564  -5.375
   54    HE1  PHE   9           HE1      PHE   9   2.353  -7.044  -7.115
   55    HE2  PHE   9           HE2      PHE   9   6.600  -7.626  -6.879
   56    HZ   PHE   9           HZ       PHE   9   4.652  -6.367  -7.750
   57    H    LEU  10           H        LEU  10   2.203 -10.997  -1.925
   58    HA   LEU  10           HA       LEU  10   0.929  -8.489  -1.757
   59   1HB   LEU  10          1HB       LEU  10  -0.312 -10.548  -1.477
   60   2HB   LEU  10          2HB       LEU  10   0.629 -10.981  -0.056
   61    HG   LEU  10           HG       LEU  10  -0.344  -9.145   1.218
   62   1HD1  LEU  10          1HD1      LEU  10  -2.247  -7.812   0.074
   63   2HD1  LEU  10          2HD1      LEU  10  -1.548  -8.360  -1.450
   64   3HD1  LEU  10          3HD1      LEU  10  -0.596  -7.370  -0.345
   65   1HD2  LEU  10          1HD2      LEU  10  -2.722  -9.852   1.189
   66   2HD2  LEU  10          2HD2      LEU  10  -1.627 -11.233   1.114
   67   3HD2  LEU  10          3HD2      LEU  10  -2.444 -10.676  -0.345
   68    H    GLY  11           H        GLY  11   2.965 -10.139   0.651
   69   1HA   GLY  11          1HA       GLY  11   2.652  -8.370   2.802
   70   2HA   GLY  11          2HA       GLY  11   4.127  -9.278   2.491
   71    H    PHE  12           H        PHE  12   5.035  -8.051   0.112
   72    HA   PHE  12           HA       PHE  12   5.944  -5.467   1.221
   73   1HB   PHE  12          1HB       PHE  12   7.535  -7.052   0.134
   74   2HB   PHE  12          2HB       PHE  12   6.714  -6.775  -1.401
   75    HD1  PHE  12           HD1      PHE  12   8.897  -5.296   1.176
   76    HD2  PHE  12           HD2      PHE  12   6.862  -4.600  -2.545
   77    HE1  PHE  12           HE1      PHE  12  10.243  -3.244   0.821
   78    HE2  PHE  12           HE2      PHE  12   8.210  -2.548  -2.896
   79    HZ   PHE  12           HZ       PHE  12   9.899  -1.870  -1.214
   80    H    LEU  13           H        LEU  13   3.984  -6.529  -1.569
   81    HA   LEU  13           HA       LEU  13   3.921  -3.952  -2.825
   82   1HB   LEU  13          1HB       LEU  13   3.062  -6.423  -3.565
   83   2HB   LEU  13          2HB       LEU  13   1.520  -5.749  -3.077
   84    HG   LEU  13           HG       LEU  13   1.821  -5.395  -5.454
   85   1HD1  LEU  13          1HD1      LEU  13   0.811  -3.553  -4.028
   86   2HD1  LEU  13          2HD1      LEU  13   1.412  -3.058  -5.607
   87   3HD1  LEU  13          3HD1      LEU  13   2.360  -2.717  -4.163
   88   1HD2  LEU  13          1HD2      LEU  13   4.238  -3.625  -5.106
   89   2HD2  LEU  13          2HD2      LEU  13   3.708  -4.550  -6.502
   90   3HD2  LEU  13          3HD2      LEU  13   4.477  -5.373  -5.151
   91    H    GLY  14           H        GLY  14   2.527  -5.084   0.072
   92   1HA   GLY  14          1HA       GLY  14   0.179  -3.366   0.094
   93   2HA   GLY  14          2HA       GLY  14   0.848  -4.228   1.477
   94    H    ALA  15           H        ALA  15   3.440  -3.152   1.504
   95    HA   ALA  15           HA       ALA  15   3.183  -0.812   3.038
   96   1HB   ALA  15          1HB       ALA  15   5.636  -0.571   2.617
   97   2HB   ALA  15          2HB       ALA  15   5.509  -1.791   1.349
   98   3HB   ALA  15          3HB       ALA  15   5.186  -2.227   3.028
   99    H    ALA  16           H        ALA  16   3.575  -1.218  -0.426
  100    HA   ALA  16           HA       ALA  16   4.266   1.425  -1.154
  101   1HB   ALA  16          1HB       ALA  16   3.398   0.734  -3.393
  102   2HB   ALA  16          2HB       ALA  16   2.720  -0.712  -2.644
  103   3HB   ALA  16          3HB       ALA  16   4.467  -0.467  -2.669
  104    H    GLY  17           H        GLY  17   1.014  -0.071  -0.964
  105   1HA   GLY  17          1HA       GLY  17  -0.368   2.320  -1.751
  106   2HA   GLY  17          2HA       GLY  17  -1.092   0.948  -0.925
  107    H    SER  18           H        SER  18   0.480   0.960   1.375
  108    HA   SER  18           HA       SER  18  -0.913   2.807   3.034
  109   1HB   SER  18          1HB       SER  18   0.354   1.774   4.800
  110   2HB   SER  18          2HB       SER  18  -0.014   0.521   3.617
  111    HG   SER  18           HG       SER  18   2.064   0.772   2.781
  112    H    THR  19           H        THR  19   2.186   2.969   1.484
  113    HA   THR  19           HA       THR  19   3.194   5.187   3.172
  114    HB   THR  19           HB       THR  19   4.362   3.947   0.661
  115    HG1  THR  19           HG1      THR  19   4.514   2.306   1.978
  116   1HG2  THR  19          1HG2      THR  19   6.483   4.857   1.601
  117   2HG2  THR  19          2HG2      THR  19   5.552   5.625   2.886
  118   3HG2  THR  19          3HG2      THR  19   5.317   6.123   1.211
  119    H    MET  20           H        MET  20   1.999   4.610  -0.101
  120    HA   MET  20           HA       MET  20   2.382   7.354  -0.995
  121   1HB   MET  20          1HB       MET  20   2.374   5.284  -2.455
  122   2HB   MET  20          2HB       MET  20   0.633   5.185  -2.197
  123   1HG   MET  20          1HG       MET  20   0.959   6.359  -4.270
  124   2HG   MET  20          2HG       MET  20   0.477   7.568  -3.081
  125   1HE   MET  20          1HE       MET  20   2.798   9.767  -5.027
  126   2HE   MET  20          2HE       MET  20   1.646   9.891  -3.702
  127   3HE   MET  20          3HE       MET  20   1.247   8.922  -5.118
  128    H    GLY  21           H        GLY  21  -0.130   5.564   0.613
  129   1HA   GLY  21          1HA       GLY  21  -2.226   7.567   0.067
  130   2HA   GLY  21          2HA       GLY  21  -2.383   6.145   1.101
  131    H    ALA  22           H        ALA  22   0.220   6.941   2.464
  132    HA   ALA  22           HA       ALA  22  -0.993   8.453   4.619
  133   1HB   ALA  22          1HB       ALA  22   1.278   8.395   5.609
  134   2HB   ALA  22          2HB       ALA  22   1.913   7.760   4.093
  135   3HB   ALA  22          3HB       ALA  22   0.780   6.800   5.042
  136    H    ALA  23           H        ALA  23   0.550   9.342   1.687
  137    HA   ALA  23           HA       ALA  23   1.669  11.867   2.548
  138   1HB   ALA  23          1HB       ALA  23   1.814  12.379   0.158
  139   2HB   ALA  23          2HB       ALA  23   0.726  11.043  -0.214
  140   3HB   ALA  23          3HB       ALA  23   2.332  10.716   0.436
  141    H    SER  24           H        SER  24  -1.436  10.849   2.555
  142    HA   SER  24           HA       SER  24  -2.493  13.575   2.727
  143   1HB   SER  24          1HB       SER  24  -2.576  13.173   0.279
  144   2HB   SER  24          2HB       SER  24  -3.507  11.705   0.558
  145    HG   SER  24           HG       SER  24  -5.220  12.874   1.050
  146    H    MET  25           H        MET  25  -2.235  11.286   4.469
  147    HA   MET  25           HA       MET  25  -3.490  10.084   6.027
  148   1HB   MET  25          1HB       MET  25  -4.519  12.407   6.261
  149   2HB   MET  25          2HB       MET  25  -5.813  11.858   5.200
  150   1HG   MET  25          1HG       MET  25  -6.412  10.087   6.758
  151   2HG   MET  25          2HG       MET  25  -5.040  10.483   7.793
  152   1HE   MET  25          1HE       MET  25  -4.706  13.168   8.529
  153   2HE   MET  25          2HE       MET  25  -5.143  11.933   9.707
  154   3HE   MET  25          3HE       MET  25  -5.948  13.499   9.742
  155    H    THR  26           H        THR  26  -5.221   8.449   6.192
  156    HA   THR  26           HA       THR  26  -5.492   6.887   3.835
  157    HB   THR  26           HB       THR  26  -7.318   6.837   6.258
  158    HG1  THR  26           HG1      THR  26  -5.002   5.283   5.839
  159   1HG2  THR  26          1HG2      THR  26  -8.155   5.493   4.416
  160   2HG2  THR  26          2HG2      THR  26  -7.487   4.418   5.641
  161   3HG2  THR  26          3HG2      THR  26  -6.567   4.765   4.178
  162    H    LEU  27           H        LEU  27  -6.302   8.283   2.173
  163    HA   LEU  27           HA       LEU  27  -8.699   9.815   2.396
  164   1HB   LEU  27          1HB       LEU  27  -7.163  10.251   0.581
  165   2HB   LEU  27          2HB       LEU  27  -7.292   8.595   0.000
  166    HG   LEU  27           HG       LEU  27  -9.583   8.943  -0.710
  167   1HD1  LEU  27          1HD1      LEU  27 -10.530  10.323   0.987
  168   2HD1  LEU  27          2HD1      LEU  27 -10.570  11.314  -0.467
  169   3HD1  LEU  27          3HD1      LEU  27  -9.321  11.586   0.751
  170   1HD2  LEU  27          1HD2      LEU  27  -7.867  11.323  -1.488
  171   2HD2  LEU  27          2HD2      LEU  27  -9.258  10.722  -2.390
  172   3HD2  LEU  27          3HD2      LEU  27  -7.810   9.727  -2.238
  173    H    THR  28           H        THR  28 -10.390   8.608   3.309
  174    HA   THR  28           HA       THR  28 -11.078   5.939   2.498
  175    HB   THR  28           HB       THR  28 -13.151   6.307   3.735
  176    HG1  THR  28           HG1      THR  28 -12.477   8.966   4.212
  177   1HG2  THR  28          1HG2      THR  28 -12.206   7.020   5.885
  178   2HG2  THR  28          2HG2      THR  28 -10.828   7.740   5.053
  179   3HG2  THR  28          3HG2      THR  28 -11.061   5.992   5.024
  180    H    VAL  29           H        VAL  29 -11.487   5.622   0.333
  181    HA   VAL  29           HA       VAL  29 -12.700   7.524  -1.411
  182    HB   VAL  29           HB       VAL  29 -13.090   5.561  -2.915
  183   1HG1  VAL  29          1HG1      VAL  29 -10.378   5.594  -1.555
  184   2HG1  VAL  29          2HG1      VAL  29 -10.893   6.716  -2.815
  185   3HG1  VAL  29          3HG1      VAL  29 -10.718   4.999  -3.180
  186   1HG2  VAL  29          1HG2      VAL  29 -12.042   4.022  -0.514
  187   2HG2  VAL  29          2HG2      VAL  29 -12.245   3.347  -2.130
  188   3HG2  VAL  29          3HG2      VAL  29 -13.654   3.885  -1.217
  189    H    GLN  30           H        GLN  30 -14.064   5.927   1.173
  190    HA   GLN  30           HA       GLN  30 -16.645   5.208   0.155
  191   1HB   GLN  30          1HB       GLN  30 -15.902   6.158   2.940
  192   2HB   GLN  30          2HB       GLN  30 -17.370   5.284   2.501
  193   1HG   GLN  30          1HG       GLN  30 -16.050   3.351   1.796
  194   2HG   GLN  30          2HG       GLN  30 -14.554   4.223   2.130
  195   1HE2  GLN  30          1HE2      GLN  30 -16.932   2.179   3.526
  196   2HE2  GLN  30          2HE2      GLN  30 -16.452   2.344   5.147
  197    H    ALA  31           H        ALA  31 -18.071   6.594  -0.762
  198    HA   ALA  31           HA       ALA  31 -19.217   8.577  -1.267
  199   1HB   ALA  31          1HB       ALA  31 -20.050   9.814   0.636
  200   2HB   ALA  31          2HB       ALA  31 -18.763   9.189   1.669
  201   3HB   ALA  31          3HB       ALA  31 -20.021   8.106   1.074
  Start of MODEL   24
    1    H    ALA   2           H        ALA   2   1.205 -18.636   2.966
    2    HA   ALA   2           HA       ALA   2   2.352 -20.477   2.610
    3   1HB   ALA   2          1HB       ALA   2   1.576 -22.603   3.488
    4   2HB   ALA   2          2HB       ALA   2  -0.093 -22.033   3.507
    5   3HB   ALA   2          3HB       ALA   2   1.091 -21.332   4.611
    6    H    VAL   3           H        VAL   3   2.076 -22.777   1.388
    7    HA   VAL   3           HA       VAL   3   1.736 -23.806  -0.660
    8    HB   VAL   3           HB       VAL   3  -0.910 -22.326  -0.697
    9   1HG1  VAL   3          1HG1      VAL   3  -0.320 -23.383  -2.825
   10   2HG1  VAL   3          2HG1      VAL   3  -1.608 -24.293  -2.037
   11   3HG1  VAL   3          3HG1      VAL   3   0.050 -24.891  -1.990
   12   1HG2  VAL   3          1HG2      VAL   3  -0.612 -23.536   1.423
   13   2HG2  VAL   3          2HG2      VAL   3  -0.147 -24.988   0.537
   14   3HG2  VAL   3          3HG2      VAL   3  -1.790 -24.362   0.403
   15    H    GLY   4           H        GLY   4   0.151 -20.657  -1.272
   16   1HA   GLY   4          1HA       GLY   4   1.783 -20.357  -3.726
   17   2HA   GLY   4          2HA       GLY   4   0.425 -19.362  -3.245
   18    H    ILE   5           H        ILE   5   3.445 -18.985  -3.888
   19    HA   ILE   5           HA       ILE   5   4.564 -17.661  -1.572
   20    HB   ILE   5           HB       ILE   5   6.173 -16.725  -3.289
   21   1HG1  ILE   5          1HG1      ILE   5   4.597 -18.475  -5.205
   22   2HG1  ILE   5          2HG1      ILE   5   4.475 -16.717  -5.158
   23   1HG2  ILE   5          1HG2      ILE   5   6.542 -18.903  -2.133
   24   2HG2  ILE   5          2HG2      ILE   5   7.209 -18.894  -3.766
   25   3HG2  ILE   5          3HG2      ILE   5   5.683 -19.717  -3.441
   26   1HD1  ILE   5          1HD1      ILE   5   6.066 -17.366  -6.888
   27   2HD1  ILE   5          2HD1      ILE   5   6.980 -18.328  -5.725
   28   3HD1  ILE   5          3HD1      ILE   5   6.930 -16.572  -5.571
   29    H    GLY   6           H        GLY   6   2.018 -16.944  -3.560
   30   1HA   GLY   6          1HA       GLY   6   2.096 -14.235  -4.200
   31   2HA   GLY   6          2HA       GLY   6   0.620 -15.046  -3.654
   32    H    ALA   7           H        ALA   7   1.961 -15.757  -1.100
   33    HA   ALA   7           HA       ALA   7   1.053 -13.659   0.576
   34   1HB   ALA   7          1HB       ALA   7   3.120 -15.829   1.075
   35   2HB   ALA   7          2HB       ALA   7   1.379 -16.007   1.287
   36   3HB   ALA   7          3HB       ALA   7   2.285 -14.910   2.329
   37    H    LEU   8           H        LEU   8   4.192 -14.307  -0.865
   38    HA   LEU   8           HA       LEU   8   5.645 -12.377   0.776
   39   1HB   LEU   8          1HB       LEU   8   6.534 -13.494  -1.899
   40   2HB   LEU   8          2HB       LEU   8   7.543 -12.919  -0.573
   41    HG   LEU   8           HG       LEU   8   5.782 -15.391  -0.554
   42   1HD1  LEU   8          1HD1      LEU   8   8.792 -15.027  -0.499
   43   2HD1  LEU   8          2HD1      LEU   8   7.847 -15.640  -1.855
   44   3HD1  LEU   8          3HD1      LEU   8   7.952 -16.571  -0.362
   45   1HD2  LEU   8          1HD2      LEU   8   5.743 -14.554   1.684
   46   2HD2  LEU   8          2HD2      LEU   8   7.434 -14.056   1.616
   47   3HD2  LEU   8          3HD2      LEU   8   7.018 -15.768   1.684
   48    H    PHE   9           H        PHE   9   4.451 -12.355  -2.643
   49    HA   PHE   9           HA       PHE   9   5.348  -9.647  -3.080
   50   1HB   PHE   9          1HB       PHE   9   4.476 -11.311  -4.881
   51   2HB   PHE   9          2HB       PHE   9   2.863 -10.793  -4.410
   52    HD1  PHE   9           HD1      PHE   9   1.949  -8.828  -5.422
   53    HD2  PHE   9           HD2      PHE   9   6.203  -9.451  -5.451
   54    HE1  PHE   9           HE1      PHE   9   2.232  -6.849  -6.888
   55    HE2  PHE   9           HE2      PHE   9   6.481  -7.471  -6.913
   56    HZ   PHE   9           HZ       PHE   9   4.497  -6.170  -7.633
   57    H    LEU  10           H        LEU  10   2.179 -10.989  -1.937
   58    HA   LEU  10           HA       LEU  10   0.868  -8.507  -1.706
   59   1HB   LEU  10          1HB       LEU  10  -0.345 -10.593  -1.486
   60   2HB   LEU  10          2HB       LEU  10   0.596 -11.047  -0.070
   61    HG   LEU  10           HG       LEU  10  -0.409  -9.259   1.246
   62   1HD1  LEU  10          1HD1      LEU  10  -0.681  -7.448  -0.273
   63   2HD1  LEU  10          2HD1      LEU  10  -2.326  -7.923   0.128
   64   3HD1  LEU  10          3HD1      LEU  10  -1.614  -8.423  -1.408
   65   1HD2  LEU  10          1HD2      LEU  10  -2.494 -10.761  -0.369
   66   2HD2  LEU  10          2HD2      LEU  10  -2.766 -10.009   1.203
   67   3HD2  LEU  10          3HD2      LEU  10  -1.658 -11.373   1.058
   68    H    GLY  11           H        GLY  11   2.925 -10.189   0.663
   69   1HA   GLY  11          1HA       GLY  11   2.575  -8.487   2.860
   70   2HA   GLY  11          2HA       GLY  11   4.073  -9.349   2.525
   71    H    PHE  12           H        PHE  12   4.917  -8.042   0.161
   72    HA   PHE  12           HA       PHE  12   5.790  -5.467   1.321
   73   1HB   PHE  12          1HB       PHE  12   6.549  -6.745  -1.315
   74   2HB   PHE  12          2HB       PHE  12   7.324  -5.350  -0.571
   75    HD1  PHE  12           HD1      PHE  12   7.440  -8.906  -0.834
   76    HD2  PHE  12           HD2      PHE  12   8.137  -5.670   1.910
   77    HE1  PHE  12           HE1      PHE  12   8.895 -10.374   0.532
   78    HE2  PHE  12           HE2      PHE  12   9.592  -7.142   3.273
   79    HZ   PHE  12           HZ       PHE  12   9.972  -9.494   2.585
   80    H    LEU  13           H        LEU  13   3.798  -6.515  -1.448
   81    HA   LEU  13           HA       LEU  13   3.659  -3.939  -2.681
   82   1HB   LEU  13          1HB       LEU  13   2.759  -6.404  -3.386
   83   2HB   LEU  13          2HB       LEU  13   1.244  -5.737  -2.808
   84    HG   LEU  13           HG       LEU  13   1.412  -5.356  -5.196
   85   1HD1  LEU  13          1HD1      LEU  13   0.496  -3.528  -3.662
   86   2HD1  LEU  13          2HD1      LEU  13   0.963  -3.032  -5.288
   87   3HD1  LEU  13          3HD1      LEU  13   2.025  -2.684  -3.926
   88   1HD2  LEU  13          1HD2      LEU  13   4.103  -5.299  -4.990
   89   2HD2  LEU  13          2HD2      LEU  13   3.821  -3.561  -4.998
   90   3HD2  LEU  13          3HD2      LEU  13   3.252  -4.552  -6.337
   91    H    GLY  14           H        GLY  14   2.306  -5.167   0.224
   92   1HA   GLY  14          1HA       GLY  14   0.088  -3.250   0.387
   93   2HA   GLY  14          2HA       GLY  14   0.622  -4.343   1.664
   94    H    ALA  15           H        ALA  15   3.354  -2.927   0.590
   95    HA   ALA  15           HA       ALA  15   3.427  -0.970   2.834
   96   1HB   ALA  15          1HB       ALA  15   5.610  -1.808   0.893
   97   2HB   ALA  15          2HB       ALA  15   5.336  -2.547   2.471
   98   3HB   ALA  15          3HB       ALA  15   5.824  -0.855   2.363
   99    H    ALA  16           H        ALA  16   3.689  -1.187  -0.652
  100    HA   ALA  16           HA       ALA  16   4.350   1.499  -1.250
  101   1HB   ALA  16          1HB       ALA  16   4.597  -0.282  -2.864
  102   2HB   ALA  16          2HB       ALA  16   3.455   0.893  -3.518
  103   3HB   ALA  16          3HB       ALA  16   2.865  -0.618  -2.824
  104    H    GLY  17           H        GLY  17   1.113  -0.045  -1.131
  105   1HA   GLY  17          1HA       GLY  17  -0.295   2.357  -1.830
  106   2HA   GLY  17          2HA       GLY  17  -1.005   0.949  -1.054
  107    H    SER  18           H        SER  18   0.570   0.900   1.248
  108    HA   SER  18           HA       SER  18  -0.843   2.676   2.967
  109   1HB   SER  18          1HB       SER  18  -0.051   0.468   3.645
  110   2HB   SER  18          2HB       SER  18   1.620   0.964   3.392
  111    HG   SER  18           HG       SER  18   0.874   1.099   5.602
  112    H    THR  19           H        THR  19   2.234   2.924   1.405
  113    HA   THR  19           HA       THR  19   3.237   5.103   3.144
  114    HB   THR  19           HB       THR  19   4.385   3.924   0.592
  115    HG1  THR  19           HG1      THR  19   4.912   2.308   1.793
  116   1HG2  THR  19          1HG2      THR  19   5.573   5.608   2.814
  117   2HG2  THR  19          2HG2      THR  19   5.333   6.097   1.136
  118   3HG2  THR  19          3HG2      THR  19   6.511   4.845   1.530
  119    H    MET  20           H        MET  20   2.028   4.601  -0.140
  120    HA   MET  20           HA       MET  20   2.367   7.378  -0.955
  121   1HB   MET  20          1HB       MET  20   0.845   5.045  -2.155
  122   2HB   MET  20          2HB       MET  20   1.063   6.605  -2.951
  123   1HG   MET  20          1HG       MET  20   3.481   6.328  -2.936
  124   2HG   MET  20          2HG       MET  20   3.337   4.834  -2.010
  125   1HE   MET  20          1HE       MET  20   5.058   4.439  -4.117
  126   2HE   MET  20          2HE       MET  20   4.533   5.752  -5.166
  127   3HE   MET  20          3HE       MET  20   4.511   4.096  -5.764
  128    H    GLY  21           H        GLY  21   0.652   6.649   1.464
  129   1HA   GLY  21          1HA       GLY  21  -2.096   7.007   0.961
  130   2HA   GLY  21          2HA       GLY  21  -1.293   7.533   2.441
  131    H    ALA  22           H        ALA  22   0.183   9.616   1.917
  132    HA   ALA  22           HA       ALA  22  -1.684  11.700   1.166
  133   1HB   ALA  22          1HB       ALA  22   0.025  12.136   2.849
  134   2HB   ALA  22          2HB       ALA  22   0.289  13.207   1.473
  135   3HB   ALA  22          3HB       ALA  22   1.304  11.780   1.688
  136    H    ALA  23           H        ALA  23   1.389  10.584  -0.302
  137    HA   ALA  23           HA       ALA  23   1.009  12.171  -2.702
  138   1HB   ALA  23          1HB       ALA  23   3.245  11.453  -1.913
  139   2HB   ALA  23          2HB       ALA  23   2.935  10.912  -3.561
  140   3HB   ALA  23          3HB       ALA  23   2.803   9.775  -2.221
  141    H    SER  24           H        SER  24  -1.284  10.500  -2.101
  142    HA   SER  24           HA       SER  24  -1.252   8.213  -3.922
  143   1HB   SER  24          1HB       SER  24  -3.698   8.135  -3.420
  144   2HB   SER  24          2HB       SER  24  -2.708   8.155  -1.965
  145    HG   SER  24           HG       SER  24  -4.310  10.164  -3.091
  146    H    MET  25           H        MET  25  -1.579  11.547  -4.295
  147    HA   MET  25           HA       MET  25  -2.350  12.908  -6.054
  148   1HB   MET  25          1HB       MET  25  -1.545  10.399  -7.555
  149   2HB   MET  25          2HB       MET  25  -1.881  11.951  -8.320
  150   1HG   MET  25          1HG       MET  25  -0.082  13.004  -7.019
  151   2HG   MET  25          2HG       MET  25   0.240  11.472  -6.205
  152   1HE   MET  25          1HE       MET  25   2.467  13.150  -7.710
  153   2HE   MET  25          2HE       MET  25   3.352  11.809  -8.430
  154   3HE   MET  25          3HE       MET  25   2.685  11.646  -6.807
  155    H    THR  26           H        THR  26  -3.350  10.075  -7.848
  156    HA   THR  26           HA       THR  26  -6.127  10.131  -6.979
  157    HB   THR  26           HB       THR  26  -5.479  11.257  -9.724
  158    HG1  THR  26           HG1      THR  26  -6.192  13.189  -8.865
  159   1HG2  THR  26          1HG2      THR  26  -7.948  11.744  -9.710
  160   2HG2  THR  26          2HG2      THR  26  -8.077  10.780  -8.240
  161   3HG2  THR  26          3HG2      THR  26  -7.560  10.025  -9.748
  162    H    LEU  27           H        LEU  27  -7.365   8.455  -8.063
  163    HA   LEU  27           HA       LEU  27  -5.759   6.199  -8.867
  164   1HB   LEU  27          1HB       LEU  27  -7.859   5.806  -7.735
  165   2HB   LEU  27          2HB       LEU  27  -8.747   6.720  -8.949
  166    HG   LEU  27           HG       LEU  27  -8.345   5.022 -10.630
  167   1HD1  LEU  27          1HD1      LEU  27  -7.109   2.878  -9.900
  168   2HD1  LEU  27          2HD1      LEU  27  -6.478   3.835  -8.559
  169   3HD1  LEU  27          3HD1      LEU  27  -6.113   4.294 -10.224
  170   1HD2  LEU  27          1HD2      LEU  27 -10.188   4.626  -9.016
  171   2HD2  LEU  27          2HD2      LEU  27  -9.083   3.694  -8.004
  172   3HD2  LEU  27          3HD2      LEU  27  -9.505   3.114  -9.615
  173    H    THR  28           H        THR  28  -4.587   6.718 -10.747
  174    HA   THR  28           HA       THR  28  -5.939   6.389 -13.262
  175    HB   THR  28           HB       THR  28  -6.687   8.657 -13.055
  176    HG1  THR  28           HG1      THR  28  -4.955   7.924 -14.870
  177   1HG2  THR  28          1HG2      THR  28  -5.299   9.365 -11.197
  178   2HG2  THR  28          2HG2      THR  28  -5.066  10.494 -12.532
  179   3HG2  THR  28          3HG2      THR  28  -3.846   9.266 -12.193
  180    H    VAL  29           H        VAL  29  -3.253   6.457 -11.317
  181    HA   VAL  29           HA       VAL  29  -1.136   7.012 -13.160
  182    HB   VAL  29           HB       VAL  29  -1.088   5.069 -10.832
  183   1HG1  VAL  29          1HG1      VAL  29   1.321   5.752 -10.768
  184   2HG1  VAL  29          2HG1      VAL  29   1.066   6.658 -12.259
  185   3HG1  VAL  29          3HG1      VAL  29   0.884   4.904 -12.252
  186   1HG2  VAL  29          1HG2      VAL  29  -1.956   7.237 -10.099
  187   2HG2  VAL  29          2HG2      VAL  29  -0.636   8.067 -10.922
  188   3HG2  VAL  29          3HG2      VAL  29  -0.298   7.044  -9.527
  189    H    GLN  30           H        GLN  30  -2.801   3.976 -12.311
  190    HA   GLN  30           HA       GLN  30  -1.222   2.258 -13.948
  191   1HB   GLN  30          1HB       GLN  30  -2.880   1.496 -12.225
  192   2HB   GLN  30          2HB       GLN  30  -4.176   1.970 -13.321
  193   1HG   GLN  30          1HG       GLN  30  -3.403   0.388 -15.001
  194   2HG   GLN  30          2HG       GLN  30  -1.996  -0.018 -14.018
  195   1HE2  GLN  30          1HE2      GLN  30  -2.295  -1.468 -12.230
  196   2HE2  GLN  30          2HE2      GLN  30  -3.772  -2.246 -11.919
  197    H    ALA  31           H        ALA  31  -1.608   1.486 -16.097
  198    HA   ALA  31           HA       ALA  31  -2.485   3.476 -17.966
  199   1HB   ALA  31          1HB       ALA  31  -2.232   1.684 -19.659
  200   2HB   ALA  31          2HB       ALA  31  -2.072   0.497 -18.363
  201   3HB   ALA  31          3HB       ALA  31  -0.844   1.745 -18.571
  Start of MODEL   25
    1    H    ALA   2           H        ALA   2  -1.386 -20.844  -5.498
    2    HA   ALA   2           HA       ALA   2  -1.267 -23.453  -5.136
    3   1HB   ALA   2          1HB       ALA   2   1.593 -22.450  -5.043
    4   2HB   ALA   2          2HB       ALA   2   0.953 -23.621  -6.195
    5   3HB   ALA   2          3HB       ALA   2   1.049 -24.031  -4.483
    6    H    VAL   3           H        VAL   3  -1.363 -20.414  -4.212
    7    HA   VAL   3           HA       VAL   3  -1.569 -19.288  -2.173
    8    HB   VAL   3           HB       VAL   3  -2.048 -22.056  -1.058
    9   1HG1  VAL   3          1HG1      VAL   3  -1.852 -20.313   0.640
   10   2HG1  VAL   3          2HG1      VAL   3  -3.539 -20.804   0.496
   11   3HG1  VAL   3          3HG1      VAL   3  -2.995 -19.296  -0.239
   12   1HG2  VAL   3          1HG2      VAL   3  -4.442 -21.616  -1.609
   13   2HG2  VAL   3          2HG2      VAL   3  -3.434 -21.743  -3.049
   14   3HG2  VAL   3          3HG2      VAL   3  -3.946 -20.158  -2.469
   15    H    GLY   4           H        GLY   4   0.595 -18.670  -1.974
   16   1HA   GLY   4          1HA       GLY   4   1.905 -19.327   0.402
   17   2HA   GLY   4          2HA       GLY   4   2.666 -20.313  -0.831
   18    H    ILE   5           H        ILE   5   3.371 -18.989  -2.847
   19    HA   ILE   5           HA       ILE   5   5.164 -16.923  -1.978
   20    HB   ILE   5           HB       ILE   5   4.289 -17.725  -4.771
   21   1HG1  ILE   5          1HG1      ILE   5   6.783 -18.500  -3.213
   22   2HG1  ILE   5          2HG1      ILE   5   5.344 -19.513  -3.299
   23   1HG2  ILE   5          1HG2      ILE   5   6.508 -16.686  -5.405
   24   2HG2  ILE   5          2HG2      ILE   5   6.606 -16.038  -3.769
   25   3HG2  ILE   5          3HG2      ILE   5   5.307 -15.527  -4.844
   26   1HD1  ILE   5          1HD1      ILE   5   7.028 -18.599  -5.648
   27   2HD1  ILE   5          2HD1      ILE   5   5.533 -19.522  -5.783
   28   3HD1  ILE   5          3HD1      ILE   5   6.942 -20.234  -4.995
   29    H    GLY   6           H        GLY   6   1.940 -16.877  -3.375
   30   1HA   GLY   6          1HA       GLY   6   1.749 -14.171  -4.180
   31   2HA   GLY   6          2HA       GLY   6   0.396 -15.086  -3.495
   32    H    ALA   7           H        ALA   7   1.727 -15.640  -0.997
   33    HA   ALA   7           HA       ALA   7   0.915 -13.440   0.612
   34   1HB   ALA   7          1HB       ALA   7   2.955 -15.579   1.337
   35   2HB   ALA   7          2HB       ALA   7   1.222 -15.889   1.269
   36   3HB   ALA   7          3HB       ALA   7   1.862 -14.720   2.422
   37    H    LEU   8           H        LEU   8   4.018 -14.273  -0.821
   38    HA   LEU   8           HA       LEU   8   5.579 -12.420   0.788
   39   1HB   LEU   8          1HB       LEU   8   6.667 -14.372  -0.134
   40   2HB   LEU   8          2HB       LEU   8   6.171 -13.943  -1.766
   41    HG   LEU   8           HG       LEU   8   7.650 -12.016  -1.786
   42   1HD1  LEU   8          1HD1      LEU   8   9.196 -11.686   0.261
   43   2HD1  LEU   8          2HD1      LEU   8   8.029 -12.664   1.150
   44   3HD1  LEU   8          3HD1      LEU   8   7.530 -11.137   0.424
   45   1HD2  LEU   8          1HD2      LEU   8   9.057 -14.430  -0.602
   46   2HD2  LEU   8          2HD2      LEU   8   9.829 -13.146  -1.533
   47   3HD2  LEU   8          3HD2      LEU   8   8.653 -14.210  -2.304
   48    H    PHE   9           H        PHE   9   4.400 -12.357  -2.637
   49    HA   PHE   9           HA       PHE   9   5.421  -9.689  -3.067
   50   1HB   PHE   9          1HB       PHE   9   4.468 -11.356  -4.864
   51   2HB   PHE   9          2HB       PHE   9   2.900 -10.670  -4.457
   52    HD1  PHE   9           HD1      PHE   9   2.205  -8.754  -5.694
   53    HD2  PHE   9           HD2      PHE   9   6.404  -9.579  -5.260
   54    HE1  PHE   9           HE1      PHE   9   2.739  -6.843  -7.179
   55    HE2  PHE   9           HE2      PHE   9   6.931  -7.666  -6.746
   56    HZ   PHE   9           HZ       PHE   9   5.100  -6.300  -7.705
   57    H    LEU  10           H        LEU  10   2.179 -10.903  -1.963
   58    HA   LEU  10           HA       LEU  10   0.964  -8.375  -1.747
   59   1HB   LEU  10          1HB       LEU  10  -0.327 -10.410  -1.508
   60   2HB   LEU  10          2HB       LEU  10   0.605 -10.893  -0.096
   61    HG   LEU  10           HG       LEU  10  -0.324  -9.065   1.218
   62   1HD1  LEU  10          1HD1      LEU  10  -0.532  -7.251  -0.309
   63   2HD1  LEU  10          2HD1      LEU  10  -2.192  -7.657   0.109
   64   3HD1  LEU  10          3HD1      LEU  10  -1.515  -8.194  -1.430
   65   1HD2  LEU  10          1HD2      LEU  10  -2.507 -10.448  -0.373
   66   2HD2  LEU  10          2HD2      LEU  10  -2.684  -9.741   1.233
   67   3HD2  LEU  10          3HD2      LEU  10  -1.650 -11.151   0.999
   68    H    GLY  11           H        GLY  11   2.954 -10.121   0.633
   69   1HA   GLY  11          1HA       GLY  11   2.690  -8.386   2.815
   70   2HA   GLY  11          2HA       GLY  11   4.151  -9.309   2.476
   71    H    PHE  12           H        PHE  12   5.025  -8.065   0.096
   72    HA   PHE  12           HA       PHE  12   5.982  -5.492   1.208
   73   1HB   PHE  12          1HB       PHE  12   7.557  -7.097   0.128
   74   2HB   PHE  12          2HB       PHE  12   6.733  -6.824  -1.407
   75    HD1  PHE  12           HD1      PHE  12   6.904  -4.666  -2.572
   76    HD2  PHE  12           HD2      PHE  12   8.923  -5.335   1.162
   77    HE1  PHE  12           HE1      PHE  12   8.263  -2.624  -2.940
   78    HE2  PHE  12           HE2      PHE  12  10.280  -3.293   0.792
   79    HZ   PHE  12           HZ       PHE  12   9.950  -1.940  -1.258
   80    H    LEU  13           H        LEU  13   3.998  -6.567  -1.557
   81    HA   LEU  13           HA       LEU  13   3.925  -3.990  -2.823
   82   1HB   LEU  13          1HB       LEU  13   3.089  -6.464  -3.575
   83   2HB   LEU  13          2HB       LEU  13   1.541  -5.809  -3.082
   84    HG   LEU  13           HG       LEU  13   1.838  -5.429  -5.457
   85   1HD1  LEU  13          1HD1      LEU  13   0.817  -3.610  -3.984
   86   2HD1  LEU  13          2HD1      LEU  13   1.376  -3.108  -5.577
   87   3HD1  LEU  13          3HD1      LEU  13   2.351  -2.752  -4.156
   88   1HD2  LEU  13          1HD2      LEU  13   4.511  -5.349  -5.108
   89   2HD2  LEU  13          2HD2      LEU  13   4.215  -3.613  -5.125
   90   3HD2  LEU  13          3HD2      LEU  13   3.730  -4.603  -6.495
   91    H    GLY  14           H        GLY  14   2.452  -5.214   0.021
   92   1HA   GLY  14          1HA       GLY  14   0.135  -3.470   0.065
   93   2HA   GLY  14          2HA       GLY  14   0.798  -4.339   1.447
   94    H    ALA  15           H        ALA  15   3.406  -3.292   1.396
   95    HA   ALA  15           HA       ALA  15   3.223  -0.961   2.961
   96   1HB   ALA  15          1HB       ALA  15   5.198  -2.388   2.924
   97   2HB   ALA  15          2HB       ALA  15   5.677  -0.762   2.438
   98   3HB   ALA  15          3HB       ALA  15   5.473  -2.022   1.221
   99    H    ALA  16           H        ALA  16   3.489  -1.347  -0.522
  100    HA   ALA  16           HA       ALA  16   4.227   1.287  -1.237
  101   1HB   ALA  16          1HB       ALA  16   3.262   0.648  -3.461
  102   2HB   ALA  16          2HB       ALA  16   2.617  -0.811  -2.708
  103   3HB   ALA  16          3HB       ALA  16   4.362  -0.561  -2.794
  104    H    GLY  17           H        GLY  17   0.925  -0.127  -1.065
  105   1HA   GLY  17          1HA       GLY  17  -0.375   2.333  -1.771
  106   2HA   GLY  17          2HA       GLY  17  -1.146   0.958  -0.996
  107    H    SER  18           H        SER  18   0.415   0.842   1.313
  108    HA   SER  18           HA       SER  18  -0.925   2.684   3.020
  109   1HB   SER  18          1HB       SER  18  -0.274   0.488   3.779
  110   2HB   SER  18          2HB       SER  18   1.418   0.808   3.409
  111    HG   SER  18           HG       SER  18   1.533   1.565   5.358
  112    H    THR  19           H        THR  19   2.162   2.786   1.468
  113    HA   THR  19           HA       THR  19   3.255   4.934   3.190
  114    HB   THR  19           HB       THR  19   4.351   3.660   0.661
  115    HG1  THR  19           HG1      THR  19   4.917   3.123   3.386
  116   1HG2  THR  19          1HG2      THR  19   5.391   5.804   1.126
  117   2HG2  THR  19          2HG2      THR  19   6.517   4.524   1.577
  118   3HG2  THR  19          3HG2      THR  19   5.604   5.375   2.823
  119    H    MET  20           H        MET  20   2.024   4.454  -0.090
  120    HA   MET  20           HA       MET  20   2.481   7.211  -0.923
  121   1HB   MET  20          1HB       MET  20   0.852   4.954  -2.128
  122   2HB   MET  20          2HB       MET  20   1.186   6.489  -2.930
  123   1HG   MET  20          1HG       MET  20   3.367   4.642  -1.916
  124   2HG   MET  20          2HG       MET  20   2.749   4.598  -3.566
  125   1HE   MET  20          1HE       MET  20   6.258   6.266  -3.848
  126   2HE   MET  20          2HE       MET  20   5.181   5.052  -4.531
  127   3HE   MET  20          3HE       MET  20   5.680   4.928  -2.846
  128    H    GLY  21           H        GLY  21   0.086   5.621   0.908
  129   1HA   GLY  21          1HA       GLY  21  -2.205   7.204   0.160
  130   2HA   GLY  21          2HA       GLY  21  -2.041   6.285   1.656
  131    H    ALA  22           H        ALA  22   0.371   7.605   2.561
  132    HA   ALA  22           HA       ALA  22  -0.831   9.904   3.848
  133   1HB   ALA  22          1HB       ALA  22   2.061   8.990   3.731
  134   2HB   ALA  22          2HB       ALA  22   0.889   8.569   4.981
  135   3HB   ALA  22          3HB       ALA  22   1.436  10.238   4.811
  136    H    ALA  23           H        ALA  23   0.742   9.446   0.846
  137    HA   ALA  23           HA       ALA  23   1.926  12.073   0.578
  138   1HB   ALA  23          1HB       ALA  23   2.139  11.518  -1.784
  139   2HB   ALA  23          2HB       ALA  23   0.987  10.194  -1.608
  140   3HB   ALA  23          3HB       ALA  23   2.565  10.099  -0.823
  141    H    SER  24           H        SER  24  -1.270  10.765   0.138
  142    HA   SER  24           HA       SER  24  -2.269  13.050  -1.407
  143   1HB   SER  24          1HB       SER  24  -4.451  11.981  -1.150
  144   2HB   SER  24          2HB       SER  24  -3.256  10.771  -1.609
  145    HG   SER  24           HG       SER  24  -3.275   9.971   0.404
  146    H    MET  25           H        MET  25  -1.031  13.298   1.394
  147    HA   MET  25           HA       MET  25  -1.408  14.558   3.332
  148   1HB   MET  25          1HB       MET  25  -1.930  16.183   1.352
  149   2HB   MET  25          2HB       MET  25  -3.618  15.966   1.801
  150   1HG   MET  25          1HG       MET  25  -2.923  16.618   4.182
  151   2HG   MET  25          2HG       MET  25  -1.378  17.111   3.492
  152   1HE   MET  25          1HE       MET  25  -2.132  19.203   4.836
  153   2HE   MET  25          2HE       MET  25  -3.861  18.931   5.035
  154   3HE   MET  25          3HE       MET  25  -3.292  20.412   4.269
  155    H    THR  26           H        THR  26  -4.389  15.675   3.546
  156    HA   THR  26           HA       THR  26  -5.300  13.518   5.297
  157    HB   THR  26           HB       THR  26  -7.312  15.009   5.579
  158    HG1  THR  26           HG1      THR  26  -7.169  15.914   3.459
  159   1HG2  THR  26          1HG2      THR  26  -4.656  16.444   5.829
  160   2HG2  THR  26          2HG2      THR  26  -5.251  15.241   6.972
  161   3HG2  THR  26          3HG2      THR  26  -6.116  16.764   6.765
  162    H    LEU  27           H        LEU  27  -7.635  12.710   5.026
  163    HA   LEU  27           HA       LEU  27  -7.872  11.405   2.474
  164   1HB   LEU  27          1HB       LEU  27  -8.757  10.314   4.437
  165   2HB   LEU  27          2HB       LEU  27  -9.782  11.694   4.814
  166    HG   LEU  27           HG       LEU  27 -11.193  11.268   2.890
  167   1HD1  LEU  27          1HD1      LEU  27  -9.676  10.579   1.184
  168   2HD1  LEU  27          2HD1      LEU  27 -10.695   9.173   1.473
  169   3HD1  LEU  27          3HD1      LEU  27  -9.068   9.236   2.153
  170   1HD2  LEU  27          1HD2      LEU  27 -11.601   9.915   4.929
  171   2HD2  LEU  27          2HD2      LEU  27 -10.553   8.650   4.286
  172   3HD2  LEU  27          3HD2      LEU  27 -12.065   9.046   3.466
  173    H    THR  28           H        THR  28  -8.411  12.525   0.655
  174    HA   THR  28           HA       THR  28 -10.909  14.019   0.522
  175    HB   THR  28           HB       THR  28  -8.323  15.557   0.114
  176    HG1  THR  28           HG1      THR  28 -10.077  15.278   2.266
  177   1HG2  THR  28          1HG2      THR  28 -11.247  16.342   0.006
  178   2HG2  THR  28          2HG2      THR  28 -10.099  16.349  -1.334
  179   3HG2  THR  28          3HG2      THR  28  -9.913  17.494  -0.006
  180    H    VAL  29           H        VAL  29 -11.457  14.528  -1.693
  181    HA   VAL  29           HA       VAL  29 -10.531  12.653  -3.614
  182    HB   VAL  29           HB       VAL  29 -11.716  14.090  -5.279
  183   1HG1  VAL  29          1HG1      VAL  29 -13.168  13.669  -2.647
  184   2HG1  VAL  29          2HG1      VAL  29 -12.965  12.463  -3.918
  185   3HG1  VAL  29          3HG1      VAL  29 -13.942  13.901  -4.215
  186   1HG2  VAL  29          1HG2      VAL  29 -12.900  16.107  -4.394
  187   2HG2  VAL  29          2HG2      VAL  29 -11.148  16.292  -4.374
  188   3HG2  VAL  29          3HG2      VAL  29 -12.013  15.932  -2.881
  189    H    GLN  30           H        GLN  30  -9.980  14.103  -5.940
  190    HA   GLN  30           HA       GLN  30  -8.118  14.923  -7.105
  191   1HB   GLN  30          1HB       GLN  30  -8.965  17.005  -5.959
  192   2HB   GLN  30          2HB       GLN  30  -7.802  16.706  -4.670
  193   1HG   GLN  30          1HG       GLN  30  -5.950  16.838  -6.261
  194   2HG   GLN  30          2HG       GLN  30  -7.084  17.039  -7.596
  195   1HE2  GLN  30          1HE2      GLN  30  -7.617  18.573  -4.445
  196   2HE2  GLN  30          2HE2      GLN  30  -7.358  20.164  -4.979
  197    H    ALA  31           H        ALA  31  -7.136  12.735  -6.553
  198    HA   ALA  31           HA       ALA  31  -4.435  13.103  -5.606
  199   1HB   ALA  31          1HB       ALA  31  -5.469  13.038  -3.400
  200   2HB   ALA  31          2HB       ALA  31  -4.601  11.525  -3.664
  201   3HB   ALA  31          3HB       ALA  31  -6.357  11.574  -3.823
  Start of MODEL   26
    1    H    ALA   2           H        ALA   2   1.979 -19.210   3.105
    2    HA   ALA   2           HA       ALA   2   1.817 -21.210   2.018
    3   1HB   ALA   2          1HB       ALA   2  -0.053 -22.426   3.064
    4   2HB   ALA   2          2HB       ALA   2  -0.841 -20.896   3.450
    5   3HB   ALA   2          3HB       ALA   2   0.689 -21.320   4.220
    6    H    VAL   3           H        VAL   3   0.187 -22.759   0.835
    7    HA   VAL   3           HA       VAL   3  -1.035 -23.204  -1.088
    8    HB   VAL   3           HB       VAL   3  -2.359 -20.505  -0.694
    9   1HG1  VAL   3          1HG1      VAL   3  -3.277 -23.130  -1.901
   10   2HG1  VAL   3          2HG1      VAL   3  -2.954 -21.631  -2.771
   11   3HG1  VAL   3          3HG1      VAL   3  -4.312 -21.725  -1.653
   12   1HG2  VAL   3          1HG2      VAL   3  -4.002 -21.777   0.718
   13   2HG2  VAL   3          2HG2      VAL   3  -2.405 -21.654   1.454
   14   3HG2  VAL   3          3HG2      VAL   3  -2.904 -23.157   0.678
   15    H    GLY   4           H        GLY   4   0.946 -20.460  -0.874
   16   1HA   GLY   4          1HA       GLY   4   2.004 -20.680  -3.419
   17   2HA   GLY   4          2HA       GLY   4   0.719 -19.493  -3.570
   18    H    ILE   5           H        ILE   5   3.556 -19.037  -3.877
   19    HA   ILE   5           HA       ILE   5   4.625 -17.681  -1.562
   20    HB   ILE   5           HB       ILE   5   5.324 -17.530  -4.513
   21   1HG1  ILE   5          1HG1      ILE   5   6.744 -18.975  -2.248
   22   2HG1  ILE   5          2HG1      ILE   5   5.566 -19.758  -3.298
   23   1HG2  ILE   5          1HG2      ILE   5   6.699 -16.392  -2.058
   24   2HG2  ILE   5          2HG2      ILE   5   6.189 -15.530  -3.509
   25   3HG2  ILE   5          3HG2      ILE   5   7.545 -16.647  -3.584
   26   1HD1  ILE   5          1HD1      ILE   5   8.124 -18.413  -4.219
   27   2HD1  ILE   5          2HD1      ILE   5   6.939 -19.191  -5.270
   28   3HD1  ILE   5          3HD1      ILE   5   7.858 -20.154  -4.112
   29    H    GLY   6           H        GLY   6   2.062 -17.015  -3.550
   30   1HA   GLY   6          1HA       GLY   6   2.105 -14.308  -4.214
   31   2HA   GLY   6          2HA       GLY   6   0.643 -15.136  -3.656
   32    H    ALA   7           H        ALA   7   1.984 -15.803  -1.094
   33    HA   ALA   7           HA       ALA   7   1.053 -13.693   0.554
   34   1HB   ALA   7          1HB       ALA   7   3.143 -15.833   1.082
   35   2HB   ALA   7          2HB       ALA   7   1.404 -16.026   1.297
   36   3HB   ALA   7          3HB       ALA   7   2.299 -14.906   2.323
   37    H    LEU   8           H        LEU   8   4.195 -14.319  -0.880
   38    HA   LEU   8           HA       LEU   8   5.635 -12.377   0.746
   39   1HB   LEU   8          1HB       LEU   8   6.846 -14.251  -0.185
   40   2HB   LEU   8          2HB       LEU   8   6.331 -13.839  -1.816
   41    HG   LEU   8           HG       LEU   8   7.682 -11.819  -1.807
   42   1HD1  LEU   8          1HD1      LEU   8   9.203 -11.426   0.249
   43   2HD1  LEU   8          2HD1      LEU   8   8.094 -12.482   1.122
   44   3HD1  LEU   8          3HD1      LEU   8   7.509 -10.978   0.412
   45   1HD2  LEU   8          1HD2      LEU   8   9.221 -14.171  -0.663
   46   2HD2  LEU   8          2HD2      LEU   8   9.931 -12.820  -1.544
   47   3HD2  LEU   8          3HD2      LEU   8   8.827 -13.924  -2.364
   48    H    PHE   9           H        PHE   9   4.408 -12.366  -2.663
   49    HA   PHE   9           HA       PHE   9   5.288  -9.656  -3.126
   50   1HB   PHE   9          1HB       PHE   9   4.397 -11.327  -4.907
   51   2HB   PHE   9          2HB       PHE   9   2.786 -10.821  -4.410
   52    HD1  PHE   9           HD1      PHE   9   1.840  -8.862  -5.404
   53    HD2  PHE   9           HD2      PHE   9   6.097  -9.456  -5.512
   54    HE1  PHE   9           HE1      PHE   9   2.082  -6.881  -6.874
   55    HE2  PHE   9           HE2      PHE   9   6.334  -7.471  -6.978
   56    HZ   PHE   9           HZ       PHE   9   4.329  -6.185  -7.660
   57    H    LEU  10           H        LEU  10   2.125 -10.992  -1.948
   58    HA   LEU  10           HA       LEU  10   0.832  -8.494  -1.686
   59   1HB   LEU  10          1HB       LEU  10   0.554 -10.981   0.021
   60   2HB   LEU  10          2HB       LEU  10  -0.586  -9.641   0.023
   61    HG   LEU  10           HG       LEU  10   0.111 -11.073  -2.566
   62   1HD1  LEU  10          1HD1      LEU  10  -0.625 -12.826  -1.028
   63   2HD1  LEU  10          2HD1      LEU  10  -1.894 -12.498  -2.207
   64   3HD1  LEU  10          3HD1      LEU  10  -2.031 -11.866  -0.568
   65   1HD2  LEU  10          1HD2      LEU  10  -1.140  -8.994  -2.835
   66   2HD2  LEU  10          2HD2      LEU  10  -2.301  -9.483  -1.604
   67   3HD2  LEU  10          3HD2      LEU  10  -2.234 -10.336  -3.144
   68    H    GLY  11           H        GLY  11   2.886 -10.204   0.660
   69   1HA   GLY  11          1HA       GLY  11   2.545  -8.505   2.861
   70   2HA   GLY  11          2HA       GLY  11   4.037  -9.376   2.525
   71    H    PHE  12           H        PHE  12   4.890  -8.069   0.163
   72    HA   PHE  12           HA       PHE  12   5.781  -5.503   1.333
   73   1HB   PHE  12          1HB       PHE  12   7.376  -7.034   0.180
   74   2HB   PHE  12          2HB       PHE  12   6.524  -6.736  -1.333
   75    HD1  PHE  12           HD1      PHE  12   6.619  -4.536  -2.433
   76    HD2  PHE  12           HD2      PHE  12   8.726  -5.275   1.241
   77    HE1  PHE  12           HE1      PHE  12   7.929  -2.457  -2.764
   78    HE2  PHE  12           HE2      PHE  12  10.033  -3.194   0.907
   79    HZ   PHE  12           HZ       PHE  12   9.634  -1.786  -1.095
   80    H    LEU  13           H        LEU  13   3.775  -6.522  -1.442
   81    HA   LEU  13           HA       LEU  13   3.656  -3.939  -2.660
   82   1HB   LEU  13          1HB       LEU  13   2.732  -6.392  -3.376
   83   2HB   LEU  13          2HB       LEU  13   1.225  -5.712  -2.795
   84    HG   LEU  13           HG       LEU  13   1.393  -5.324  -5.178
   85   1HD1  LEU  13          1HD1      LEU  13   2.039  -2.665  -3.898
   86   2HD1  LEU  13          2HD1      LEU  13   0.498  -3.492  -3.645
   87   3HD1  LEU  13          3HD1      LEU  13   0.975  -2.992  -5.265
   88   1HD2  LEU  13          1HD2      LEU  13   3.831  -3.566  -4.965
   89   2HD2  LEU  13          2HD2      LEU  13   3.236  -4.514  -6.320
   90   3HD2  LEU  13          3HD2      LEU  13   4.075  -5.314  -4.999
   91    H    GLY  14           H        GLY  14   2.311  -5.155   0.247
   92   1HA   GLY  14          1HA       GLY  14   0.097  -3.234   0.419
   93   2HA   GLY  14          2HA       GLY  14   0.637  -4.324   1.695
   94    H    ALA  15           H        ALA  15   3.368  -2.907   0.613
   95    HA   ALA  15           HA       ALA  15   3.438  -0.946   2.852
   96   1HB   ALA  15          1HB       ALA  15   5.838  -0.822   2.365
   97   2HB   ALA  15          2HB       ALA  15   5.618  -1.800   0.916
   98   3HB   ALA  15          3HB       ALA  15   5.351  -2.511   2.509
   99    H    ALA  16           H        ALA  16   3.707  -1.169  -0.632
  100    HA   ALA  16           HA       ALA  16   4.365   1.517  -1.236
  101   1HB   ALA  16          1HB       ALA  16   4.532  -0.439  -2.766
  102   2HB   ALA  16          2HB       ALA  16   3.684   0.922  -3.499
  103   3HB   ALA  16          3HB       ALA  16   2.773  -0.459  -2.888
  104    H    GLY  17           H        GLY  17   1.132  -0.033  -1.111
  105   1HA   GLY  17          1HA       GLY  17  -0.282   2.361  -1.823
  106   2HA   GLY  17          2HA       GLY  17  -0.990   0.956  -1.038
  107    H    SER  18           H        SER  18   0.593   0.930   1.265
  108    HA   SER  18           HA       SER  18  -0.831   2.712   2.970
  109   1HB   SER  18          1HB       SER  18   1.665   1.068   3.459
  110   2HB   SER  18          2HB       SER  18   0.613   1.731   4.707
  111    HG   SER  18           HG       SER  18   0.119  -0.309   2.826
  112    H    THR  19           H        THR  19   2.244   2.965   1.403
  113    HA   THR  19           HA       THR  19   3.240   5.158   3.127
  114    HB   THR  19           HB       THR  19   4.392   3.987   0.574
  115    HG1  THR  19           HG1      THR  19   4.252   2.375   2.085
  116   1HG2  THR  19          1HG2      THR  19   5.590   5.633   2.820
  117   2HG2  THR  19          2HG2      THR  19   5.328   6.163   1.158
  118   3HG2  THR  19          3HG2      THR  19   6.513   4.904   1.505
  119    H    MET  20           H        MET  20   2.020   4.639  -0.151
  120    HA   MET  20           HA       MET  20   2.356   7.409  -0.985
  121   1HB   MET  20          1HB       MET  20   0.806   5.080  -2.157
  122   2HB   MET  20          2HB       MET  20   1.040   6.629  -2.967
  123   1HG   MET  20          1HG       MET  20   3.339   4.902  -2.002
  124   2HG   MET  20          2HG       MET  20   2.686   4.821  -3.639
  125   1HE   MET  20          1HE       MET  20   5.801   5.542  -3.079
  126   2HE   MET  20          2HE       MET  20   5.887   6.644  -4.451
  127   3HE   MET  20          3HE       MET  20   4.897   5.190  -4.559
  128    H    GLY  21           H        GLY  21   0.516   6.419   1.382
  129   1HA   GLY  21          1HA       GLY  21  -2.150   7.272   0.620
  130   2HA   GLY  21          2HA       GLY  21  -1.581   7.017   2.270
  131    H    ALA  22           H        ALA  22   0.721   8.964   1.218
  132    HA   ALA  22           HA       ALA  22  -0.378  11.316   2.508
  133   1HB   ALA  22          1HB       ALA  22   2.127  10.972   0.828
  134   2HB   ALA  22          2HB       ALA  22   2.030  10.827   2.583
  135   3HB   ALA  22          3HB       ALA  22   1.750  12.388   1.809
  136    H    ALA  23           H        ALA  23   0.225  10.386  -0.873
  137    HA   ALA  23           HA       ALA  23  -0.568  12.945  -1.969
  138   1HB   ALA  23          1HB       ALA  23  -0.596  11.777  -4.118
  139   2HB   ALA  23          2HB       ALA  23  -0.566  10.217  -3.294
  140   3HB   ALA  23          3HB       ALA  23   0.831  11.290  -3.203
  141    H    SER  24           H        SER  24  -2.355  10.905  -0.214
  142    HA   SER  24           HA       SER  24  -4.769  10.721  -1.870
  143   1HB   SER  24          1HB       SER  24  -4.203   9.052  -0.086
  144   2HB   SER  24          2HB       SER  24  -4.456  10.310   1.120
  145    HG   SER  24           HG       SER  24  -6.532  10.084   0.883
  146    H    MET  25           H        MET  25  -3.653  13.406  -1.433
  147    HA   MET  25           HA       MET  25  -4.360  15.563  -0.824
  148   1HB   MET  25          1HB       MET  25  -7.075  14.225  -1.037
  149   2HB   MET  25          2HB       MET  25  -6.768  15.960  -1.105
  150   1HG   MET  25          1HG       MET  25  -5.430  15.681  -3.130
  151   2HG   MET  25          2HG       MET  25  -5.620  13.930  -3.041
  152   1HE   MET  25          1HE       MET  25  -7.662  15.002  -6.135
  153   2HE   MET  25          2HE       MET  25  -6.063  14.625  -5.497
  154   3HE   MET  25          3HE       MET  25  -6.637  16.290  -5.488
  155    H    THR  26           H        THR  26  -3.409  14.935   1.393
  156    HA   THR  26           HA       THR  26  -5.176  14.200   3.543
  157    HB   THR  26           HB       THR  26  -3.341  14.860   5.013
  158    HG1  THR  26           HG1      THR  26  -1.675  16.078   4.271
  159   1HG2  THR  26          1HG2      THR  26  -2.323  13.635   2.435
  160   2HG2  THR  26          2HG2      THR  26  -3.084  12.757   3.762
  161   3HG2  THR  26          3HG2      THR  26  -1.520  13.536   4.002
  162    H    LEU  27           H        LEU  27  -4.186  16.491   5.287
  163    HA   LEU  27           HA       LEU  27  -5.107  18.493   6.086
  164   1HB   LEU  27          1HB       LEU  27  -5.588  19.209   3.178
  165   2HB   LEU  27          2HB       LEU  27  -5.221  20.291   4.519
  166    HG   LEU  27           HG       LEU  27  -3.338  18.257   3.280
  167   1HD1  LEU  27          1HD1      LEU  27  -2.077  20.250   2.587
  168   2HD1  LEU  27          2HD1      LEU  27  -3.284  21.290   3.343
  169   3HD1  LEU  27          3HD1      LEU  27  -3.718  20.307   1.945
  170   1HD2  LEU  27          1HD2      LEU  27  -1.654  19.433   4.831
  171   2HD2  LEU  27          2HD2      LEU  27  -2.793  18.345   5.616
  172   3HD2  LEU  27          3HD2      LEU  27  -3.050  20.089   5.689
  173    H    THR  28           H        THR  28  -6.898  16.392   6.129
  174    HA   THR  28           HA       THR  28  -9.374  16.957   4.772
  175    HB   THR  28           HB       THR  28 -10.354  15.325   6.291
  176    HG1  THR  28           HG1      THR  28  -9.557  15.812   8.243
  177   1HG2  THR  28          1HG2      THR  28  -7.500  14.565   5.608
  178   2HG2  THR  28          2HG2      THR  28  -8.866  14.492   4.494
  179   3HG2  THR  28          3HG2      THR  28  -8.828  13.445   5.911
  180    H    VAL  29           H        VAL  29 -11.387  17.674   5.893
  181    HA   VAL  29           HA       VAL  29 -11.034  20.181   7.205
  182    HB   VAL  29           HB       VAL  29 -13.484  20.018   7.692
  183   1HG1  VAL  29          1HG1      VAL  29 -14.185  19.956   5.346
  184   2HG1  VAL  29          2HG1      VAL  29 -12.694  19.124   4.904
  185   3HG1  VAL  29          3HG1      VAL  29 -12.635  20.786   5.486
  186   1HG2  VAL  29          1HG2      VAL  29 -14.683  18.014   6.809
  187   2HG2  VAL  29          2HG2      VAL  29 -13.625  17.618   8.161
  188   3HG2  VAL  29          3HG2      VAL  29 -13.126  17.242   6.512
  189    H    GLN  30           H        GLN  30 -11.070  20.747   9.384
  190    HA   GLN  30           HA       GLN  30 -10.246  18.751  11.289
  191   1HB   GLN  30          1HB       GLN  30  -9.661  21.189  11.420
  192   2HB   GLN  30          2HB       GLN  30 -11.337  21.525  11.856
  193   1HG   GLN  30          1HG       GLN  30 -11.141  20.142  13.853
  194   2HG   GLN  30          2HG       GLN  30  -9.509  19.654  13.392
  195   1HE2  GLN  30          1HE2      GLN  30 -10.997  21.644  15.526
  196   2HE2  GLN  30          2HE2      GLN  30  -9.866  22.907  15.610
  197    H    ALA  31           H        ALA  31 -13.341  20.369  10.641
  198    HA   ALA  31           HA       ALA  31 -14.848  18.154  11.713
  199   1HB   ALA  31          1HB       ALA  31 -14.176  19.061  13.870
  200   2HB   ALA  31          2HB       ALA  31 -15.884  19.420  13.617
  201   3HB   ALA  31          3HB       ALA  31 -14.673  20.681  13.383
  Start of MODEL   27
    1    H    ALA   2           H        ALA   2  -3.407 -18.566  -2.110
    2    HA   ALA   2           HA       ALA   2  -4.503 -19.001  -4.570
    3   1HB   ALA   2          1HB       ALA   2  -3.502 -16.813  -5.260
    4   2HB   ALA   2          2HB       ALA   2  -2.836 -18.183  -6.148
    5   3HB   ALA   2          3HB       ALA   2  -1.913 -17.449  -4.837
    6    H    VAL   3           H        VAL   3  -3.010 -19.855  -2.032
    7    HA   VAL   3           HA       VAL   3  -1.728 -21.665  -1.355
    8    HB   VAL   3           HB       VAL   3  -1.917 -22.651  -4.215
    9   1HG1  VAL   3          1HG1      VAL   3  -1.898 -24.869  -3.075
   10   2HG1  VAL   3          2HG1      VAL   3  -1.645 -24.047  -1.537
   11   3HG1  VAL   3          3HG1      VAL   3  -0.418 -23.951  -2.800
   12   1HG2  VAL   3          1HG2      VAL   3  -3.914 -22.868  -1.940
   13   2HG2  VAL   3          2HG2      VAL   3  -4.010 -23.780  -3.447
   14   3HG2  VAL   3          3HG2      VAL   3  -4.158 -22.024  -3.469
   15    H    GLY   4           H        GLY   4  -0.612 -19.718  -3.987
   16   1HA   GLY   4          1HA       GLY   4   2.106 -20.881  -3.953
   17   2HA   GLY   4          2HA       GLY   4   1.549 -19.552  -4.947
   18    H    ILE   5           H        ILE   5   3.759 -18.899  -4.104
   19    HA   ILE   5           HA       ILE   5   4.024 -17.886  -1.413
   20    HB   ILE   5           HB       ILE   5   6.069 -16.784  -2.377
   21   1HG1  ILE   5          1HG1      ILE   5   5.247 -18.227  -4.917
   22   2HG1  ILE   5          2HG1      ILE   5   5.074 -16.489  -4.678
   23   1HG2  ILE   5          1HG2      ILE   5   5.721 -19.715  -3.075
   24   2HG2  ILE   5          2HG2      ILE   5   6.093 -19.102  -1.465
   25   3HG2  ILE   5          3HG2      ILE   5   7.252 -18.894  -2.775
   26   1HD1  ILE   5          1HD1      ILE   5   7.160 -16.937  -5.862
   27   2HD1  ILE   5          2HD1      ILE   5   7.666 -18.060  -4.600
   28   3HD1  ILE   5          3HD1      ILE   5   7.523 -16.339  -4.243
   29    H    GLY   6           H        GLY   6   1.850 -16.953  -3.463
   30   1HA   GLY   6          1HA       GLY   6   2.049 -14.267  -4.137
   31   2HA   GLY   6          2HA       GLY   6   0.535 -14.997  -3.588
   32    H    ALA   7           H        ALA   7   1.860 -15.711  -1.011
   33    HA   ALA   7           HA       ALA   7   1.005 -13.555   0.621
   34   1HB   ALA   7          1HB       ALA   7   3.015 -15.764   1.172
   35   2HB   ALA   7          2HB       ALA   7   1.269 -15.895   1.377
   36   3HB   ALA   7          3HB       ALA   7   2.196 -14.800   2.401
   37    H    LEU   8           H        LEU   8   4.152 -14.303  -0.781
   38    HA   LEU   8           HA       LEU   8   5.616 -12.370   0.853
   39   1HB   LEU   8          1HB       LEU   8   6.530 -13.541  -1.789
   40   2HB   LEU   8          2HB       LEU   8   7.527 -12.951  -0.459
   41    HG   LEU   8           HG       LEU   8   5.755 -15.413  -0.441
   42   1HD1  LEU   8          1HD1      LEU   8   8.758 -15.146  -0.112
   43   2HD1  LEU   8          2HD1      LEU   8   7.975 -15.541  -1.640
   44   3HD1  LEU   8          3HD1      LEU   8   7.836 -16.641  -0.268
   45   1HD2  LEU   8          1HD2      LEU   8   5.613 -14.541   1.777
   46   2HD2  LEU   8          2HD2      LEU   8   7.303 -14.035   1.777
   47   3HD2  LEU   8          3HD2      LEU   8   6.893 -15.748   1.857
   48    H    PHE   9           H        PHE   9   4.447 -12.345  -2.581
   49    HA   PHE   9           HA       PHE   9   5.431  -9.659  -3.021
   50   1HB   PHE   9          1HB       PHE   9   3.075 -11.056  -4.342
   51   2HB   PHE   9          2HB       PHE   9   3.734  -9.502  -4.852
   52    HD1  PHE   9           HD1      PHE   9   4.312 -13.137  -4.720
   53    HD2  PHE   9           HD2      PHE   9   5.973  -9.343  -5.873
   54    HE1  PHE   9           HE1      PHE   9   6.045 -14.300  -6.059
   55    HE2  PHE   9           HE2      PHE   9   7.703 -10.510  -7.212
   56    HZ   PHE   9           HZ       PHE   9   7.740 -12.987  -7.304
   57    H    LEU  10           H        LEU  10   2.208 -10.905  -1.902
   58    HA   LEU  10           HA       LEU  10   0.973  -8.385  -1.685
   59   1HB   LEU  10          1HB       LEU  10   0.653 -10.838   0.063
   60   2HB   LEU  10          2HB       LEU  10  -0.450  -9.468   0.081
   61    HG   LEU  10           HG       LEU  10   0.155 -10.924  -2.517
   62   1HD1  LEU  10          1HD1      LEU  10  -1.849 -12.318  -2.125
   63   2HD1  LEU  10          2HD1      LEU  10  -1.994 -11.648  -0.500
   64   3HD1  LEU  10          3HD1      LEU  10  -0.599 -12.641  -0.923
   65   1HD2  LEU  10          1HD2      LEU  10  -2.193  -9.269  -1.511
   66   2HD2  LEU  10          2HD2      LEU  10  -2.183 -10.129  -3.048
   67   3HD2  LEU  10          3HD2      LEU  10  -1.047  -8.817  -2.771
   68    H    GLY  11           H        GLY  11   3.004 -10.071   0.696
   69   1HA   GLY  11          1HA       GLY  11   2.724  -8.310   2.856
   70   2HA   GLY  11          2HA       GLY  11   4.200  -9.209   2.518
   71    H    PHE  12           H        PHE  12   5.049  -7.993   0.123
   72    HA   PHE  12           HA       PHE  12   5.944  -5.373   1.174
   73   1HB   PHE  12          1HB       PHE  12   7.560  -6.965   0.134
   74   2HB   PHE  12          2HB       PHE  12   6.730  -6.753  -1.405
   75    HD1  PHE  12           HD1      PHE  12   8.892  -5.150   1.115
   76    HD2  PHE  12           HD2      PHE  12   6.839  -4.616  -2.623
   77    HE1  PHE  12           HE1      PHE  12  10.202  -3.088   0.688
   78    HE2  PHE  12           HE2      PHE  12   8.148  -2.555  -3.046
   79    HZ   PHE  12           HZ       PHE  12   9.829  -1.790  -1.392
   80    H    LEU  13           H        LEU  13   4.004  -6.556  -1.582
   81    HA   LEU  13           HA       LEU  13   3.880  -4.022  -2.914
   82   1HB   LEU  13          1HB       LEU  13   3.082  -6.526  -3.588
   83   2HB   LEU  13          2HB       LEU  13   1.525  -5.892  -3.096
   84    HG   LEU  13           HG       LEU  13   1.764  -5.574  -5.476
   85   1HD1  LEU  13          1HD1      LEU  13   0.766  -3.708  -4.067
   86   2HD1  LEU  13          2HD1      LEU  13   1.313  -3.252  -5.679
   87   3HD1  LEU  13          3HD1      LEU  13   2.298  -2.855  -4.275
   88   1HD2  LEU  13          1HD2      LEU  13   3.610  -4.708  -6.591
   89   2HD2  LEU  13          2HD2      LEU  13   4.416  -5.527  -5.262
   90   3HD2  LEU  13          3HD2      LEU  13   4.179  -3.781  -5.208
   91    H    GLY  14           H        GLY  14   2.439  -5.185  -0.032
   92   1HA   GLY  14          1HA       GLY  14   0.108  -3.445  -0.026
   93   2HA   GLY  14          2HA       GLY  14   0.747  -4.324   1.361
   94    H    ALA  15           H        ALA  15   3.357  -3.274   1.389
   95    HA   ALA  15           HA       ALA  15   3.128  -0.952   2.957
   96   1HB   ALA  15          1HB       ALA  15   5.449  -1.902   1.245
   97   2HB   ALA  15          2HB       ALA  15   5.105  -2.425   2.894
   98   3HB   ALA  15          3HB       ALA  15   5.575  -0.754   2.578
   99    H    ALA  16           H        ALA  16   3.504  -1.310  -0.516
  100    HA   ALA  16           HA       ALA  16   4.245   1.329  -1.203
  101   1HB   ALA  16          1HB       ALA  16   3.577   0.703  -3.440
  102   2HB   ALA  16          2HB       ALA  16   2.533  -0.576  -2.817
  103   3HB   ALA  16          3HB       ALA  16   4.286  -0.713  -2.664
  104    H    GLY  17           H        GLY  17   0.959  -0.094  -1.032
  105   1HA   GLY  17          1HA       GLY  17  -0.365   2.347  -1.767
  106   2HA   GLY  17          2HA       GLY  17  -1.124   0.975  -0.975
  107    H    SER  18           H        SER  18   0.445   0.905   1.335
  108    HA   SER  18           HA       SER  18  -0.918   2.745   3.024
  109   1HB   SER  18          1HB       SER  18   1.513   1.018   3.541
  110   2HB   SER  18          2HB       SER  18   0.468   1.716   4.775
  111    HG   SER  18           HG       SER  18  -0.138  -0.422   4.311
  112    H    THR  19           H        THR  19   2.193   2.884   1.497
  113    HA   THR  19           HA       THR  19   3.217   5.062   3.229
  114    HB   THR  19           HB       THR  19   5.168   4.896   1.568
  115    HG1  THR  19           HG1      THR  19   4.277   2.423   0.785
  116   1HG2  THR  19          1HG2      THR  19   5.365   3.766   3.680
  117   2HG2  THR  19          2HG2      THR  19   5.868   2.619   2.439
  118   3HG2  THR  19          3HG2      THR  19   4.268   2.484   3.167
  119    H    MET  20           H        MET  20   2.031   4.550  -0.062
  120    HA   MET  20           HA       MET  20   2.462   7.303  -0.910
  121   1HB   MET  20          1HB       MET  20   2.453   5.327  -2.447
  122   2HB   MET  20          2HB       MET  20   0.727   5.138  -2.134
  123   1HG   MET  20          1HG       MET  20   0.270   7.346  -3.048
  124   2HG   MET  20          2HG       MET  20   1.995   7.659  -3.243
  125   1HE   MET  20          1HE       MET  20   1.298   7.381  -6.912
  126   2HE   MET  20          2HE       MET  20   2.473   7.947  -5.729
  127   3HE   MET  20          3HE       MET  20   0.775   8.375  -5.547
  128    H    GLY  21           H        GLY  21  -0.209   5.443   0.428
  129   1HA   GLY  21          1HA       GLY  21  -2.175   7.589   0.013
  130   2HA   GLY  21          2HA       GLY  21  -2.437   6.093   0.910
  131    H    ALA  22           H        ALA  22   0.434   7.463   1.934
  132    HA   ALA  22           HA       ALA  22  -0.652   8.130   4.535
  133   1HB   ALA  22          1HB       ALA  22   1.661   7.271   4.191
  134   2HB   ALA  22          2HB       ALA  22   1.638   8.791   5.086
  135   3HB   ALA  22          3HB       ALA  22   2.076   8.779   3.377
  136    H    ALA  23           H        ALA  23  -0.296   9.879   1.598
  137    HA   ALA  23           HA       ALA  23   0.003  12.525   2.728
  138   1HB   ALA  23          1HB       ALA  23  -1.161  11.667   0.062
  139   2HB   ALA  23          2HB       ALA  23   0.534  12.047   0.366
  140   3HB   ALA  23          3HB       ALA  23  -0.690  13.310   0.490
  141    H    SER  24           H        SER  24  -2.593  10.325   2.569
  142    HA   SER  24           HA       SER  24  -4.744  12.325   2.605
  143   1HB   SER  24          1HB       SER  24  -6.204  10.394   3.008
  144   2HB   SER  24          2HB       SER  24  -5.101  10.055   1.679
  145    HG   SER  24           HG       SER  24  -4.717   9.303   4.394
  146    H    MET  25           H        MET  25  -3.290  13.308   4.515
  147    HA   MET  25           HA       MET  25  -3.106  13.781   6.808
  148   1HB   MET  25          1HB       MET  25  -5.906  12.611   6.817
  149   2HB   MET  25          2HB       MET  25  -5.214  13.657   8.058
  150   1HG   MET  25          1HG       MET  25  -4.949  15.464   6.413
  151   2HG   MET  25          2HG       MET  25  -5.599  14.420   5.148
  152   1HE   MET  25          1HE       MET  25  -6.448  17.352   6.404
  153   2HE   MET  25          2HE       MET  25  -8.196  17.306   6.186
  154   3HE   MET  25          3HE       MET  25  -7.140  16.736   4.895
  155    H    THR  26           H        THR  26  -3.786  12.585   9.107
  156    HA   THR  26           HA       THR  26  -2.114  10.240   9.177
  157    HB   THR  26           HB       THR  26  -2.903  10.064  11.547
  158    HG1  THR  26           HG1      THR  26  -5.008  11.150  10.706
  159   1HG2  THR  26          1HG2      THR  26  -1.039  11.578  10.877
  160   2HG2  THR  26          2HG2      THR  26  -1.929  12.175  12.278
  161   3HG2  THR  26          3HG2      THR  26  -2.208  12.886  10.687
  162    H    LEU  27           H        LEU  27  -5.647  10.659   9.597
  163    HA   LEU  27           HA       LEU  27  -6.228   8.202   8.200
  164   1HB   LEU  27          1HB       LEU  27  -5.408   7.140  10.225
  165   2HB   LEU  27          2HB       LEU  27  -6.381   8.203  11.233
  166    HG   LEU  27           HG       LEU  27  -8.440   7.177  10.429
  167   1HD1  LEU  27          1HD1      LEU  27  -8.034   6.684   8.138
  168   2HD1  LEU  27          2HD1      LEU  27  -8.190   5.105   8.895
  169   3HD1  LEU  27          3HD1      LEU  27  -6.591   5.741   8.504
  170   1HD2  LEU  27          1HD2      LEU  27  -7.199   6.065  12.271
  171   2HD2  LEU  27          2HD2      LEU  27  -6.382   5.047  11.086
  172   3HD2  LEU  27          3HD2      LEU  27  -8.126   4.911  11.311
  173    H    THR  28           H        THR  28  -8.266   8.480   7.389
  174    HA   THR  28           HA       THR  28 -10.449   9.575   8.939
  175    HB   THR  28           HB       THR  28  -9.418  11.714   8.574
  176    HG1  THR  28           HG1      THR  28 -11.577  11.022   6.954
  177   1HG2  THR  28          1HG2      THR  28  -9.125  10.819   5.693
  178   2HG2  THR  28          2HG2      THR  28  -7.821  11.091   6.849
  179   3HG2  THR  28          3HG2      THR  28  -8.784  12.450   6.271
  180    H    VAL  29           H        VAL  29  -9.627   7.380   6.997
  181    HA   VAL  29           HA       VAL  29 -11.159   7.740   4.581
  182    HB   VAL  29           HB       VAL  29 -10.413   5.137   5.948
  183   1HG1  VAL  29          1HG1      VAL  29 -12.029   4.845   4.147
  184   2HG1  VAL  29          2HG1      VAL  29 -10.450   4.297   3.589
  185   3HG1  VAL  29          3HG1      VAL  29 -11.068   5.866   3.077
  186   1HG2  VAL  29          1HG2      VAL  29  -8.426   6.538   5.661
  187   2HG2  VAL  29          2HG2      VAL  29  -8.868   6.856   3.983
  188   3HG2  VAL  29          3HG2      VAL  29  -8.401   5.230   4.478
  189    H    GLN  30           H        GLN  30 -13.338   7.993   4.592
  190    HA   GLN  30           HA       GLN  30 -15.055   7.413   6.762
  191   1HB   GLN  30          1HB       GLN  30 -16.917   7.553   5.082
  192   2HB   GLN  30          2HB       GLN  30 -15.807   8.917   5.022
  193   1HG   GLN  30          1HG       GLN  30 -15.469   6.507   3.200
  194   2HG   GLN  30          2HG       GLN  30 -16.494   7.868   2.760
  195   1HE2  GLN  30          1HE2      GLN  30 -14.970  10.042   3.722
  196   2HE2  GLN  30          2HE2      GLN  30 -13.498  10.108   2.878
  197    H    ALA  31           H        ALA  31 -17.153   5.856   5.907
  198    HA   ALA  31           HA       ALA  31 -16.318   3.311   4.817
  199   1HB   ALA  31          1HB       ALA  31 -16.701   3.492   7.823
  200   2HB   ALA  31          2HB       ALA  31 -15.192   3.116   6.992
  201   3HB   ALA  31          3HB       ALA  31 -16.548   1.991   6.910
  Start of MODEL   28
    1    H    ALA   2           H        ALA   2   1.191 -26.394   2.885
    2    HA   ALA   2           HA       ALA   2   2.951 -24.769   1.892
    3   1HB   ALA   2          1HB       ALA   2   3.044 -27.204   1.681
    4   2HB   ALA   2          2HB       ALA   2   3.376 -26.467   0.114
    5   3HB   ALA   2          3HB       ALA   2   1.791 -27.167   0.440
    6    H    VAL   3           H        VAL   3   3.433 -24.334  -0.568
    7    HA   VAL   3           HA       VAL   3   2.969 -22.994  -2.413
    8    HB   VAL   3           HB       VAL   3   0.151 -24.075  -2.205
    9   1HG1  VAL   3          1HG1      VAL   3   0.195 -23.815  -4.651
   10   2HG1  VAL   3          2HG1      VAL   3   1.850 -23.212  -4.562
   11   3HG1  VAL   3          3HG1      VAL   3   0.530 -22.278  -3.855
   12   1HG2  VAL   3          1HG2      VAL   3   2.623 -25.338  -3.426
   13   2HG2  VAL   3          2HG2      VAL   3   0.978 -25.932  -3.650
   14   3HG2  VAL   3          3HG2      VAL   3   1.712 -25.953  -2.047
   15    H    GLY   4           H        GLY   4   2.993 -20.898  -1.981
   16   1HA   GLY   4          1HA       GLY   4   0.701 -19.319  -1.770
   17   2HA   GLY   4          2HA       GLY   4   1.255 -19.549  -0.123
   18    H    ILE   5           H        ILE   5   3.103 -19.055  -3.150
   19    HA   ILE   5           HA       ILE   5   4.950 -17.247  -1.878
   20    HB   ILE   5           HB       ILE   5   5.668 -16.807  -4.268
   21   1HG1  ILE   5          1HG1      ILE   5   3.548 -18.883  -4.914
   22   2HG1  ILE   5          2HG1      ILE   5   3.361 -17.159  -5.229
   23   1HG2  ILE   5          1HG2      ILE   5   6.594 -18.669  -2.893
   24   2HG2  ILE   5          2HG2      ILE   5   6.541 -19.071  -4.608
   25   3HG2  ILE   5          3HG2      ILE   5   5.326 -19.727  -3.511
   26   1HD1  ILE   5          1HD1      ILE   5   5.424 -17.227  -6.626
   27   2HD1  ILE   5          2HD1      ILE   5   4.149 -18.270  -7.254
   28   3HD1  ILE   5          3HD1      ILE   5   5.506 -18.970  -6.373
   29    H    GLY   6           H        GLY   6   1.899 -16.877  -3.507
   30   1HA   GLY   6          1HA       GLY   6   1.904 -14.157  -4.227
   31   2HA   GLY   6          2HA       GLY   6   0.470 -14.999  -3.620
   32    H    ALA   7           H        ALA   7   1.767 -15.677  -1.090
   33    HA   ALA   7           HA       ALA   7   0.947 -13.529   0.567
   34   1HB   ALA   7          1HB       ALA   7   1.178 -15.899   1.273
   35   2HB   ALA   7          2HB       ALA   7   2.080 -14.822   2.337
   36   3HB   ALA   7          3HB       ALA   7   2.930 -15.767   1.113
   37    H    LEU   8           H        LEU   8   4.071 -14.320  -0.837
   38    HA   LEU   8           HA       LEU   8   5.589 -12.451   0.816
   39   1HB   LEU   8          1HB       LEU   8   6.447 -13.628  -1.844
   40   2HB   LEU   8          2HB       LEU   8   7.476 -13.056  -0.533
   41    HG   LEU   8           HG       LEU   8   5.625 -15.460  -0.424
   42   1HD1  LEU   8          1HD1      LEU   8   8.649 -15.228  -0.486
   43   2HD1  LEU   8          2HD1      LEU   8   7.629 -15.827  -1.794
   44   3HD1  LEU   8          3HD1      LEU   8   7.749 -16.730  -0.283
   45   1HD2  LEU   8          1HD2      LEU   8   6.940 -15.841   1.777
   46   2HD2  LEU   8          2HD2      LEU   8   5.703 -14.590   1.797
   47   3HD2  LEU   8          3HD2      LEU   8   7.404 -14.142   1.654
   48    H    PHE   9           H        PHE   9   4.415 -12.376  -2.605
   49    HA   PHE   9           HA       PHE   9   5.447  -9.712  -3.033
   50   1HB   PHE   9          1HB       PHE   9   4.468 -11.373  -4.822
   51   2HB   PHE   9          2HB       PHE   9   2.908 -10.678  -4.398
   52    HD1  PHE   9           HD1      PHE   9   2.214  -8.746  -5.615
   53    HD2  PHE   9           HD2      PHE   9   6.410  -9.621  -5.251
   54    HE1  PHE   9           HE1      PHE   9   2.744  -6.844  -7.111
   55    HE2  PHE   9           HE2      PHE   9   6.934  -7.714  -6.745
   56    HZ   PHE   9           HZ       PHE   9   5.103  -6.327  -7.675
   57    H    LEU  10           H        LEU  10   2.208 -10.907  -1.909
   58    HA   LEU  10           HA       LEU  10   0.998  -8.379  -1.687
   59   1HB   LEU  10          1HB       LEU  10  -0.288 -10.413  -1.426
   60   2HB   LEU  10          2HB       LEU  10   0.650 -10.886  -0.017
   61    HG   LEU  10           HG       LEU  10  -0.272  -9.047   1.289
   62   1HD1  LEU  10          1HD1      LEU  10  -1.478  -8.200  -1.360
   63   2HD1  LEU  10          2HD1      LEU  10  -0.494  -7.245  -0.250
   64   3HD1  LEU  10          3HD1      LEU  10  -2.151  -7.653   0.177
   65   1HD2  LEU  10          1HD2      LEU  10  -1.592 -11.142   1.084
   66   2HD2  LEU  10          2HD2      LEU  10  -2.469 -10.438  -0.274
   67   3HD2  LEU  10          3HD2      LEU  10  -2.624  -9.733   1.335
   68    H    GLY  11           H        GLY  11   3.010 -10.104   0.693
   69   1HA   GLY  11          1HA       GLY  11   2.750  -8.364   2.867
   70   2HA   GLY  11          2HA       GLY  11   4.219  -9.271   2.520
   71    H    PHE  12           H        PHE  12   5.057  -8.027   0.132
   72    HA   PHE  12           HA       PHE  12   5.991  -5.433   1.217
   73   1HB   PHE  12          1HB       PHE  12   6.748  -6.872  -1.338
   74   2HB   PHE  12          2HB       PHE  12   7.519  -5.418  -0.708
   75    HD1  PHE  12           HD1      PHE  12   8.443  -5.510   1.713
   76    HD2  PHE  12           HD2      PHE  12   7.541  -9.012  -0.614
   77    HE1  PHE  12           HE1      PHE  12   9.906  -6.868   3.183
   78    HE2  PHE  12           HE2      PHE  12   9.004 -10.365   0.858
   79    HZ   PHE  12           HZ       PHE  12  10.187  -9.295   2.756
   80    H    LEU  13           H        LEU  13   3.995  -6.559  -1.517
   81    HA   LEU  13           HA       LEU  13   3.882  -4.000  -2.815
   82   1HB   LEU  13          1HB       LEU  13   3.057  -6.489  -3.519
   83   2HB   LEU  13          2HB       LEU  13   1.510  -5.846  -3.005
   84    HG   LEU  13           HG       LEU  13   1.756  -5.490  -5.388
   85   1HD1  LEU  13          1HD1      LEU  13   0.753  -3.660  -3.914
   86   2HD1  LEU  13          2HD1      LEU  13   1.265  -3.177  -5.528
   87   3HD1  LEU  13          3HD1      LEU  13   2.273  -2.791  -4.137
   88   1HD2  LEU  13          1HD2      LEU  13   3.622  -4.667  -6.474
   89   2HD2  LEU  13          2HD2      LEU  13   4.437  -5.380  -5.090
   90   3HD2  LEU  13          3HD2      LEU  13   4.122  -3.648  -5.130
   91    H    GLY  14           H        GLY  14   2.424  -5.218   0.050
   92   1HA   GLY  14          1HA       GLY  14   0.111  -3.475   0.101
   93   2HA   GLY  14          2HA       GLY  14   0.784  -4.334   1.486
   94    H    ALA  15           H        ALA  15   3.390  -3.275   1.395
   95    HA   ALA  15           HA       ALA  15   3.214  -0.943   2.959
   96   1HB   ALA  15          1HB       ALA  15   5.663  -0.751   2.437
   97   2HB   ALA  15          2HB       ALA  15   5.456  -1.997   1.206
   98   3HB   ALA  15          3HB       ALA  15   5.183  -2.383   2.905
   99    H    ALA  16           H        ALA  16   3.466  -1.324  -0.530
  100    HA   ALA  16           HA       ALA  16   4.210   1.310  -1.242
  101   1HB   ALA  16          1HB       ALA  16   4.316  -0.564  -2.790
  102   2HB   ALA  16          2HB       ALA  16   3.267   0.683  -3.464
  103   3HB   ALA  16          3HB       ALA  16   2.565  -0.755  -2.726
  104    H    GLY  17           H        GLY  17   0.901  -0.090  -1.075
  105   1HA   GLY  17          1HA       GLY  17  -0.392   2.373  -1.775
  106   2HA   GLY  17          2HA       GLY  17  -1.166   1.002  -0.995
  107    H    SER  18           H        SER  18   0.407   0.885   1.309
  108    HA   SER  18           HA       SER  18  -0.926   2.731   3.018
  109   1HB   SER  18          1HB       SER  18   1.486   0.965   3.503
  110   2HB   SER  18          2HB       SER  18   0.472   1.678   4.753
  111    HG   SER  18           HG       SER  18  -1.231   0.442   4.047
  112    H    THR  19           H        THR  19   2.150   2.830   1.448
  113    HA   THR  19           HA       THR  19   3.258   4.977   3.161
  114    HB   THR  19           HB       THR  19   4.335   3.702   0.624
  115    HG1  THR  19           HG1      THR  19   4.918   3.161   3.345
  116   1HG2  THR  19          1HG2      THR  19   6.509   4.561   1.523
  117   2HG2  THR  19          2HG2      THR  19   5.608   5.408   2.780
  118   3HG2  THR  19          3HG2      THR  19   5.380   5.845   1.088
  119    H    MET  20           H        MET  20   2.013   4.500  -0.117
  120    HA   MET  20           HA       MET  20   2.471   7.255  -0.949
  121   1HB   MET  20          1HB       MET  20   0.849   4.989  -2.145
  122   2HB   MET  20          2HB       MET  20   1.144   6.534  -2.944
  123   1HG   MET  20          1HG       MET  20   3.543   6.144  -2.929
  124   2HG   MET  20          2HG       MET  20   3.331   4.667  -1.989
  125   1HE   MET  20          1HE       MET  20   4.432   2.946  -3.527
  126   2HE   MET  20          2HE       MET  20   5.047   4.418  -4.276
  127   3HE   MET  20          3HE       MET  20   4.423   3.117  -5.288
  128    H    GLY  21           H        GLY  21   0.092   5.684   0.909
  129   1HA   GLY  21          1HA       GLY  21  -2.244   7.157   0.175
  130   2HA   GLY  21          2HA       GLY  21  -1.979   6.401   1.747
  131    H    ALA  22           H        ALA  22   0.624   8.120   1.799
  132    HA   ALA  22           HA       ALA  22  -0.505  10.263   3.389
  133   1HB   ALA  22          1HB       ALA  22   1.806  11.012   3.641
  134   2HB   ALA  22          2HB       ALA  22   2.315   9.976   2.308
  135   3HB   ALA  22          3HB       ALA  22   1.739   9.258   3.814
  136    H    ALA  23           H        ALA  23   1.459  10.386   0.386
  137    HA   ALA  23           HA       ALA  23   0.764  13.148  -0.122
  138   1HB   ALA  23          1HB       ALA  23   1.901  12.831  -2.255
  139   2HB   ALA  23          2HB       ALA  23   1.840  11.079  -2.057
  140   3HB   ALA  23          3HB       ALA  23   2.838  12.053  -0.979
  141    H    SER  24           H        SER  24  -1.073  10.396  -0.334
  142    HA   SER  24           HA       SER  24  -2.513  11.005  -2.818
  143   1HB   SER  24          1HB       SER  24  -2.295   8.684  -1.879
  144   2HB   SER  24          2HB       SER  24  -3.329   9.175  -0.540
  145    HG   SER  24           HG       SER  24  -4.469   8.179  -2.299
  146    H    MET  25           H        MET  25  -2.370  13.168  -0.856
  147    HA   MET  25           HA       MET  25  -3.773  14.730   0.196
  148   1HB   MET  25          1HB       MET  25  -5.861  13.528  -1.647
  149   2HB   MET  25          2HB       MET  25  -5.879  15.145  -0.940
  150   1HG   MET  25          1HG       MET  25  -3.743  15.642  -2.150
  151   2HG   MET  25          2HG       MET  25  -3.872  14.072  -2.944
  152   1HE   MET  25          1HE       MET  25  -3.530  16.795  -4.251
  153   2HE   MET  25          2HE       MET  25  -4.716  16.929  -5.549
  154   3HE   MET  25          3HE       MET  25  -3.791  15.441  -5.361
  155    H    THR  26           H        THR  26  -6.821  13.972   0.271
  156    HA   THR  26           HA       THR  26  -6.994  11.709   2.062
  157    HB   THR  26           HB       THR  26  -5.935  13.118   3.692
  158    HG1  THR  26           HG1      THR  26  -8.253  12.176   4.025
  159   1HG2  THR  26          1HG2      THR  26  -6.826  15.403   4.179
  160   2HG2  THR  26          2HG2      THR  26  -7.892  15.244   2.784
  161   3HG2  THR  26          3HG2      THR  26  -6.144  15.258   2.559
  162    H    LEU  27           H        LEU  27  -8.298  13.506  -0.182
  163    HA   LEU  27           HA       LEU  27 -10.928  14.153   0.824
  164   1HB   LEU  27          1HB       LEU  27 -10.279  13.503  -2.068
  165   2HB   LEU  27          2HB       LEU  27 -11.505  14.608  -1.449
  166    HG   LEU  27           HG       LEU  27  -8.496  14.981  -1.290
  167   1HD1  LEU  27          1HD1      LEU  27  -9.539  15.372  -3.516
  168   2HD1  LEU  27          2HD1      LEU  27  -8.903  16.857  -2.807
  169   3HD1  LEU  27          3HD1      LEU  27 -10.637  16.535  -2.774
  170   1HD2  LEU  27          1HD2      LEU  27  -9.399  15.955   0.707
  171   2HD2  LEU  27          2HD2      LEU  27 -10.803  16.595  -0.148
  172   3HD2  LEU  27          3HD2      LEU  27  -9.207  17.296  -0.419
  173    H    THR  28           H        THR  28  -9.412  11.194   0.128
  174    HA   THR  28           HA       THR  28 -11.613   9.670  -0.881
  175    HB   THR  28           HB       THR  28 -10.361   7.712  -0.129
  176    HG1  THR  28           HG1      THR  28  -9.643   9.326   1.804
  177   1HG2  THR  28          1HG2      THR  28  -8.448   9.885  -1.025
  178   2HG2  THR  28          2HG2      THR  28  -9.536   9.008  -2.101
  179   3HG2  THR  28          3HG2      THR  28  -8.248   8.148  -1.255
  180    H    VAL  29           H        VAL  29 -13.516   9.287   0.131
  181    HA   VAL  29           HA       VAL  29 -13.958   9.928   2.906
  182    HB   VAL  29           HB       VAL  29 -15.665   8.189   1.098
  183   1HG1  VAL  29          1HG1      VAL  29 -16.264   9.827   3.580
  184   2HG1  VAL  29          2HG1      VAL  29 -16.328   8.070   3.438
  185   3HG1  VAL  29          3HG1      VAL  29 -17.494   9.069   2.568
  186   1HG2  VAL  29          1HG2      VAL  29 -16.863  10.328   0.610
  187   2HG2  VAL  29          2HG2      VAL  29 -15.207  10.328   0.006
  188   3HG2  VAL  29          3HG2      VAL  29 -15.607  11.199   1.487
  189    H    GLN  30           H        GLN  30 -12.403   8.680   4.087
  190    HA   GLN  30           HA       GLN  30 -12.084   5.854   3.837
  191   1HB   GLN  30          1HB       GLN  30 -11.132   6.000   6.159
  192   2HB   GLN  30          2HB       GLN  30 -10.432   7.167   5.038
  193   1HG   GLN  30          1HG       GLN  30 -11.984   8.904   5.893
  194   2HG   GLN  30          2HG       GLN  30 -12.638   7.736   7.041
  195   1HE2  GLN  30          1HE2      GLN  30 -11.313  10.167   7.879
  196   2HE2  GLN  30          2HE2      GLN  30  -9.887   9.727   8.686
  197    H    ALA  31           H        ALA  31 -14.415   7.818   5.596
  198    HA   ALA  31           HA       ALA  31 -15.451   5.703   7.252
  199   1HB   ALA  31          1HB       ALA  31 -16.745   8.254   6.243
  200   2HB   ALA  31          2HB       ALA  31 -15.924   8.034   7.788
  201   3HB   ALA  31          3HB       ALA  31 -17.446   7.201   7.472
  Start of MODEL   29
    1    H    ALA   2           H        ALA   2   3.881 -26.935  -0.239
    2    HA   ALA   2           HA       ALA   2   4.115 -25.114  -1.738
    3   1HB   ALA   2          1HB       ALA   2   1.655 -26.726  -2.478
    4   2HB   ALA   2          2HB       ALA   2   3.311 -27.313  -2.633
    5   3HB   ALA   2          3HB       ALA   2   2.769 -25.937  -3.593
    6    H    VAL   3           H        VAL   3   2.605 -23.715  -3.278
    7    HA   VAL   3           HA       VAL   3   1.268 -21.814  -3.415
    8    HB   VAL   3           HB       VAL   3  -0.508 -23.218  -1.406
    9   1HG1  VAL   3          1HG1      VAL   3  -1.111 -21.311  -3.683
   10   2HG1  VAL   3          2HG1      VAL   3  -1.086 -20.878  -1.973
   11   3HG1  VAL   3          3HG1      VAL   3  -2.294 -22.012  -2.579
   12   1HG2  VAL   3          1HG2      VAL   3   0.053 -24.805  -3.176
   13   2HG2  VAL   3          2HG2      VAL   3  -0.299 -23.593  -4.407
   14   3HG2  VAL   3          3HG2      VAL   3  -1.601 -24.237  -3.407
   15    H    GLY   4           H        GLY   4   2.258 -20.124  -2.526
   16   1HA   GLY   4          1HA       GLY   4   1.440 -18.965  -0.123
   17   2HA   GLY   4          2HA       GLY   4   2.904 -19.845   0.268
   18    H    ILE   5           H        ILE   5   3.503 -19.010  -2.820
   19    HA   ILE   5           HA       ILE   5   5.319 -16.912  -2.102
   20    HB   ILE   5           HB       ILE   5   5.590 -16.706  -4.610
   21   1HG1  ILE   5          1HG1      ILE   5   3.583 -18.984  -4.653
   22   2HG1  ILE   5          2HG1      ILE   5   3.209 -17.329  -5.130
   23   1HG2  ILE   5          1HG2      ILE   5   6.612 -18.911  -4.860
   24   2HG2  ILE   5          2HG2      ILE   5   5.641 -19.542  -3.531
   25   3HG2  ILE   5          3HG2      ILE   5   6.885 -18.332  -3.217
   26   1HD1  ILE   5          1HD1      ILE   5   3.747 -18.616  -7.122
   27   2HD1  ILE   5          2HD1      ILE   5   5.267 -19.150  -6.405
   28   3HD1  ILE   5          3HD1      ILE   5   5.040 -17.453  -6.829
   29    H    GLY   6           H        GLY   6   2.042 -16.917  -3.370
   30   1HA   GLY   6          1HA       GLY   6   1.825 -14.204  -4.177
   31   2HA   GLY   6          2HA       GLY   6   0.484 -15.144  -3.506
   32    H    ALA   7           H        ALA   7   1.768 -15.700  -0.988
   33    HA   ALA   7           HA       ALA   7   0.927 -13.510   0.607
   34   1HB   ALA   7          1HB       ALA   7   3.004 -15.605   1.353
   35   2HB   ALA   7          2HB       ALA   7   1.276 -15.946   1.282
   36   3HB   ALA   7          3HB       ALA   7   1.892 -14.760   2.430
   37    H    LEU   8           H        LEU   8   4.035 -14.298  -0.800
   38    HA   LEU   8           HA       LEU   8   5.568 -12.397   0.784
   39   1HB   LEU   8          1HB       LEU   8   6.690 -14.340  -0.120
   40   2HB   LEU   8          2HB       LEU   8   6.188 -13.934  -1.756
   41    HG   LEU   8           HG       LEU   8   7.627 -11.977  -1.788
   42   1HD1  LEU   8          1HD1      LEU   8   7.497 -11.086   0.416
   43   2HD1  LEU   8          2HD1      LEU   8   9.169 -11.608   0.257
   44   3HD1  LEU   8          3HD1      LEU   8   8.019 -12.601   1.153
   45   1HD2  LEU   8          1HD2      LEU   8   8.682 -14.140  -2.307
   46   2HD2  LEU   8          2HD2      LEU   8   9.067 -14.372  -0.600
   47   3HD2  LEU   8          3HD2      LEU   8   9.833 -13.068  -1.507
   48    H    PHE   9           H        PHE   9   4.330 -12.390  -2.621
   49    HA   PHE   9           HA       PHE   9   5.320  -9.718  -3.110
   50   1HB   PHE   9          1HB       PHE   9   4.379 -11.396  -4.879
   51   2HB   PHE   9          2HB       PHE   9   2.794 -10.776  -4.432
   52    HD1  PHE   9           HD1      PHE   9   1.990  -8.880  -5.636
   53    HD2  PHE   9           HD2      PHE   9   6.226  -9.551  -5.333
   54    HE1  PHE   9           HE1      PHE   9   2.406  -6.953  -7.135
   55    HE2  PHE   9           HE2      PHE   9   6.636  -7.620  -6.831
   56    HZ   PHE   9           HZ       PHE   9   4.728  -6.321  -7.732
   57    H    LEU  10           H        LEU  10   2.072 -10.925  -1.975
   58    HA   LEU  10           HA       LEU  10   0.914  -8.350  -1.756
   59   1HB   LEU  10          1HB       LEU  10   0.407 -11.048  -0.557
   60   2HB   LEU  10          2HB       LEU  10  -0.336  -9.691   0.280
   61    HG   LEU  10           HG       LEU  10  -1.373  -8.977  -1.889
   62   1HD1  LEU  10          1HD1      LEU  10   0.311 -10.116  -3.368
   63   2HD1  LEU  10          2HD1      LEU  10  -1.358 -10.496  -3.788
   64   3HD1  LEU  10          3HD1      LEU  10  -0.389 -11.663  -2.896
   65   1HD2  LEU  10          1HD2      LEU  10  -3.070 -10.754  -1.913
   66   2HD2  LEU  10          2HD2      LEU  10  -2.593 -10.386  -0.256
   67   3HD2  LEU  10          3HD2      LEU  10  -1.970 -11.831  -1.054
   68    H    GLY  11           H        GLY  11   2.852 -10.166   0.609
   69   1HA   GLY  11          1HA       GLY  11   2.613  -8.445   2.807
   70   2HA   GLY  11          2HA       GLY  11   4.060  -9.386   2.463
   71    H    PHE  12           H        PHE  12   4.950  -8.136   0.087
   72    HA   PHE  12           HA       PHE  12   5.946  -5.589   1.219
   73   1HB   PHE  12          1HB       PHE  12   7.490  -7.205   0.111
   74   2HB   PHE  12          2HB       PHE  12   6.663  -6.900  -1.415
   75    HD1  PHE  12           HD1      PHE  12   6.877  -4.738  -2.563
   76    HD2  PHE  12           HD2      PHE  12   8.875  -5.472   1.170
   77    HE1  PHE  12           HE1      PHE  12   8.267  -2.715  -2.908
   78    HE2  PHE  12           HE2      PHE  12  10.266  -3.449   0.822
   79    HZ   PHE  12           HZ       PHE  12   9.962  -2.071  -1.216
   80    H    LEU  13           H        LEU  13   3.923  -6.600  -1.543
   81    HA   LEU  13           HA       LEU  13   3.891  -4.008  -2.782
   82   1HB   LEU  13          1HB       LEU  13   3.006  -6.460  -3.551
   83   2HB   LEU  13          2HB       LEU  13   1.471  -5.779  -3.049
   84    HG   LEU  13           HG       LEU  13   1.771  -5.391  -5.422
   85   1HD1  LEU  13          1HD1      LEU  13   1.364  -3.056  -5.531
   86   2HD1  LEU  13          2HD1      LEU  13   2.339  -2.734  -4.100
   87   3HD1  LEU  13          3HD1      LEU  13   0.786  -3.563  -3.944
   88   1HD2  LEU  13          1HD2      LEU  13   4.193  -3.631  -5.073
   89   2HD2  LEU  13          2HD2      LEU  13   3.672  -4.578  -6.460
   90   3HD2  LEU  13          3HD2      LEU  13   4.438  -5.379  -5.097
   91    H    GLY  14           H        GLY  14   2.442  -5.202   0.077
   92   1HA   GLY  14          1HA       GLY  14   0.132  -3.451   0.139
   93   2HA   GLY  14          2HA       GLY  14   0.814  -4.309   1.521
   94    H    ALA  15           H        ALA  15   3.420  -3.264   1.426
   95    HA   ALA  15           HA       ALA  15   3.259  -0.923   2.975
   96   1HB   ALA  15          1HB       ALA  15   5.210  -2.468   2.802
   97   2HB   ALA  15          2HB       ALA  15   5.682  -0.782   2.584
   98   3HB   ALA  15          3HB       ALA  15   5.532  -1.845   1.184
   99    H    ALA  16           H        ALA  16   3.487  -1.328  -0.509
  100    HA   ALA  16           HA       ALA  16   4.230   1.299  -1.247
  101   1HB   ALA  16          1HB       ALA  16   2.479  -0.640  -2.776
  102   2HB   ALA  16          2HB       ALA  16   4.239  -0.728  -2.703
  103   3HB   ALA  16          3HB       ALA  16   3.457   0.660  -3.458
  104    H    GLY  17           H        GLY  17   0.923  -0.096  -1.031
  105   1HA   GLY  17          1HA       GLY  17  -0.373   2.362  -1.745
  106   2HA   GLY  17          2HA       GLY  17  -1.143   0.999  -0.948
  107    H    SER  18           H        SER  18   0.450   0.905   1.349
  108    HA   SER  18           HA       SER  18  -0.875   2.766   3.047
  109   1HB   SER  18          1HB       SER  18  -0.132   0.507   3.706
  110   2HB   SER  18          2HB       SER  18   1.548   1.007   3.523
  111    HG   SER  18           HG       SER  18   0.191   1.168   5.679
  112    H    THR  19           H        THR  19   2.189   2.852   1.455
  113    HA   THR  19           HA       THR  19   3.311   5.015   3.139
  114    HB   THR  19           HB       THR  19   4.364   3.720   0.604
  115    HG1  THR  19           HG1      THR  19   4.534   3.075   3.331
  116   1HG2  THR  19          1HG2      THR  19   5.659   5.431   2.743
  117   2HG2  THR  19          2HG2      THR  19   5.418   5.861   1.049
  118   3HG2  THR  19          3HG2      THR  19   6.547   4.576   1.481
  119    H    MET  20           H        MET  20   2.028   4.512  -0.119
  120    HA   MET  20           HA       MET  20   2.485   7.259  -0.984
  121   1HB   MET  20          1HB       MET  20   0.849   4.982  -2.139
  122   2HB   MET  20          2HB       MET  20   1.132   6.519  -2.957
  123   1HG   MET  20          1HG       MET  20   3.530   6.129  -2.971
  124   2HG   MET  20          2HG       MET  20   3.337   4.667  -2.002
  125   1HE   MET  20          1HE       MET  20   4.451   3.297  -5.429
  126   2HE   MET  20          2HE       MET  20   4.548   3.012  -3.694
  127   3HE   MET  20          3HE       MET  20   5.008   4.581  -4.348
  128    H    GLY  21           H        GLY  21   0.665   6.473   1.423
  129   1HA   GLY  21          1HA       GLY  21  -2.031   7.063   0.874
  130   2HA   GLY  21          2HA       GLY  21  -1.240   7.431   2.406
  131    H    ALA  22           H        ALA  22   0.714   9.259   1.179
  132    HA   ALA  22           HA       ALA  22  -0.876  11.682   1.270
  133   1HB   ALA  22          1HB       ALA  22   1.492  11.561   2.044
  134   2HB   ALA  22          2HB       ALA  22   1.240  12.833   0.848
  135   3HB   ALA  22          3HB       ALA  22   1.998  11.314   0.373
  136    H    ALA  23           H        ALA  23   1.200  10.370  -1.346
  137    HA   ALA  23           HA       ALA  23  -0.027  12.072  -3.349
  138   1HB   ALA  23          1HB       ALA  23   1.335  10.830  -4.939
  139   2HB   ALA  23          2HB       ALA  23   1.634   9.570  -3.740
  140   3HB   ALA  23          3HB       ALA  23   2.302  11.186  -3.507
  141    H    SER  24           H        SER  24  -1.673   9.984  -1.745
  142    HA   SER  24           HA       SER  24  -2.658   8.147  -3.803
  143   1HB   SER  24          1HB       SER  24  -4.296   7.486  -2.112
  144   2HB   SER  24          2HB       SER  24  -2.696   7.575  -1.380
  145    HG   SER  24           HG       SER  24  -3.862   9.978  -1.276
  146    H    MET  25           H        MET  25  -2.777  11.046  -4.380
  147    HA   MET  25           HA       MET  25  -4.281  12.617  -5.262
  148   1HB   MET  25          1HB       MET  25  -4.699  10.560  -6.700
  149   2HB   MET  25          2HB       MET  25  -6.080  10.205  -5.665
  150   1HG   MET  25          1HG       MET  25  -6.936  11.421  -7.550
  151   2HG   MET  25          2HG       MET  25  -6.932  12.552  -6.198
  152   1HE   MET  25          1HE       MET  25  -6.888  14.820  -7.750
  153   2HE   MET  25          2HE       MET  25  -7.359  13.506  -8.828
  154   3HE   MET  25          3HE       MET  25  -6.147  14.673  -9.349
  155    H    THR  26           H        THR  26  -4.893  13.836  -3.460
  156    HA   THR  26           HA       THR  26  -6.705  12.907  -1.435
  157    HB   THR  26           HB       THR  26  -6.175  15.784  -2.244
  158    HG1  THR  26           HG1      THR  26  -4.309  15.607  -1.289
  159   1HG2  THR  26          1HG2      THR  26  -7.031  14.492   0.362
  160   2HG2  THR  26          2HG2      THR  26  -8.035  15.504  -0.677
  161   3HG2  THR  26          3HG2      THR  26  -6.647  16.202   0.160
  162    H    LEU  27           H        LEU  27  -7.394  15.610  -3.671
  163    HA   LEU  27           HA       LEU  27 -10.234  15.266  -3.463
  164   1HB   LEU  27          1HB       LEU  27  -8.803  16.571  -5.800
  165   2HB   LEU  27          2HB       LEU  27 -10.409  16.939  -5.171
  166    HG   LEU  27           HG       LEU  27  -7.776  17.418  -3.737
  167   1HD1  LEU  27          1HD1      LEU  27  -8.322  19.789  -4.055
  168   2HD1  LEU  27          2HD1      LEU  27  -9.814  19.349  -4.887
  169   3HD1  LEU  27          3HD1      LEU  27  -8.253  18.967  -5.613
  170   1HD2  LEU  27          1HD2      LEU  27  -9.347  18.703  -2.139
  171   2HD2  LEU  27          2HD2      LEU  27  -9.393  16.947  -2.036
  172   3HD2  LEU  27          3HD2      LEU  27 -10.669  17.810  -2.897
  173    H    THR  28           H        THR  28 -11.250  15.208  -6.021
  174    HA   THR  28           HA       THR  28 -10.180  13.101  -7.660
  175    HB   THR  28           HB       THR  28 -10.806  11.576  -5.915
  176    HG1  THR  28           HG1      THR  28 -12.795  11.773  -7.920
  177   1HG2  THR  28          1HG2      THR  28 -13.423  13.102  -5.846
  178   2HG2  THR  28          2HG2      THR  28 -12.194  13.056  -4.580
  179   3HG2  THR  28          3HG2      THR  28 -13.120  11.605  -4.964
  180    H    VAL  29           H        VAL  29 -11.352  12.953  -9.604
  181    HA   VAL  29           HA       VAL  29 -13.115  15.145 -10.210
  182    HB   VAL  29           HB       VAL  29 -13.439  13.963 -12.388
  183   1HG1  VAL  29          1HG1      VAL  29 -11.481  15.421 -12.017
  184   2HG1  VAL  29          2HG1      VAL  29 -11.073  14.069 -13.075
  185   3HG1  VAL  29          3HG1      VAL  29 -10.579  14.046 -11.383
  186   1HG2  VAL  29          1HG2      VAL  29 -13.425  11.651 -11.595
  187   2HG2  VAL  29          2HG2      VAL  29 -11.768  11.827 -11.022
  188   3HG2  VAL  29          3HG2      VAL  29 -12.112  11.872 -12.749
  189    H    GLN  30           H        GLN  30 -15.188  14.026 -11.699
  190    HA   GLN  30           HA       GLN  30 -17.122  13.463  -9.667
  191   1HB   GLN  30          1HB       GLN  30 -17.582  14.438 -11.970
  192   2HB   GLN  30          2HB       GLN  30 -17.378  12.814 -12.622
  193   1HG   GLN  30          1HG       GLN  30 -19.737  13.130 -12.276
  194   2HG   GLN  30          2HG       GLN  30 -19.182  12.044 -11.005
  195   1HE2  GLN  30          1HE2      GLN  30 -20.547  12.623  -9.264
  196   2HE2  GLN  30          2HE2      GLN  30 -20.677  14.199  -8.647
  197    H    ALA  31           H        ALA  31 -17.590  11.554  -8.679
  198    HA   ALA  31           HA       ALA  31 -16.086   9.163  -9.284
  199   1HB   ALA  31          1HB       ALA  31 -16.875   9.651  -7.006
  200   2HB   ALA  31          2HB       ALA  31 -17.524   8.109  -7.564
  201   3HB   ALA  31          3HB       ALA  31 -18.548   9.544  -7.555
  Start of MODEL   30
    1    H    ALA   2           H        ALA   2  -6.400 -21.726  -1.210
    2    HA   ALA   2           HA       ALA   2  -5.063 -23.496  -1.629
    3   1HB   ALA   2          1HB       ALA   2  -5.854 -22.612  -3.794
    4   2HB   ALA   2          2HB       ALA   2  -4.259 -23.346  -3.962
    5   3HB   ALA   2          3HB       ALA   2  -4.421 -21.590  -3.898
    6    H    VAL   3           H        VAL   3  -3.556 -20.881  -0.487
    7    HA   VAL   3           HA       VAL   3  -1.413 -20.429   0.279
    8    HB   VAL   3           HB       VAL   3  -0.780 -23.335  -0.318
    9   1HG1  VAL   3          1HG1      VAL   3   0.740 -23.090   1.579
   10   2HG1  VAL   3          2HG1      VAL   3   0.202 -21.429   1.821
   11   3HG1  VAL   3          3HG1      VAL   3   1.095 -21.863   0.364
   12   1HG2  VAL   3          1HG2      VAL   3  -2.894 -23.263   0.907
   13   2HG2  VAL   3          2HG2      VAL   3  -2.213 -22.118   2.062
   14   3HG2  VAL   3          3HG2      VAL   3  -1.605 -23.773   1.998
   15    H    GLY   4           H        GLY   4   0.540 -19.760  -0.541
   16   1HA   GLY   4          1HA       GLY   4   1.920 -20.766  -2.738
   17   2HA   GLY   4          2HA       GLY   4   0.812 -19.574  -3.391
   18    H    ILE   5           H        ILE   5   3.367 -19.036  -3.762
   19    HA   ILE   5           HA       ILE   5   4.695 -17.565  -1.668
   20    HB   ILE   5           HB       ILE   5   5.042 -17.565  -4.683
   21   1HG1  ILE   5          1HG1      ILE   5   6.708 -18.904  -2.522
   22   2HG1  ILE   5          2HG1      ILE   5   5.423 -19.731  -3.403
   23   1HG2  ILE   5          1HG2      ILE   5   7.330 -16.629  -4.104
   24   2HG2  ILE   5          2HG2      ILE   5   6.728 -16.357  -2.473
   25   3HG2  ILE   5          3HG2      ILE   5   5.992 -15.517  -3.835
   26   1HD1  ILE   5          1HD1      ILE   5   7.578 -20.193  -4.464
   27   2HD1  ILE   5          2HD1      ILE   5   7.895 -18.466  -4.623
   28   3HD1  ILE   5          3HD1      ILE   5   6.585 -19.210  -5.540
   29    H    GLY   6           H        GLY   6   2.002 -16.916  -3.599
   30   1HA   GLY   6          1HA       GLY   6   2.081 -14.198  -4.227
   31   2HA   GLY   6          2HA       GLY   6   0.609 -15.012  -3.675
   32    H    ALA   7           H        ALA   7   1.960 -15.737  -1.131
   33    HA   ALA   7           HA       ALA   7   1.055 -13.656   0.562
   34   1HB   ALA   7          1HB       ALA   7   1.380 -16.013   1.237
   35   2HB   ALA   7          2HB       ALA   7   2.271 -14.926   2.302
   36   3HB   ALA   7          3HB       ALA   7   3.123 -15.824   1.046
   37    H    LEU   8           H        LEU   8   4.234 -14.282  -0.833
   38    HA   LEU   8           HA       LEU   8   5.618 -12.339   0.865
   39   1HB   LEU   8          1HB       LEU   8   6.397 -13.953  -1.576
   40   2HB   LEU   8          2HB       LEU   8   7.456 -12.677  -0.985
   41    HG   LEU   8           HG       LEU   8   7.434 -13.789   1.277
   42   1HD1  LEU   8          1HD1      LEU   8   6.716 -16.234   1.248
   43   2HD1  LEU   8          2HD1      LEU   8   5.889 -15.890  -0.269
   44   3HD1  LEU   8          3HD1      LEU   8   5.403 -15.063   1.210
   45   1HD2  LEU   8          1HD2      LEU   8   9.315 -14.169  -0.196
   46   2HD2  LEU   8          2HD2      LEU   8   8.419 -15.375  -1.112
   47   3HD2  LEU   8          3HD2      LEU   8   8.897 -15.709   0.551
   48    H    PHE   9           H        PHE   9   4.475 -12.298  -2.574
   49    HA   PHE   9           HA       PHE   9   5.378  -9.575  -2.965
   50   1HB   PHE   9          1HB       PHE   9   3.054 -10.983  -4.325
   51   2HB   PHE   9          2HB       PHE   9   3.739  -9.435  -4.822
   52    HD1  PHE   9           HD1      PHE   9   4.290 -13.078  -4.655
   53    HD2  PHE   9           HD2      PHE   9   5.976  -9.306  -5.838
   54    HE1  PHE   9           HE1      PHE   9   6.032 -14.263  -5.962
   55    HE2  PHE   9           HE2      PHE   9   7.716 -10.493  -7.144
   56    HZ   PHE   9           HZ       PHE   9   7.745 -12.972  -7.206
   57    H    LEU  10           H        LEU  10   2.197 -10.947  -1.871
   58    HA   LEU  10           HA       LEU  10   0.868  -8.478  -1.640
   59   1HB   LEU  10          1HB       LEU  10  -0.325 -10.572  -1.387
   60   2HB   LEU  10          2HB       LEU  10   0.637 -11.011   0.017
   61    HG   LEU  10           HG       LEU  10  -0.365  -9.224   1.337
   62   1HD1  LEU  10          1HD1      LEU  10  -0.667  -7.425  -0.190
   63   2HD1  LEU  10          2HD1      LEU  10  -2.304  -7.906   0.238
   64   3HD1  LEU  10          3HD1      LEU  10  -1.612  -8.412  -1.304
   65   1HD2  LEU  10          1HD2      LEU  10  -1.603 -11.342   1.191
   66   2HD2  LEU  10          2HD2      LEU  10  -2.451 -10.761  -0.242
   67   3HD2  LEU  10          3HD2      LEU  10  -2.724  -9.986   1.318
   68    H    GLY  11           H        GLY  11   2.958 -10.126   0.724
   69   1HA   GLY  11          1HA       GLY  11   2.636  -8.404   2.909
   70   2HA   GLY  11          2HA       GLY  11   4.137  -9.255   2.553
   71    H    PHE  12           H        PHE  12   4.916  -7.975   0.159
   72    HA   PHE  12           HA       PHE  12   5.766  -5.356   1.246
   73   1HB   PHE  12          1HB       PHE  12   7.399  -6.885   0.146
   74   2HB   PHE  12          2HB       PHE  12   6.533  -6.667  -1.374
   75    HD1  PHE  12           HD1      PHE  12   6.566  -4.509  -2.557
   76    HD2  PHE  12           HD2      PHE  12   8.703  -5.053   1.133
   77    HE1  PHE  12           HE1      PHE  12   7.817  -2.409  -2.969
   78    HE2  PHE  12           HE2      PHE  12   9.952  -2.952   0.718
   79    HZ   PHE  12           HZ       PHE  12   9.510  -1.631  -1.332
   80    H    LEU  13           H        LEU  13   3.787  -6.536  -1.480
   81    HA   LEU  13           HA       LEU  13   3.567  -4.012  -2.797
   82   1HB   LEU  13          1HB       LEU  13   2.729  -6.504  -3.423
   83   2HB   LEU  13          2HB       LEU  13   1.211  -5.897  -2.797
   84    HG   LEU  13           HG       LEU  13   1.216  -5.545  -5.175
   85   1HD1  LEU  13          1HD1      LEU  13   1.898  -2.832  -4.034
   86   2HD1  LEU  13          2HD1      LEU  13   0.388  -3.670  -3.664
   87   3HD1  LEU  13          3HD1      LEU  13   0.765  -3.222  -5.325
   88   1HD2  LEU  13          1HD2      LEU  13   3.682  -3.796  -5.109
   89   2HD2  LEU  13          2HD2      LEU  13   2.947  -4.649  -6.460
   90   3HD2  LEU  13          3HD2      LEU  13   3.857  -5.547  -5.253
   91    H    GLY  14           H        GLY  14   2.209  -5.244   0.121
   92   1HA   GLY  14          1HA       GLY  14   0.013  -3.302   0.291
   93   2HA   GLY  14          2HA       GLY  14   0.523  -4.414   1.560
   94    H    ALA  15           H        ALA  15   3.281  -3.015   0.518
   95    HA   ALA  15           HA       ALA  15   3.362  -1.090   2.788
   96   1HB   ALA  15          1HB       ALA  15   5.256  -2.684   2.413
   97   2HB   ALA  15          2HB       ALA  15   5.762  -0.996   2.335
   98   3HB   ALA  15          3HB       ALA  15   5.547  -1.921   0.850
   99    H    ALA  16           H        ALA  16   3.649  -1.259  -0.696
  100    HA   ALA  16           HA       ALA  16   4.349   1.425  -1.255
  101   1HB   ALA  16          1HB       ALA  16   4.545  -0.407  -2.860
  102   2HB   ALA  16          2HB       ALA  16   3.535   0.872  -3.534
  103   3HB   ALA  16          3HB       ALA  16   2.792  -0.592  -2.891
  104    H    GLY  17           H        GLY  17   1.095  -0.071  -1.142
  105   1HA   GLY  17          1HA       GLY  17  -0.286   2.352  -1.823
  106   2HA   GLY  17          2HA       GLY  17  -1.011   0.950  -1.051
  107    H    SER  18           H        SER  18   0.583   0.880   1.248
  108    HA   SER  18           HA       SER  18  -0.815   2.657   2.977
  109   1HB   SER  18          1HB       SER  18   1.664   0.986   3.448
  110   2HB   SER  18          2HB       SER  18   0.610   1.635   4.701
  111    HG   SER  18           HG       SER  18  -0.403   0.037   2.607
  112    H    THR  19           H        THR  19   2.271   2.902   1.422
  113    HA   THR  19           HA       THR  19   3.267   5.072   3.179
  114    HB   THR  19           HB       THR  19   5.203   4.978   1.500
  115    HG1  THR  19           HG1      THR  19   3.879   4.022  -0.156
  116   1HG2  THR  19          1HG2      THR  19   5.960   2.699   2.315
  117   2HG2  THR  19          2HG2      THR  19   4.368   2.513   3.054
  118   3HG2  THR  19          3HG2      THR  19   5.441   3.807   3.585
  119    H    MET  20           H        MET  20   2.064   4.593  -0.112
  120    HA   MET  20           HA       MET  20   2.435   7.366  -0.917
  121   1HB   MET  20          1HB       MET  20   0.869   5.059  -2.108
  122   2HB   MET  20          2HB       MET  20   1.090   6.619  -2.903
  123   1HG   MET  20          1HG       MET  20   3.523   6.314  -2.875
  124   2HG   MET  20          2HG       MET  20   3.338   4.785  -2.018
  125   1HE   MET  20          1HE       MET  20   4.516   4.095  -5.751
  126   2HE   MET  20          2HE       MET  20   4.899   3.760  -4.064
  127   3HE   MET  20          3HE       MET  20   4.893   5.424  -4.645
  128    H    GLY  21           H        GLY  21   0.359   6.031   1.253
  129   1HA   GLY  21          1HA       GLY  21  -2.115   7.408   0.472
  130   2HA   GLY  21          2HA       GLY  21  -1.831   6.557   1.992
  131    H    ALA  22           H        ALA  22   0.777   8.538   1.547
  132    HA   ALA  22           HA       ALA  22  -0.042  10.347   3.657
  133   1HB   ALA  22          1HB       ALA  22   2.140  11.393   3.319
  134   2HB   ALA  22          2HB       ALA  22   2.331  10.556   1.778
  135   3HB   ALA  22          3HB       ALA  22   2.321   9.639   3.284
  136    H    ALA  23           H        ALA  23   0.843  10.979   0.233
  137    HA   ALA  23           HA       ALA  23  -0.218  13.668   0.299
  138   1HB   ALA  23          1HB       ALA  23   1.526  12.972  -1.309
  139   2HB   ALA  23          2HB       ALA  23   0.112  13.614  -2.143
  140   3HB   ALA  23          3HB       ALA  23   0.378  11.872  -2.070
  141    H    SER  24           H        SER  24  -1.758  10.736   0.377
  142    HA   SER  24           HA       SER  24  -4.011  11.353  -1.398
  143   1HB   SER  24          1HB       SER  24  -3.298   9.013  -0.899
  144   2HB   SER  24          2HB       SER  24  -3.772   9.253   0.779
  145    HG   SER  24           HG       SER  24  -5.516   8.368  -0.223
  146    H    MET  25           H        MET  25  -3.615  13.480   0.361
  147    HA   MET  25           HA       MET  25  -4.699  14.798   1.977
  148   1HB   MET  25          1HB       MET  25  -7.022  13.120   0.974
  149   2HB   MET  25          2HB       MET  25  -7.196  14.552   1.983
  150   1HG   MET  25          1HG       MET  25  -7.510  15.277  -0.282
  151   2HG   MET  25          2HG       MET  25  -5.906  15.831   0.192
  152   1HE   MET  25          1HE       MET  25  -6.335  16.050  -2.554
  153   2HE   MET  25          2HE       MET  25  -5.146  15.093  -3.435
  154   3HE   MET  25          3HE       MET  25  -4.644  16.032  -2.032
  155    H    THR  26           H        THR  26  -6.783  14.224   3.758
  156    HA   THR  26           HA       THR  26  -5.428  12.886   5.862
  157    HB   THR  26           HB       THR  26  -7.596  12.907   7.029
  158    HG1  THR  26           HG1      THR  26  -9.398  12.977   5.949
  159   1HG2  THR  26          1HG2      THR  26  -7.160  15.381   5.335
  160   2HG2  THR  26          2HG2      THR  26  -6.317  15.012   6.840
  161   3HG2  THR  26          3HG2      THR  26  -8.054  15.317   6.855
  162    H    LEU  27           H        LEU  27  -7.010  10.978   6.973
  163    HA   LEU  27           HA       LEU  27  -6.355   8.619   5.516
  164   1HB   LEU  27          1HB       LEU  27  -8.249   9.179   7.814
  165   2HB   LEU  27          2HB       LEU  27  -8.115   7.559   7.135
  166    HG   LEU  27           HG       LEU  27  -5.727   7.501   7.637
  167   1HD1  LEU  27          1HD1      LEU  27  -6.179  10.365   8.522
  168   2HD1  LEU  27          2HD1      LEU  27  -5.018   9.760   7.340
  169   3HD1  LEU  27          3HD1      LEU  27  -4.781   9.427   9.051
  170   1HD2  LEU  27          1HD2      LEU  27  -7.348   6.847   9.400
  171   2HD2  LEU  27          2HD2      LEU  27  -7.335   8.501  10.011
  172   3HD2  LEU  27          3HD2      LEU  27  -5.872   7.518  10.093
  173    H    THR  28           H        THR  28  -8.392   6.970   5.143
  174    HA   THR  28           HA       THR  28  -9.723   7.975   2.805
  175    HB   THR  28           HB       THR  28 -10.936   5.841   2.826
  176    HG1  THR  28           HG1      THR  28  -9.727   4.934   5.113
  177   1HG2  THR  28          1HG2      THR  28  -8.586   5.844   2.079
  178   2HG2  THR  28          2HG2      THR  28  -8.994   4.323   2.873
  179   3HG2  THR  28          3HG2      THR  28  -8.058   5.545   3.736
  180    H    VAL  29           H        VAL  29 -12.023   8.346   2.525
  181    HA   VAL  29           HA       VAL  29 -13.199   9.911   4.629
  182    HB   VAL  29           HB       VAL  29 -15.228   9.905   3.166
  183   1HG1  VAL  29          1HG1      VAL  29 -12.572  10.354   1.770
  184   2HG1  VAL  29          2HG1      VAL  29 -13.436  11.526   2.766
  185   3HG1  VAL  29          3HG1      VAL  29 -14.121  11.000   1.228
  186   1HG2  VAL  29          1HG2      VAL  29 -15.027   8.760   0.953
  187   2HG2  VAL  29          2HG2      VAL  29 -15.077   7.621   2.297
  188   3HG2  VAL  29          3HG2      VAL  29 -13.542   7.994   1.513
  189    H    GLN  30           H        GLN  30 -14.989   9.401   5.982
  190    HA   GLN  30           HA       GLN  30 -15.058   6.755   7.037
  191   1HB   GLN  30          1HB       GLN  30 -17.168   8.928   7.237
  192   2HB   GLN  30          2HB       GLN  30 -17.047   7.512   8.283
  193   1HG   GLN  30          1HG       GLN  30 -14.814   8.250   9.029
  194   2HG   GLN  30          2HG       GLN  30 -14.934   9.667   7.988
  195   1HE2  GLN  30          1HE2      GLN  30 -15.222  11.389   9.443
  196   2HE2  GLN  30          2HE2      GLN  30 -16.414  11.432  10.650
  197    H    ALA  31           H        ALA  31 -16.847   5.203   6.940
  198    HA   ALA  31           HA       ALA  31 -17.744   4.708   4.255
  199   1HB   ALA  31          1HB       ALA  31 -18.756   3.534   6.864
  200   2HB   ALA  31          2HB       ALA  31 -17.412   2.901   5.911
  201   3HB   ALA  31          3HB       ALA  31 -19.049   2.872   5.256