*HEADER    BIOSYNTHETIC PROTEIN                    14-DEC-17   6BVX              
*TITLE     SFTI-HFRW-2                                                           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TRYPSIN INHIBITOR 1 HFRW-2;                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HELIANTHUS ANNUUS;                              
*SOURCE   4 ORGANISM_COMMON: COMMON SUNFLOWER;                                   
*SOURCE   5 ORGANISM_TAXID: 4232                                                 
*KEYWDS    MELANOCORTIN, PHARMACOPHORE, CYCLIC PEPTIDE, SFTI, BIOSYNTHETIC       
*KEYWDS   2 PROTEIN                                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    C.I.SCHROEDER                                                         
*REVDAT   1   19-DEC-18 6BVX    0                                                
# Restraints file 1: restraints.tbl
!Distance restraints
assign (resid 2     and name HN   ) (resid 2     and name QG2  )    3.68    3.68    0.00
assign (resid 14    and name HN   ) (resid 14    and name HB2  )    3.83    3.83    0.00
assign (resid 14    and name HN   ) (resid 14    and name HB1  )    3.83    3.83    0.00
assign (resid 14    and name HN   ) (resid 14    and name QG   )    4.22    4.22    0.00
assign (resid 5     and name HA   ) (resid 5     and name HE   )    5.50    5.50    0.00
assign (resid 5     and name HB2  ) (resid 5     and name HE   )    5.50    5.50    0.00
assign (resid 5     and name HB1  ) (resid 5     and name HE   )    5.50    5.50    0.00
assign (resid 8     and name HN   ) (resid 8     and name HB   )    4.00    4.00    0.00
assign (resid 8     and name HN   ) (resid 8     and name QD1  )    4.67    4.67    0.00
assign (resid 5     and name QG   ) (resid 6     and name HN   )    4.66    4.66    0.00
assign (resid 5     and name HA   ) (resid 6     and name HN   )    3.31    3.31    0.00
assign (resid 2     and name HA   ) (resid 2     and name QG2  )    3.50    3.50    0.00
assign (resid 4     and name HN   ) (resid 4     and name QB   )    3.21    3.21    0.00
assign (resid 5     and name HA   ) (resid 5     and name QG   )    3.86    3.86    0.00
assign (resid 5     and name HB2  ) (resid 5     and name QD   )    4.13    4.13    0.00
assign (resid 5     and name HB1  ) (resid 5     and name QD   )    4.13    4.13    0.00
assign (resid 7     and name HB2  ) (resid 8     and name HN   )    4.63    4.63    0.00
assign (resid 7     and name HB1  ) (resid 8     and name HN   )    4.63    4.63    0.00
assign (resid 6     and name HN   ) (resid 7     and name HD1  )    4.18    4.18    0.00
assign (resid 6     and name HN   ) (resid 7     and name HD2  )    4.18    4.18    0.00
assign (resid 7     and name HA   ) (resid 8     and name HN   )    2.93    2.93    0.00
assign (resid 2     and name QG2  ) (resid 8     and name HN   )    4.94    4.94    0.00
assign (resid 8     and name HA   ) (resid 8     and name QG2  )    4.16    4.16    0.00
assign (resid 8     and name HB   ) (resid 8     and name QD1  )    3.75    3.75    0.00
assign (resid 8     and name QD1  ) (resid 9     and name HN   )    4.41    4.41    0.00
assign (resid 8     and name HG12 ) (resid 9     and name HN   )    5.32    5.32    0.00
assign (resid 8     and name HB   ) (resid 9     and name HN   )    4.26    4.26    0.00
assign (resid 8     and name HA   ) (resid 9     and name HN   )    2.95    2.95    0.00
assign (resid 9     and name HN   ) (resid 9     and name HB2  )    4.00    4.00    0.00
assign (resid 9     and name HN   ) (resid 9     and name HB1  )    4.00    4.00    0.00
assign (resid 9     and name HA   ) (resid 10    and name HN   )    2.91    2.91    0.00
assign (resid 6     and name HA   ) (resid 7     and name HD2  )    3.87    3.87    0.00
assign (resid 6     and name HA   ) (resid 7     and name HD1  )    3.87    3.87    0.00
assign (resid 10    and name HA   ) (resid 11    and name QD   )    2.85    2.85    0.00
assign (resid 11    and name QD   ) (resid 12    and name HN   )    4.23    4.23    0.00
assign (resid 10    and name HB2  ) (resid 12    and name HN   )    4.07    4.07    0.00
assign (resid 10    and name HB1  ) (resid 12    and name HN   )    4.07    4.07    0.00
assign (resid 10    and name HN   ) (resid 10    and name QD   )    4.72    4.72    0.00
assign (resid 10    and name HA   ) (resid 10    and name QD   )    4.29    4.29    0.00
assign (resid 1     and name HN   ) (resid 14    and name QD   )    5.50    5.50    0.00
assign (resid 14    and name HA   ) (resid 14    and name QG   )    4.07    4.07    0.00
assign (resid 10    and name QD   ) (resid 11    and name QD   )    3.96    3.96    0.00
assign (resid 1     and name HA   ) (resid 2     and name HN   )    2.99    2.99    0.00
assign (resid 1     and name HA   ) (resid 10    and name HN   )    4.06    4.06    0.00
assign (resid 1     and name HN   ) (resid 14    and name HA   )    2.90    2.90    0.00
assign (resid 4     and name HA   ) (resid 4     and name QD   )    3.96    3.96    0.00
assign (resid 2     and name HN   ) (resid 8     and name HN   )    3.76    3.76    0.00
assign (resid 12    and name HN   ) (resid 13    and name HN   )    3.81    3.81    0.00
assign (resid 13    and name HN   ) (resid 14    and name HN   )    3.72    3.72    0.00
assign (resid 1     and name HA   ) (resid 9     and name HA   )    3.08    3.08    0.00
assign (resid 1     and name HN   ) (resid 14    and name QG   )    4.67    4.67    0.00
assign (resid 1     and name HN   ) (resid 14    and name HB1  )    4.72    4.72    0.00
assign (resid 1     and name HN   ) (resid 14    and name HB2  )    4.72    4.72    0.00
assign (resid 5     and name HB2  ) (resid 6     and name HE3  )    5.29    5.29    0.00
assign (resid 5     and name HB1  ) (resid 6     and name HE3  )    5.29    5.29    0.00
assign (resid 8     and name HG11 ) (resid 9     and name HN   )    5.32    5.32    0.00
assign (resid 10    and name QD   ) (resid 14    and name HB2  )    4.73    4.73    0.00
assign (resid 10    and name QD   ) (resid 14    and name HB1  )    4.73    4.73    0.00
assign (resid 8     and name HA   ) (resid 8     and name QD1  )    4.23    4.23    0.00
assign (resid 2     and name HA   ) (resid 3     and name HN   )    3.03    3.03    0.00
assign (resid 2     and name HB   ) (resid 3     and name HN   )    3.44    3.44    0.00
assign (resid 6     and name HA   ) (resid 6     and name HE3  )    4.65    4.65    0.00
assign (resid 6     and name HA   ) (resid 6     and name HD1  )    4.48    4.48    0.00
assign (resid 2     and name HN   ) (resid 9     and name HA   )    4.48    4.48    0.00
assign (resid 5     and name QN   ) (resid 6     and name HE3  )    4.91    4.91    0.00
assign (resid 2     and name QG2  ) (resid 3     and name HN   )    4.47    4.47    0.00
assign (resid 2     and name HN   ) (resid 8     and name QD1  )    5.50    5.50    0.00
assign (resid 2     and name HN   ) (resid 8     and name HB   )    5.50    5.50    0.00
assign (resid 10    and name QD   ) (resid 14    and name QG   )    5.11    5.11    0.00
assign (resid 4     and name QD   ) (resid 5     and name QN   )    3.89    3.89    0.00
assign (resid 5     and name QN   ) (resid 6     and name HN   )    4.31    4.31    0.00
assign (resid 4     and name HA   ) (resid 5     and name QN   )    2.88    2.88    0.00
assign (resid 5     and name QN   ) (resid 5     and name HB2  )    3.82    3.82    0.00
assign (resid 5     and name QN   ) (resid 5     and name HB1  )    3.82    3.82    0.00
assign (resid 5     and name QN   ) (resid 5     and name QG   )    3.77    3.77    0.00
assign (resid 1     and name HN   ) (resid 1     and name QB   )    3.35    3.35    0.00
assign (resid 1     and name HN   ) (resid 14    and name QB   )    3.98    3.98    0.00
assign (resid 1     and name QB   ) (resid 2     and name HN   )    3.67    3.67    0.00
assign (resid 3     and name HN   ) (resid 3     and name QB   )    3.65    3.65    0.00
assign (resid 3     and name QB   ) (resid 4     and name HN   )    3.53    3.53    0.00
assign (resid 5     and name QN   ) (resid 5     and name QB   )    3.30    3.30    0.00
assign (resid 5     and name HA   ) (resid 7     and name QD   )    4.19    4.19    0.00
assign (resid 5     and name QB   ) (resid 5     and name HE   )    4.81    4.81    0.00
assign (resid 5     and name QB   ) (resid 6     and name HN   )    4.00    4.00    0.00
assign (resid 5     and name QB   ) (resid 6     and name HE3  )    4.64    4.64    0.00
assign (resid 6     and name HN   ) (resid 7     and name QD   )    3.45    3.45    0.00
assign (resid 6     and name HA   ) (resid 7     and name QD   )    3.24    3.24    0.00
assign (resid 6     and name QB   ) (resid 6     and name HE3  )    3.55    3.55    0.00
assign (resid 8     and name HN   ) (resid 8     and name QG1  )    4.26    4.26    0.00
assign (resid 8     and name QG2  ) (resid 8     and name QG1  )    2.91    2.91    0.00
assign (resid 8     and name QG1  ) (resid 9     and name HN   )    4.67    4.67    0.00
assign (resid 9     and name HN   ) (resid 9     and name QB   )    3.37    3.37    0.00
assign (resid 9     and name QB   ) (resid 10    and name HN   )    3.66    3.66    0.00
assign (resid 10    and name HN   ) (resid 10    and name QB   )    3.17    3.17    0.00
assign (resid 10    and name QB   ) (resid 11    and name QD   )    3.23    3.23    0.00
assign (resid 10    and name QB   ) (resid 12    and name HN   )    3.51    3.51    0.00
assign (resid 10    and name QD   ) (resid 14    and name QB   )    4.04    4.04    0.00
assign (resid 11    and name QB   ) (resid 12    and name HN   )    3.93    3.93    0.00
assign (resid 12    and name HN   ) (resid 12    and name QB   )    3.43    3.43    0.00
assign (resid 14    and name HN   ) (resid 14    and name QB   )    3.24    3.24    0.00
assign (resid 14    and name QB   ) (resid 14    and name HE   )    4.45    4.45    0.00
!Dihedral restraints
assign (resid 8     and name C    ) (resid 9     and name N    ) (resid 9     and name CA   ) (resid 9     and name C    )    1.0 -105.0   30.0 2
assign (resid 9     and name C    ) (resid 10    and name N    ) (resid 10    and name CA   ) (resid 10    and name C    )    1.0 -120.0   30.0 2
assign (resid 1     and name C    ) (resid 2     and name N    ) (resid 2     and name CA   ) (resid 2     and name C    )    1.0 -120.0   30.0 2
assign (resid 7     and name C    ) (resid 8     and name N    ) (resid 8     and name CA   ) (resid 8     and name C    )    1.0 -120.0   30.0 2
!Hbonds
assign (resid 2     and name HN   ) (resid 8     and name O    )    2.30    2.30    0.00
assign (resid 2     and name N    ) (resid 8     and name O    )    3.30    3.30    0.00
assign (resid 10    and name HN   ) (resid 14    and name O    )    2.30    2.30    0.00
assign (resid 10    and name N    ) (resid 14    and name O    )    3.30    3.30    0.00
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   CYS   1           H        CYS   1   2.082   4.120  -2.980
    2    HA   CYS   1           HA       CYS   1   1.717   3.181  -0.280
    3    HB3  CYS   1          2HB       CYS   1   0.212   5.204   0.246
    4    H    THR   2           H        THR   2  -0.125   2.045  -0.111
    5    HA   THR   2           HA       THR   2  -1.926   2.046  -2.420
    6    HB   THR   2           HB       THR   2  -2.792  -0.081  -1.502
    7    HG1  THR   2          1HG       THR   2  -1.910  -0.944   0.337
    8   HG21  THR   2          1HG2      THR   2  -1.148  -1.270  -2.491
    9   HG22  THR   2          2HG2      THR   2   0.107  -0.587  -1.456
   10   HG23  THR   2          3HG2      THR   2  -0.474   0.317  -2.855
   11    H    HIS   3           H        HIS   3  -4.227   1.987  -2.116
   12    HA   HIS   3           HA       HIS   3  -5.232   2.893   0.470
   13    HB3  HIS   3          2HB       HIS   3  -6.647   4.605  -0.950
   14    HD1  HIS   3          1HD       HIS   3  -2.935   5.251  -1.130
   15    HD2  HIS   3          2HD       HIS   3  -6.202   6.177   1.263
   16    HE1  HIS   3          1HE       HIS   3  -2.108   6.985   0.495
   17    H    DPN   4           H        DPN   4  -6.912   1.667   0.975
   18    HA   DPN   4           HA       DPN   4  -8.462   0.430  -1.194
   19    HB2  DPN   4          2HB       DPN   4  -9.721   1.556   1.311
   20    HB3  DPN   4          3HB       DPN   4 -10.546   0.900  -0.099
   21    HD1  DPN   4          1HD       DPN   4 -10.101   2.127  -2.346
   22    HD2  DPN   4          2HD       DPN   4  -9.418   3.834   1.492
   23    HE1  DPN   4          1HE       DPN   4 -10.217   4.380  -3.331
   24    HE2  DPN   4          2HE       DPN   4  -9.531   6.089   0.513
   25    HZ   DPN   4           HZ       DPN   4  -9.931   6.364  -1.902
   26    HA   MMO   5           HA       NAR   5  -7.978  -2.825   1.738
   27   HCB1  MMO   5          2HB       NAR   5  -6.807  -3.954  -0.810
   28   HCB2  MMO   5          3HB       NAR   5  -7.497  -4.875   0.520
   29   HCG1  MMO   5          2HG       NAR   5  -9.669  -3.675   0.061
   30   HCG2  MMO   5          3HG       NAR   5  -8.920  -3.083  -1.424
   31   HCD1  MMO   5          2HD       NAR   5  -8.549  -5.373  -2.164
   32   HCD2  MMO   5          3HD       NAR   5  -9.241  -5.985  -0.663
   33   HH21  MMO   5          1HH1      NAR   5  -9.694  -7.481  -2.100
   34   HH22  MMO   5          2HH1      NAR   5 -11.065  -8.189  -2.889
   35   HH11  MMO   5          1HH2      NAR   5 -12.883  -5.206  -3.040
   36    HC1  MMO   5          2HN       NAR   5  -7.344  -1.033  -1.814
   37    HC2  MMO   5          3HN       NAR   5  -6.047  -2.092  -1.212
   38    HC3  MMO   5           H        NAR   5  -6.042  -0.360  -0.804
   39    HE   MMO   5           HE       NAR   5 -11.073  -4.285  -2.004
   40   HH12  MMO   5          2HH2      NAR   5 -12.878  -6.894  -3.423
   41    H    TRP   6           H        TRP   6  -6.562  -2.854   3.347
   42    HA   TRP   6           HA       TRP   6  -4.616  -2.944   4.523
   43    HB3  TRP   6          2HB       TRP   6  -2.749  -4.311   3.317
   44    HD1  TRP   6           HD       TRP   6  -3.292  -5.187   5.878
   45    HE1  TRP   6          1HE       TRP   6  -4.624  -7.251   6.648
   46    HE3  TRP   6          3HE       TRP   6  -5.899  -6.121   1.579
   47    HZ2  TRP   6          2HZ       TRP   6  -6.527  -9.039   5.574
   48    HZ3  TRP   6          3HZ       TRP   6  -7.453  -8.029   1.535
   49    HH2  TRP   6           HH       TRP   6  -7.760  -9.455   3.491
   50    HA   PRO   7           HA       PRO   7  -2.906   0.603   2.024
   51    HB3  PRO   7          2HB       PRO   7  -4.530   2.051   2.765
   52    HG3  PRO   7          2HG       PRO   7  -5.695   1.638   4.735
   53    HD3  PRO   7          2HD       PRO   7  -5.930  -0.409   3.697
   54    H    ILE   8           H        ILE   8  -0.754   0.556   2.035
   55    HA   ILE   8           HA       ILE   8   0.657   0.908   4.578
   56    HB   ILE   8           HB       ILE   8   2.389  -0.744   3.800
   57   HG13  ILE   8          2HG1      ILE   8   1.261  -0.691   1.413
   58   HG21  ILE   8          1HG2      ILE   8  -0.181  -2.207   4.167
   59   HG22  ILE   8          2HG2      ILE   8   1.385  -2.467   4.936
   60   HG23  ILE   8          3HG2      ILE   8   0.374  -1.111   5.434
   61   HD11  ILE   8          1HD1      ILE   8   1.866  -3.415   1.571
   62   HD12  ILE   8          2HD1      ILE   8   2.918  -2.103   1.037
   63   HD13  ILE   8          3HD1      ILE   8   2.930  -2.610   2.725
   64    H    CYS   9           H        CYS   9   2.955   1.525   4.261
   65    HA   CYS   9           HA       CYS   9   3.358   2.958   1.719
   66    HB3  CYS   9          2HB       CYS   9   4.756   4.520   3.385
   67    H    PHE  10           H        PHE  10   5.364   2.861   0.819
   68    HA   PHE  10           HA       PHE  10   7.297   1.094   2.157
   69    HB3  PHE  10          2HB       PHE  10   8.224   1.082  -0.328
   70    HD1  PHE  10          1HD       PHE  10   8.114  -0.866   1.690
   71    HD2  PHE  10          2HD       PHE  10   5.344  -0.217  -1.476
   72    HE1  PHE  10          1HE       PHE  10   7.418  -3.221   1.821
   73    HE2  PHE  10          2HE       PHE  10   4.641  -2.572  -1.349
   74    HZ   PHE  10           HZ       PHE  10   5.678  -4.076   0.301
   75    HA   PRO  11           HA       PRO  11  10.340   4.239   2.457
   76    HB3  PRO  11          2HB       PRO  11  11.749   2.658   3.347
   77    HG3  PRO  11          2HG       PRO  11  11.777   0.482   2.531
   78    HD3  PRO  11          2HD       PRO  11   9.511   0.757   2.850
   79    H    ASP  12           H        ASP  12   9.873   2.614  -0.544
   80    HA   ASP  12           HA       ASP  12  11.733   4.152  -2.082
   81    HB3  ASP  12          2HB       ASP  12  10.454   3.208  -4.036
   82    H    GLY  13           H        GLY  13   8.249   4.320  -1.467
   83    HA2  GLY  13          2HA       GLY  13   7.487   6.721  -1.241
   84    HA3  GLY  13          3HA       GLY  13   8.223   6.946  -2.821
   85    H    ARG  14           H        ARG  14   6.316   4.181  -1.719
   86    HA   ARG  14           HA       ARG  14   4.163   4.991  -3.550
   87    HB3  ARG  14          2HB       ARG  14   4.039   2.365  -3.934
   88    HG3  ARG  14          2HG       ARG  14   4.627   4.337  -5.580
   89    HD3  ARG  14          2HD       ARG  14   7.211   2.790  -5.438
   90    HE   ARG  14           HE       ARG  14   7.062   5.196  -7.013
   91   HH11  ARG  14          1HH1      ARG  14   6.673   1.736  -7.004
   92   HH12  ARG  14          2HH1      ARG  14   6.930   1.573  -8.710
   93   HH21  ARG  14          1HH2      ARG  14   7.400   4.994  -9.258
   94   HH22  ARG  14          2HH2      ARG  14   7.343   3.425  -9.991
  Start of MODEL    2
    1    H1   CYS   1           H        CYS   1   2.791   5.150  -1.756
    2    HA   CYS   1           HA       CYS   1   1.642   3.575   0.406
    3    HB3  CYS   1          2HB       CYS   1   0.276   5.703   0.758
    4    H    THR   2           H        THR   2   0.053   2.206  -0.031
    5    HA   THR   2           HA       THR   2  -1.617   2.590  -2.382
    6    HB   THR   2           HB       THR   2  -2.617   0.342  -1.300
    7    HG1  THR   2          1HG       THR   2   0.121   0.267  -0.535
    8   HG21  THR   2          1HG2      THR   2  -0.150   0.712  -2.982
    9   HG22  THR   2          2HG2      THR   2  -1.789   0.332  -3.509
   10   HG23  THR   2          3HG2      THR   2  -0.834  -0.880  -2.653
   11    H    HIS   3           H        HIS   3  -4.013   1.843  -1.994
   12    HA   HIS   3           HA       HIS   3  -5.172   2.649   0.509
   13    HB3  HIS   3          2HB       HIS   3  -6.147   4.302  -1.774
   14    HD1  HIS   3          1HD       HIS   3  -6.539   6.860  -0.619
   15    HD2  HIS   3          2HD       HIS   3  -6.624   3.500   1.823
   16    HE1  HIS   3          1HE       HIS   3  -7.776   7.568   1.452
   17    H    DPN   4           H        DPN   4  -7.139   1.742   0.796
   18    HA   DPN   4           HA       DPN   4  -8.249   0.255  -1.484
   19    HB2  DPN   4          2HB       DPN   4  -9.584   2.278   0.220
   20    HB3  DPN   4          3HB       DPN   4 -10.511   0.820  -0.123
   21    HD1  DPN   4          1HD       DPN   4 -11.924   0.935  -1.915
   22    HD2  DPN   4          2HD       DPN   4  -8.324   3.206  -1.989
   23    HE1  DPN   4          1HE       DPN   4 -12.549   1.848  -4.113
   24    HE2  DPN   4          2HE       DPN   4  -8.945   4.121  -4.187
   25    HZ   DPN   4           HZ       DPN   4 -11.057   3.441  -5.253
   26    HA   MMO   5           HA       NAR   5  -8.338  -2.534   1.971
   27   HCB1  MMO   5          2HB       NAR   5  -7.466  -3.932  -0.549
   28   HCB2  MMO   5          3HB       NAR   5  -7.754  -4.811   0.947
   29   HCG1  MMO   5          2HG       NAR   5 -10.061  -3.926   0.978
   30   HCG2  MMO   5          3HG       NAR   5  -9.753  -3.161  -0.582
   31   HCD1  MMO   5          2HD       NAR   5  -9.146  -5.467  -1.438
   32   HCD2  MMO   5          3HD       NAR   5  -9.810  -6.098   0.068
   33   HH21  MMO   5          1HH1      NAR   5 -10.425  -7.626  -1.060
   34   HH22  MMO   5          2HH1      NAR   5 -11.854  -8.344  -1.728
   35   HH11  MMO   5          1HH2      NAR   5 -13.503  -5.300  -2.217
   36    HC1  MMO   5          2HN       NAR   5  -7.075  -1.276  -1.686
   37    HC2  MMO   5          3HN       NAR   5  -5.962  -2.267  -0.716
   38    HC3  MMO   5           H        NAR   5  -5.981  -0.500  -0.516
   39    HE   MMO   5           HE       NAR   5 -11.618  -4.367  -1.335
   40   HH12  MMO   5          2HH2      NAR   5 -13.604  -7.020  -2.386
   41    H    TRP   6           H        TRP   6  -6.880  -2.113   3.539
   42    HA   TRP   6           HA       TRP   6  -4.976  -2.229   4.782
   43    HB3  TRP   6          2HB       TRP   6  -3.464  -4.221   4.269
   44    HD1  TRP   6           HD       TRP   6  -4.485  -4.276   6.828
   45    HE1  TRP   6          1HE       TRP   6  -6.325  -5.773   7.825
   46    HE3  TRP   6          3HE       TRP   6  -6.712  -5.814   2.492
   47    HZ2  TRP   6          2HZ       TRP   6  -8.441  -7.392   6.895
   48    HZ3  TRP   6          3HZ       TRP   6  -8.641  -7.336   2.633
   49    HH2  TRP   6           HH       TRP   6  -9.485  -8.110   4.789
   50    HA   PRO   7           HA       PRO   7  -2.635   0.055   1.485
   51    HB3  PRO   7          2HB       PRO   7  -3.850   1.971   1.847
   52    HG3  PRO   7          2HG       PRO   7  -4.952   2.329   3.863
   53    HD3  PRO   7          2HD       PRO   7  -5.696   0.204   3.376
   54    H    ILE   8           H        ILE   8  -0.454   0.214   1.430
   55    HA   ILE   8           HA       ILE   8   1.005   0.155   3.985
   56    HB   ILE   8           HB       ILE   8   1.844  -1.416   1.551
   57   HG13  ILE   8          2HG1      ILE   8   1.125  -3.423   2.817
   58   HG21  ILE   8          1HG2      ILE   8   2.998  -2.510   3.806
   59   HG22  ILE   8          2HG2      ILE   8   3.785  -1.438   2.647
   60   HG23  ILE   8          3HG2      ILE   8   3.057  -0.773   4.109
   61   HD11  ILE   8          1HD1      ILE   8   0.534  -3.334   4.940
   62   HD12  ILE   8          2HD1      ILE   8   0.728  -1.582   4.938
   63   HD13  ILE   8          3HD1      ILE   8  -0.826  -2.295   4.513
   64    H    CYS   9           H        CYS   9   2.813   1.397   4.100
   65    HA   CYS   9           HA       CYS   9   3.439   3.014   1.722
   66    HB3  CYS   9          2HB       CYS   9   4.533   4.514   3.566
   67    H    PHE  10           H        PHE  10   5.394   2.873   0.827
   68    HA   PHE  10           HA       PHE  10   7.445   1.313   2.244
   69    HB3  PHE  10          2HB       PHE  10   8.391   1.313  -0.248
   70    HD1  PHE  10          1HD       PHE  10   9.134  -0.853  -0.114
   71    HD2  PHE  10          2HD       PHE  10   5.025  -0.033   0.636
   72    HE1  PHE  10          1HE       PHE  10   8.697  -3.266   0.110
   73    HE2  PHE  10          2HE       PHE  10   4.582  -2.443   0.862
   74    HZ   PHE  10           HZ       PHE  10   6.419  -4.063   0.599
   75    HA   PRO  11           HA       PRO  11  10.230   4.695   2.453
   76    HB3  PRO  11          2HB       PRO  11  11.753   3.259   3.402
   77    HG3  PRO  11          2HG       PRO  11  11.959   1.066   2.660
   78    HD3  PRO  11          2HD       PRO  11   9.676   1.172   2.958
   79    H    ASP  12           H        ASP  12  10.075   2.858  -0.493
   80    HA   ASP  12           HA       ASP  12  11.721   4.632  -2.034
   81    HB3  ASP  12          2HB       ASP  12   9.705   2.666  -3.116
   82    H    GLY  13           H        GLY  13   8.227   4.091  -1.686
   83    HA2  GLY  13          2HA       GLY  13   7.119   6.442  -1.664
   84    HA3  GLY  13          3HA       GLY  13   7.728   6.485  -3.311
   85    H    ARG  14           H        ARG  14   6.102   3.994  -1.347
   86    HA   ARG  14           HA       ARG  14   3.977   3.902  -3.377
   87    HB3  ARG  14          2HB       ARG  14   4.039   1.320  -2.727
   88    HG3  ARG  14          2HG       ARG  14   4.505   2.537  -5.002
   89    HD3  ARG  14          2HD       ARG  14   6.897   3.031  -4.155
   90    HE   ARG  14           HE       ARG  14   7.983   1.073  -3.652
   91   HH11  ARG  14          1HH1      ARG  14   6.372   0.754  -6.721
   92   HH12  ARG  14          2HH1      ARG  14   7.124  -0.758  -7.107
   93   HH21  ARG  14          1HH2      ARG  14   8.980  -0.918  -4.148
   94   HH22  ARG  14          2HH2      ARG  14   8.606  -1.710  -5.642
  Start of MODEL    3
    1    H1   CYS   1           H        CYS   1   2.082   4.819  -2.716
    2    HA   CYS   1           HA       CYS   1   1.779   3.183  -0.303
    3    HB3  CYS   1          2HB       CYS   1   0.280   4.901   0.677
    4    H    THR   2           H        THR   2  -0.209   2.173  -0.075
    5    HA   THR   2           HA       THR   2  -1.883   2.211  -2.490
    6    HB   THR   2           HB       THR   2  -2.749   0.015  -1.666
    7    HG1  THR   2          1HG       THR   2  -0.614   0.243   0.212
    8   HG21  THR   2          1HG2      THR   2  -1.222  -0.673  -3.146
    9   HG22  THR   2          2HG2      THR   2  -0.127  -0.908  -1.785
   10   HG23  THR   2          3HG2      THR   2  -0.104   0.607  -2.686
   11    H    HIS   3           H        HIS   3  -4.218   1.917  -2.197
   12    HA   HIS   3           HA       HIS   3  -5.294   2.740   0.383
   13    HB3  HIS   3          2HB       HIS   3  -4.901   4.857  -0.787
   14    HD1  HIS   3          1HD       HIS   3  -3.918   4.252  -3.247
   15    HD2  HIS   3          2HD       HIS   3  -8.037   4.679  -2.926
   16    HE1  HIS   3          1HE       HIS   3  -4.742   4.594  -5.598
   17    H    DPN   4           H        DPN   4  -7.037   1.576   0.847
   18    HA   DPN   4           HA       DPN   4  -8.394   0.166  -1.343
   19    HB2  DPN   4          2HB       DPN   4  -9.611   2.271  -0.351
   20    HB3  DPN   4          3HB       DPN   4  -9.992   1.181   0.979
   21    HD1  DPN   4          1HD       DPN   4 -10.721  -1.285  -0.059
   22    HD2  DPN   4          2HD       DPN   4 -11.337   2.542  -1.820
   23    HE1  DPN   4          1HE       DPN   4 -12.619  -2.182  -1.340
   24    HE2  DPN   4          2HE       DPN   4 -13.237   1.649  -3.105
   25    HZ   DPN   4           HZ       DPN   4 -13.881  -0.715  -2.864
   26    HA   MMO   5           HA       NAR   5  -7.996  -2.854   1.858
   27   HCB1  MMO   5          2HB       NAR   5  -7.077  -3.977  -0.777
   28   HCB2  MMO   5          3HB       NAR   5  -7.164  -4.980   0.664
   29   HCG1  MMO   5          2HG       NAR   5  -9.552  -3.390  -0.130
   30   HCG2  MMO   5          3HG       NAR   5  -9.161  -4.864  -1.018
   31   HCD1  MMO   5          2HD       NAR   5 -10.629  -5.548   0.683
   32   HCD2  MMO   5          3HD       NAR   5  -9.024  -6.006   1.249
   33   HH21  MMO   5          1HH1      NAR   5 -11.683  -3.866   0.581
   34   HH22  MMO   5          2HH1      NAR   5 -12.528  -2.717   1.565
   35   HH11  MMO   5          1HH2      NAR   5 -10.347  -3.007   4.282
   36    HC1  MMO   5          2HN       NAR   5  -5.994  -0.525  -0.738
   37    HC2  MMO   5          3HN       NAR   5  -7.202  -1.302  -1.787
   38    HC3  MMO   5           H        NAR   5  -5.920  -2.278  -1.032
   39    HE   MMO   5           HE       NAR   5  -9.243  -4.517   2.977
   40   HH12  MMO   5          2HH2      NAR   5 -11.768  -2.228   3.670
   41    H    TRP   6           H        TRP   6  -6.598  -2.791   3.481
   42    HA   TRP   6           HA       TRP   6  -4.670  -2.847   4.686
   43    HB3  TRP   6          2HB       TRP   6  -2.770  -4.231   3.518
   44    HD1  TRP   6           HD       TRP   6  -3.326  -4.921   6.163
   45    HE1  TRP   6          1HE       TRP   6  -4.582  -6.984   7.053
   46    HE3  TRP   6          3HE       TRP   6  -5.815  -6.261   1.901
   47    HZ2  TRP   6          2HZ       TRP   6  -6.386  -8.923   6.078
   48    HZ3  TRP   6          3HZ       TRP   6  -7.285  -8.235   1.966
   49    HH2  TRP   6           HH       TRP   6  -7.563  -9.537   4.012
   50    HA   PRO   7           HA       PRO   7  -2.956   0.643   2.134
   51    HB3  PRO   7          2HB       PRO   7  -4.552   2.106   2.905
   52    HG3  PRO   7          2HG       PRO   7  -5.673   1.711   4.905
   53    HD3  PRO   7          2HD       PRO   7  -5.946  -0.338   3.885
   54    H    ILE   8           H        ILE   8  -0.807   0.736   2.097
   55    HA   ILE   8           HA       ILE   8   0.662   1.003   4.613
   56    HB   ILE   8           HB       ILE   8   2.351  -0.626   3.906
   57   HG13  ILE   8          2HG1      ILE   8   0.592  -0.758   1.512
   58   HG21  ILE   8          1HG2      ILE   8   1.177  -2.564   4.552
   59   HG22  ILE   8          2HG2      ILE   8   0.337  -1.222   5.324
   60   HG23  ILE   8          3HG2      ILE   8  -0.337  -1.967   3.875
   61   HD11  ILE   8          1HD1      ILE   8   2.602   0.160   0.925
   62   HD12  ILE   8          2HD1      ILE   8   3.512  -0.827   2.067
   63   HD13  ILE   8          3HD1      ILE   8   2.897  -1.545   0.578
   64    H    CYS   9           H        CYS   9   3.061   1.442   4.112
   65    HA   CYS   9           HA       CYS   9   3.327   3.048   1.664
   66    HB3  CYS   9          2HB       CYS   9   4.790   4.559   3.293
   67    H    PHE  10           H        PHE  10   5.175   2.738   0.584
   68    HA   PHE  10           HA       PHE  10   7.134   0.906   1.728
   69    HB3  PHE  10          2HB       PHE  10   8.065   1.220  -0.737
   70    HD1  PHE  10          1HD       PHE  10   7.880  -0.994   0.976
   71    HD2  PHE  10          2HD       PHE  10   5.138   0.211  -2.050
   72    HE1  PHE  10          1HE       PHE  10   7.096  -3.318   0.763
   73    HE2  PHE  10          2HE       PHE  10   4.349  -2.109  -2.266
   74    HZ   PHE  10           HZ       PHE  10   5.327  -3.876  -0.858
   75    HA   PRO  11           HA       PRO  11  10.290   3.858   2.472
   76    HB3  PRO  11          2HB       PRO  11  11.639   2.113   3.116
   77    HG3  PRO  11          2HG       PRO  11  11.589   0.079   1.991
   78    HD3  PRO  11          2HD       PRO  11   9.333   0.387   2.354
   79    H    ASP  12           H        ASP  12  10.218   2.450  -0.756
   80    HA   ASP  12           HA       ASP  12  11.945   4.351  -1.972
   81    HB3  ASP  12          2HB       ASP  12   9.786   2.840  -3.427
   82    H    GLY  13           H        GLY  13   8.569   4.331  -1.162
   83    HA2  GLY  13          2HA       GLY  13   7.468   6.484  -0.931
   84    HA3  GLY  13          3HA       GLY  13   8.332   7.016  -2.367
   85    H    ARG  14           H        ARG  14   5.893   4.688  -1.258
   86    HA   ARG  14           HA       ARG  14   4.119   5.343  -3.375
   87    HB3  ARG  14          2HB       ARG  14   5.577   2.703  -3.561
   88    HG3  ARG  14          2HG       ARG  14   3.113   3.665  -4.970
   89    HD3  ARG  14          2HD       ARG  14   5.103   1.585  -5.860
   90    HE   ARG  14           HE       ARG  14   2.747   1.905  -7.460
   91   HH11  ARG  14          1HH1      ARG  14   4.151   0.181  -4.781
   92   HH12  ARG  14          2HH1      ARG  14   3.110  -1.192  -4.950
   93   HH21  ARG  14          1HH2      ARG  14   1.371   0.099  -7.694
   94   HH22  ARG  14          2HH2      ARG  14   1.530  -1.239  -6.608
  Start of MODEL    4
    1    H1   CYS   1           H        CYS   1   2.373   5.222  -1.730
    2    HA   CYS   1           HA       CYS   1   1.713   3.232   0.311
    3    HB3  CYS   1          2HB       CYS   1   0.215   4.950   1.225
    4    H    THR   2           H        THR   2  -0.099   2.016   0.264
    5    HA   THR   2           HA       THR   2  -1.685   2.097  -2.188
    6    HB   THR   2           HB       THR   2  -2.665  -0.069  -1.042
    7    HG1  THR   2          1HG       THR   2  -1.064  -1.062   0.273
    8   HG21  THR   2          1HG2      THR   2   0.127  -0.469  -1.958
    9   HG22  THR   2          2HG2      THR   2  -0.975   0.347  -3.067
   10   HG23  THR   2          3HG2      THR   2  -1.358  -1.268  -2.470
   11    H    HIS   3           H        HIS   3  -3.959   2.133  -2.183
   12    HA   HIS   3           HA       HIS   3  -5.247   2.886   0.343
   13    HB3  HIS   3          2HB       HIS   3  -6.494   4.674  -0.797
   14    HD1  HIS   3          1HD       HIS   3  -4.111   6.299  -2.594
   15    HD2  HIS   3          2HD       HIS   3  -4.125   4.970   1.342
   16    HE1  HIS   3          1HE       HIS   3  -2.391   7.696  -1.409
   17    H    DPN   4           H        DPN   4  -6.995   1.702   0.714
   18    HA   DPN   4           HA       DPN   4  -8.227   0.277  -1.539
   19    HB2  DPN   4          2HB       DPN   4  -9.600   1.953   0.546
   20    HB3  DPN   4          3HB       DPN   4 -10.448   0.641  -0.266
   21    HD1  DPN   4          1HD       DPN   4 -10.220   0.687  -2.907
   22    HD2  DPN   4          2HD       DPN   4  -9.763   4.056  -0.348
   23    HE1  DPN   4          1HE       DPN   4 -10.734   2.184  -4.792
   24    HE2  DPN   4          2HE       DPN   4 -10.278   5.557  -2.226
   25    HZ   DPN   4           HZ       DPN   4 -10.765   4.622  -4.451
   26    HA   MMO   5           HA       NAR   5  -7.986  -2.707   1.718
   27   HCB1  MMO   5          2HB       NAR   5  -7.050  -3.847  -0.899
   28   HCB2  MMO   5          3HB       NAR   5  -7.113  -4.850   0.546
   29   HCG1  MMO   5          2HG       NAR   5  -9.160  -5.289  -0.363
   30   HCG2  MMO   5          3HG       NAR   5  -9.564  -3.936   0.696
   31   HCD1  MMO   5          2HD       NAR   5 -10.568  -3.233  -1.232
   32   HCD2  MMO   5          3HD       NAR   5  -8.967  -2.527  -1.452
   33   HH21  MMO   5          1HH1      NAR   5 -10.484  -1.999  -3.086
   34   HH22  MMO   5          2HH1      NAR   5 -10.653  -2.217  -4.796
   35   HH11  MMO   5          1HH2      NAR   5  -9.154  -5.377  -4.831
   36    HC1  MMO   5          2HN       NAR   5  -5.863  -0.406  -0.796
   37    HC2  MMO   5          3HN       NAR   5  -7.010  -1.191  -1.907
   38    HC3  MMO   5           H        NAR   5  -5.773  -2.164  -1.073
   39    HE   MMO   5           HE       NAR   5  -8.938  -5.076  -2.580
   40   HH12  MMO   5          2HH2      NAR   5  -9.896  -4.139  -5.788
   41    H    TRP   6           H        TRP   6  -6.626  -2.575   3.375
   42    HA   TRP   6           HA       TRP   6  -4.728  -2.614   4.629
   43    HB3  TRP   6          2HB       TRP   6  -2.856  -4.137   3.487
   44    HD1  TRP   6           HD       TRP   6  -2.792  -4.973   5.988
   45    HE1  TRP   6          1HE       TRP   6  -4.181  -6.699   7.301
   46    HE3  TRP   6          3HE       TRP   6  -6.653  -5.586   2.692
   47    HZ2  TRP   6          2HZ       TRP   6  -6.592  -8.130   6.980
   48    HZ3  TRP   6          3HZ       TRP   6  -8.460  -7.151   3.271
   49    HH2  TRP   6           HH       TRP   6  -8.430  -8.397   5.370
   50    HA   PRO   7           HA       PRO   7  -2.800   0.635   1.929
   51    HB3  PRO   7          2HB       PRO   7  -4.319   2.216   2.620
   52    HG3  PRO   7          2HG       PRO   7  -5.467   1.978   4.627
   53    HD3  PRO   7          2HD       PRO   7  -5.845  -0.100   3.707
   54    H    ILE   8           H        ILE   8  -0.674   0.190   1.935
   55    HA   ILE   8           HA       ILE   8   0.810   0.635   4.438
   56    HB   ILE   8           HB       ILE   8   1.546  -1.455   2.390
   57   HG13  ILE   8          2HG1      ILE   8   0.782  -3.107   4.070
   58   HG21  ILE   8          1HG2      ILE   8   2.947  -2.251   4.374
   59   HG22  ILE   8          2HG2      ILE   8   3.484  -0.801   3.527
   60   HG23  ILE   8          3HG2      ILE   8   2.640  -0.659   5.069
   61   HD11  ILE   8          1HD1      ILE   8   0.579  -0.887   5.785
   62   HD12  ILE   8          2HD1      ILE   8  -1.055  -1.490   5.516
   63   HD13  ILE   8          3HD1      ILE   8   0.197  -2.572   6.128
   64    H    CYS   9           H        CYS   9   2.601   1.872   4.288
   65    HA   CYS   9           HA       CYS   9   3.184   3.049   1.677
   66    HB3  CYS   9          2HB       CYS   9   4.601   4.630   3.119
   67    H    PHE  10           H        PHE  10   5.287   3.182   0.831
   68    HA   PHE  10           HA       PHE  10   7.140   1.159   1.905
   69    HB3  PHE  10          2HB       PHE  10   8.020   1.353  -0.591
   70    HD1  PHE  10          1HD       PHE  10   7.880  -0.774   1.233
   71    HD2  PHE  10          2HD       PHE  10   5.072   0.268  -1.790
   72    HE1  PHE  10          1HE       PHE  10   7.105  -3.107   1.154
   73    HE2  PHE  10          2HE       PHE  10   4.290  -2.063  -1.873
   74    HZ   PHE  10           HZ       PHE  10   5.307  -3.755  -0.401
   75    HA   PRO  11           HA       PRO  11  10.296   4.160   2.435
   76    HB3  PRO  11          2HB       PRO  11  11.667   2.455   3.138
   77    HG3  PRO  11          2HG       PRO  11  11.602   0.366   2.119
   78    HD3  PRO  11          2HD       PRO  11   9.354   0.683   2.512
   79    H    ASP  12           H        ASP  12  10.186   2.579  -0.717
   80    HA   ASP  12           HA       ASP  12  11.867   4.442  -2.052
   81    HB3  ASP  12          2HB       ASP  12  11.269   3.333  -4.048
   82    H    GLY  13           H        GLY  13   8.329   4.077  -1.875
   83    HA2  GLY  13          2HA       GLY  13   7.388   6.497  -1.547
   84    HA3  GLY  13          3HA       GLY  13   8.020   6.685  -3.175
   85    H    ARG  14           H        ARG  14   5.974   4.426  -1.326
   86    HA   ARG  14           HA       ARG  14   3.864   4.693  -3.279
   87    HB3  ARG  14          2HB       ARG  14   5.223   2.025  -2.855
   88    HG3  ARG  14          2HG       ARG  14   2.828   2.732  -4.538
   89    HD3  ARG  14          2HD       ARG  14   2.884   0.215  -4.958
   90    HE   ARG  14           HE       ARG  14   4.082   2.208  -6.428
   91   HH11  ARG  14          1HH1      ARG  14   4.574  -1.201  -5.921
   92   HH12  ARG  14          2HH1      ARG  14   5.233  -1.473  -7.500
   93   HH21  ARG  14          1HH2      ARG  14   4.948   1.861  -8.511
   94   HH22  ARG  14          2HH2      ARG  14   5.446   0.269  -8.971
  Start of MODEL    5
    1    H1   CYS   1           H        CYS   1   2.609   5.343  -1.485
    2    HA   CYS   1           HA       CYS   1   1.821   3.328   0.419
    3    HB3  CYS   1          2HB       CYS   1   0.399   5.014   1.365
    4    H    THR   2           H        THR   2   0.057   2.055   0.381
    5    HA   THR   2           HA       THR   2  -1.498   2.004  -2.085
    6    HB   THR   2           HB       THR   2  -2.480  -0.101  -0.782
    7    HG1  THR   2          1HG       THR   2  -1.274  -0.742   0.848
    8   HG21  THR   2          1HG2      THR   2   0.014   0.237  -2.382
    9   HG22  THR   2          2HG2      THR   2  -1.484  -0.595  -2.795
   10   HG23  THR   2          3HG2      THR   2  -0.338  -1.343  -1.682
   11    H    HIS   3           H        HIS   3  -3.717   2.201  -2.187
   12    HA   HIS   3           HA       HIS   3  -5.108   2.964   0.289
   13    HB3  HIS   3          2HB       HIS   3  -4.627   5.050  -0.790
   14    HD1  HIS   3          1HD       HIS   3  -3.048   4.755  -2.880
   15    HD2  HIS   3          2HD       HIS   3  -7.113   4.454  -3.680
   16    HE1  HIS   3          1HE       HIS   3  -3.259   4.971  -5.378
   17    H    DPN   4           H        DPN   4  -6.770   1.657   0.613
   18    HA   DPN   4           HA       DPN   4  -7.994   0.314  -1.691
   19    HB2  DPN   4          2HB       DPN   4  -9.384   1.962   0.401
   20    HB3  DPN   4          3HB       DPN   4 -10.224   0.633  -0.389
   21    HD1  DPN   4          1HD       DPN   4  -9.742   0.684  -3.091
   22    HD2  DPN   4          2HD       DPN   4  -9.857   4.023  -0.455
   23    HE1  DPN   4          1HE       DPN   4 -10.290   2.158  -4.986
   24    HE2  DPN   4          2HE       DPN   4 -10.404   5.501  -2.343
   25    HZ   DPN   4           HZ       DPN   4 -10.621   4.570  -4.612
   26    HA   MMO   5           HA       NAR   5  -7.785  -2.762   1.477
   27   HCB1  MMO   5          2HB       NAR   5  -6.541  -3.948  -1.010
   28   HCB2  MMO   5          3HB       NAR   5  -7.094  -4.880   0.373
   29   HCG1  MMO   5          2HG       NAR   5  -9.318  -4.503  -0.086
   30   HCG2  MMO   5          3HG       NAR   5  -8.985  -3.033  -1.007
   31   HCD1  MMO   5          2HD       NAR   5  -8.459  -4.183  -2.914
   32   HCD2  MMO   5          3HD       NAR   5  -7.907  -5.605  -2.032
   33   HH21  MMO   5          1HH1      NAR   5  -8.701  -5.340  -4.476
   34   HH22  MMO   5          2HH1      NAR   5  -9.910  -6.092  -5.460
   35   HH11  MMO   5          1HH2      NAR   5 -12.153  -6.594  -2.825
   36    HC1  MMO   5          2HN       NAR   5  -5.632  -0.375  -0.939
   37    HC2  MMO   5          3HN       NAR   5  -6.764  -1.136  -2.084
   38    HC3  MMO   5           H        NAR   5  -5.530  -2.123  -1.262
   39    HE   MMO   5           HE       NAR   5 -10.553  -5.601  -1.540
   40   HH12  MMO   5          2HH2      NAR   5 -11.874  -6.806  -4.521
   41    H    TRP   6           H        TRP   6  -6.492  -2.794   3.183
   42    HA   TRP   6           HA       TRP   6  -4.634  -2.823   4.498
   43    HB3  TRP   6          2HB       TRP   6  -2.694  -4.245   3.470
   44    HD1  TRP   6           HD       TRP   6  -3.318  -5.071   6.004
   45    HE1  TRP   6          1HE       TRP   6  -4.740  -7.066   6.795
   46    HE3  TRP   6          3HE       TRP   6  -5.855  -6.028   1.670
   47    HZ2  TRP   6          2HZ       TRP   6  -6.679  -8.816   5.723
   48    HZ3  TRP   6          3HZ       TRP   6  -7.475  -7.880   1.636
   49    HH2  TRP   6           HH       TRP   6  -7.877  -9.244   3.621
   50    HA   PRO   7           HA       PRO   7  -2.722   0.638   2.051
   51    HB3  PRO   7          2HB       PRO   7  -4.327   2.125   2.752
   52    HG3  PRO   7          2HG       PRO   7  -5.552   1.746   4.692
   53    HD3  PRO   7          2HD       PRO   7  -5.812  -0.295   3.650
   54    H    ILE   8           H        ILE   8  -0.573   0.707   2.125
   55    HA   ILE   8           HA       ILE   8   0.791   1.043   4.674
   56    HB   ILE   8           HB       ILE   8   0.760  -1.375   4.430
   57   HG13  ILE   8          2HG1      ILE   8   3.475  -0.210   3.770
   58   HG21  ILE   8          1HG2      ILE   8   2.255  -1.056   1.839
   59   HG22  ILE   8          2HG2      ILE   8   1.601  -2.534   2.546
   60   HG23  ILE   8          3HG2      ILE   8   0.507  -1.299   1.919
   61   HD11  ILE   8          1HD1      ILE   8   2.471   0.839   5.750
   62   HD12  ILE   8          2HD1      ILE   8   2.260  -0.760   6.466
   63   HD13  ILE   8          3HD1      ILE   8   3.881  -0.143   6.142
   64    H    CYS   9           H        CYS   9   2.521   2.344   4.512
   65    HA   CYS   9           HA       CYS   9   3.187   3.390   1.880
   66    HB3  CYS   9          2HB       CYS   9   4.712   4.883   3.449
   67    H    PHE  10           H        PHE  10   4.971   2.894   0.779
   68    HA   PHE  10           HA       PHE  10   6.929   1.125   2.048
   69    HB3  PHE  10          2HB       PHE  10   7.702   1.045  -0.489
   70    HD1  PHE  10          1HD       PHE  10   7.589  -0.886   1.543
   71    HD2  PHE  10          2HD       PHE  10   4.680  -0.066  -1.452
   72    HE1  PHE  10          1HE       PHE  10   6.753  -3.191   1.731
   73    HE2  PHE  10          2HE       PHE  10   3.837  -2.369  -1.267
   74    HZ   PHE  10           HZ       PHE  10   4.873  -3.935   0.325
   75    HA   PRO  11           HA       PRO  11  10.180   4.070   2.145
   76    HB3  PRO  11          2HB       PRO  11  11.537   2.403   2.957
   77    HG3  PRO  11          2HG       PRO  11  11.376   0.226   2.155
   78    HD3  PRO  11          2HD       PRO  11   9.154   0.647   2.608
   79    H    ASP  12           H        ASP  12   9.581   2.359  -0.825
   80    HA   ASP  12           HA       ASP  12  11.372   3.890  -2.446
   81    HB3  ASP  12          2HB       ASP  12   9.966   2.898  -4.336
   82    H    GLY  13           H        GLY  13   8.136   4.306  -1.285
   83    HA2  GLY  13          2HA       GLY  13   7.322   6.619  -1.257
   84    HA3  GLY  13          3HA       GLY  13   7.932   6.773  -2.898
   85    H    ARG  14           H        ARG  14   6.171   3.997  -1.643
   86    HA   ARG  14           HA       ARG  14   3.857   4.774  -3.285
   87    HB3  ARG  14          2HB       ARG  14   3.702   2.144  -3.589
   88    HG3  ARG  14          2HG       ARG  14   4.144   4.023  -5.343
   89    HD3  ARG  14          2HD       ARG  14   6.850   2.856  -4.839
   90    HE   ARG  14           HE       ARG  14   6.610   4.187  -7.361
   91   HH11  ARG  14          1HH1      ARG  14   6.414   1.108  -5.751
   92   HH12  ARG  14          2HH1      ARG  14   6.776   0.191  -7.177
   93   HH21  ARG  14          1HH2      ARG  14   7.089   2.993  -9.245
   94   HH22  ARG  14          2HH2      ARG  14   7.162   1.265  -9.163
  Start of MODEL    6
    1    H1   CYS   1           H        CYS   1   2.240   4.087  -2.982
    2    HA   CYS   1           HA       CYS   1   2.019   3.100  -0.252
    3    HB3  CYS   1          2HB       CYS   1   0.466   5.189   0.158
    4    H    THR   2           H        THR   2   0.254   1.887  -0.012
    5    HA   THR   2           HA       THR   2  -1.722   1.892  -2.175
    6    HB   THR   2           HB       THR   2  -2.459  -0.235  -0.712
    7    HG1  THR   2          1HG       THR   2   0.360  -0.060  -0.321
    8   HG21  THR   2          1HG2      THR   2  -1.776  -1.375  -2.521
    9   HG22  THR   2          2HG2      THR   2  -0.097  -0.881  -2.305
   10   HG23  THR   2          3HG2      THR   2  -1.231   0.185  -3.134
   11    H    HIS   3           H        HIS   3  -3.958   1.935  -1.760
   12    HA   HIS   3           HA       HIS   3  -4.880   2.498   0.935
   13    HB3  HIS   3          2HB       HIS   3  -6.052   4.589   0.178
   14    HD1  HIS   3          1HD       HIS   3  -2.801   5.479  -1.260
   15    HD2  HIS   3          2HD       HIS   3  -4.437   5.056   2.535
   16    HE1  HIS   3          1HE       HIS   3  -1.200   6.637   0.295
   17    H    DPN   4           H        DPN   4  -6.700   1.410   1.233
   18    HA   DPN   4           HA       DPN   4  -8.281   0.636  -1.118
   19    HB2  DPN   4          2HB       DPN   4  -9.406   1.750   1.461
   20    HB3  DPN   4          3HB       DPN   4 -10.365   1.055   0.158
   21    HD1  DPN   4          1HD       DPN   4  -9.441   2.144  -2.252
   22    HD2  DPN   4          2HD       DPN   4  -9.628   4.021   1.563
   23    HE1  DPN   4          1HE       DPN   4  -9.552   4.347  -3.346
   24    HE2  DPN   4          2HE       DPN   4  -9.740   6.226   0.478
   25    HZ   DPN   4           HZ       DPN   4  -9.704   6.391  -1.981
   26    HA   MMO   5           HA       NAR   5  -8.183  -2.972   1.431
   27   HCB1  MMO   5          2HB       NAR   5  -7.314  -3.817  -1.338
   28   HCB2  MMO   5          3HB       NAR   5  -7.871  -4.915  -0.083
   29   HCG1  MMO   5          2HG       NAR   5  -9.982  -3.365  -0.091
   30   HCG2  MMO   5          3HG       NAR   5  -9.410  -2.958  -1.709
   31   HCD1  MMO   5          2HD       NAR   5 -10.895  -4.747  -2.022
   32   HCD2  MMO   5          3HD       NAR   5  -9.288  -5.465  -2.123
   33   HH21  MMO   5          1HH1      NAR   5 -10.675  -7.031  -2.619
   34   HH22  MMO   5          2HH1      NAR   5 -11.217  -8.556  -2.000
   35   HH11  MMO   5          1HH2      NAR   5 -10.977  -7.604   1.357
   36    HC1  MMO   5          2HN       NAR   5  -5.980  -0.431  -0.777
   37    HC2  MMO   5          3HN       NAR   5  -7.300  -0.851  -1.894
   38    HC3  MMO   5           H        NAR   5  -6.126  -2.094  -1.395
   39    HE   MMO   5           HE       NAR   5 -10.264  -5.602   0.529
   40   HH12  MMO   5          2HH2      NAR   5 -11.390  -8.881   0.261
   41    H    TRP   6           H        TRP   6  -5.676  -1.356   1.386
   42    HA   TRP   6           HA       TRP   6  -4.014  -3.149   2.770
   43    HB3  TRP   6          2HB       TRP   6  -2.664  -2.360   0.224
   44    HD1  TRP   6           HD       TRP   6  -1.317  -2.859   3.075
   45    HE1  TRP   6          1HE       TRP   6   0.336  -4.814   3.358
   46    HE3  TRP   6          3HE       TRP   6  -2.775  -5.739  -0.891
   47    HZ2  TRP   6          2HZ       TRP   6   0.942  -7.250   2.069
   48    HZ3  TRP   6          3HZ       TRP   6  -1.606  -7.866  -1.297
   49    HH2  TRP   6           HH       TRP   6   0.214  -8.604   0.154
   50    HA   PRO   7           HA       PRO   7  -3.324   1.407   3.359
   51    HB3  PRO   7          2HB       PRO   7  -5.000   1.533   4.926
   52    HG3  PRO   7          2HG       PRO   7  -5.700  -0.356   6.086
   53    HD3  PRO   7          2HD       PRO   7  -5.782  -1.163   3.929
   54    H    ILE   8           H        ILE   8  -1.128   0.997   2.763
   55    HA   ILE   8           HA       ILE   8   0.645   0.903   5.065
   56    HB   ILE   8           HB       ILE   8   2.148  -0.758   4.019
   57   HG13  ILE   8          2HG1      ILE   8   1.211  -0.401   1.693
   58   HG21  ILE   8          1HG2      ILE   8  -0.648  -1.731   4.583
   59   HG22  ILE   8          2HG2      ILE   8   0.796  -2.742   4.565
   60   HG23  ILE   8          3HG2      ILE   8   0.630  -1.464   5.768
   61   HD11  ILE   8          1HD1      ILE   8   1.846  -3.031   2.860
   62   HD12  ILE   8          2HD1      ILE   8   1.073  -3.032   1.275
   63   HD13  ILE   8          3HD1      ILE   8   2.592  -2.169   1.514
   64    H    CYS   9           H        CYS   9   2.907   1.447   4.456
   65    HA   CYS   9           HA       CYS   9   3.089   2.972   1.953
   66    HB3  CYS   9          2HB       CYS   9   4.542   4.554   3.604
   67    H    PHE  10           H        PHE  10   5.049   2.915   0.956
   68    HA   PHE  10           HA       PHE  10   7.112   1.258   2.245
   69    HB3  PHE  10          2HB       PHE  10   7.882   1.140  -0.292
   70    HD1  PHE  10          1HD       PHE  10   7.973  -0.697   1.827
   71    HD2  PHE  10          2HD       PHE  10   4.982  -0.313  -1.179
   72    HE1  PHE  10          1HE       PHE  10   7.371  -3.065   2.125
   73    HE2  PHE  10          2HE       PHE  10   4.377  -2.679  -0.882
   74    HZ   PHE  10           HZ       PHE  10   5.572  -4.058   0.771
   75    HA   PRO  11           HA       PRO  11  10.051   4.514   2.182
   76    HB3  PRO  11          2HB       PRO  11  11.571   3.032   3.060
   77    HG3  PRO  11          2HG       PRO  11  11.629   0.815   2.357
   78    HD3  PRO  11          2HD       PRO  11   9.377   1.031   2.808
   79    H    ASP  12           H        ASP  12  10.077   2.442  -0.689
   80    HA   ASP  12           HA       ASP  12  11.572   4.047  -2.396
   81    HB3  ASP  12          2HB       ASP  12  11.037   1.848  -3.118
   82    H    GLY  13           H        GLY  13   8.323   4.427  -1.246
   83    HA2  GLY  13          2HA       GLY  13   7.400   6.680  -1.291
   84    HA3  GLY  13          3HA       GLY  13   8.089   6.863  -2.899
   85    H    ARG  14           H        ARG  14   6.593   3.857  -2.102
   86    HA   ARG  14           HA       ARG  14   4.277   4.606  -3.762
   87    HB3  ARG  14          2HB       ARG  14   5.241   1.781  -3.429
   88    HG3  ARG  14          2HG       ARG  14   3.562   3.241  -5.419
   89    HD3  ARG  14          2HD       ARG  14   5.300   0.855  -5.883
   90    HE   ARG  14           HE       ARG  14   3.523  -0.215  -6.821
   91   HH11  ARG  14          1HH1      ARG  14   3.145   3.208  -7.330
   92   HH12  ARG  14          2HH1      ARG  14   1.725   3.038  -8.308
   93   HH21  ARG  14          1HH2      ARG  14   1.653  -0.450  -8.107
   94   HH22  ARG  14          2HH2      ARG  14   0.876   0.957  -8.748
  Start of MODEL    7
    1    H1   CYS   1           H        CYS   1   2.640   4.991  -2.388
    2    HA   CYS   1           HA       CYS   1   2.211   2.936  -0.330
    3    HB3  CYS   1          2HB       CYS   1   1.134   4.617   0.990
    4    H    THR   2           H        THR   2   0.312   1.865  -0.158
    5    HA   THR   2           HA       THR   2  -1.548   2.121  -2.382
    6    HB   THR   2           HB       THR   2  -2.302   0.126  -0.423
    7    HG1  THR   2          1HG       THR   2  -0.426  -1.150  -0.601
    8   HG21  THR   2          1HG2      THR   2  -1.748   0.338  -3.325
    9   HG22  THR   2          2HG2      THR   2  -3.118  -0.385  -2.483
   10   HG23  THR   2          3HG2      THR   2  -1.596  -1.265  -2.605
   11    H    HIS   3           H        HIS   3  -3.943   1.534  -1.615
   12    HA   HIS   3           HA       HIS   3  -4.854   2.597   0.836
   13    HB3  HIS   3          2HB       HIS   3  -4.315   4.767   0.067
   14    HD1  HIS   3          1HD       HIS   3  -2.845   5.113  -1.973
   15    HD2  HIS   3          2HD       HIS   3  -6.816   4.343  -2.930
   16    HE1  HIS   3          1HE       HIS   3  -3.049   5.591  -4.434
   17    H    DPN   4           H        DPN   4  -6.640   1.472   1.196
   18    HA   DPN   4           HA       DPN   4  -8.247   0.594  -1.100
   19    HB2  DPN   4          2HB       DPN   4  -9.171   2.626   0.287
   20    HB3  DPN   4          3HB       DPN   4  -9.617   1.376   1.445
   21    HD1  DPN   4          1HD       DPN   4 -10.763  -0.752   0.215
   22    HD2  DPN   4          2HD       DPN   4 -10.817   3.276  -1.156
   23    HE1  DPN   4          1HE       DPN   4 -12.806  -1.222  -1.074
   24    HE2  DPN   4          2HE       DPN   4 -12.858   2.814  -2.450
   25    HZ   DPN   4           HZ       DPN   4 -13.855   0.562  -2.409
   26    HA   MMO   5           HA       NAR   5  -8.052  -2.933   1.556
   27   HCB1  MMO   5          2HB       NAR   5  -8.696  -3.517  -0.880
   28   HCB2  MMO   5          3HB       NAR   5  -7.054  -4.134  -1.013
   29   HCG1  MMO   5          2HG       NAR   5  -7.506  -5.642   0.891
   30   HCG2  MMO   5          3HG       NAR   5  -9.173  -5.070   0.907
   31   HCD1  MMO   5          2HD       NAR   5  -7.974  -6.169  -1.602
   32   HCD2  MMO   5          3HD       NAR   5  -8.581  -7.259  -0.357
   33   HH21  MMO   5          1HH1      NAR   5  -9.007  -8.123  -2.327
   34   HH22  MMO   5          2HH1      NAR   5 -10.378  -8.553  -3.296
   35   HH11  MMO   5          1HH2      NAR   5 -12.345  -5.872  -2.215
   36    HC1  MMO   5          2HN       NAR   5  -7.266  -0.912  -1.855
   37    HC2  MMO   5          3HN       NAR   5  -6.068  -2.120  -1.340
   38    HC3  MMO   5           H        NAR   5  -5.930  -0.436  -0.779
   39    HE   MMO   5           HE       NAR   5 -10.533  -5.315  -0.946
   40   HH12  MMO   5          2HH2      NAR   5 -12.277  -7.272  -3.231
   41    H    TRP   6           H        TRP   6  -5.562  -1.295   1.389
   42    HA   TRP   6           HA       TRP   6  -3.835  -3.116   2.714
   43    HB3  TRP   6          2HB       TRP   6  -1.994  -2.427   0.808
   44    HD1  TRP   6           HD       TRP   6  -1.608  -4.627   2.666
   45    HE1  TRP   6          1HE       TRP   6  -1.649  -7.128   2.054
   46    HE3  TRP   6          3HE       TRP   6  -4.246  -4.349  -1.704
   47    HZ2  TRP   6          2HZ       TRP   6  -2.665  -8.764  -0.010
   48    HZ3  TRP   6          3HZ       TRP   6  -4.710  -6.429  -2.935
   49    HH2  TRP   6           HH       TRP   6  -3.934  -8.590  -2.105
   50    HA   PRO   7           HA       PRO   7  -3.344   1.398   3.665
   51    HB3  PRO   7          2HB       PRO   7  -4.973   1.298   5.284
   52    HG3  PRO   7          2HG       PRO   7  -5.534  -0.718   6.298
   53    HD3  PRO   7          2HD       PRO   7  -5.643  -1.344   4.082
   54    H    ILE   8           H        ILE   8  -1.143   0.756   2.866
   55    HA   ILE   8           HA       ILE   8   0.735   0.904   5.081
   56    HB   ILE   8           HB       ILE   8   2.184  -0.878   4.101
   57   HG13  ILE   8          2HG1      ILE   8   0.855  -0.785   1.876
   58   HG21  ILE   8          1HG2      ILE   8   0.701  -1.220   6.074
   59   HG22  ILE   8          2HG2      ILE   8  -0.512  -1.890   4.987
   60   HG23  ILE   8          3HG2      ILE   8   1.046  -2.694   5.172
   61   HD11  ILE   8          1HD1      ILE   8   1.102  -3.630   2.489
   62   HD12  ILE   8          2HD1      ILE   8   1.867  -2.663   1.225
   63   HD13  ILE   8          3HD1      ILE   8   2.538  -2.675   2.856
   64    H    CYS   9           H        CYS   9   2.787   1.711   4.492
   65    HA   CYS   9           HA       CYS   9   2.959   2.774   1.750
   66    HB3  CYS   9          2HB       CYS   9   3.802   4.182   4.291
   67    H    PHE  10           H        PHE  10   4.922   2.670   0.751
   68    HA   PHE  10           HA       PHE  10   6.976   1.100   2.128
   69    HB3  PHE  10          2HB       PHE  10   7.894   1.115  -0.360
   70    HD1  PHE  10          1HD       PHE  10   7.870  -0.829   1.662
   71    HD2  PHE  10          2HD       PHE  10   5.061  -0.301  -1.492
   72    HE1  PHE  10          1HE       PHE  10   7.269  -3.211   1.803
   73    HE2  PHE  10          2HE       PHE  10   4.456  -2.681  -1.356
   74    HZ   PHE  10           HZ       PHE  10   5.561  -4.140   0.293
   75    HA   PRO  11           HA       PRO  11   9.886   4.367   2.407
   76    HB3  PRO  11          2HB       PRO  11  11.363   2.849   3.297
   77    HG3  PRO  11          2HG       PRO  11  11.478   0.672   2.490
   78    HD3  PRO  11          2HD       PRO  11   9.203   0.856   2.815
   79    H    ASP  12           H        ASP  12   9.877   2.515  -0.581
   80    HA   ASP  12           HA       ASP  12  11.532   4.200  -2.110
   81    HB3  ASP  12          2HB       ASP  12   9.225   2.690  -3.303
   82    H    GLY  13           H        GLY  13   8.028   4.191  -1.576
   83    HA2  GLY  13          2HA       GLY  13   7.393   6.750  -1.495
   84    HA3  GLY  13          3HA       GLY  13   7.746   6.599  -3.210
   85    H    ARG  14           H        ARG  14   6.704   3.915  -3.462
   86    HA   ARG  14           HA       ARG  14   4.011   4.539  -4.040
   87    HB3  ARG  14          2HB       ARG  14   3.862   1.961  -4.297
   88    HG3  ARG  14          2HG       ARG  14   4.397   3.716  -6.122
   89    HD3  ARG  14          2HD       ARG  14   7.069   2.346  -5.834
   90    HE   ARG  14           HE       ARG  14   5.997   3.354  -8.139
   91   HH11  ARG  14          1HH1      ARG  14   8.715   4.146  -6.114
   92   HH12  ARG  14          2HH1      ARG  14   9.671   4.768  -7.419
   93   HH21  ARG  14          1HH2      ARG  14   7.247   4.170  -9.864
   94   HH22  ARG  14          2HH2      ARG  14   8.834   4.782  -9.550
  Start of MODEL    8
    1    H1   CYS   1           H        CYS   1   2.172   4.676  -2.747
    2    HA   CYS   1           HA       CYS   1   1.971   2.966  -0.360
    3    HB3  CYS   1          2HB       CYS   1   0.461   5.527  -0.396
    4    H    THR   2           H        THR   2   0.178   1.751  -0.225
    5    HA   THR   2           HA       THR   2  -1.711   1.877  -2.435
    6    HB   THR   2           HB       THR   2  -2.592  -0.254  -1.519
    7    HG1  THR   2          1HG       THR   2  -1.715  -1.132   0.297
    8   HG21  THR   2          1HG2      THR   2   0.239  -0.922  -1.545
    9   HG22  THR   2          2HG2      THR   2  -0.205   0.183  -2.845
   10   HG23  THR   2          3HG2      THR   2  -1.033  -1.364  -2.680
   11    H    HIS   3           H        HIS   3  -3.964   2.011  -2.175
   12    HA   HIS   3           HA       HIS   3  -4.968   2.795   0.459
   13    HB3  HIS   3          2HB       HIS   3  -6.083   4.444  -1.681
   14    HD1  HIS   3          1HD       HIS   3  -4.950   7.104  -0.559
   15    HD2  HIS   3          2HD       HIS   3  -6.373   3.969   1.767
   16    HE1  HIS   3          1HE       HIS   3  -5.603   8.140   1.637
   17    H    DPN   4           H        DPN   4  -6.876   1.894   0.905
   18    HA   DPN   4           HA       DPN   4  -8.323   0.588  -1.296
   19    HB2  DPN   4          2HB       DPN   4  -9.586   2.166   0.958
   20    HB3  DPN   4          3HB       DPN   4 -10.465   1.228  -0.246
   21    HD1  DPN   4          1HD       DPN   4  -9.854   1.859  -2.752
   22    HD2  DPN   4          2HD       DPN   4  -9.371   4.420   0.615
   23    HE1  DPN   4          1HE       DPN   4  -9.909   3.820  -4.237
   24    HE2  DPN   4          2HE       DPN   4  -9.427   6.384  -0.865
   25    HZ   DPN   4           HZ       DPN   4  -9.697   6.086  -3.296
   26    HA   MMO   5           HA       NAR   5  -8.255  -2.390   1.980
   27   HCB1  MMO   5          2HB       NAR   5  -7.677  -3.607  -0.695
   28   HCB2  MMO   5          3HB       NAR   5  -7.669  -4.620   0.741
   29   HCG1  MMO   5          2HG       NAR   5  -9.974  -3.881   1.234
   30   HCG2  MMO   5          3HG       NAR   5  -9.969  -2.965  -0.274
   31   HCD1  MMO   5          2HD       NAR   5  -9.270  -5.862  -0.338
   32   HCD2  MMO   5          3HD       NAR   5 -10.962  -5.398  -0.164
   33   HH21  MMO   5          1HH1      NAR   5 -10.569  -7.259  -1.466
   34   HH22  MMO   5          2HH1      NAR   5 -10.832  -7.749  -3.106
   35   HH11  MMO   5          1HH2      NAR   5 -10.248  -4.574  -4.452
   36    HC1  MMO   5          2HN       NAR   5  -6.132  -2.102  -0.916
   37    HC2  MMO   5          3HN       NAR   5  -6.015  -0.347  -0.634
   38    HC3  MMO   5           H        NAR   5  -7.284  -0.995  -1.702
   39    HE   MMO   5           HE       NAR   5  -9.903  -3.940  -2.288
   40   HH12  MMO   5          2HH2      NAR   5 -10.648  -6.221  -4.803
   41    H    TRP   6           H        TRP   6  -6.762  -2.316   3.534
   42    HA   TRP   6           HA       TRP   6  -4.822  -2.626   4.677
   43    HB3  TRP   6          2HB       TRP   6  -3.208  -4.340   3.361
   44    HD1  TRP   6           HD       TRP   6  -3.014  -4.965   5.960
   45    HE1  TRP   6          1HE       TRP   6  -4.368  -6.577   7.441
   46    HE3  TRP   6          3HE       TRP   6  -7.079  -5.625   2.933
   47    HZ2  TRP   6          2HZ       TRP   6  -6.833  -7.949   7.338
   48    HZ3  TRP   6          3HZ       TRP   6  -8.892  -7.104   3.698
   49    HH2  TRP   6           HH       TRP   6  -8.769  -8.242   5.855
   50    HA   PRO   7           HA       PRO   7  -2.705   0.403   1.868
   51    HB3  PRO   7          2HB       PRO   7  -3.969   2.141   2.682
   52    HG3  PRO   7          2HG       PRO   7  -4.990   2.010   4.766
   53    HD3  PRO   7          2HD       PRO   7  -5.680   0.006   3.861
   54    H    ILE   8           H        ILE   8  -0.558   0.322   1.699
   55    HA   ILE   8           HA       ILE   8   1.051   0.063   4.151
   56    HB   ILE   8           HB       ILE   8   0.973  -2.132   3.134
   57   HG13  ILE   8          2HG1      ILE   8   3.093  -1.434   4.144
   58   HG21  ILE   8          1HG2      ILE   8   0.887  -2.473   0.940
   59   HG22  ILE   8          2HG2      ILE   8   0.868  -0.722   0.729
   60   HG23  ILE   8          3HG2      ILE   8   2.398  -1.599   0.689
   61   HD11  ILE   8          1HD1      ILE   8   4.679  -2.861   2.949
   62   HD12  ILE   8          2HD1      ILE   8   3.118  -3.649   3.174
   63   HD13  ILE   8          3HD1      ILE   8   3.548  -2.978   1.600
   64    H    CYS   9           H        CYS   9   2.743   1.408   4.291
   65    HA   CYS   9           HA       CYS   9   3.387   3.035   1.926
   66    HB3  CYS   9          2HB       CYS   9   4.496   4.446   3.921
   67    H    PHE  10           H        PHE  10   5.259   2.652   0.966
   68    HA   PHE  10           HA       PHE  10   7.362   1.260   2.471
   69    HB3  PHE  10          2HB       PHE  10   8.275   1.060  -0.013
   70    HD1  PHE  10          1HD       PHE  10   8.345  -0.659   2.204
   71    HD2  PHE  10          2HD       PHE  10   5.514  -0.599  -0.973
   72    HE1  PHE  10          1HE       PHE  10   7.857  -3.038   2.598
   73    HE2  PHE  10          2HE       PHE  10   5.022  -2.978  -0.585
   74    HZ   PHE  10           HZ       PHE  10   6.194  -4.201   1.203
   75    HA   PRO  11           HA       PRO  11  10.125   4.666   2.389
   76    HB3  PRO  11          2HB       PRO  11  11.672   3.316   3.419
   77    HG3  PRO  11          2HG       PRO  11  11.882   1.074   2.839
   78    HD3  PRO  11          2HD       PRO  11   9.604   1.189   3.162
   79    H    ASP  12           H        ASP  12   9.698   2.746  -0.416
   80    HA   ASP  12           HA       ASP  12  11.448   4.209  -2.147
   81    HB3  ASP  12          2HB       ASP  12  10.957   1.992  -2.823
   82    H    GLY  13           H        GLY  13   8.138   4.520  -1.100
   83    HA2  GLY  13          2HA       GLY  13   7.437   6.958  -1.296
   84    HA3  GLY  13          3HA       GLY  13   7.755   6.736  -3.011
   85    H    ARG  14           H        ARG  14   6.681   4.176  -3.360
   86    HA   ARG  14           HA       ARG  14   4.032   4.709  -3.923
   87    HB3  ARG  14          2HB       ARG  14   3.745   2.327  -4.256
   88    HG3  ARG  14          2HG       ARG  14   6.609   2.954  -4.929
   89    HD3  ARG  14          2HD       ARG  14   4.578   0.984  -5.876
   90    HE   ARG  14           HE       ARG  14   5.937   2.514  -7.732
   91   HH11  ARG  14          1HH1      ARG  14   5.718  -0.849  -6.856
   92   HH12  ARG  14          2HH1      ARG  14   6.043  -1.422  -8.459
   93   HH21  ARG  14          1HH2      ARG  14   6.367   1.772  -9.846
   94   HH22  ARG  14          2HH2      ARG  14   6.414   0.071 -10.158
  Start of MODEL    9
    1    H1   CYS   1           H        CYS   1   2.483   4.601  -2.868
    2    HA   CYS   1           HA       CYS   1   1.924   2.844  -0.614
    3    HB3  CYS   1          2HB       CYS   1   0.852   4.494   0.725
    4    H    THR   2           H        THR   2  -0.277   2.248  -0.433
    5    HA   THR   2           HA       THR   2  -1.906   2.919  -2.799
    6    HB   THR   2           HB       THR   2  -0.997   0.559  -2.759
    7    HG1  THR   2          1HG       THR   2  -2.741   0.758  -4.035
    8   HG21  THR   2          1HG2      THR   2  -1.656   0.530  -0.152
    9   HG22  THR   2          2HG2      THR   2  -1.518  -0.931  -1.132
   10   HG23  THR   2          3HG2      THR   2  -3.101  -0.213  -0.836
   11    H    HIS   3           H        HIS   3  -4.265   1.779  -2.159
   12    HA   HIS   3           HA       HIS   3  -5.117   2.319   0.507
   13    HB3  HIS   3          2HB       HIS   3  -6.789   4.129  -0.767
   14    HD1  HIS   3          1HD       HIS   3  -6.633   3.912   2.044
   15    HD2  HIS   3          2HD       HIS   3  -3.863   6.280   0.051
   16    HE1  HIS   3          1HE       HIS   3  -5.716   5.479   3.784
   17    H    DPN   4           H        DPN   4  -7.169   1.536   0.918
   18    HA   DPN   4           HA       DPN   4  -8.316  -0.072  -1.231
   19    HB2  DPN   4          2HB       DPN   4  -9.894   1.928   0.399
   20    HB3  DPN   4          3HB       DPN   4 -10.617   0.689  -0.621
   21    HD1  DPN   4          1HD       DPN   4 -10.037   0.716  -3.106
   22    HD2  DPN   4          2HD       DPN   4  -9.292   3.989  -0.488
   23    HE1  DPN   4          1HE       DPN   4  -9.905   2.232  -5.041
   24    HE2  DPN   4          2HE       DPN   4  -9.159   5.509  -2.418
   25    HZ   DPN   4           HZ       DPN   4  -9.464   4.630  -4.698
   26    HA   MMO   5           HA       NAR   5  -8.749  -2.319   2.578
   27   HCB1  MMO   5          2HB       NAR   5  -8.673  -3.776   0.156
   28   HCB2  MMO   5          3HB       NAR   5  -7.739  -4.696   1.328
   29   HCG1  MMO   5          2HG       NAR   5 -10.260  -3.699   2.395
   30   HCG2  MMO   5          3HG       NAR   5 -10.455  -4.785   1.019
   31   HCD1  MMO   5          2HD       NAR   5  -8.879  -5.358   3.526
   32   HCD2  MMO   5          3HD       NAR   5 -10.467  -6.013   3.130
   33   HH21  MMO   5          1HH1      NAR   5  -8.596  -7.086   4.476
   34   HH22  MMO   5          2HH1      NAR   5  -7.703  -8.569   4.383
   35   HH11  MMO   5          1HH2      NAR   5  -7.768  -8.720   0.889
   36    HC1  MMO   5          2HN       NAR   5  -7.261  -1.713  -1.158
   37    HC2  MMO   5          3HN       NAR   5  -6.245  -2.583   0.015
   38    HC3  MMO   5           H        NAR   5  -6.184  -0.807  -0.068
   39    HE   MMO   5           HE       NAR   5  -8.942  -6.769   1.028
   40   HH12  MMO   5          2HH2      NAR   5  -7.232  -9.497   2.341
   41    H    TRP   6           H        TRP   6  -7.235  -1.668   4.050
   42    HA   TRP   6           HA       TRP   6  -5.317  -1.653   5.279
   43    HB3  TRP   6          2HB       TRP   6  -4.144  -4.016   5.242
   44    HD1  TRP   6           HD       TRP   6  -4.285  -4.118   7.798
   45    HE1  TRP   6          1HE       TRP   6  -6.183  -4.294   9.529
   46    HE3  TRP   6          3HE       TRP   6  -8.294  -3.679   4.656
   47    HZ2  TRP   6          2HZ       TRP   6  -9.003  -4.252   9.558
   48    HZ3  TRP   6          3HZ       TRP   6 -10.559  -3.757   5.615
   49    HH2  TRP   6           HH       TRP   6 -10.905  -4.040   8.017
   50    HA   PRO   7           HA       PRO   7  -2.721  -1.050   1.430
   51    HB3  PRO   7          2HB       PRO   7  -3.742   0.934   0.883
   52    HG3  PRO   7          2HG       PRO   7  -4.873   2.182   2.486
   53    HD3  PRO   7          2HD       PRO   7  -5.815   0.111   2.858
   54    H    ILE   8           H        ILE   8  -0.566   0.321   1.432
   55    HA   ILE   8           HA       ILE   8   0.725   0.393   4.036
   56    HB   ILE   8           HB       ILE   8   2.695  -0.931   2.912
   57   HG13  ILE   8          2HG1      ILE   8   0.266  -2.075   1.511
   58   HG21  ILE   8          1HG2      ILE   8   0.699  -2.890   3.694
   59   HG22  ILE   8          2HG2      ILE   8   2.218  -2.451   4.474
   60   HG23  ILE   8          3HG2      ILE   8   0.760  -1.510   4.790
   61   HD11  ILE   8          1HD1      ILE   8   2.671  -0.642   0.412
   62   HD12  ILE   8          2HD1      ILE   8   1.553  -1.602  -0.561
   63   HD13  ILE   8          3HD1      ILE   8   0.980  -0.162   0.281
   64    H    CYS   9           H        CYS   9   3.142   1.021   3.693
   65    HA   CYS   9           HA       CYS   9   3.404   2.845   1.405
   66    HB3  CYS   9          2HB       CYS   9   4.465   3.768   4.026
   67    H    PHE  10           H        PHE  10   5.303   2.681   0.405
   68    HA   PHE  10           HA       PHE  10   7.349   0.974   1.572
   69    HB3  PHE  10          2HB       PHE  10   8.393   1.522  -0.806
   70    HD1  PHE  10          1HD       PHE  10   8.299  -0.806   0.755
   71    HD2  PHE  10          2HD       PHE  10   5.645   0.366  -2.359
   72    HE1  PHE  10          1HE       PHE  10   7.727  -3.166   0.356
   73    HE2  PHE  10          2HE       PHE  10   5.069  -1.991  -2.763
   74    HZ   PHE  10           HZ       PHE  10   6.113  -3.762  -1.406
   75    HA   PRO  11           HA       PRO  11  10.197   4.118   2.688
   76    HB3  PRO  11          2HB       PRO  11  11.651   2.449   3.309
   77    HG3  PRO  11          2HG       PRO  11  11.837   0.495   2.062
   78    HD3  PRO  11          2HD       PRO  11   9.545   0.596   2.301
   79    H    ASP  12           H        ASP  12  10.565   2.878  -0.607
   80    HA   ASP  12           HA       ASP  12  12.132   5.029  -1.578
   81    HB3  ASP  12          2HB       ASP  12  10.393   2.987  -2.962
   82    H    GLY  13           H        GLY  13   8.741   4.630  -1.014
   83    HA2  GLY  13          2HA       GLY  13   7.445   6.688  -0.779
   84    HA3  GLY  13          3HA       GLY  13   8.287   7.299  -2.194
   85    H    ARG  14           H        ARG  14   6.307   4.474  -1.283
   86    HA   ARG  14           HA       ARG  14   4.516   5.020  -3.500
   87    HB3  ARG  14          2HB       ARG  14   4.792   2.405  -3.999
   88    HG3  ARG  14          2HG       ARG  14   6.628   4.506  -5.131
   89    HD3  ARG  14          2HD       ARG  14   7.048   1.945  -5.520
   90    HE   ARG  14           HE       ARG  14   5.257   0.975  -6.548
   91   HH11  ARG  14          1HH1      ARG  14   5.694   4.175  -7.849
   92   HH12  ARG  14          2HH1      ARG  14   4.475   3.987  -9.065
   93   HH21  ARG  14          1HH2      ARG  14   3.651   0.716  -8.146
   94   HH22  ARG  14          2HH2      ARG  14   3.312   2.019  -9.233
  Start of MODEL   10
    1    H1   CYS   1           H        CYS   1   2.206   4.509  -2.856
    2    HA   CYS   1           HA       CYS   1   1.928   2.928  -0.404
    3    HB3  CYS   1          2HB       CYS   1   0.535   5.567  -0.527
    4    H    THR   2           H        THR   2  -0.065   1.984  -0.116
    5    HA   THR   2           HA       THR   2  -1.838   2.081  -2.449
    6    HB   THR   2           HB       THR   2  -2.868   0.017  -1.310
    7    HG1  THR   2          1HG       THR   2  -1.633  -0.962   0.249
    8   HG21  THR   2          1HG2      THR   2  -1.395  -0.030  -3.311
    9   HG22  THR   2          2HG2      THR   2  -1.222  -1.455  -2.288
   10   HG23  THR   2          3HG2      THR   2  -0.003  -0.183  -2.241
   11    H    HIS   3           H        HIS   3  -4.198   1.858  -2.018
   12    HA   HIS   3           HA       HIS   3  -5.143   2.886   0.524
   13    HB3  HIS   3          2HB       HIS   3  -6.477   4.692  -0.727
   14    HD1  HIS   3          1HD       HIS   3  -2.923   5.282  -1.712
   15    HD2  HIS   3          2HD       HIS   3  -5.438   6.021   1.511
   16    HE1  HIS   3          1HE       HIS   3  -1.684   6.911  -0.252
   17    H    DPN   4           H        DPN   4  -6.862   1.719   1.037
   18    HA   DPN   4           HA       DPN   4  -8.447   0.513  -1.120
   19    HB2  DPN   4          2HB       DPN   4  -9.394   2.256   1.111
   20    HB3  DPN   4          3HB       DPN   4 -10.419   0.912   0.616
   21    HD1  DPN   4          1HD       DPN   4 -10.563   0.737  -2.097
   22    HD2  DPN   4          2HD       DPN   4  -9.908   4.276   0.178
   23    HE1  DPN   4          1HE       DPN   4 -11.443   2.090  -3.953
   24    HE2  DPN   4          2HE       DPN   4 -10.785   5.635  -1.675
   25    HZ   DPN   4           HZ       DPN   4 -11.554   4.543  -3.745
   26    HA   MMO   5           HA       NAR   5  -8.056  -2.717   1.856
   27   HCB1  MMO   5          2HB       NAR   5  -8.508  -3.581  -0.558
   28   HCB2  MMO   5          3HB       NAR   5  -6.831  -4.108  -0.502
   29   HCG1  MMO   5          2HG       NAR   5  -7.240  -5.659   1.173
   30   HCG2  MMO   5          3HG       NAR   5  -8.739  -4.871   1.670
   31   HCD1  MMO   5          2HD       NAR   5  -9.767  -5.544  -0.467
   32   HCD2  MMO   5          3HD       NAR   5  -8.275  -6.374  -0.905
   33   HH21  MMO   5          1HH1      NAR   5  -6.900  -7.433   0.187
   34   HH22  MMO   5          2HH1      NAR   5  -6.673  -8.983   0.929
   35   HH11  MMO   5          1HH2      NAR   5 -10.028  -9.364   1.831
   36    HC1  MMO   5          2HN       NAR   5  -7.374  -0.991  -1.722
   37    HC2  MMO   5          3HN       NAR   5  -6.108  -2.081  -1.107
   38    HC3  MMO   5           H        NAR   5  -6.053  -0.346  -0.717
   39    HE   MMO   5           HE       NAR   5 -10.316  -7.325   0.851
   40   HH12  MMO   5          2HH2      NAR   5  -8.454 -10.081   1.862
   41    H    TRP   6           H        TRP   6  -6.598  -2.597   3.440
   42    HA   TRP   6           HA       TRP   6  -4.643  -2.741   4.591
   43    HB3  TRP   6          2HB       TRP   6  -2.870  -4.268   3.302
   44    HD1  TRP   6           HD       TRP   6  -2.484  -5.716   5.373
   45    HE1  TRP   6          1HE       TRP   6  -3.932  -7.251   6.847
   46    HE3  TRP   6          3HE       TRP   6  -7.035  -4.874   3.201
   47    HZ2  TRP   6          2HZ       TRP   6  -6.643  -8.004   7.062
   48    HZ3  TRP   6          3HZ       TRP   6  -9.006  -6.041   4.101
   49    HH2  TRP   6           HH       TRP   6  -8.812  -7.574   5.990
   50    HA   PRO   7           HA       PRO   7  -2.783   0.526   1.838
   51    HB3  PRO   7          2HB       PRO   7  -4.290   2.115   2.540
   52    HG3  PRO   7          2HG       PRO   7  -5.414   1.890   4.563
   53    HD3  PRO   7          2HD       PRO   7  -5.809  -0.190   3.656
   54    H    ILE   8           H        ILE   8  -0.655   0.127   1.813
   55    HA   ILE   8           HA       ILE   8   0.841   0.426   4.336
   56    HB   ILE   8           HB       ILE   8   0.818  -1.919   3.541
   57   HG13  ILE   8          2HG1      ILE   8   2.990  -2.277   4.167
   58   HG21  ILE   8          1HG2      ILE   8   0.638  -1.649   1.184
   59   HG22  ILE   8          2HG2      ILE   8   2.133  -0.721   1.114
   60   HG23  ILE   8          3HG2      ILE   8   2.181  -2.440   1.501
   61   HD11  ILE   8          1HD1      ILE   8   3.723  -0.153   2.205
   62   HD12  ILE   8          2HD1      ILE   8   4.851  -0.626   3.478
   63   HD13  ILE   8          3HD1      ILE   8   4.279  -1.823   2.313
   64    H    CYS   9           H        CYS   9   2.773   1.543   4.276
   65    HA   CYS   9           HA       CYS   9   3.313   2.999   1.772
   66    HB3  CYS   9          2HB       CYS   9   4.474   4.600   3.554
   67    H    PHE  10           H        PHE  10   5.178   2.558   0.817
   68    HA   PHE  10           HA       PHE  10   7.245   1.140   2.323
   69    HB3  PHE  10          2HB       PHE  10   8.212   1.031  -0.146
   70    HD1  PHE  10          1HD       PHE  10   8.186  -0.795   1.986
   71    HD2  PHE  10          2HD       PHE  10   5.429  -0.505  -1.244
   72    HE1  PHE  10          1HE       PHE  10   7.628  -3.175   2.254
   73    HE2  PHE  10          2HE       PHE  10   4.866  -2.886  -0.980
   74    HZ   PHE  10           HZ       PHE  10   5.967  -4.224   0.769
   75    HA   PRO  11           HA       PRO  11  10.090   4.475   2.467
   76    HB3  PRO  11          2HB       PRO  11  11.577   3.040   3.469
   77    HG3  PRO  11          2HG       PRO  11  11.748   0.822   2.790
   78    HD3  PRO  11          2HD       PRO  11   9.464   0.979   3.063
   79    H    ASP  12           H        ASP  12   9.809   2.622  -0.434
   80    HA   ASP  12           HA       ASP  12  11.603   4.103  -2.058
   81    HB3  ASP  12          2HB       ASP  12   9.176   2.488  -2.869
   82    H    GLY  13           H        GLY  13   8.139   4.371  -1.386
   83    HA2  GLY  13          2HA       GLY  13   7.623   6.925  -1.356
   84    HA3  GLY  13          3HA       GLY  13   8.008   6.777  -3.065
   85    H    ARG  14           H        ARG  14   6.788   3.975  -2.921
   86    HA   ARG  14           HA       ARG  14   4.218   4.712  -3.866
   87    HB3  ARG  14          2HB       ARG  14   3.896   2.100  -3.575
   88    HG3  ARG  14          2HG       ARG  14   4.461   3.531  -5.703
   89    HD3  ARG  14          2HD       ARG  14   6.896   3.616  -5.119
   90    HE   ARG  14           HE       ARG  14   7.732   1.562  -4.535
   91   HH11  ARG  14          1HH1      ARG  14   5.950   1.283  -7.512
   92   HH12  ARG  14          2HH1      ARG  14   6.468  -0.339  -7.823
   93   HH21  ARG  14          1HH2      ARG  14   8.421  -0.577  -4.931
   94   HH22  ARG  14          2HH2      ARG  14   7.874  -1.398  -6.353
  Start of MODEL   11
    1    H1   CYS   1           H        CYS   1   2.151   4.889  -1.926
    2    HA   CYS   1           HA       CYS   1   1.825   2.809   0.128
    3    HB3  CYS   1          2HB       CYS   1   0.182   5.313   0.065
    4    H    THR   2           H        THR   2  -0.242   1.850   0.433
    5    HA   THR   2           HA       THR   2  -1.703   1.533  -2.064
    6    HB   THR   2           HB       THR   2  -2.742   0.019   0.195
    7    HG1  THR   2          1HG       THR   2  -0.011  -0.369  -0.534
    8   HG21  THR   2          1HG2      THR   2  -3.330  -0.813  -1.881
    9   HG22  THR   2          2HG2      THR   2  -1.970  -1.853  -1.460
   10   HG23  THR   2          3HG2      THR   2  -1.738  -0.504  -2.573
   11    H    HIS   3           H        HIS   3  -3.859   1.987  -2.354
   12    HA   HIS   3           HA       HIS   3  -5.201   3.443  -0.173
   13    HB3  HIS   3          2HB       HIS   3  -4.617   5.130  -1.721
   14    HD1  HIS   3          1HD       HIS   3  -2.873   4.037  -3.446
   15    HD2  HIS   3          2HD       HIS   3  -6.858   4.032  -4.618
   16    HE1  HIS   3          1HE       HIS   3  -2.843   3.615  -5.925
   17    H    DPN   4           H        DPN   4  -6.676   2.015   0.529
   18    HA   DPN   4           HA       DPN   4  -8.297   0.581  -1.462
   19    HB2  DPN   4          2HB       DPN   4  -9.408   2.686  -0.465
   20    HB3  DPN   4          3HB       DPN   4  -9.522   1.754   1.026
   21    HD1  DPN   4          1HD       DPN   4 -11.640   0.974   1.383
   22    HD2  DPN   4          2HD       DPN   4 -10.106   1.002  -2.586
   23    HE1  DPN   4          1HE       DPN   4 -13.723  -0.062   0.576
   24    HE2  DPN   4          2HE       DPN   4 -12.184  -0.033  -3.401
   25    HZ   DPN   4           HZ       DPN   4 -13.996  -0.566  -1.820
   26    HA   MMO   5           HA       NAR   5  -7.627  -2.448   1.662
   27   HCB1  MMO   5          2HB       NAR   5  -7.894  -4.365   0.527
   28   HCB2  MMO   5          3HB       NAR   5  -7.795  -3.383  -0.928
   29   HCG1  MMO   5          2HG       NAR   5  -5.354  -3.778  -0.980
   30   HCG2  MMO   5          3HG       NAR   5  -5.535  -4.852   0.407
   31   HCD1  MMO   5          2HD       NAR   5  -7.085  -5.252  -2.134
   32   HCD2  MMO   5          3HD       NAR   5  -5.467  -5.918  -1.913
   33   HH21  MMO   5          1HH1      NAR   5  -8.770  -5.196  -1.418
   34   HH22  MMO   5          2HH1      NAR   5 -10.080  -6.120  -0.759
   35   HH11  MMO   5          1HH2      NAR   5  -8.027  -8.648   0.518
   36    HC1  MMO   5          2HN       NAR   5  -5.873  -0.156  -1.169
   37    HC2  MMO   5          3HN       NAR   5  -7.223  -0.930  -2.037
   38    HC3  MMO   5           H        NAR   5  -5.869  -1.917  -1.435
   39    HE   MMO   5           HE       NAR   5  -6.315  -7.421  -0.355
   40   HH12  MMO   5          2HH2      NAR   5  -9.656  -8.084   0.343
   41    H    TRP   6           H        TRP   6  -6.137  -3.139   3.104
   42    HA   TRP   6           HA       TRP   6  -4.151  -3.158   4.224
   43    HB3  TRP   6          2HB       TRP   6  -2.201  -3.947   2.567
   44    HD1  TRP   6           HD       TRP   6  -1.479  -5.811   4.158
   45    HE1  TRP   6          1HE       TRP   6  -2.582  -7.909   5.166
   46    HE3  TRP   6          3HE       TRP   6  -6.212  -5.204   2.323
   47    HZ2  TRP   6          2HZ       TRP   6  -5.119  -9.143   5.179
   48    HZ3  TRP   6          3HZ       TRP   6  -7.918  -6.888   2.880
   49    HH2  TRP   6           HH       TRP   6  -7.380  -8.816   4.278
   50    HA   PRO   7           HA       PRO   7  -2.934   1.014   2.584
   51    HB3  PRO   7          2HB       PRO   7  -4.586   2.054   3.797
   52    HG3  PRO   7          2HG       PRO   7  -5.504   1.048   5.682
   53    HD3  PRO   7          2HD       PRO   7  -5.678  -0.690   4.178
   54    H    ILE   8           H        ILE   8  -0.800   0.155   2.387
   55    HA   ILE   8           HA       ILE   8   0.875   0.697   4.746
   56    HB   ILE   8           HB       ILE   8   1.463  -1.488   2.752
   57   HG13  ILE   8          2HG1      ILE   8   0.774  -3.061   4.555
   58   HG21  ILE   8          1HG2      ILE   8   2.741  -0.481   5.250
   59   HG22  ILE   8          2HG2      ILE   8   2.872  -2.193   4.851
   60   HG23  ILE   8          3HG2      ILE   8   3.478  -0.976   3.726
   61   HD11  ILE   8          1HD1      ILE   8  -1.034  -1.391   5.960
   62   HD12  ILE   8          2HD1      ILE   8   0.267  -2.396   6.597
   63   HD13  ILE   8          3HD1      ILE   8   0.589  -0.725   6.132
   64    H    CYS   9           H        CYS   9   2.649   1.915   4.400
   65    HA   CYS   9           HA       CYS   9   3.120   2.830   1.649
   66    HB3  CYS   9          2HB       CYS   9   4.197   4.781   2.657
   67    H    PHE  10           H        PHE  10   5.176   2.868   0.758
   68    HA   PHE  10           HA       PHE  10   7.141   1.160   2.134
   69    HB3  PHE  10          2HB       PHE  10   8.050   1.070  -0.356
   70    HD1  PHE  10          1HD       PHE  10   7.990  -0.803   1.731
   71    HD2  PHE  10          2HD       PHE  10   5.184  -0.322  -1.434
   72    HE1  PHE  10          1HE       PHE  10   7.339  -3.164   1.955
   73    HE2  PHE  10          2HE       PHE  10   4.527  -2.682  -1.213
   74    HZ   PHE  10           HZ       PHE  10   5.604  -4.107   0.483
   75    HA   PRO  11           HA       PRO  11  10.123   4.372   2.291
   76    HB3  PRO  11          2HB       PRO  11  11.570   2.855   3.229
   77    HG3  PRO  11          2HG       PRO  11  11.635   0.649   2.496
   78    HD3  PRO  11          2HD       PRO  11   9.367   0.892   2.823
   79    H    ASP  12           H        ASP  12   9.671   2.624  -0.644
   80    HA   ASP  12           HA       ASP  12  11.484   4.155  -2.248
   81    HB3  ASP  12          2HB       ASP  12  10.616   1.806  -2.747
   82    H    GLY  13           H        GLY  13   8.064   4.331  -1.443
   83    HA2  GLY  13          2HA       GLY  13   7.239   6.697  -1.385
   84    HA3  GLY  13          3HA       GLY  13   7.901   6.836  -3.006
   85    H    ARG  14           H        ARG  14   6.088   4.131  -1.617
   86    HA   ARG  14           HA       ARG  14   3.796   4.801  -3.306
   87    HB3  ARG  14          2HB       ARG  14   5.083   2.065  -3.301
   88    HG3  ARG  14          2HG       ARG  14   3.044   3.077  -5.249
   89    HD3  ARG  14          2HD       ARG  14   4.086   0.370  -4.446
   90    HE   ARG  14           HE       ARG  14   1.510   0.817  -5.316
   91   HH11  ARG  14          1HH1      ARG  14   4.304  -0.927  -6.441
   92   HH12  ARG  14          2HH1      ARG  14   3.378  -2.143  -7.259
   93   HH21  ARG  14          1HH2      ARG  14   0.280  -0.776  -6.389
   94   HH22  ARG  14          2HH2      ARG  14   1.089  -2.055  -7.230
  Start of MODEL   12
    1    H1   CYS   1           H        CYS   1   2.028   4.036  -2.996
    2    HA   CYS   1           HA       CYS   1   1.650   3.471  -0.196
    3    HB3  CYS   1          2HB       CYS   1   0.243   5.654   0.019
    4    H    THR   2           H        THR   2  -0.068   2.202  -0.096
    5    HA   THR   2           HA       THR   2  -1.992   2.197  -2.284
    6    HB   THR   2           HB       THR   2  -2.813   0.262  -0.477
    7    HG1  THR   2          1HG       THR   2  -0.011  -0.029  -0.689
    8   HG21  THR   2          1HG2      THR   2  -2.823  -0.609  -2.549
    9   HG22  THR   2          2HG2      THR   2  -1.171  -1.109  -2.187
   10   HG23  THR   2          3HG2      THR   2  -1.466   0.388  -3.072
   11    H    HIS   3           H        HIS   3  -4.335   1.654  -1.515
   12    HA   HIS   3           HA       HIS   3  -5.282   2.716   0.919
   13    HB3  HIS   3          2HB       HIS   3  -4.673   4.879   0.073
   14    HD1  HIS   3          1HD       HIS   3  -7.443   5.316  -2.200
   15    HD2  HIS   3          2HD       HIS   3  -3.414   4.369  -2.558
   16    HE1  HIS   3          1HE       HIS   3  -6.859   5.760  -4.607
   17    H    DPN   4           H        DPN   4  -6.880   1.303   1.176
   18    HA   DPN   4           HA       DPN   4  -8.417   0.337  -1.070
   19    HB2  DPN   4          2HB       DPN   4  -9.539   2.482  -0.469
   20    HB3  DPN   4          3HB       DPN   4  -9.832   1.836   1.143
   21    HD1  DPN   4          1HD       DPN   4 -11.717   0.540   1.581
   22    HD2  DPN   4          2HD       DPN   4 -10.536   1.240  -2.449
   23    HE1  DPN   4          1HE       DPN   4 -13.814  -0.479   0.793
   24    HE2  DPN   4          2HE       DPN   4 -12.631   0.222  -3.244
   25    HZ   DPN   4           HZ       DPN   4 -14.272  -0.640  -1.621
   26    HA   MMO   5           HA       NAR   5  -8.784  -2.788   1.977
   27   HCB1  MMO   5          2HB       NAR   5  -8.550  -3.831  -0.348
   28   HCB2  MMO   5          3HB       NAR   5  -6.882  -4.175   0.096
   29   HCG1  MMO   5          2HG       NAR   5  -8.248  -6.121   0.472
   30   HCG2  MMO   5          3HG       NAR   5  -7.689  -5.483   2.017
   31   HCD1  MMO   5          2HD       NAR   5  -9.800  -5.415   2.703
   32   HCD2  MMO   5          3HD       NAR   5 -10.123  -4.196   1.471
   33   HH21  MMO   5          1HH1      NAR   5 -12.024  -4.443   2.173
   34   HH22  MMO   5          2HH1      NAR   5 -13.570  -5.067   1.697
   35   HH11  MMO   5          1HH2      NAR   5 -12.246  -7.683  -0.207
   36    HC1  MMO   5          2HN       NAR   5  -6.299  -2.397  -0.577
   37    HC2  MMO   5          3HN       NAR   5  -6.134  -0.658  -0.238
   38    HC3  MMO   5           H        NAR   5  -7.353  -1.224  -1.405
   39    HE   MMO   5           HE       NAR   5 -10.220  -6.852   0.425
   40   HH12  MMO   5          2HH2      NAR   5 -13.694  -6.910   0.343
   41    H    TRP   6           H        TRP   6  -5.440  -3.226   0.831
   42    HA   TRP   6           HA       TRP   6  -4.577  -3.176   3.647
   43    HB3  TRP   6          2HB       TRP   6  -4.039  -5.315   2.944
   44    HD1  TRP   6           HD       TRP   6  -2.138  -3.745  -0.032
   45    HE1  TRP   6          1HE       TRP   6  -2.850  -4.977  -2.176
   46    HE3  TRP   6          3HE       TRP   6  -5.766  -6.764   1.932
   47    HZ2  TRP   6          2HZ       TRP   6  -4.704  -6.964  -2.934
   48    HZ3  TRP   6          3HZ       TRP   6  -6.963  -8.301   0.430
   49    HH2  TRP   6           HH       TRP   6  -6.443  -8.398  -1.953
   50    HA   PRO   7           HA       PRO   7  -2.689   0.534   1.615
   51    HB3  PRO   7          2HB       PRO   7  -4.325   1.904   2.466
   52    HG3  PRO   7          2HG       PRO   7  -5.544   1.289   4.347
   53    HD3  PRO   7          2HD       PRO   7  -5.760  -0.631   3.090
   54    H    ILE   8           H        ILE   8  -0.553   0.800   1.738
   55    HA   ILE   8           HA       ILE   8   0.793   0.783   4.314
   56    HB   ILE   8           HB       ILE   8   2.486  -0.844   3.625
   57   HG13  ILE   8          2HG1      ILE   8   0.884  -0.808   1.121
   58   HG21  ILE   8          1HG2      ILE   8   1.201  -2.825   3.993
   59   HG22  ILE   8          2HG2      ILE   8   0.463  -1.519   4.918
   60   HG23  ILE   8          3HG2      ILE   8  -0.265  -2.047   3.402
   61   HD11  ILE   8          1HD1      ILE   8   3.316  -1.689   0.422
   62   HD12  ILE   8          2HD1      ILE   8   2.898   0.018   0.563
   63   HD13  ILE   8          3HD1      ILE   8   3.725  -0.800   1.888
   64    H    CYS   9           H        CYS   9   2.836   1.777   4.285
   65    HA   CYS   9           HA       CYS   9   3.472   3.196   1.780
   66    HB3  CYS   9          2HB       CYS   9   4.583   4.762   3.723
   67    H    PHE  10           H        PHE  10   5.387   2.724   0.941
   68    HA   PHE  10           HA       PHE  10   7.376   1.385   2.624
   69    HB3  PHE  10          2HB       PHE  10   8.428   1.074   0.207
   70    HD1  PHE  10          1HD       PHE  10   8.319  -0.568   2.482
   71    HD2  PHE  10          2HD       PHE  10   5.683  -0.548  -0.860
   72    HE1  PHE  10          1HE       PHE  10   7.745  -2.920   2.925
   73    HE2  PHE  10          2HE       PHE  10   5.105  -2.898  -0.423
   74    HZ   PHE  10           HZ       PHE  10   6.137  -4.088   1.472
   75    HA   PRO  11           HA       PRO  11  10.228   4.716   2.593
   76    HB3  PRO  11          2HB       PRO  11  11.674   3.366   3.760
   77    HG3  PRO  11          2HG       PRO  11  11.860   1.100   3.271
   78    HD3  PRO  11          2HD       PRO  11   9.568   1.281   3.452
   79    H    ASP  12           H        ASP  12  10.025   2.642  -0.156
   80    HA   ASP  12           HA       ASP  12  11.885   3.991  -1.830
   81    HB3  ASP  12          2HB       ASP  12   9.531   2.208  -2.487
   82    H    GLY  13           H        GLY  13   8.321   3.914  -2.072
   83    HA2  GLY  13          2HA       GLY  13   7.627   6.501  -1.966
   84    HA3  GLY  13          3HA       GLY  13   8.366   6.409  -3.559
   85    H    ARG  14           H        ARG  14   6.172   4.290  -1.710
   86    HA   ARG  14           HA       ARG  14   4.117   4.648  -3.739
   87    HB3  ARG  14          2HB       ARG  14   3.868   2.060  -3.748
   88    HG3  ARG  14          2HG       ARG  14   5.615   1.804  -5.539
   89    HD3  ARG  14          2HD       ARG  14   3.644   4.073  -5.630
   90    HE   ARG  14           HE       ARG  14   5.551   3.417  -7.639
   91   HH11  ARG  14          1HH1      ARG  14   2.233   4.351  -7.137
   92   HH12  ARG  14          2HH1      ARG  14   2.070   5.090  -8.694
   93   HH21  ARG  14          1HH2      ARG  14   5.348   4.386  -9.692
   94   HH22  ARG  14          2HH2      ARG  14   3.841   5.110 -10.148
  Start of MODEL   13
    1    H1   CYS   1           H        CYS   1   2.030   5.250  -2.212
    2    HA   CYS   1           HA       CYS   1   1.754   2.987  -0.348
    3    HB3  CYS   1          2HB       CYS   1  -0.376   4.855   0.036
    4    H    THR   2           H        THR   2  -0.016   1.659  -0.614
    5    HA   THR   2           HA       THR   2  -1.291   1.814  -3.225
    6    HB   THR   2           HB       THR   2  -2.325  -0.439  -2.259
    7    HG1  THR   2          1HG       THR   2  -0.724  -1.412  -0.871
    8   HG21  THR   2          1HG2      THR   2  -0.841  -0.220  -4.221
    9   HG22  THR   2          2HG2      THR   2  -0.463  -1.647  -3.256
   10   HG23  THR   2          3HG2      THR   2   0.554  -0.212  -3.143
   11    H    HIS   3           H        HIS   3  -3.679   0.803  -3.085
   12    HA   HIS   3           HA       HIS   3  -5.162   2.619  -1.310
   13    HB3  HIS   3          2HB       HIS   3  -6.989   2.482  -2.903
   14    HD1  HIS   3          1HD       HIS   3  -4.464   4.379  -2.561
   15    HD2  HIS   3          2HD       HIS   3  -5.864   2.769  -6.125
   16    HE1  HIS   3          1HE       HIS   3  -3.619   5.911  -4.365
   17    H    DPN   4           H        DPN   4  -7.635   1.531  -1.314
   18    HA   DPN   4           HA       DPN   4  -7.304  -1.195  -0.268
   19    HB2  DPN   4          2HB       DPN   4  -9.546   0.244  -1.597
   20    HB3  DPN   4          3HB       DPN   4  -9.960  -0.967  -0.387
   21    HD1  DPN   4          1HD       DPN   4 -10.709  -2.858  -1.452
   22    HD2  DPN   4          2HD       DPN   4  -7.299  -0.834  -2.996
   23    HE1  DPN   4          1HE       DPN   4 -10.419  -4.634  -3.130
   24    HE2  DPN   4          2HE       DPN   4  -7.003  -2.605  -4.676
   25    HZ   DPN   4           HZ       DPN   4  -8.563  -4.509  -4.742
   26    HA   MMO   5           HA       NAR   5  -9.054   0.482   3.450
   27   HCB1  MMO   5          2HB       NAR   5  -9.804  -2.410   3.875
   28   HCB2  MMO   5          3HB       NAR   5 -10.412  -1.008   4.743
   29   HCG1  MMO   5          2HG       NAR   5 -10.861  -1.469   1.805
   30   HCG2  MMO   5          3HG       NAR   5 -11.984  -1.986   3.065
   31   HCD1  MMO   5          2HD       NAR   5 -12.914   0.033   2.695
   32   HCD2  MMO   5          3HD       NAR   5 -11.630   0.592   3.767
   33   HH21  MMO   5          1HH1      NAR   5 -12.846   2.314   3.220
   34   HH22  MMO   5          2HH1      NAR   5 -12.683   3.809   2.358
   35   HH11  MMO   5          1HH2      NAR   5 -10.487   2.522  -0.042
   36    HC1  MMO   5          2HN       NAR   5  -8.635  -2.915   2.364
   37    HC2  MMO   5          3HN       NAR   5  -7.395  -2.452   1.175
   38    HC3  MMO   5           H        NAR   5  -9.114  -2.421   0.722
   39    HE   MMO   5           HE       NAR   5 -10.708   0.562   1.102
   40   HH12  MMO   5          2HH2      NAR   5 -11.343   3.926   0.504
   41    H    TRP   6           H        TRP   6  -6.454  -1.134   2.721
   42    HA   TRP   6           HA       TRP   6  -5.091  -0.663   5.110
   43    HB3  TRP   6          2HB       TRP   6  -6.100  -2.438   6.227
   44    HD1  TRP   6           HD       TRP   6  -4.996  -4.569   3.175
   45    HE1  TRP   6          1HE       TRP   6  -6.958  -6.106   2.532
   46    HE3  TRP   6          3HE       TRP   6  -8.462  -2.904   6.543
   47    HZ2  TRP   6          2HZ       TRP   6  -9.623  -6.553   3.349
   48    HZ3  TRP   6          3HZ       TRP   6 -10.694  -3.939   6.547
   49    HH2  TRP   6           HH       TRP   6 -11.263  -5.726   4.981
   50    HA   PRO   7           HA       PRO   7  -2.724  -1.638   1.171
   51    HB3  PRO   7          2HB       PRO   7  -3.287   0.339   0.139
   52    HG3  PRO   7          2HG       PRO   7  -3.981   2.180   1.377
   53    HD3  PRO   7          2HD       PRO   7  -5.356   0.561   2.272
   54    H    ILE   8           H        ILE   8  -0.308  -0.568   0.836
   55    HA   ILE   8           HA       ILE   8   1.052  -0.801   3.438
   56    HB   ILE   8           HB       ILE   8   2.882  -2.024   2.337
   57   HG13  ILE   8          2HG1      ILE   8   1.147  -1.583  -0.042
   58   HG21  ILE   8          1HG2      ILE   8   0.939  -3.158   3.473
   59   HG22  ILE   8          2HG2      ILE   8   0.277  -3.451   1.867
   60   HG23  ILE   8          3HG2      ILE   8   1.833  -4.147   2.320
   61   HD11  ILE   8          1HD1      ILE   8   3.750  -0.900   0.653
   62   HD12  ILE   8          2HD1      ILE   8   3.911  -2.173  -0.557
   63   HD13  ILE   8          3HD1      ILE   8   2.982  -0.720  -0.922
   64    H    CYS   9           H        CYS   9   3.252   0.108   3.448
   65    HA   CYS   9           HA       CYS   9   3.595   2.266   1.474
   66    HB3  CYS   9          2HB       CYS   9   4.696   3.404   3.646
   67    H    PHE  10           H        PHE  10   5.636   2.606   0.741
   68    HA   PHE  10           HA       PHE  10   7.731   0.837   1.817
   69    HB3  PHE  10          2HB       PHE  10   8.709   1.341  -0.597
   70    HD1  PHE  10          1HD       PHE  10   8.817  -0.900   1.089
   71    HD2  PHE  10          2HD       PHE  10   6.056  -0.121  -2.056
   72    HE1  PHE  10          1HE       PHE  10   8.442  -3.317   0.824
   73    HE2  PHE  10          2HE       PHE  10   5.677  -2.537  -2.326
   74    HZ   PHE  10           HZ       PHE  10   6.872  -4.140  -0.886
   75    HA   PRO  11           HA       PRO  11  10.317   4.262   2.731
   76    HB3  PRO  11          2HB       PRO  11  11.906   2.755   3.424
   77    HG3  PRO  11          2HG       PRO  11  12.246   0.758   2.281
   78    HD3  PRO  11          2HD       PRO  11   9.956   0.684   2.541
   79    H    ASP  12           H        ASP  12  10.052   3.135  -0.493
   80    HA   ASP  12           HA       ASP  12  11.785   5.010  -1.751
   81    HB3  ASP  12          2HB       ASP  12   9.388   3.808  -3.107
   82    H    GLY  13           H        GLY  13   8.231   4.884  -1.435
   83    HA2  GLY  13          2HA       GLY  13   7.465   7.246  -0.643
   84    HA3  GLY  13          3HA       GLY  13   8.116   7.713  -2.205
   85    H    ARG  14           H        ARG  14   6.263   4.823  -1.311
   86    HA   ARG  14           HA       ARG  14   4.056   5.780  -2.997
   87    HB3  ARG  14          2HB       ARG  14   3.873   3.292  -3.725
   88    HG3  ARG  14          2HG       ARG  14   4.758   5.374  -5.075
   89    HD3  ARG  14          2HD       ARG  14   7.089   4.941  -4.064
   90    HE   ARG  14           HE       ARG  14   7.868   2.852  -4.554
   91   HH11  ARG  14          1HH1      ARG  14   6.275   4.144  -7.368
   92   HH12  ARG  14          2HH1      ARG  14   6.742   2.833  -8.397
   93   HH21  ARG  14          1HH2      ARG  14   8.491   1.119  -5.900
   94   HH22  ARG  14          2HH2      ARG  14   8.002   1.111  -7.561
  Start of MODEL   14
    1    H1   CYS   1           H        CYS   1   2.402   5.363  -1.506
    2    HA   CYS   1           HA       CYS   1   1.769   2.955   0.001
    3    HB3  CYS   1          2HB       CYS   1   0.249   4.307   1.247
    4    H    THR   2           H        THR   2  -0.366   2.031   0.008
    5    HA   THR   2           HA       THR   2  -1.492   1.931  -2.675
    6    HB   THR   2           HB       THR   2  -0.998  -0.151  -1.324
    7    HG1  THR   2          1HG       THR   2  -3.240  -1.002  -1.873
    8   HG21  THR   2          1HG2      THR   2  -3.492   0.696   0.155
    9   HG22  THR   2          2HG2      THR   2  -1.863   0.665   0.829
   10   HG23  THR   2          3HG2      THR   2  -2.641  -0.839   0.338
   11    H    HIS   3           H        HIS   3  -4.086   1.286  -2.286
   12    HA   HIS   3           HA       HIS   3  -5.399   3.171  -0.550
   13    HB3  HIS   3          2HB       HIS   3  -4.897   4.730  -2.287
   14    HD1  HIS   3          1HD       HIS   3  -3.240   3.393  -3.984
   15    HD2  HIS   3          2HD       HIS   3  -7.281   3.440  -4.947
   16    HE1  HIS   3          1HE       HIS   3  -3.357   2.777  -6.418
   17    H    DPN   4           H        DPN   4  -6.840   1.799   0.281
   18    HA   DPN   4           HA       DPN   4  -8.293   0.002  -1.535
   19    HB2  DPN   4          2HB       DPN   4  -9.453   1.918   0.478
   20    HB3  DPN   4          3HB       DPN   4 -10.343   0.496  -0.059
   21    HD1  DPN   4          1HD       DPN   4 -10.523   0.222  -2.663
   22    HD2  DPN   4          2HD       DPN   4  -9.723   3.893  -0.662
   23    HE1  DPN   4          1HE       DPN   4 -11.325   1.463  -4.630
   24    HE2  DPN   4          2HE       DPN   4 -10.520   5.141  -2.628
   25    HZ   DPN   4           HZ       DPN   4 -11.322   3.928  -4.615
   26    HA   MMO   5           HA       NAR   5  -7.578  -2.534   1.985
   27   HCB1  MMO   5          2HB       NAR   5  -6.196  -4.140  -0.161
   28   HCB2  MMO   5          3HB       NAR   5  -7.075  -4.734   1.242
   29   HCG1  MMO   5          2HG       NAR   5  -8.270  -3.331  -1.140
   30   HCG2  MMO   5          3HG       NAR   5  -8.362  -5.057  -0.785
   31   HCD1  MMO   5          2HD       NAR   5  -9.553  -2.804   0.822
   32   HCD2  MMO   5          3HD       NAR   5 -10.425  -4.006  -0.127
   33   HH21  MMO   5          1HH1      NAR   5 -11.276  -2.853   1.910
   34   HH22  MMO   5          2HH1      NAR   5 -11.885  -3.351   3.455
   35   HH11  MMO   5          1HH2      NAR   5  -9.794  -6.143   3.701
   36    HC1  MMO   5          2HN       NAR   5  -5.872  -0.538  -1.103
   37    HC2  MMO   5          3HN       NAR   5  -7.135  -1.530  -1.869
   38    HC3  MMO   5           H        NAR   5  -5.734  -2.311  -1.099
   39    HE   MMO   5           HE       NAR   5  -9.000  -5.477   1.669
   40   HH12  MMO   5          2HH2      NAR   5 -11.041  -5.223   4.472
   41    H    TRP   6           H        TRP   6  -5.961  -3.575   3.326
   42    HA   TRP   6           HA       TRP   6  -4.067  -3.193   4.591
   43    HB3  TRP   6          2HB       TRP   6  -3.310  -5.094   3.452
   44    HD1  TRP   6           HD       TRP   6  -1.695  -2.881   0.765
   45    HE1  TRP   6          1HE       TRP   6  -2.425  -3.743  -1.550
   46    HE3  TRP   6          3HE       TRP   6  -5.131  -6.368   2.242
   47    HZ2  TRP   6          2HZ       TRP   6  -4.220  -5.646  -2.607
   48    HZ3  TRP   6          3HZ       TRP   6  -6.311  -7.665   0.518
   49    HH2  TRP   6           HH       TRP   6  -5.863  -7.310  -1.857
   50    HA   PRO   7           HA       PRO   7  -3.187   1.048   2.954
   51    HB3  PRO   7          2HB       PRO   7  -4.905   1.940   4.194
   52    HG3  PRO   7          2HG       PRO   7  -5.708   0.852   6.086
   53    HD3  PRO   7          2HD       PRO   7  -5.752  -0.889   4.577
   54    H    ILE   8           H        ILE   8  -1.003   0.828   2.674
   55    HA   ILE   8           HA       ILE   8   0.658   1.449   4.984
   56    HB   ILE   8           HB       ILE   8   2.333  -0.320   4.226
   57   HG13  ILE   8          2HG1      ILE   8   0.910  -0.732   2.094
   58   HG21  ILE   8          1HG2      ILE   8   0.725  -0.335   6.254
   59   HG22  ILE   8          2HG2      ILE   8  -0.150  -1.563   5.340
   60   HG23  ILE   8          3HG2      ILE   8   1.535  -1.831   5.790
   61   HD11  ILE   8          1HD1      ILE   8   2.877  -2.108   2.753
   62   HD12  ILE   8          2HD1      ILE   8   1.766  -3.182   3.604
   63   HD13  ILE   8          3HD1      ILE   8   1.635  -2.982   1.857
   64    H    CYS   9           H        CYS   9   3.038   1.680   4.196
   65    HA   CYS   9           HA       CYS   9   3.020   2.995   1.557
   66    HB3  CYS   9          2HB       CYS   9   4.750   4.554   2.534
   67    H    PHE  10           H        PHE  10   5.213   3.206   0.586
   68    HA   PHE  10           HA       PHE  10   6.747   0.750   1.088
   69    HB3  PHE  10          2HB       PHE  10   7.687   1.501  -1.290
   70    HD1  PHE  10          1HD       PHE  10   7.584  -0.359  -2.634
   71    HD2  PHE  10          2HD       PHE  10   4.278   0.554  -0.115
   72    HE1  PHE  10          1HE       PHE  10   6.488  -2.451  -3.322
   73    HE2  PHE  10          2HE       PHE  10   3.176  -1.536  -0.799
   74    HZ   PHE  10           HZ       PHE  10   4.281  -3.044  -2.403
   75    HA   PRO  11           HA       PRO  11  10.355   2.923   2.315
   76    HB3  PRO  11          2HB       PRO  11  11.411   0.890   2.476
   77    HG3  PRO  11          2HG       PRO  11  11.013  -0.795   0.926
   78    HD3  PRO  11          2HD       PRO  11   8.844  -0.234   1.466
   79    H    ASP  12           H        ASP  12   9.602   2.646  -1.035
   80    HA   ASP  12           HA       ASP  12  11.693   4.512  -1.837
   81    HB3  ASP  12          2HB       ASP  12  10.449   4.171  -4.124
   82    H    GLY  13           H        GLY  13   8.198   4.351  -1.450
   83    HA2  GLY  13          2HA       GLY  13   7.341   6.620  -0.668
   84    HA3  GLY  13          3HA       GLY  13   8.031   7.205  -2.177
   85    H    ARG  14           H        ARG  14   6.102   4.314  -1.391
   86    HA   ARG  14           HA       ARG  14   3.941   5.329  -3.077
   87    HB3  ARG  14          2HB       ARG  14   5.050   2.549  -3.466
   88    HG3  ARG  14          2HG       ARG  14   2.632   3.349  -4.184
   89    HD3  ARG  14          2HD       ARG  14   3.452   5.272  -5.479
   90    HE   ARG  14           HE       ARG  14   5.359   4.846  -6.674
   91   HH11  ARG  14          1HH1      ARG  14   3.035   2.329  -7.296
   92   HH12  ARG  14          2HH1      ARG  14   3.968   1.600  -8.561
   93   HH21  ARG  14          1HH2      ARG  14   6.595   3.897  -8.338
   94   HH22  ARG  14          2HH2      ARG  14   5.993   2.492  -9.153
  Start of MODEL   15
    1    H1   CYS   1           H        CYS   1   2.172   5.903  -0.853
    2    HA   CYS   1           HA       CYS   1   1.359   3.473   0.442
    3    HB3  CYS   1          2HB       CYS   1  -0.664   4.840   1.077
    4    H    THR   2           H        THR   2  -0.175   2.039  -0.154
    5    HA   THR   2           HA       THR   2  -1.285   2.339  -2.850
    6    HB   THR   2           HB       THR   2  -1.727  -0.067  -2.771
    7    HG1  THR   2          1HG       THR   2  -1.846  -0.994  -0.881
    8   HG21  THR   2          1HG2      THR   2   0.375   0.296  -3.671
    9   HG22  THR   2          2HG2      THR   2   0.743  -0.795  -2.331
   10   HG23  THR   2          3HG2      THR   2   1.023   0.938  -2.160
   11    H    HIS   3           H        HIS   3  -3.488   1.899  -3.284
   12    HA   HIS   3           HA       HIS   3  -5.259   2.783  -1.184
   13    HB3  HIS   3          2HB       HIS   3  -6.956   2.884  -2.887
   14    HD1  HIS   3          1HD       HIS   3  -4.161   3.062  -5.325
   15    HD2  HIS   3          2HD       HIS   3  -6.125   5.581  -2.668
   16    HE1  HIS   3          1HE       HIS   3  -3.437   5.389  -5.944
   17    H    DPN   4           H        DPN   4  -7.601   1.474  -1.671
   18    HA   DPN   4           HA       DPN   4  -7.108  -1.384  -1.393
   19    HB2  DPN   4          2HB       DPN   4  -9.627  -1.515  -1.390
   20    HB3  DPN   4          3HB       DPN   4  -8.921  -0.832  -2.852
   21    HD1  DPN   4          1HD       DPN   4  -9.620   1.239  -3.633
   22    HD2  DPN   4          2HD       DPN   4 -10.473   0.120   0.384
   23    HE1  DPN   4          1HE       DPN   4 -11.035   3.235  -3.380
   24    HE2  DPN   4          2HE       DPN   4 -11.889   2.116   0.643
   25    HZ   DPN   4           HZ       DPN   4 -12.170   3.678  -1.242
   26    HA   MMO   5           HA       NAR   5  -8.440  -1.076   2.823
   27   HCB1  MMO   5          2HB       NAR   5  -8.800  -4.047   2.450
   28   HCB2  MMO   5          3HB       NAR   5  -9.486  -3.024   3.706
   29   HCG1  MMO   5          2HG       NAR   5 -10.679  -1.825   1.756
   30   HCG2  MMO   5          3HG       NAR   5 -10.280  -3.277   0.836
   31   HCD1  MMO   5          2HD       NAR   5 -12.518  -3.414   1.817
   32   HCD2  MMO   5          3HD       NAR   5 -11.445  -4.654   2.465
   33   HH21  MMO   5          1HH1      NAR   5 -13.125  -5.295   3.374
   34   HH22  MMO   5          2HH1      NAR   5 -13.864  -5.418   4.937
   35   HH11  MMO   5          1HH2      NAR   5 -12.489  -2.434   6.135
   36    HC1  MMO   5          2HN       NAR   5  -7.896  -3.910   0.690
   37    HC2  MMO   5          3HN       NAR   5  -6.787  -2.986  -0.348
   38    HC3  MMO   5           H        NAR   5  -8.533  -2.985  -0.688
   39    HE   MMO   5           HE       NAR   5 -11.522  -2.287   4.076
   40   HH12  MMO   5          2HH2      NAR   5 -13.503  -3.789   6.507
   41    H    TRP   6           H        TRP   6  -5.766  -1.415   1.701
   42    HA   TRP   6           HA       TRP   6  -4.515  -2.641   4.051
   43    HB3  TRP   6          2HB       TRP   6  -3.200  -3.044   1.399
   44    HD1  TRP   6           HD       TRP   6  -0.905  -3.887   2.143
   45    HE1  TRP   6          1HE       TRP   6  -0.027  -5.552   3.899
   46    HE3  TRP   6          3HE       TRP   6  -5.329  -5.076   4.413
   47    HZ2  TRP   6          2HZ       TRP   6  -1.074  -7.157   5.973
   48    HZ3  TRP   6          3HZ       TRP   6  -5.302  -6.684   6.275
   49    HH2  TRP   6           HH       TRP   6  -3.220  -7.704   7.037
   50    HA   PRO   7           HA       PRO   7  -2.838   1.573   3.265
   51    HB3  PRO   7          2HB       PRO   7  -4.141   2.419   4.957
   52    HG3  PRO   7          2HG       PRO   7  -4.922   1.050   6.668
   53    HD3  PRO   7          2HD       PRO   7  -5.543  -0.208   4.839
   54    H    ILE   8           H        ILE   8  -0.832   0.896   2.533
   55    HA   ILE   8           HA       ILE   8   1.219   0.655   4.595
   56    HB   ILE   8           HB       ILE   8   2.315  -1.229   3.482
   57   HG13  ILE   8          2HG1      ILE   8   0.086  -0.838   1.566
   58   HG21  ILE   8          1HG2      ILE   8   0.672  -1.549   5.347
   59   HG22  ILE   8          2HG2      ILE   8  -0.537  -1.947   4.128
   60   HG23  ILE   8          3HG2      ILE   8   0.898  -2.956   4.308
   61   HD11  ILE   8          1HD1      ILE   8   1.772  -0.686   0.152
   62   HD12  ILE   8          2HD1      ILE   8   2.911  -1.037   1.453
   63   HD13  ILE   8          3HD1      ILE   8   2.217  -2.354   0.504
   64    H    CYS   9           H        CYS   9   3.112   1.621   4.061
   65    HA   CYS   9           HA       CYS   9   3.270   2.811   1.375
   66    HB3  CYS   9          2HB       CYS   9   4.716   4.529   2.403
   67    H    PHE  10           H        PHE  10   5.197   2.746   0.224
   68    HA   PHE  10           HA       PHE  10   6.955   0.542   0.948
   69    HB3  PHE  10          2HB       PHE  10   7.943   1.278  -1.405
   70    HD1  PHE  10          1HD       PHE  10   7.510  -1.220  -0.198
   71    HD2  PHE  10          2HD       PHE  10   4.948   0.876  -2.874
   72    HE1  PHE  10          1HE       PHE  10   6.492  -3.350  -0.888
   73    HE2  PHE  10          2HE       PHE  10   3.928  -1.252  -3.569
   74    HZ   PHE  10           HZ       PHE  10   4.699  -3.369  -2.576
   75    HA   PRO  11           HA       PRO  11  10.403   2.911   2.262
   76    HB3  PRO  11          2HB       PRO  11  11.553   0.936   2.494
   77    HG3  PRO  11          2HG       PRO  11  11.297  -0.789   0.956
   78    HD3  PRO  11          2HD       PRO  11   9.084  -0.330   1.410
   79    H    ASP  12           H        ASP  12   9.593   2.730  -1.021
   80    HA   ASP  12           HA       ASP  12  11.704   4.582  -1.847
   81    HB3  ASP  12          2HB       ASP  12  10.584   4.257  -4.135
   82    H    GLY  13           H        GLY  13   8.254   4.416  -1.282
   83    HA2  GLY  13          2HA       GLY  13   7.355   6.638  -0.515
   84    HA3  GLY  13          3HA       GLY  13   8.051   7.276  -1.997
   85    H    ARG  14           H        ARG  14   5.598   5.096  -0.705
   86    HA   ARG  14           HA       ARG  14   3.635   5.921  -2.541
   87    HB3  ARG  14          2HB       ARG  14   4.966   3.277  -3.150
   88    HG3  ARG  14          2HG       ARG  14   2.472   3.139  -3.285
   89    HD3  ARG  14          2HD       ARG  14   2.062   5.461  -3.994
   90    HE   ARG  14           HE       ARG  14   3.367   6.201  -5.713
   91   HH11  ARG  14          1HH1      ARG  14   2.199   3.015  -6.490
   92   HH12  ARG  14          2HH1      ARG  14   2.849   3.030  -8.097
   93   HH21  ARG  14          1HH2      ARG  14   4.226   6.230  -7.825
   94   HH22  ARG  14          2HH2      ARG  14   4.002   4.857  -8.854
  Start of MODEL   16
    1    H1   CYS   1           H        CYS   1   2.360   5.822  -1.125
    2    HA   CYS   1           HA       CYS   1   1.423   3.554   0.399
    3    HB3  CYS   1          2HB       CYS   1  -0.564   5.162   0.794
    4    H    THR   2           H        THR   2  -0.226   2.205  -0.092
    5    HA   THR   2           HA       THR   2  -1.336   2.419  -2.802
    6    HB   THR   2           HB       THR   2  -1.983  -0.057  -1.458
    7    HG1  THR   2          1HG       THR   2   0.156  -0.818  -1.239
    8   HG21  THR   2          1HG2      THR   2  -0.518  -0.870  -3.464
    9   HG22  THR   2          2HG2      THR   2  -0.610   0.817  -3.965
   10   HG23  THR   2          3HG2      THR   2  -2.087  -0.125  -3.766
   11    H    HIS   3           H        HIS   3  -3.598   1.588  -3.068
   12    HA   HIS   3           HA       HIS   3  -5.283   2.735  -0.959
   13    HB3  HIS   3          2HB       HIS   3  -5.699   3.760  -3.070
   14    HD1  HIS   3          1HD       HIS   3  -5.674   3.722  -5.577
   15    HD2  HIS   3          2HD       HIS   3  -5.713  -0.088  -3.925
   16    HE1  HIS   3          1HE       HIS   3  -5.310   2.150  -7.506
   17    H    DPN   4           H        DPN   4  -7.662   1.600  -1.286
   18    HA   DPN   4           HA       DPN   4  -7.326  -1.304  -1.229
   19    HB2  DPN   4          2HB       DPN   4  -9.500   0.519  -1.892
   20    HB3  DPN   4          3HB       DPN   4 -10.015  -0.758  -0.797
   21    HD1  DPN   4          1HD       DPN   4 -11.026  -2.503  -1.871
   22    HD2  DPN   4          2HD       DPN   4  -7.748  -0.550  -3.759
   23    HE1  DPN   4          1HE       DPN   4 -11.196  -4.061  -3.769
   24    HE2  DPN   4          2HE       DPN   4  -7.913  -2.106  -5.659
   25    HZ   DPN   4           HZ       DPN   4  -9.637  -3.863  -5.666
   26    HA   MMO   5           HA       NAR   5  -8.632  -1.149   3.024
   27   HCB1  MMO   5          2HB       NAR   5 -10.212  -2.973   2.093
   28   HCB2  MMO   5          3HB       NAR   5  -8.975  -4.108   2.625
   29   HCG1  MMO   5          2HG       NAR   5 -10.370  -4.082   4.439
   30   HCG2  MMO   5          3HG       NAR   5  -9.198  -2.843   4.897
   31   HCD1  MMO   5          2HD       NAR   5 -11.546  -1.939   3.344
   32   HCD2  MMO   5          3HD       NAR   5 -11.854  -2.476   4.994
   33   HH21  MMO   5          1HH1      NAR   5 -13.088  -0.666   4.341
   34   HH22  MMO   5          2HH1      NAR   5 -13.292   0.987   4.818
   35   HH11  MMO   5          1HH2      NAR   5  -9.936   1.451   5.685
   36    HC1  MMO   5          2HN       NAR   5  -8.978  -2.831  -0.533
   37    HC2  MMO   5          3HN       NAR   5  -8.319  -3.879   0.748
   38    HC3  MMO   5           H        NAR   5  -7.217  -2.990  -0.330
   39    HE   MMO   5           HE       NAR   5  -9.680  -0.726   5.054
   40   HH12  MMO   5          2HH2      NAR   5 -11.497   2.190   5.581
   41    H    TRP   6           H        TRP   6  -5.982  -1.422   1.849
   42    HA   TRP   6           HA       TRP   6  -4.657  -2.581   4.162
   43    HB3  TRP   6          2HB       TRP   6  -2.996  -3.635   2.369
   44    HD1  TRP   6           HD       TRP   6  -3.238  -4.918   4.868
   45    HE1  TRP   6          1HE       TRP   6  -4.448  -7.129   5.395
   46    HE3  TRP   6          3HE       TRP   6  -6.298  -5.163   0.780
   47    HZ2  TRP   6          2HZ       TRP   6  -6.433  -8.759   4.230
   48    HZ3  TRP   6          3HZ       TRP   6  -7.823  -7.082   0.563
   49    HH2  TRP   6           HH       TRP   6  -7.887  -8.842   2.253
   50    HA   PRO   7           HA       PRO   7  -2.805   1.392   2.704
   51    HB3  PRO   7          2HB       PRO   7  -4.035   2.573   4.242
   52    HG3  PRO   7          2HG       PRO   7  -4.871   1.544   6.154
   53    HD3  PRO   7          2HD       PRO   7  -5.586   0.049   4.554
   54    H    ILE   8           H        ILE   8  -0.807   0.692   2.094
   55    HA   ILE   8           HA       ILE   8   1.161   0.330   4.246
   56    HB   ILE   8           HB       ILE   8   2.317  -1.380   2.812
   57   HG13  ILE   8          2HG1      ILE   8   0.534  -0.606   0.884
   58   HG21  ILE   8          1HG2      ILE   8   0.128  -1.654   4.580
   59   HG22  ILE   8          2HG2      ILE   8  -0.066  -2.860   3.310
   60   HG23  ILE   8          3HG2      ILE   8   1.423  -2.807   4.254
   61   HD11  ILE   8          1HD1      ILE   8   1.289  -3.349   0.418
   62   HD12  ILE   8          2HD1      ILE   8   1.790  -1.879  -0.419
   63   HD13  ILE   8          3HD1      ILE   8   2.639  -2.398   1.037
   64    H    CYS   9           H        CYS   9   3.056   1.369   3.945
   65    HA   CYS   9           HA       CYS   9   3.416   2.780   1.383
   66    HB3  CYS   9          2HB       CYS   9   4.715   4.450   2.683
   67    H    PHE  10           H        PHE  10   5.349   2.669   0.333
   68    HA   PHE  10           HA       PHE  10   7.201   0.618   1.268
   69    HB3  PHE  10          2HB       PHE  10   8.194   1.243  -1.130
   70    HD1  PHE  10          1HD       PHE  10   8.658  -1.014  -1.411
   71    HD2  PHE  10          2HD       PHE  10   4.628   0.242  -0.876
   72    HE1  PHE  10          1HE       PHE  10   7.885  -3.293  -1.916
   73    HE2  PHE  10          2HE       PHE  10   3.847  -2.038  -1.379
   74    HZ   PHE  10           HZ       PHE  10   5.477  -3.808  -1.901
   75    HA   PRO  11           HA       PRO  11  10.462   3.314   2.424
   76    HB3  PRO  11          2HB       PRO  11  11.738   1.446   2.832
   77    HG3  PRO  11          2HG       PRO  11  11.627  -0.411   1.438
   78    HD3  PRO  11          2HD       PRO  11   9.380  -0.070   1.824
   79    H    ASP  12           H        ASP  12   9.728   2.812  -0.845
   80    HA   ASP  12           HA       ASP  12  11.751   4.665  -1.830
   81    HB3  ASP  12          2HB       ASP  12   9.549   3.460  -3.489
   82    H    GLY  13           H        GLY  13   8.243   4.442  -1.440
   83    HA2  GLY  13          2HA       GLY  13   7.361   6.729  -0.693
   84    HA3  GLY  13          3HA       GLY  13   8.028   7.276  -2.223
   85    H    ARG  14           H        ARG  14   5.840   4.767  -0.953
   86    HA   ARG  14           HA       ARG  14   3.792   5.557  -2.826
   87    HB3  ARG  14          2HB       ARG  14   4.412   2.668  -3.017
   88    HG3  ARG  14          2HG       ARG  14   4.108   3.482  -5.540
   89    HD3  ARG  14          2HD       ARG  14   1.610   3.353  -3.927
   90    HE   ARG  14           HE       ARG  14   2.017   1.490  -6.057
   91   HH11  ARG  14          1HH1      ARG  14   1.198   4.792  -5.315
   92   HH12  ARG  14          2HH1      ARG  14   0.310   5.039  -6.782
   93   HH21  ARG  14          1HH2      ARG  14   0.849   1.802  -7.991
   94   HH22  ARG  14          2HH2      ARG  14   0.113   3.337  -8.303
  Start of MODEL   17
    1    H1   CYS   1           H        CYS   1   3.321   4.783  -1.294
    2    HA   CYS   1           HA       CYS   1   1.610   3.440   0.457
    3    HB3  CYS   1          2HB       CYS   1   0.634   5.606   0.932
    4    H    THR   2           H        THR   2  -0.137   2.285   0.024
    5    HA   THR   2           HA       THR   2  -1.577   2.680  -2.474
    6    HB   THR   2           HB       THR   2  -0.953   0.386  -1.622
    7    HG1  THR   2          1HG       THR   2  -3.249  -0.378  -2.029
    8   HG21  THR   2          1HG2      THR   2  -1.643  -0.363   0.368
    9   HG22  THR   2          2HG2      THR   2  -3.305   0.130   0.051
   10   HG23  THR   2          3HG2      THR   2  -2.156   1.288   0.721
   11    H    HIS   3           H        HIS   3  -4.113   1.969  -1.934
   12    HA   HIS   3           HA       HIS   3  -5.237   3.352   0.299
   13    HB3  HIS   3          2HB       HIS   3  -4.761   5.339  -0.942
   14    HD1  HIS   3          1HD       HIS   3  -7.378   5.091  -3.406
   15    HD2  HIS   3          2HD       HIS   3  -3.285   4.387  -3.338
   16    HE1  HIS   3          1HE       HIS   3  -6.660   5.079  -5.815
   17    H    DPN   4           H        DPN   4  -6.829   2.015   0.812
   18    HA   DPN   4           HA       DPN   4  -8.354   0.728  -1.347
   19    HB2  DPN   4          2HB       DPN   4  -9.546   2.721  -0.272
   20    HB3  DPN   4          3HB       DPN   4  -9.657   1.732   1.179
   21    HD1  DPN   4          1HD       DPN   4 -11.563   0.500   1.493
   22    HD2  DPN   4          2HD       DPN   4 -10.381   1.490  -2.471
   23    HE1  DPN   4          1HE       DPN   4 -13.611  -0.553   0.625
   24    HE2  DPN   4          2HE       DPN   4 -12.424   0.438  -3.348
   25    HZ   DPN   4           HZ       DPN   4 -14.042  -0.585  -1.799
   26    HA   MMO   5           HA       NAR   5  -7.740  -2.521   1.567
   27   HCB1  MMO   5          2HB       NAR   5  -8.064  -4.350   0.308
   28   HCB2  MMO   5          3HB       NAR   5  -7.991  -3.267  -1.073
   29   HCG1  MMO   5          2HG       NAR   5  -5.550  -3.694  -1.211
   30   HCG2  MMO   5          3HG       NAR   5  -5.731  -4.883   0.081
   31   HCD1  MMO   5          2HD       NAR   5  -5.725  -5.966  -2.101
   32   HCD2  MMO   5          3HD       NAR   5  -7.289  -6.154  -1.310
   33   HH21  MMO   5          1HH1      NAR   5  -4.834  -4.280  -2.957
   34   HH22  MMO   5          2HH1      NAR   5  -4.864  -3.353  -4.420
   35   HH11  MMO   5          1HH2      NAR   5  -8.288  -3.800  -4.973
   36    HC1  MMO   5          2HN       NAR   5  -5.979  -0.025  -1.076
   37    HC2  MMO   5          3HN       NAR   5  -7.295  -0.761  -2.024
   38    HC3  MMO   5           H        NAR   5  -5.936  -1.763  -1.459
   39    HE   MMO   5           HE       NAR   5  -8.233  -5.019  -3.044
   40   HH12  MMO   5          2HH2      NAR   5  -6.830  -3.080  -5.566
   41    H    TRP   6           H        TRP   6  -6.243  -3.283   2.952
   42    HA   TRP   6           HA       TRP   6  -4.234  -3.399   4.027
   43    HB3  TRP   6          2HB       TRP   6  -2.363  -4.211   2.268
   44    HD1  TRP   6           HD       TRP   6  -1.593  -6.118   3.781
   45    HE1  TRP   6          1HE       TRP   6  -2.688  -8.181   4.860
   46    HE3  TRP   6          3HE       TRP   6  -6.422  -5.340   2.297
   47    HZ2  TRP   6          2HZ       TRP   6  -5.260  -9.328   5.056
   48    HZ3  TRP   6          3HZ       TRP   6  -8.140  -6.967   2.972
   49    HH2  TRP   6           HH       TRP   6  -7.568  -8.919   4.323
   50    HA   PRO   7           HA       PRO   7  -2.865   0.763   2.552
   51    HB3  PRO   7          2HB       PRO   7  -4.332   1.798   3.988
   52    HG3  PRO   7          2HG       PRO   7  -5.127   0.708   5.883
   53    HD3  PRO   7          2HD       PRO   7  -5.539  -0.910   4.291
   54    H    ILE   8           H        ILE   8  -0.786   0.033   2.066
   55    HA   ILE   8           HA       ILE   8   1.082  -0.051   4.347
   56    HB   ILE   8           HB       ILE   8   1.606  -1.355   1.686
   57   HG13  ILE   8          2HG1      ILE   8   1.022  -3.507   2.918
   58   HG21  ILE   8          1HG2      ILE   8   3.119  -2.743   3.218
   59   HG22  ILE   8          2HG2      ILE   8   3.608  -1.088   2.856
   60   HG23  ILE   8          3HG2      ILE   8   2.860  -1.467   4.407
   61   HD11  ILE   8          1HD1      ILE   8   0.086  -3.540   4.931
   62   HD12  ILE   8          2HD1      ILE   8   0.672  -1.885   5.106
   63   HD13  ILE   8          3HD1      ILE   8  -0.975  -2.184   4.555
   64    H    CYS   9           H        CYS   9   2.842   1.248   4.303
   65    HA   CYS   9           HA       CYS   9   3.258   2.882   1.885
   66    HB3  CYS   9          2HB       CYS   9   3.892   3.925   4.623
   67    H    PHE  10           H        PHE  10   5.252   2.876   1.068
   68    HA   PHE  10           HA       PHE  10   7.430   1.811   2.744
   69    HB3  PHE  10          2HB       PHE  10   8.378   1.241   0.334
   70    HD1  PHE  10          1HD       PHE  10   8.615  -0.014   2.832
   71    HD2  PHE  10          2HD       PHE  10   5.811  -0.852  -0.259
   72    HE1  PHE  10          1HE       PHE  10   8.380  -2.314   3.673
   73    HE2  PHE  10          2HE       PHE  10   5.570  -3.151   0.577
   74    HZ   PHE  10           HZ       PHE  10   6.857  -3.886   2.545
   75    HA   PRO  11           HA       PRO  11   9.809   5.415   1.982
   76    HB3  PRO  11          2HB       PRO  11  11.483   4.460   3.230
   77    HG3  PRO  11          2HG       PRO  11  11.940   2.184   3.086
   78    HD3  PRO  11          2HD       PRO  11   9.658   2.112   3.409
   79    H    ASP  12           H        ASP  12   9.963   2.833  -0.362
   80    HA   ASP  12           HA       ASP  12  11.418   4.226  -2.361
   81    HB3  ASP  12          2HB       ASP  12  10.225   2.478  -3.878
   82    H    GLY  13           H        GLY  13   8.065   4.164  -1.419
   83    HA2  GLY  13          2HA       GLY  13   6.881   6.275  -2.059
   84    HA3  GLY  13          3HA       GLY  13   7.440   5.949  -3.692
   85    H    ARG  14           H        ARG  14   6.284   3.471  -1.494
   86    HA   ARG  14           HA       ARG  14   3.971   3.081  -3.278
   87    HB3  ARG  14          2HB       ARG  14   4.049   0.726  -2.721
   88    HG3  ARG  14          2HG       ARG  14   6.306   2.042  -3.942
   89    HD3  ARG  14          2HD       ARG  14   7.204   0.444  -1.975
   90    HE   ARG  14           HE       ARG  14   6.251  -1.422  -3.857
   91   HH11  ARG  14          1HH1      ARG  14   9.069  -0.710  -1.940
   92   HH12  ARG  14          2HH1      ARG  14   9.578  -2.363  -1.839
   93   HH21  ARG  14          1HH2      ARG  14   6.913  -3.601  -3.732
   94   HH22  ARG  14          2HH2      ARG  14   8.353  -4.006  -2.861
  Start of MODEL   18
    1    H1   CYS   1           H        CYS   1   2.286   5.992  -0.645
    2    HA   CYS   1           HA       CYS   1   1.400   3.509   0.488
    3    HB3  CYS   1          2HB       CYS   1  -0.598   4.837   1.173
    4    H    THR   2           H        THR   2  -0.127   2.124  -0.231
    5    HA   THR   2           HA       THR   2  -1.059   2.496  -2.972
    6    HB   THR   2           HB       THR   2   0.034   0.343  -2.225
    7    HG1  THR   2          1HG       THR   2  -1.321   0.464  -4.092
    8   HG21  THR   2          1HG2      THR   2  -1.054  -1.166  -0.827
    9   HG22  THR   2          2HG2      THR   2  -2.616  -0.369  -1.019
   10   HG23  THR   2          3HG2      THR   2  -1.359   0.379  -0.034
   11    H    HIS   3           H        HIS   3  -3.327   1.052  -3.100
   12    HA   HIS   3           HA       HIS   3  -5.182   2.548  -1.368
   13    HB3  HIS   3          2HB       HIS   3  -5.265   3.111  -3.805
   14    HD1  HIS   3          1HD       HIS   3  -7.591   0.182  -3.966
   15    HD2  HIS   3          2HD       HIS   3  -4.060   1.484  -5.729
   16    HE1  HIS   3          1HE       HIS   3  -7.210  -1.352  -5.921
   17    H    DPN   4           H        DPN   4  -7.509   1.210  -1.872
   18    HA   DPN   4           HA       DPN   4  -7.077  -1.619  -1.366
   19    HB2  DPN   4          2HB       DPN   4  -9.588  -1.714  -1.409
   20    HB3  DPN   4          3HB       DPN   4  -8.856  -1.109  -2.892
   21    HD1  DPN   4          1HD       DPN   4  -9.300   1.075  -3.677
   22    HD2  DPN   4          2HD       DPN   4 -10.660  -0.130   0.169
   23    HE1  DPN   4          1HE       DPN   4 -10.694   3.097  -3.543
   24    HE2  DPN   4          2HE       DPN   4 -12.057   1.891   0.314
   25    HZ   DPN   4           HZ       DPN   4 -12.075   3.507  -1.545
   26    HA   MMO   5           HA       NAR   5  -8.462  -1.019   2.800
   27   HCB1  MMO   5          2HB       NAR   5  -8.863  -4.003   2.568
   28   HCB2  MMO   5          3HB       NAR   5  -9.507  -2.928   3.801
   29   HCG1  MMO   5          2HG       NAR   5 -10.237  -2.732   0.891
   30   HCG2  MMO   5          3HG       NAR   5 -11.147  -3.683   2.068
   31   HCD1  MMO   5          2HD       NAR   5 -11.408  -1.597   3.422
   32   HCD2  MMO   5          3HD       NAR   5 -10.681  -0.706   2.086
   33   HH21  MMO   5          1HH1      NAR   5 -12.529  -0.014   3.738
   34   HH22  MMO   5          2HH1      NAR   5 -14.150   0.579   3.586
   35   HH11  MMO   5          1HH2      NAR   5 -14.850  -1.240   0.683
   36    HC1  MMO   5          2HN       NAR   5  -6.780  -3.146  -0.219
   37    HC2  MMO   5          3HN       NAR   5  -8.522  -3.152  -0.579
   38    HC3  MMO   5           H        NAR   5  -7.910  -3.990   0.867
   39    HE   MMO   5           HE       NAR   5 -12.714  -2.012   0.892
   40   HH12  MMO   5          2HH2      NAR   5 -15.470  -0.122   1.849
   41    H    TRP   6           H        TRP   6  -5.776  -1.403   1.781
   42    HA   TRP   6           HA       TRP   6  -4.579  -2.528   4.206
   43    HB3  TRP   6          2HB       TRP   6  -3.255  -3.048   1.568
   44    HD1  TRP   6           HD       TRP   6  -0.993  -4.104   2.087
   45    HE1  TRP   6          1HE       TRP   6   0.012  -5.477   4.016
   46    HE3  TRP   6          3HE       TRP   6  -5.128  -4.456   5.075
   47    HZ2  TRP   6          2HZ       TRP   6  -0.834  -6.568   6.477
   48    HZ3  TRP   6          3HZ       TRP   6  -4.945  -5.682   7.198
   49    HH2  TRP   6           HH       TRP   6  -2.841  -6.717   7.884
   50    HA   PRO   7           HA       PRO   7  -2.879   1.647   3.324
   51    HB3  PRO   7          2HB       PRO   7  -4.169   2.521   5.014
   52    HG3  PRO   7          2HG       PRO   7  -4.931   1.185   6.756
   53    HD3  PRO   7          2HD       PRO   7  -5.569  -0.107   4.956
   54    H    ILE   8           H        ILE   8  -0.885   0.928   2.581
   55    HA   ILE   8           HA       ILE   8   1.186   0.736   4.629
   56    HB   ILE   8           HB       ILE   8   2.282  -1.141   3.367
   57   HG13  ILE   8          2HG1      ILE   8   0.424  -0.658   1.450
   58   HG21  ILE   8          1HG2      ILE   8  -0.266  -2.277   4.312
   59   HG22  ILE   8          2HG2      ILE   8   1.389  -2.634   4.802
   60   HG23  ILE   8          3HG2      ILE   8   0.570  -1.210   5.440
   61   HD11  ILE   8          1HD1      ILE   8   1.237  -2.456   0.291
   62   HD12  ILE   8          2HD1      ILE   8   2.519  -2.212   1.478
   63   HD13  ILE   8          3HD1      ILE   8   1.317  -3.483   1.721
   64    H    CYS   9           H        CYS   9   3.080   1.683   4.059
   65    HA   CYS   9           HA       CYS   9   3.180   2.894   1.382
   66    HB3  CYS   9          2HB       CYS   9   4.789   4.495   2.399
   67    H    PHE  10           H        PHE  10   5.102   2.858   0.175
   68    HA   PHE  10           HA       PHE  10   6.746   0.512   0.681
   69    HB3  PHE  10          2HB       PHE  10   7.722   1.372  -1.635
   70    HD1  PHE  10          1HD       PHE  10   7.173  -1.185  -0.607
   71    HD2  PHE  10          2HD       PHE  10   4.676   1.251  -3.048
   72    HE1  PHE  10          1HE       PHE  10   6.022  -3.197  -1.431
   73    HE2  PHE  10          2HE       PHE  10   3.521  -0.759  -3.875
   74    HZ   PHE  10           HZ       PHE  10   4.194  -2.986  -3.068
   75    HA   PRO  11           HA       PRO  11  10.355   2.575   2.078
   76    HB3  PRO  11          2HB       PRO  11  11.394   0.525   2.126
   77    HG3  PRO  11          2HG       PRO  11  11.003  -1.056   0.469
   78    HD3  PRO  11          2HD       PRO  11   8.831  -0.512   1.018
   79    H    ASP  12           H        ASP  12   9.460   2.698  -1.186
   80    HA   ASP  12           HA       ASP  12  11.650   4.500  -1.914
   81    HB3  ASP  12          2HB       ASP  12  10.834   2.596  -3.429
   82    H    GLY  13           H        GLY  13   8.285   4.480  -1.093
   83    HA2  GLY  13          2HA       GLY  13   7.476   6.661  -0.227
   84    HA3  GLY  13          3HA       GLY  13   8.169   7.378  -1.675
   85    H    ARG  14           H        ARG  14   5.774   4.959  -0.649
   86    HA   ARG  14           HA       ARG  14   3.760   6.090  -2.323
   87    HB3  ARG  14          2HB       ARG  14   3.595   3.630  -3.448
   88    HG3  ARG  14          2HG       ARG  14   5.425   5.581  -4.763
   89    HD3  ARG  14          2HD       ARG  14   3.791   5.059  -6.652
   90    HE   ARG  14           HE       ARG  14   5.827   3.291  -5.648
   91   HH11  ARG  14          1HH1      ARG  14   3.487   3.846  -8.165
   92   HH12  ARG  14          2HH1      ARG  14   4.311   2.860  -9.327
   93   HH21  ARG  14          1HH2      ARG  14   6.921   1.991  -7.169
   94   HH22  ARG  14          2HH2      ARG  14   6.263   1.804  -8.761
  Start of MODEL   19
    1    H1   CYS   1           H        CYS   1   2.181   3.789  -2.857
    2    HA   CYS   1           HA       CYS   1   1.732   3.006  -0.072
    3    HB3  CYS   1          2HB       CYS   1   0.838   5.740  -0.816
    4    H    THR   2           H        THR   2  -0.164   2.030   0.103
    5    HA   THR   2           HA       THR   2  -2.179   2.462  -1.986
    6    HB   THR   2           HB       THR   2  -2.750   0.344  -0.056
    7    HG1  THR   2          1HG       THR   2  -1.040  -1.014  -0.980
    8   HG21  THR   2          1HG2      THR   2  -3.997   0.013  -1.912
    9   HG22  THR   2          2HG2      THR   2  -2.563  -0.837  -2.482
   10   HG23  THR   2          3HG2      THR   2  -2.845   0.836  -2.959
   11    H    HIS   3           H        HIS   3  -4.510   2.030  -1.068
   12    HA   HIS   3           HA       HIS   3  -4.916   3.270   1.537
   13    HB3  HIS   3          2HB       HIS   3  -6.494   4.389  -0.747
   14    HD1  HIS   3          1HD       HIS   3  -8.035   6.114   0.133
   15    HD2  HIS   3          2HD       HIS   3  -4.863   5.402   2.722
   16    HE1  HIS   3          1HE       HIS   3  -8.504   7.510   2.171
   17    H    DPN   4           H        DPN   4  -6.679   2.252  -1.395
   18    HA   DPN   4           HA       DPN   4  -8.371   0.750  -1.682
   19    HB2  DPN   4          2HB       DPN   4  -9.187   2.521   0.543
   20    HB3  DPN   4          3HB       DPN   4 -10.121   1.041   0.357
   21    HD1  DPN   4          1HD       DPN   4 -11.154   0.561  -1.914
   22    HD2  DPN   4          2HD       DPN   4  -9.578   4.362  -0.828
   23    HE1  DPN   4          1HE       DPN   4 -12.460   1.612  -3.713
   24    HE2  DPN   4          2HE       DPN   4 -10.881   5.420  -2.626
   25    HZ   DPN   4           HZ       DPN   4 -12.326   4.044  -4.072
   26    HA   MMO   5           HA       NAR   5  -7.549  -2.490   1.165
   27   HCB1  MMO   5          2HB       NAR   5  -6.290  -3.655  -1.310
   28   HCB2  MMO   5          3HB       NAR   5  -7.174  -4.492  -0.037
   29   HCG1  MMO   5          2HG       NAR   5  -8.990  -2.652  -1.045
   30   HCG2  MMO   5          3HG       NAR   5  -8.143  -3.269  -2.465
   31   HCD1  MMO   5          2HD       NAR   5  -8.972  -5.271  -0.459
   32   HCD2  MMO   5          3HD       NAR   5 -10.269  -4.483  -1.355
   33   HH21  MMO   5          1HH1      NAR   5 -11.167  -6.212  -1.459
   34   HH22  MMO   5          2HH1      NAR   5 -11.561  -7.502  -2.547
   35   HH11  MMO   5          1HH2      NAR   5  -8.642  -7.184  -4.442
   36    HC1  MMO   5          2HN       NAR   5  -7.313  -0.733  -2.415
   37    HC2  MMO   5          3HN       NAR   5  -5.898  -1.696  -1.930
   38    HC3  MMO   5           H        NAR   5  -5.951   0.047  -1.576
   39    HE   MMO   5           HE       NAR   5  -8.133  -5.488  -3.006
   40   HH12  MMO   5          2HH2      NAR   5 -10.125  -8.055  -4.242
   41    H    TRP   6           H        TRP   6  -5.939  -3.690   2.286
   42    HA   TRP   6           HA       TRP   6  -3.978  -3.577   3.497
   43    HB3  TRP   6          2HB       TRP   6  -3.401  -5.337   2.041
   44    HD1  TRP   6           HD       TRP   6  -1.660  -2.813  -0.271
   45    HE1  TRP   6          1HE       TRP   6  -2.450  -3.242  -2.683
   46    HE3  TRP   6          3HE       TRP   6  -5.283  -6.297   0.665
   47    HZ2  TRP   6          2HZ       TRP   6  -4.355  -4.842  -4.014
   48    HZ3  TRP   6          3HZ       TRP   6  -6.544  -7.229  -1.233
   49    HH2  TRP   6           HH       TRP   6  -6.086  -6.513  -3.523
   50    HA   PRO   7           HA       PRO   7  -2.948   0.795   2.186
   51    HB3  PRO   7          2HB       PRO   7  -4.782   1.688   3.242
   52    HG3  PRO   7          2HG       PRO   7  -5.851   0.546   4.961
   53    HD3  PRO   7          2HD       PRO   7  -5.754  -1.125   3.375
   54    H    ILE   8           H        ILE   8  -0.766   0.723   2.190
   55    HA   ILE   8           HA       ILE   8   0.579   0.927   4.778
   56    HB   ILE   8           HB       ILE   8   2.162  -0.737   4.395
   57   HG13  ILE   8          2HG1      ILE   8   2.426  -1.909   2.224
   58   HG21  ILE   8          1HG2      ILE   8   0.899  -2.781   3.949
   59   HG22  ILE   8          2HG2      ILE   8  -0.011  -1.676   4.977
   60   HG23  ILE   8          3HG2      ILE   8  -0.414  -1.822   3.267
   61   HD11  ILE   8          1HD1      ILE   8   0.691   0.214   1.014
   62   HD12  ILE   8          2HD1      ILE   8   1.408  -1.194   0.235
   63   HD13  ILE   8          3HD1      ILE   8   0.095  -1.400   1.394
   64    H    CYS   9           H        CYS   9   2.954   1.513   4.443
   65    HA   CYS   9           HA       CYS   9   3.338   3.125   2.017
   66    HB3  CYS   9          2HB       CYS   9   4.555   4.667   3.924
   67    H    PHE  10           H        PHE  10   5.390   3.164   1.232
   68    HA   PHE  10           HA       PHE  10   7.447   1.753   2.798
   69    HB3  PHE  10          2HB       PHE  10   8.306   1.196   0.351
   70    HD1  PHE  10          1HD       PHE  10   8.439  -0.190   2.783
   71    HD2  PHE  10          2HD       PHE  10   5.523  -0.584  -0.293
   72    HE1  PHE  10          1HE       PHE  10   7.971  -2.489   3.525
   73    HE2  PHE  10          2HE       PHE  10   5.051  -2.884   0.445
   74    HZ   PHE  10           HZ       PHE  10   6.275  -3.840   2.354
   75    HA   PRO  11           HA       PRO  11  10.169   5.131   2.157
   76    HB3  PRO  11          2HB       PRO  11  11.751   3.957   3.340
   77    HG3  PRO  11          2HG       PRO  11  11.973   1.657   3.089
   78    HD3  PRO  11          2HD       PRO  11   9.700   1.800   3.442
   79    H    ASP  12           H        ASP  12   9.731   2.801  -0.325
   80    HA   ASP  12           HA       ASP  12  11.399   4.082  -2.285
   81    HB3  ASP  12          2HB       ASP  12   9.174   2.213  -3.009
   82    H    GLY  13           H        GLY  13   7.920   3.945  -1.601
   83    HA2  GLY  13          2HA       GLY  13   7.071   6.396  -2.060
   84    HA3  GLY  13          3HA       GLY  13   7.413   5.904  -3.714
   85    H    ARG  14           H        ARG  14   6.603   3.091  -2.999
   86    HA   ARG  14           HA       ARG  14   3.949   3.224  -3.901
   87    HB3  ARG  14          2HB       ARG  14   3.873   0.793  -3.153
   88    HG3  ARG  14          2HG       ARG  14   5.973   0.189  -4.635
   89    HD3  ARG  14          2HD       ARG  14   3.462   0.110  -5.163
   90    HE   ARG  14           HE       ARG  14   2.619   2.138  -5.781
   91   HH11  ARG  14          1HH1      ARG  14   5.790   1.777  -7.173
   92   HH12  ARG  14          2HH1      ARG  14   5.696   3.242  -8.094
   93   HH21  ARG  14          1HH2      ARG  14   2.482   4.066  -6.989
   94   HH22  ARG  14          2HH2      ARG  14   3.812   4.544  -7.988
  Start of MODEL   20
    1    H1   CYS   1           H        CYS   1   2.125   5.913  -0.855
    2    HA   CYS   1           HA       CYS   1   1.387   3.484   0.523
    3    HB3  CYS   1          2HB       CYS   1  -0.567   4.865   1.297
    4    H    THR   2           H        THR   2  -0.029   1.997  -0.131
    5    HA   THR   2           HA       THR   2  -1.289   2.329  -2.732
    6    HB   THR   2           HB       THR   2  -1.952  -0.086  -2.406
    7    HG1  THR   2          1HG       THR   2  -1.367  -1.109  -0.608
    8   HG21  THR   2          1HG2      THR   2   0.313  -0.952  -2.785
    9   HG22  THR   2          2HG2      THR   2   0.991   0.571  -2.209
   10   HG23  THR   2          3HG2      THR   2   0.032   0.537  -3.688
   11    H    HIS   3           H        HIS   3  -3.554   1.522  -3.012
   12    HA   HIS   3           HA       HIS   3  -5.237   2.669  -0.914
   13    HB3  HIS   3          2HB       HIS   3  -6.948   2.879  -2.571
   14    HD1  HIS   3          1HD       HIS   3  -4.030   2.796  -4.933
   15    HD2  HIS   3          2HD       HIS   3  -6.140   5.535  -2.628
   16    HE1  HIS   3          1HE       HIS   3  -3.226   5.059  -5.676
   17    H    DPN   4           H        DPN   4  -7.629   1.436  -1.370
   18    HA   DPN   4           HA       DPN   4  -7.187  -1.434  -1.045
   19    HB2  DPN   4          2HB       DPN   4  -9.698  -1.548  -1.152
   20    HB3  DPN   4          3HB       DPN   4  -8.931  -0.892  -2.596
   21    HD1  DPN   4          1HD       DPN   4  -9.308   1.352  -3.285
   22    HD2  DPN   4          2HD       DPN   4 -10.885  -0.060   0.405
   23    HE1  DPN   4          1HE       DPN   4 -10.720   3.360  -3.126
   24    HE2  DPN   4          2HE       DPN   4 -12.301   1.946   0.573
   25    HZ   DPN   4           HZ       DPN   4 -12.218   3.661  -1.194
   26    HA   MMO   5           HA       NAR   5  -8.711  -1.000   3.096
   27   HCB1  MMO   5          2HB       NAR   5  -8.967  -3.990   2.755
   28   HCB2  MMO   5          3HB       NAR   5  -9.681  -2.994   4.018
   29   HCG1  MMO   5          2HG       NAR   5 -10.370  -2.687   1.110
   30   HCG2  MMO   5          3HG       NAR   5 -11.241  -3.763   2.204
   31   HCD1  MMO   5          2HD       NAR   5 -10.894  -0.790   2.582
   32   HCD2  MMO   5          3HD       NAR   5 -12.344  -1.578   1.959
   33   HH21  MMO   5          1HH1      NAR   5 -12.401   0.485   3.260
   34   HH22  MMO   5          2HH1      NAR   5 -13.139   1.010   4.737
   35   HH11  MMO   5          1HH2      NAR   5 -12.840  -2.088   6.329
   36    HC1  MMO   5          2HN       NAR   5  -8.026  -3.887   1.090
   37    HC2  MMO   5          3HN       NAR   5  -6.890  -2.986   0.059
   38    HC3  MMO   5           H        NAR   5  -8.624  -3.015  -0.343
   39    HE   MMO   5           HE       NAR   5 -11.868  -2.769   4.381
   40   HH12  MMO   5          2HH2      NAR   5 -13.389  -0.453   6.481
   41    H    TRP   6           H        TRP   6  -5.965  -1.472   1.993
   42    HA   TRP   6           HA       TRP   6  -4.683  -1.982   4.505
   43    HB3  TRP   6          2HB       TRP   6  -4.761  -4.262   4.060
   44    HD1  TRP   6           HD       TRP   6  -3.189  -3.445   0.617
   45    HE1  TRP   6          1HE       TRP   6  -4.492  -4.748  -1.180
   46    HE3  TRP   6          3HE       TRP   6  -6.826  -5.486   3.572
   47    HZ2  TRP   6          2HZ       TRP   6  -6.761  -6.420  -1.326
   48    HZ3  TRP   6          3HZ       TRP   6  -8.525  -6.925   2.527
   49    HH2  TRP   6           HH       TRP   6  -8.492  -7.382   0.128
   50    HA   PRO   7           HA       PRO   7  -2.553   0.845   1.457
   51    HB3  PRO   7          2HB       PRO   7  -3.855   2.648   2.034
   52    HG3  PRO   7          2HG       PRO   7  -4.959   2.725   4.078
   53    HD3  PRO   7          2HD       PRO   7  -5.605   0.632   3.356
   54    H    ILE   8           H        ILE   8  -0.519   0.049   1.489
   55    HA   ILE   8           HA       ILE   8   1.031   0.310   3.980
   56    HB   ILE   8           HB       ILE   8   1.136  -1.662   1.744
   57   HG13  ILE   8          2HG1      ILE   8   1.371  -1.798   4.754
   58   HG21  ILE   8          1HG2      ILE   8   3.354  -0.973   1.583
   59   HG22  ILE   8          2HG2      ILE   8   3.489  -0.679   3.313
   60   HG23  ILE   8          3HG2      ILE   8   3.427  -2.333   2.703
   61   HD11  ILE   8          1HD1      ILE   8  -0.913  -1.514   4.014
   62   HD12  ILE   8          2HD1      ILE   8  -0.730  -2.855   2.882
   63   HD13  ILE   8          3HD1      ILE   8  -0.659  -3.152   4.617
   64    H    CYS   9           H        CYS   9   2.889   1.464   4.014
   65    HA   CYS   9           HA       CYS   9   3.525   2.998   1.594
   66    HB3  CYS   9          2HB       CYS   9   4.804   4.465   3.183
   67    H    PHE  10           H        PHE  10   5.288   2.556   0.457
   68    HA   PHE  10           HA       PHE  10   7.205   0.633   1.493
   69    HB3  PHE  10          2HB       PHE  10   8.139   1.063  -0.952
   70    HD1  PHE  10          1HD       PHE  10   7.893  -1.241   0.629
   71    HD2  PHE  10          2HD       PHE  10   5.182   0.219  -2.311
   72    HE1  PHE  10          1HE       PHE  10   7.039  -3.524   0.286
   73    HE2  PHE  10          2HE       PHE  10   4.325  -2.061  -2.657
   74    HZ   PHE  10           HZ       PHE  10   5.252  -3.935  -1.358
   75    HA   PRO  11           HA       PRO  11  10.462   3.428   2.391
   76    HB3  PRO  11          2HB       PRO  11  11.760   1.604   2.912
   77    HG3  PRO  11          2HG       PRO  11  11.637  -0.352   1.663
   78    HD3  PRO  11          2HD       PRO  11   9.395   0.004   2.064
   79    H    ASP  12           H        ASP  12   9.674   2.681  -0.818
   80    HA   ASP  12           HA       ASP  12  11.677   4.435  -1.992
   81    HB3  ASP  12          2HB       ASP  12   9.385   3.028  -3.371
   82    H    GLY  13           H        GLY  13   8.254   4.398  -1.225
   83    HA2  GLY  13          2HA       GLY  13   7.388   6.681  -0.673
   84    HA3  GLY  13          3HA       GLY  13   8.070   7.178  -2.214
   85    H    ARG  14           H        ARG  14   5.591   5.190  -0.691
   86    HA   ARG  14           HA       ARG  14   3.600   5.877  -2.527
   87    HB3  ARG  14          2HB       ARG  14   3.642   3.187  -3.240
   88    HG3  ARG  14          2HG       ARG  14   4.927   5.084  -5.108
   89    HD3  ARG  14          2HD       ARG  14   2.405   3.519  -5.502
   90    HE   ARG  14           HE       ARG  14   2.822   4.340  -7.585
   91   HH11  ARG  14          1HH1      ARG  14   5.861   3.529  -6.092
   92   HH12  ARG  14          2HH1      ARG  14   6.798   3.889  -7.503
   93   HH21  ARG  14          1HH2      ARG  14   4.046   4.818  -9.449
   94   HH22  ARG  14          2HH2      ARG  14   5.765   4.625  -9.412