*HEADER    TOXIN                                   21-SEP-06   2IFI              
*TITLE     ALA6 VARIANT OF IMI CONOTOXIN                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ALPHA-CONOTOXIN IMI;                                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: CHEMICALLY SYNTHESIZED BY FMOC SOLID PHASE            
*SOURCE   4 PEPTIDE SYNTHESIS.                                                   
*KEYWDS    CONOTOXIN, DISULFIDE LINKAGES, RIBBON CONFORMATION                    
*EXPDTA    NMR, 15 STRUCTURES                                                    
*AUTHOR    R.M.KINI, T.S.KANG                                                    
*REVDAT   1   14-AUG-07 2IFI    0                                                

!BIOSYM restraint 1
!
#distance
1:TRP_10:HB1       1:TRP_10:HB2        1.900  3.100  1.00  1.00 1000.000
1:ASP_5:HB1        1:ASP_5:HB2         1.900  3.100  1.00  1.00 1000.000
1:ARG_11:HD*       1:ARG_11:HG*        1.900  3.100  1.00  1.00 1000.000
1:ASP_5:HA         1:ALA_6:HN          1.900  3.800  1.00  1.00 1000.000
1:SER_4:HB*        1:SER_4:HA          1.900  3.100  1.00  1.00 1000.000
1:ALA_9:HA         1:ALA_9:HB*         1.900  3.100  1.00  1.00 1000.000
1:ALA_6:HB*        1:ALA_6:HA          1.900  3.100  1.00  1.00 1000.000
1:ASP_5:HB2        1:ASP_5:HA          1.900  3.100  1.00  1.00 1000.000
1:ASP_5:HB1        1:ASP_5:HA          1.900  3.100  1.00  1.00 1000.000
1:TRP_10:HB2       1:TRP_10:HA         1.900  3.100  1.00  1.00 1000.000
1:ARG_7:HB1        1:ARG_7:HA          1.900  3.100  1.00  1.00 1000.000
1:ARG_7:HD*        1:ARG_7:HA          1.900  3.100  1.00  1.00 1000.000
1:ALA_6:HA         1:ALA_6:HN          1.900  3.100  1.00  1.00 1000.000
1:TRP_10:HA        1:TRP_10:HN         1.900  3.100  1.00  1.00 1000.000
1:ARG_7:HB2        1:ARG_7:HA          1.900  3.100  1.00  1.00 1000.000
1:ARG_11:HB2       1:ARG_11:HG*        1.900  3.100  1.00  1.00 1000.000
1:TRP_10:HB1       1:TRP_10:HA         1.900  3.100  1.00  1.00 1000.000
1:ARG_7:HB2        1:ARG_7:HG*         1.900  3.100  1.00  1.00 1000.000
1:ARG_7:HB1        1:ARG_7:HG*         1.900  3.800  1.00  1.00 1000.000
1:SER_4:HA         1:ASP_5:HN          1.900  3.800  1.00  1.00 1000.000
1:TRP_10:HB1       1:TRP_10:HE3        1.900  3.800  1.00  1.00 1000.000
1:ALA_9:HB*        1:ALA_9:HN          1.900  3.800  1.00  1.00 1000.000
1:TRP_10:HA        1:ARG_11:HN         1.900  3.800  1.00  1.00 1000.000
1:ALA_9:HA         1:TRP_10:HN         1.900  3.800  1.00  1.00 1000.000
1:ALA_6:HB*        1:ALA_6:HN          1.900  3.800  1.00  1.00 1000.000
1:ALA_9:HA         1:ALA_9:HN          1.900  3.800  1.00  1.00 1000.000
1:SER_4:HB*        1:SER_4:HN          1.900  3.800  1.00  1.00 1000.000
1:SER_4:HA         1:SER_4:HN          1.900  3.800  1.00  1.00 1000.000
1:TRP_10:HB1       1:TRP_10:HN         1.900  3.800  1.00  1.00 1000.000
1:ASP_5:HB1        1:ALA_6:HN          1.900  3.800  1.00  1.00 1000.000
1:ARG_7:HA         1:ARG_7:HN          1.900  3.800  1.00  1.00 1000.000
1:TRP_10:HB2       1:TRP_10:HE3        1.900  3.800  1.00  1.00 1000.000
1:ARG_11:HB1       1:ARG_11:HG*        1.900  3.800  1.00  1.00 1000.000
1:ARG_7:HB2        1:ARG_7:HN          1.900  3.800  1.00  1.00 1000.000
1:ARG_11:HB1       1:ARG_11:HA         1.900  3.800  1.00  1.00 1000.000
1:ARG_7:HD*        1:ARG_7:HN          1.900  3.800  1.00  1.00 1000.000
1:TRP_10:HB2       1:TRP_10:HN         1.900  3.800  1.00  1.00 1000.000
1:TRP_10:HD1       1:TRP_10:HB1        1.900  5.000  1.00  1.00 1000.000
1:ARG_11:HD*       1:ARG_11:HA         1.900  5.000  1.00  1.00 1000.000
1:ARG_11:HA        1:ARG_11:HN         1.900  5.000  1.00  1.00 1000.000
1:ALA_6:HA         1:ARG_7:HN          1.900  5.000  1.00  1.00 1000.000
1:ARG_11:HB2       1:ARG_11:HN         1.900  5.000  1.00  1.00 1000.000
1:ARG_11:HB2       1:ARG_11:HA         1.900  5.000  1.00  1.00 1000.000
1:ALA_9:HB*        1:TRP_10:HN         1.900  5.000  1.00  1.00 1000.000
1:ARG_7:HB1        1:ARG_7:HN          1.900  5.000  1.00  1.00 1000.000
1:ALA_6:HN         1:ARG_7:HN          1.900  5.000  1.00  1.00 1000.000
1:ASP_5:HB2        1:ASP_5:HN          1.900  5.000  1.00  1.00 1000.000
1:SER_4:HN         1:ASP_5:HN          1.900  5.000  1.00  1.00 1000.000
1:ASP_5:HB1        1:ASP_5:HN          1.900  5.000  1.00  1.00 1000.000
1:ALA_6:HB*        1:ARG_7:HN          1.900  5.000  1.00  1.00 1000.000
1:ARG_11:HD*       1:ARG_11:HN         1.900  5.000  1.00  1.00 1000.000
1:ALA_9:HB*        1:TRP_10:HD1        1.900  5.000  1.00  1.00 1000.000
1:ALA_9:HB*        1:TRP_10:HE3        1.900  5.000  1.00  1.00 1000.000
1:ARG_11:HB1       1:ARG_11:HN         1.900  5.000  1.00  1.00 1000.000
1:TRP_10:HD1       1:TRP_10:HN         1.900  5.000  1.00  1.00 1000.000
1:ARG_11:HN        1:TRP_10:HD1        1.900  5.000  1.00  1.00 1000.000
1:SER_4:HB*        1:ASP_5:HN          1.900  5.000  1.00  1.00 1000.000
1:ASP_5:HB2        1:ARG_7:HN          1.900  5.000  1.00  1.00 1000.000
1:ASP_5:HB1        1:ARG_7:HN          1.900  5.000  1.00  1.00 1000.000
1:CYS_12:HB2       1:CYS_12:HB1        1.900  3.100  1.00  1.00 1000.000
1:CYS_3:HB1        1:CYS_3:HB2         1.900  3.100  1.00  1.00 1000.000
1:CYS_12:HB1       1:CYS_12:HA         1.900  3.100  1.00  1.00 1000.000
1:CYS_12:HB2       1:CYS_12:HA         1.900  3.100  1.00  1.00 1000.000
1:CYS_2:HB1        1:CYS_2:HB2         1.900  3.100  1.00  1.00 1000.000
1:CYS_3:HA         1:SER_4:HN          1.900  3.100  1.00  1.00 1000.000
1:CYS_3:HB2        1:CYS_3:HA          1.900  3.100  1.00  1.00 1000.000
1:CYS_3:HB1        1:CYS_3:HA          1.900  3.100  1.00  1.00 1000.000
1:CYS_2:HA         1:CYS_3:HN          1.900  3.100  1.00  1.00 1000.000
1:ARG_11:HA        1:CYS_12:HN         1.900  3.100  1.00  1.00 1000.000
1:ARG_7:HA         1:CYS_8:HN          1.900  3.800  1.00  1.00 1000.000
1:CYS_12:HB2       1:CYS_12:HN         1.900  3.800  1.00  1.00 1000.000
1:GLYn_1:HA2       1:CYS_2:HN          1.900  3.800  1.00  1.00 1000.000
1:GLYn_1:HA1       1:CYS_2:HN          1.900  3.800  1.00  1.00 1000.000
1:CYS_12:HA        1:CYS_12:HN         1.900  3.800  1.00  1.00 1000.000
1:CYS_3:HB2        1:CYS_2:HA          1.900  3.800  1.00  1.00 1000.000
1:CYS_3:HA         1:CYS_3:HN          1.900  3.800  1.00  1.00 1000.000
1:CYS_2:HB1        1:CYS_2:HN          1.900  5.000  1.00  1.00 1000.000
1:CYS_3:HB1        1:SER_4:HN          1.900  5.000  1.00  1.00 1000.000
1:CYS_2:HA         1:CYS_2:HN          1.900  5.000  1.00  1.00 1000.000
1:CYS_2:HB1        1:CYS_3:HN          1.900  5.000  1.00  1.00 1000.000
1:CYS_8:HN         1:ARG_7:HN          1.900  5.000  1.00  1.00 1000.000
1:CYS_8:HN         1:ALA_9:HN          1.900  5.000  1.00  1.00 1000.000
1:CYS_3:HB2        1:CYS_3:HN          1.900  5.000  1.00  1.00 1000.000
1:ARG_11:HB1       1:CYS_12:HN         1.900  5.000  1.00  1.00 1000.000
1:ARG_11:HB2       1:CYS_12:HN         1.900  5.000  1.00  1.00 1000.000
1:CYS_2:HB2        1:CYS_2:HN          1.900  5.000  1.00  1.00 1000.000


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H1       GLY   1  16.215  15.395   9.596
    2    H2   GLY   1           H2       GLY   1  16.715  14.582  10.906
    3    HA2  GLY   1           HA2      GLY   1  17.268  12.602   9.671
    4    HA3  GLY   1           HA3      GLY   1  15.616  13.091   9.388
    5    H    CYS   2           H        CYS   2  18.784  12.853   8.000
    6    HA   CYS   2           HA       CYS   2  17.767  13.738   5.256
    7    HB2  CYS   2           HB2      CYS   2  20.588  13.525   6.454
    8    HB3  CYS   2           HB3      CYS   2  20.293  13.728   4.719
    9    H    CYS   3           H        CYS   3  17.563  12.491   3.578
   10    HA   CYS   3           HA       CYS   3  18.544   9.652   3.472
   11    HB2  CYS   3           HB2      CYS   3  16.193   8.664   3.374
   12    HB3  CYS   3           HB3      CYS   3  16.788   9.208   4.925
   13    H    SER   4           H        SER   4  15.992   9.527   1.434
   14    HA   SER   4           HA       SER   4  17.911   9.392  -0.765
   15    HB2  SER   4           HB2      SER   4  16.153   8.532  -2.141
   16    HB3  SER   4           HB3      SER   4  16.067   7.798  -0.566
   17    HG   SER   4           HG       SER   4  14.267   9.009  -0.054
   18    H    ASP   5           H        ASP   5  18.491  10.707  -2.293
   19    HA   ASP   5           HA       ASP   5  18.260  13.542  -1.881
   20    HB2  ASP   5           HB2      ASP   5  20.155  12.006  -2.827
   21    HB3  ASP   5           HB3      ASP   5  19.319  12.037  -4.364
   22    HD2  ASP   5           HD2      ASP   5  20.673  15.042  -5.206
   23    H    ALA   6           H        ALA   6  16.582  11.752  -4.520
   24    HA   ALA   6           HA       ALA   6  15.503  14.182  -5.838
   25    HB1  ALA   6           HB1      ALA   6  15.789  11.961  -6.974
   26    HB2  ALA   6           HB2      ALA   6  14.510  11.258  -5.950
   27    HB3  ALA   6           HB3      ALA   6  14.125  12.550  -7.103
   28    H    ARG   7           H        ARG   7  14.360  12.651  -2.931
   29    HA   ARG   7           HA       ARG   7  11.924  14.521  -2.939
   30    HB2  ARG   7           HB2      ARG   7  11.833  11.550  -2.129
   31    HB3  ARG   7           HB3      ARG   7  10.570  12.698  -1.757
   32    HG2  ARG   7           HG2      ARG   7  11.408  11.845  -4.601
   33    HG3  ARG   7           HG3      ARG   7  10.001  11.283  -3.725
   34    HD2  ARG   7           HD2      ARG   7   9.049  13.603  -3.643
   35    HD3  ARG   7           HD3      ARG   7  10.437  14.246  -4.515
   36   HH11  ARG   7          HH11      ARG   7  11.476  13.573  -6.263
   37   HH12  ARG   7          HH12      ARG   7  11.262  13.279  -8.074
   38   HH21  ARG   7          HH21      ARG   7   8.019  12.434  -7.619
   39   HH22  ARG   7          HH22      ARG   7   9.410  12.709  -8.803
   40    H    CYS   8           H        CYS   8  13.651  12.379  -0.658
   41    HA   CYS   8           HA       CYS   8  13.179  14.197   1.692
   42    HB2  CYS   8           HB2      CYS   8  13.166  11.754   1.947
   43    HB3  CYS   8           HB3      CYS   8  14.730  11.576   1.143
   44    H    ALA   9           H        ALA   9  14.935  15.175   2.904
   45    HA   ALA   9           HA       ALA   9  16.774  16.688   1.145
   46    HB1  ALA   9           HB1      ALA   9  17.312  17.959   3.208
   47    HB2  ALA   9           HB2      ALA   9  15.562  17.732   3.068
   48    HB3  ALA   9           HB3      ALA   9  16.511  16.741   4.219
   49    H    TRP  10           H        TRP  10  18.910  17.041   1.398
   50    HA   TRP  10           HA       TRP  10  20.691  14.886   2.649
   51    HB2  TRP  10           HB2      TRP  10  22.497  15.574   1.208
   52    HB3  TRP  10           HB3      TRP  10  21.131  15.039   0.278
   53    HD1  TRP  10           HD1      TRP  10  22.966  18.357   1.239
   54    HE1  TRP  10           HE1      TRP  10  22.386  20.314  -0.465
   55    HE3  TRP  10           HE3      TRP  10  19.356  15.881  -1.293
   56    HZ2  TRP  10           HZ2      TRP  10  20.728  20.463  -2.756
   57    HZ3  TRP  10           HZ3      TRP  10  18.215  17.001  -3.175
   58    HH2  TRP  10           HH2      TRP  10  18.890  19.258  -3.910
   59    H    ARG  11           H        ARG  11  19.947  18.369   2.751
   60    HA   ARG  11           HA       ARG  11  22.243  19.006   4.559
   61    HB2  ARG  11           HB2      ARG  11  19.749  20.666   3.844
   62    HB3  ARG  11           HB3      ARG  11  21.092  21.244   4.818
   63    HG2  ARG  11           HG2      ARG  11  22.690  20.804   2.847
   64    HG3  ARG  11           HG3      ARG  11  21.284  20.344   1.887
   65    HD2  ARG  11           HD2      ARG  11  20.273  22.678   2.366
   66    HD3  ARG  11           HD3      ARG  11  21.787  23.119   3.135
   67   HH11  ARG  11          HH11      ARG  11  19.622  22.250   0.561
   68   HH12  ARG  11          HH12      ARG  11  19.772  22.473  -1.266
   69   HH21  ARG  11          HH21      ARG  11  23.063  23.215  -0.958
   70   HH22  ARG  11          HH22      ARG  11  21.622  22.954  -2.083
   71    H    CYS  12           H        CYS  12  22.336  18.796   6.670
   72    HA   CYS  12           HA       CYS  12  19.879  18.674   8.451
   73    HB2  CYS  12           HB2      CYS  12  21.754  16.268   7.961
   74    HB3  CYS  12           HB3      CYS  12  20.958  16.480   9.521
   75    HN1  NH2  13           HN1      NH2  13  21.947  20.117  10.966
   76    HN2  NH2  13           HN2      NH2  13  20.261  19.744  10.350
  Start of MODEL    2
    1    H1   GLY   1           H1       GLY   1  15.709  14.256   9.341
    2    H2   GLY   1           H2       GLY   1  16.071  13.283  10.590
    3    HA2  GLY   1           HA2      GLY   1  16.868  11.500   9.091
    4    HA3  GLY   1           HA3      GLY   1  15.192  11.921   8.806
    5    H    CYS   2           H        CYS   2  18.463  12.675   7.687
    6    HA   CYS   2           HA       CYS   2  17.459  13.650   5.000
    7    HB2  CYS   2           HB2      CYS   2  20.217  13.564   6.360
    8    HB3  CYS   2           HB3      CYS   2  20.005  14.014   4.674
    9    H    CYS   3           H        CYS   3  16.483  11.529   4.736
   10    HA   CYS   3           HA       CYS   3  18.051   9.213   4.008
   11    HB2  CYS   3           HB2      CYS   3  15.750   8.253   3.546
   12    HB3  CYS   3           HB3      CYS   3  16.074   8.934   5.126
   13    H    SER   4           H        SER   4  15.726   9.640   1.466
   14    HA   SER   4           HA       SER   4  17.949   9.193  -0.524
   15    HB2  SER   4           HB2      SER   4  16.278   8.476  -2.057
   16    HB3  SER   4           HB3      SER   4  15.921   7.748  -0.509
   17    HG   SER   4           HG       SER   4  14.588   9.810  -1.888
   18    H    ASP   5           H        ASP   5  19.023  10.993  -1.051
   19    HA   ASP   5           HA       ASP   5  18.498  13.647  -0.957
   20    HB2  ASP   5           HB2      ASP   5  20.633  12.548  -1.624
   21    HB3  ASP   5           HB3      ASP   5  20.018  12.241  -3.242
   22    HD2  ASP   5           HD2      ASP   5  20.639  15.399  -4.417
   23    H    ALA   6           H        ALA   6  17.572  12.091  -4.092
   24    HA   ALA   6           HA       ALA   6  16.587  14.590  -5.277
   25    HB1  ALA   6           HB1      ALA   6  17.294  12.559  -6.563
   26    HB2  ALA   6           HB2      ALA   6  15.867  11.662  -5.984
   27    HB3  ALA   6           HB3      ALA   6  15.666  13.088  -7.018
   28    H    ARG   7           H        ARG   7  14.992  13.077  -2.765
   29    HA   ARG   7           HA       ARG   7  12.442  14.542  -3.335
   30    HB2  ARG   7           HB2      ARG   7  12.314  11.513  -2.783
   31    HB3  ARG   7           HB3      ARG   7  10.940  12.588  -2.735
   32    HG2  ARG   7           HG2      ARG   7  12.610  11.980  -5.272
   33    HG3  ARG   7           HG3      ARG   7  11.094  11.219  -4.842
   34    HD2  ARG   7           HD2      ARG   7   9.899  13.421  -4.963
   35    HD3  ARG   7           HD3      ARG   7  11.388  14.275  -5.286
   36   HH11  ARG   7          HH11      ARG   7  12.723  14.469  -6.768
   37   HH12  ARG   7          HH12      ARG   7  12.877  14.698  -8.583
   38   HH21  ARG   7          HH21      ARG   7  10.166  12.761  -9.166
   39   HH22  ARG   7          HH22      ARG   7  11.561  13.750  -9.852
   40    H    CYS   8           H        CYS   8  13.834  12.272  -0.950
   41    HA   CYS   8           HA       CYS   8  12.947  13.871   1.439
   42    HB2  CYS   8           HB2      CYS   8  13.186  11.352   1.426
   43    HB3  CYS   8           HB3      CYS   8  14.866  11.498   0.936
   44    H    ALA   9           H        ALA   9  14.505  14.834   2.907
   45    HA   ALA   9           HA       ALA   9  16.268  16.739   1.597
   46    HB1  ALA   9           HB1      ALA   9  16.712  17.529   3.927
   47    HB2  ALA   9           HB2      ALA   9  14.996  17.165   3.718
   48    HB3  ALA   9           HB3      ALA   9  16.051  16.023   4.603
   49    H    TRP  10           H        TRP  10  18.435  17.313   2.242
   50    HA   TRP  10           HA       TRP  10  20.358  14.985   2.731
   51    HB2  TRP  10           HB2      TRP  10  21.873  15.790   1.031
   52    HB3  TRP  10           HB3      TRP  10  20.339  15.322   0.378
   53    HD1  TRP  10           HD1      TRP  10  22.329  18.583   1.213
   54    HE1  TRP  10           HE1      TRP  10  21.967  20.379  -0.704
   55    HE3  TRP  10           HE3      TRP  10  18.507  16.161  -1.071
   56    HZ2  TRP  10           HZ2      TRP  10  20.197  20.475  -2.937
   57    HZ3  TRP  10           HZ3      TRP  10  17.524  17.135  -3.149
   58    HH2  TRP  10           HH2      TRP  10  18.359  19.253  -4.061
   59    H    ARG  11           H        ARG  11  19.736  18.328   3.604
   60    HA   ARG  11           HA       ARG  11  22.239  18.234   5.407
   61    HB2  ARG  11           HB2      ARG  11  20.416  20.651   4.865
   62    HB3  ARG  11           HB3      ARG  11  21.917  20.632   5.773
   63    HG2  ARG  11           HG2      ARG  11  23.075  19.823   3.553
   64    HG3  ARG  11           HG3      ARG  11  21.536  20.171   2.767
   65    HD2  ARG  11           HD2      ARG  11  21.815  22.623   3.868
   66    HD3  ARG  11           HD3      ARG  11  23.486  22.148   4.090
   67   HH11  ARG  11          HH11      ARG  11  20.462  22.579   2.340
   68   HH12  ARG  11          HH12      ARG  11  20.155  23.141   0.612
   69   HH21  ARG  11          HH21      ARG  11  23.384  22.609  -0.251
   70   HH22  ARG  11          HH22      ARG  11  21.681  23.113  -0.748
   71    H    CYS  12           H        CYS  12  21.828  17.289   7.333
   72    HA   CYS  12           HA       CYS  12  19.304  18.111   8.913
   73    HB2  CYS  12           HB2      CYS  12  20.753  15.403   8.788
   74    HB3  CYS  12           HB3      CYS  12  19.641  15.864  10.085
   75    HN1  NH2  13           HN1      NH2  13  21.396  19.456  11.457
   76    HN2  NH2  13           HN2      NH2  13  19.886  19.622  10.411
  Start of MODEL    3
    1    H1   GLY   1           H1       GLY   1  14.753  15.013   8.724
    2    H2   GLY   1           H2       GLY   1  15.262  14.435  10.173
    3    HA2  GLY   1           HA2      GLY   1  16.411  12.564   9.187
    4    HA3  GLY   1           HA3      GLY   1  14.746  12.591   8.640
    5    H    CYS   2           H        CYS   2  18.036  13.255   7.751
    6    HA   CYS   2           HA       CYS   2  17.387  13.812   4.851
    7    HB2  CYS   2           HB2      CYS   2  20.007  13.755   6.463
    8    HB3  CYS   2           HB3      CYS   2  19.939  14.003   4.722
    9    H    CYS   3           H        CYS   3  16.315  11.764   4.693
   10    HA   CYS   3           HA       CYS   3  17.937   9.311   4.237
   11    HB2  CYS   3           HB2      CYS   3  15.651   8.314   3.895
   12    HB3  CYS   3           HB3      CYS   3  15.948   9.134   5.418
   13    H    SER   4           H        SER   4  15.636   9.274   1.778
   14    HA   SER   4           HA       SER   4  17.751   8.911  -0.248
   15    HB2  SER   4           HB2      SER   4  15.959   8.236  -1.722
   16    HB3  SER   4           HB3      SER   4  15.714   7.525  -0.138
   17    HG   SER   4           HG       SER   4  13.736   8.347  -0.714
   18    H    ASP   5           H        ASP   5  18.881  10.672  -0.681
   19    HA   ASP   5           HA       ASP   5  18.466  13.335  -0.770
   20    HB2  ASP   5           HB2      ASP   5  20.573  11.950  -1.280
   21    HB3  ASP   5           HB3      ASP   5  20.086  11.874  -2.961
   22    HD2  ASP   5           HD2      ASP   5  21.027  15.178  -3.582
   23    H    ALA   6           H        ALA   6  17.644  11.620  -3.818
   24    HA   ALA   6           HA       ALA   6  16.756  14.017  -5.274
   25    HB1  ALA   6           HB1      ALA   6  17.394  11.846  -6.344
   26    HB2  ALA   6           HB2      ALA   6  15.954  11.051  -5.656
   27    HB3  ALA   6           HB3      ALA   6  15.776  12.352  -6.854
   28    H    ARG   7           H        ARG   7  15.025  12.446  -2.768
   29    HA   ARG   7           HA       ARG   7  12.563  14.147  -3.364
   30    HB2  ARG   7           HB2      ARG   7  12.321  11.233  -2.418
   31    HB3  ARG   7           HB3      ARG   7  11.011  12.387  -2.466
   32    HG2  ARG   7           HG2      ARG   7  12.537  11.357  -4.949
   33    HG3  ARG   7           HG3      ARG   7  10.976  10.796  -4.378
   34    HD2  ARG   7           HD2      ARG   7   9.948  13.030  -4.754
   35    HD3  ARG   7           HD3      ARG   7  11.494  13.724  -5.213
   36   HH11  ARG   7          HH11      ARG   7  12.876  13.479  -6.651
   37   HH12  ARG   7          HH12      ARG   7  13.164  13.275  -8.455
   38   HH21  ARG   7          HH21      ARG   7  10.242  11.616  -8.847
   39   HH22  ARG   7          HH22      ARG   7  11.746  12.341  -9.617
   40    H    CYS   8           H        CYS   8  14.012  12.155  -0.809
   41    HA   CYS   8           HA       CYS   8  13.115  13.952   1.440
   42    HB2  CYS   8           HB2      CYS   8  13.146  11.443   1.554
   43    HB3  CYS   8           HB3      CYS   8  14.865  11.427   1.164
   44    H    ALA   9           H        ALA   9  14.711  14.886   2.888
   45    HA   ALA   9           HA       ALA   9  16.438  16.717   1.413
   46    HB1  ALA   9           HB1      ALA   9  16.795  17.715   3.688
   47    HB2  ALA   9           HB2      ALA   9  15.094  17.314   3.440
   48    HB3  ALA   9           HB3      ALA   9  16.135  16.269   4.464
   49    H    TRP  10           H        TRP  10  18.561  17.441   2.161
   50    HA   TRP  10           HA       TRP  10  20.513  15.262   3.023
   51    HB2  TRP  10           HB2      TRP  10  22.119  15.812   1.317
   52    HB3  TRP  10           HB3      TRP  10  20.618  15.296   0.619
   53    HD1  TRP  10           HD1      TRP  10  22.616  18.596   1.219
   54    HE1  TRP  10           HE1      TRP  10  22.113  20.384  -0.695
   55    HE3  TRP  10           HE3      TRP  10  18.854  16.017  -0.999
   56    HZ2  TRP  10           HZ2      TRP  10  20.368  20.389  -2.920
   57    HZ3  TRP  10           HZ3      TRP  10  17.776  16.958  -3.023
   58    HH2  TRP  10           HH2      TRP  10  18.514  19.113  -3.970
   59    H    ARG  11           H        ARG  11  19.628  18.555   3.505
   60    HA   ARG  11           HA       ARG  11  22.173  19.159   5.061
   61    HB2  ARG  11           HB2      ARG  11  19.724  20.868   4.276
   62    HB3  ARG  11           HB3      ARG  11  21.123  21.473   5.142
   63    HG2  ARG  11           HG2      ARG  11  22.639  20.931   3.226
   64    HG3  ARG  11           HG3      ARG  11  21.274  20.280   2.313
   65    HD2  ARG  11           HD2      ARG  11  20.112  22.472   2.288
   66    HD3  ARG  11           HD3      ARG  11  21.346  23.196   3.308
   67   HH11  ARG  11          HH11      ARG  11  19.740  22.760   0.416
   68   HH12  ARG  11          HH12      ARG  11  20.338  23.187  -1.282
   69   HH21  ARG  11          HH21      ARG  11  23.549  23.204  -0.399
   70   HH22  ARG  11          HH22      ARG  11  22.239  23.358  -1.699
   71    H    CYS  12           H        CYS  12  21.442  17.405   6.696
   72    HA   CYS  12           HA       CYS  12  19.528  18.505   8.840
   73    HB2  CYS  12           HB2      CYS  12  20.659  15.675   8.431
   74    HB3  CYS  12           HB3      CYS  12  19.636  16.179   9.785
   75    HN1  NH2  13           HN1      NH2  13  22.257  19.471  10.951
   76    HN2  NH2  13           HN2      NH2  13  20.744  19.996  10.047
  Start of MODEL    4
    1    H1   GLY   1           H1       GLY   1  14.503  14.743  10.006
    2    H2   GLY   1           H2       GLY   1  15.650  15.293   9.000
    3    HA2  GLY   1           HA2      GLY   1  15.139  12.804   8.946
    4    HA3  GLY   1           HA3      GLY   1  13.639  13.254   8.170
    5    H    CYS   2           H        CYS   2  17.140  13.423   7.843
    6    HA   CYS   2           HA       CYS   2  16.954  13.816   4.837
    7    HB2  CYS   2           HB2      CYS   2  19.377  13.598   6.716
    8    HB3  CYS   2           HB3      CYS   2  19.455  13.934   4.990
    9    H    CYS   3           H        CYS   3  17.035  12.247   3.419
   10    HA   CYS   3           HA       CYS   3  18.201   9.543   3.947
   11    HB2  CYS   3           HB2      CYS   3  16.003   8.284   3.635
   12    HB3  CYS   3           HB3      CYS   3  16.279   9.098   5.163
   13    H    SER   4           H        SER   4  15.779   9.374   1.549
   14    HA   SER   4           HA       SER   4  17.875   9.095  -0.532
   15    HB2  SER   4           HB2      SER   4  16.193   8.385  -2.025
   16    HB3  SER   4           HB3      SER   4  15.927   7.619  -0.475
   17    HG   SER   4           HG       SER   4  14.123   8.895  -0.125
   18    H    ASP   5           H        ASP   5  18.892  11.013  -0.638
   19    HA   ASP   5           HA       ASP   5  18.498  13.604  -0.895
   20    HB2  ASP   5           HB2      ASP   5  20.598  12.254  -1.419
   21    HB3  ASP   5           HB3      ASP   5  20.060  12.082  -3.080
   22    HD2  ASP   5           HD2      ASP   5  20.987  15.289  -3.970
   23    H    ALA   6           H        ALA   6  17.642  11.870  -3.904
   24    HA   ALA   6           HA       ALA   6  16.823  14.180  -5.506
   25    HB1  ALA   6           HB1      ALA   6  17.251  11.875  -6.391
   26    HB2  ALA   6           HB2      ALA   6  15.810  11.256  -5.547
   27    HB3  ALA   6           HB3      ALA   6  15.635  12.435  -6.863
   28    H    ARG   7           H        ARG   7  14.969  12.468  -3.090
   29    HA   ARG   7           HA       ARG   7  12.588  14.375  -3.470
   30    HB2  ARG   7           HB2      ARG   7  12.391  11.313  -3.128
   31    HB3  ARG   7           HB3      ARG   7  11.027  12.401  -3.023
   32    HG2  ARG   7           HG2      ARG   7  12.748  11.956  -5.558
   33    HG3  ARG   7           HG3      ARG   7  11.178  11.250  -5.245
   34    HD2  ARG   7           HD2      ARG   7  10.124  13.527  -5.140
   35    HD3  ARG   7           HD3      ARG   7  11.674  14.296  -5.430
   36   HH11  ARG   7          HH11      ARG   7  13.156  14.206  -6.867
   37   HH12  ARG   7          HH12      ARG   7  13.441  14.370  -8.685
   38   HH21  ARG   7          HH21      ARG   7  10.419  13.054  -9.400
   39   HH22  ARG   7          HH22      ARG   7  12.001  13.778 -10.012
   40    H    CYS   8           H        CYS   8  14.212  12.259  -1.167
   41    HA   CYS   8           HA       CYS   8  12.996  13.763   1.196
   42    HB2  CYS   8           HB2      CYS   8  12.911  11.332   1.439
   43    HB3  CYS   8           HB3      CYS   8  14.588  11.135   0.924
   44    H    ALA   9           H        ALA   9  14.485  14.660   2.693
   45    HA   ALA   9           HA       ALA   9  16.355  16.455   1.437
   46    HB1  ALA   9           HB1      ALA   9  16.638  17.253   3.837
   47    HB2  ALA   9           HB2      ALA   9  14.951  16.979   3.399
   48    HB3  ALA   9           HB3      ALA   9  15.830  15.801   4.425
   49    H    TRP  10           H        TRP  10  18.417  17.097   2.336
   50    HA   TRP  10           HA       TRP  10  20.307  14.870   3.170
   51    HB2  TRP  10           HB2      TRP  10  22.022  15.372   1.627
   52    HB3  TRP  10           HB3      TRP  10  20.568  15.030   0.744
   53    HD1  TRP  10           HD1      TRP  10  22.905  17.972   1.673
   54    HE1  TRP  10           HE1      TRP  10  22.867  19.861  -0.227
   55    HE3  TRP  10           HE3      TRP  10  18.875  16.170  -0.819
   56    HZ2  TRP  10           HZ2      TRP  10  21.212  20.269  -2.496
   57    HZ3  TRP  10           HZ3      TRP  10  18.077  17.350  -2.848
   58    HH2  TRP  10           HH2      TRP  10  19.226  19.367  -3.672
   59    H    ARG  11           H        ARG  11  19.548  18.278   3.494
   60    HA   ARG  11           HA       ARG  11  21.999  18.763   5.237
   61    HB2  ARG  11           HB2      ARG  11  19.701  20.618   4.346
   62    HB3  ARG  11           HB3      ARG  11  21.014  21.087   5.410
   63    HG2  ARG  11           HG2      ARG  11  22.689  20.398   3.594
   64    HG3  ARG  11           HG3      ARG  11  21.343  20.156   2.488
   65    HD2  ARG  11           HD2      ARG  11  20.651  22.545   2.646
   66    HD3  ARG  11           HD3      ARG  11  21.795  22.850   3.934
   67   HH11  ARG  11          HH11      ARG  11  20.697  22.306   0.679
   68   HH12  ARG  11          HH12      ARG  11  21.547  22.618  -0.923
   69   HH21  ARG  11          HH21      ARG  11  24.537  23.000   0.626
   70   HH22  ARG  11          HH22      ARG  11  23.583  23.024  -0.946
   71    H    CYS  12           H        CYS  12  21.522  17.252   6.885
   72    HA   CYS  12           HA       CYS  12  19.648  18.418   9.055
   73    HB2  CYS  12           HB2      CYS  12  20.610  15.514   8.642
   74    HB3  CYS  12           HB3      CYS  12  19.757  16.104  10.068
   75    HN1  NH2  13           HN1      NH2  13  22.654  19.353  10.784
   76    HN2  NH2  13           HN2      NH2  13  21.022  19.850  10.104
  Start of MODEL    5
    1    H1   GLY   1           H1       GLY   1  13.629  15.224   9.335
    2    H2   GLY   1           H2       GLY   1  14.899  15.948   8.582
    3    HA2  GLY   1           HA2      GLY   1  15.549  13.690   9.173
    4    HA3  GLY   1           HA3      GLY   1  14.104  13.071   8.403
    5    H    CYS   2           H        CYS   2  17.313  13.518   7.944
    6    HA   CYS   2           HA       CYS   2  17.236  13.775   4.936
    7    HB2  CYS   2           HB2      CYS   2  19.599  13.469   6.892
    8    HB3  CYS   2           HB3      CYS   2  19.763  13.527   5.131
    9    H    CYS   3           H        CYS   3  17.348  12.229   3.505
   10    HA   CYS   3           HA       CYS   3  18.217   9.478   3.964
   11    HB2  CYS   3           HB2      CYS   3  16.000   8.265   3.769
   12    HB3  CYS   3           HB3      CYS   3  16.314   9.110   5.272
   13    H    SER   4           H        SER   4  15.721   9.264   1.695
   14    HA   SER   4           HA       SER   4  17.758   8.849  -0.393
   15    HB2  SER   4           HB2      SER   4  16.013   8.114  -1.859
   16    HB3  SER   4           HB3      SER   4  15.798   7.404  -0.271
   17    HG   SER   4           HG       SER   4  14.144   8.924   0.144
   18    H    ASP   5           H        ASP   5  18.766  10.363  -1.374
   19    HA   ASP   5           HA       ASP   5  18.367  13.097  -1.098
   20    HB2  ASP   5           HB2      ASP   5  20.456  11.666  -1.796
   21    HB3  ASP   5           HB3      ASP   5  19.933  11.861  -3.456
   22    HD2  ASP   5           HD2      ASP   5  21.141  15.045  -3.731
   23    H    ALA   6           H        ALA   6  17.155  11.446  -3.987
   24    HA   ALA   6           HA       ALA   6  16.458  13.764  -5.647
   25    HB1  ALA   6           HB1      ALA   6  16.449  11.384  -6.423
   26    HB2  ALA   6           HB2      ALA   6  15.051  11.021  -5.384
   27    HB3  ALA   6           HB3      ALA   6  14.891  12.159  -6.741
   28    H    ARG   7           H        ARG   7  14.688  12.432  -2.887
   29    HA   ARG   7           HA       ARG   7  12.631  14.708  -3.104
   30    HB2  ARG   7           HB2      ARG   7  11.885  11.781  -2.520
   31    HB3  ARG   7           HB3      ARG   7  10.791  13.142  -2.462
   32    HG2  ARG   7           HG2      ARG   7  12.198  12.088  -4.993
   33    HG3  ARG   7           HG3      ARG   7  10.523  11.810  -4.550
   34    HD2  ARG   7           HD2      ARG   7   9.997  14.242  -4.740
   35    HD3  ARG   7           HD3      ARG   7  11.667  14.652  -5.045
   36   HH11  ARG   7          HH11      ARG   7  13.022  14.511  -6.516
   37   HH12  ARG   7          HH12      ARG   7  13.225  14.581  -8.350
   38   HH21  ARG   7          HH21      ARG   7  10.180  13.261  -8.903
   39   HH22  ARG   7          HH22      ARG   7  11.777  13.887  -9.577
   40    H    CYS   8           H        CYS   8  13.835  12.240  -0.826
   41    HA   CYS   8           HA       CYS   8  13.151  13.924   1.581
   42    HB2  CYS   8           HB2      CYS   8  12.957  11.465   1.670
   43    HB3  CYS   8           HB3      CYS   8  14.633  11.259   1.141
   44    H    ALA   9           H        ALA   9  14.757  14.679   3.020
   45    HA   ALA   9           HA       ALA   9  16.566  16.465   1.656
   46    HB1  ALA   9           HB1      ALA   9  17.071  17.298   3.957
   47    HB2  ALA   9           HB2      ALA   9  15.339  17.007   3.755
   48    HB3  ALA   9           HB3      ALA   9  16.337  15.855   4.682
   49    H    TRP  10           H        TRP  10  18.689  16.936   2.012
   50    HA   TRP  10           HA       TRP  10  20.538  14.792   3.171
   51    HB2  TRP  10           HB2      TRP  10  22.276  15.231   1.597
   52    HB3  TRP  10           HB3      TRP  10  20.831  14.815   0.739
   53    HD1  TRP  10           HD1      TRP  10  23.080  17.902   1.520
   54    HE1  TRP  10           HE1      TRP  10  22.929  19.708  -0.439
   55    HE3  TRP  10           HE3      TRP  10  19.110  15.809  -0.838
   56    HZ2  TRP  10           HZ2      TRP  10  21.184  19.981  -2.669
   57    HZ3  TRP  10           HZ3      TRP  10  18.210  16.888  -2.882
   58    HH2  TRP  10           HH2      TRP  10  19.234  18.918  -3.793
   59    H    ARG  11           H        ARG  11  19.695  18.206   3.163
   60    HA   ARG  11           HA       ARG  11  22.023  18.994   4.909
   61    HB2  ARG  11           HB2      ARG  11  19.538  20.484   3.850
   62    HB3  ARG  11           HB3      ARG  11  20.699  21.207   4.935
   63    HG2  ARG  11           HG2      ARG  11  22.574  20.722   3.295
   64    HG3  ARG  11           HG3      ARG  11  21.390  20.123   2.131
   65    HD2  ARG  11           HD2      ARG  11  20.243  22.377   2.102
   66    HD3  ARG  11           HD3      ARG  11  21.327  22.956   3.355
   67   HH11  ARG  11          HH11      ARG  11  20.370  21.976   0.160
   68   HH12  ARG  11          HH12      ARG  11  21.124  22.419  -1.464
   69   HH21  ARG  11          HH21      ARG  11  24.002  23.352   0.079
   70   HH22  ARG  11          HH22      ARG  11  23.097  23.110  -1.512
   71    H    CYS  12           H        CYS  12  21.879  17.842   6.805
   72    HA   CYS  12           HA       CYS  12  19.675  18.687   8.793
   73    HB2  CYS  12           HB2      CYS  12  20.953  15.898   8.366
   74    HB3  CYS  12           HB3      CYS  12  19.987  16.347   9.770
   75    HN1  NH2  13           HN1      NH2  13  22.526  19.991  10.590
   76    HN2  NH2  13           HN2      NH2  13  20.963  20.370   9.704
  Start of MODEL    6
    1    H1   GLY   1           H1       GLY   1  13.594  15.472   9.419
    2    H2   GLY   1           H2       GLY   1  14.957  15.976   8.674
    3    HA2  GLY   1           HA2      GLY   1  15.098  13.590   9.244
    4    HA3  GLY   1           HA3      GLY   1  13.646  13.312   8.304
    5    H    CYS   2           H        CYS   2  17.040  13.643   8.144
    6    HA   CYS   2           HA       CYS   2  17.175  13.923   5.162
    7    HB2  CYS   2           HB2      CYS   2  19.380  13.415   7.244
    8    HB3  CYS   2           HB3      CYS   2  19.656  13.599   5.502
    9    H    CYS   3           H        CYS   3  16.915  12.414   3.743
   10    HA   CYS   3           HA       CYS   3  17.771   9.583   4.133
   11    HB2  CYS   3           HB2      CYS   3  15.478   8.573   3.711
   12    HB3  CYS   3           HB3      CYS   3  15.768   9.305   5.280
   13    H    SER   4           H        SER   4  15.614   9.355   1.640
   14    HA   SER   4           HA       SER   4  17.934   9.120  -0.155
   15    HB2  SER   4           HB2      SER   4  16.475   8.168  -1.794
   16    HB3  SER   4           HB3      SER   4  16.148   7.486  -0.216
   17    HG   SER   4           HG       SER   4  14.305   8.779  -0.036
   18    H    ASP   5           H        ASP   5  18.919  10.738  -0.928
   19    HA   ASP   5           HA       ASP   5  18.521  13.353  -1.071
   20    HB2  ASP   5           HB2      ASP   5  20.573  11.922  -1.675
   21    HB3  ASP   5           HB3      ASP   5  19.972  11.797  -3.306
   22    HD2  ASP   5           HD2      ASP   5  21.045  14.974  -4.161
   23    H    ALA   6           H        ALA   6  17.261  11.561  -3.894
   24    HA   ALA   6           HA       ALA   6  16.674  13.879  -5.603
   25    HB1  ALA   6           HB1      ALA   6  16.770  11.525  -6.432
   26    HB2  ALA   6           HB2      ALA   6  15.322  11.101  -5.479
   27    HB3  ALA   6           HB3      ALA   6  15.203  12.257  -6.820
   28    H    ARG   7           H        ARG   7  14.743  12.578  -2.971
   29    HA   ARG   7           HA       ARG   7  12.744  14.870  -3.338
   30    HB2  ARG   7           HB2      ARG   7  11.886  11.959  -2.856
   31    HB3  ARG   7           HB3      ARG   7  10.815  13.330  -2.707
   32    HG2  ARG   7           HG2      ARG   7  12.240  12.496  -5.324
   33    HG3  ARG   7           HG3      ARG   7  10.587  12.118  -4.890
   34    HD2  ARG   7           HD2      ARG   7   9.957  14.528  -4.857
   35    HD3  ARG   7           HD3      ARG   7  11.606  15.029  -5.175
   36   HH11  ARG   7          HH11      ARG   7  13.037  14.732  -6.666
   37   HH12  ARG   7          HH12      ARG   7  13.242  14.936  -8.484
   38   HH21  ARG   7          HH21      ARG   7  10.070  14.017  -9.141
   39   HH22  ARG   7          HH22      ARG   7  11.716  14.567  -9.747
   40    H    CYS   8           H        CYS   8  13.882  12.461  -0.989
   41    HA   CYS   8           HA       CYS   8  13.145  14.226   1.354
   42    HB2  CYS   8           HB2      CYS   8  12.897  11.764   1.488
   43    HB3  CYS   8           HB3      CYS   8  14.598  11.522   1.057
   44    H    ALA   9           H        ALA   9  14.880  14.818   2.878
   45    HA   ALA   9           HA       ALA   9  16.852  16.487   1.486
   46    HB1  ALA   9           HB1      ALA   9  17.346  17.346   3.777
   47    HB2  ALA   9           HB2      ALA   9  15.601  17.220   3.509
   48    HB3  ALA   9           HB3      ALA   9  16.444  16.010   4.518
   49    H    TRP  10           H        TRP  10  18.977  16.690   1.745
   50    HA   TRP  10           HA       TRP  10  20.649  14.433   2.980
   51    HB2  TRP  10           HB2      TRP  10  22.515  15.072   1.577
   52    HB3  TRP  10           HB3      TRP  10  21.146  14.609   0.615
   53    HD1  TRP  10           HD1      TRP  10  23.256  17.707   1.568
   54    HE1  TRP  10           HE1      TRP  10  23.070  19.613  -0.308
   55    HE3  TRP  10           HE3      TRP  10  19.338  15.669  -0.911
   56    HZ2  TRP  10           HZ2      TRP  10  21.386  19.925  -2.556
   57    HZ3  TRP  10           HZ3      TRP  10  18.460  16.808  -2.939
   58    HH2  TRP  10           HH2      TRP  10  19.480  18.888  -3.752
   59    H    ARG  11           H        ARG  11  20.001  17.889   3.142
   60    HA   ARG  11           HA       ARG  11  22.317  18.492   4.915
   61    HB2  ARG  11           HB2      ARG  11  19.850  20.212   4.290
   62    HB3  ARG  11           HB3      ARG  11  21.314  20.757   5.085
   63    HG2  ARG  11           HG2      ARG  11  22.643  20.213   2.948
   64    HG3  ARG  11           HG3      ARG  11  21.132  19.754   2.175
   65    HD2  ARG  11           HD2      ARG  11  20.224  22.153   2.824
   66    HD3  ARG  11           HD3      ARG  11  21.865  22.548   3.271
   67   HH11  ARG  11          HH11      ARG  11  19.434  21.023   1.180
   68   HH12  ARG  11          HH12      ARG  11  19.122  21.221  -0.625
   69   HH21  ARG  11          HH21      ARG  11  22.069  22.852  -0.994
   70   HH22  ARG  11          HH22      ARG  11  20.524  22.217  -1.783
   71    H    CYS  12           H        CYS  12  22.248  17.436   6.841
   72    HA   CYS  12           HA       CYS  12  20.253  18.555   8.893
   73    HB2  CYS  12           HB2      CYS  12  21.231  15.623   8.645
   74    HB3  CYS  12           HB3      CYS  12  20.530  16.297  10.116
   75    HN1  NH2  13           HN1      NH2  13  23.112  19.438  10.864
   76    HN2  NH2  13           HN2      NH2  13  21.283  19.484  10.695
  Start of MODEL    7
    1    H1   GLY   1           H1       GLY   1  14.428  15.606   9.224
    2    H2   GLY   1           H2       GLY   1  15.818  15.869   8.415
    3    HA2  GLY   1           HA2      GLY   1  15.214  13.450   8.589
    4    HA3  GLY   1           HA3      GLY   1  13.783  13.812   7.646
    5    H    CYS   2           H        CYS   2  17.175  13.292   7.523
    6    HA   CYS   2           HA       CYS   2  17.280  13.684   4.486
    7    HB2  CYS   2           HB2      CYS   2  19.515  13.118   6.541
    8    HB3  CYS   2           HB3      CYS   2  19.748  13.386   4.805
    9    H    CYS   3           H        CYS   3  15.603  11.852   4.690
   10    HA   CYS   3           HA       CYS   3  16.647   9.152   5.082
   11    HB2  CYS   3           HB2      CYS   3  14.382   8.448   4.907
   12    HB3  CYS   3           HB3      CYS   3  14.472   9.932   5.834
   13    H    SER   4           H        SER   4  15.698  10.608   2.038
   14    HA   SER   4           HA       SER   4  17.852   8.991   0.756
   15    HB2  SER   4           HB2      SER   4  16.626   8.178  -1.180
   16    HB3  SER   4           HB3      SER   4  15.848   7.580   0.270
   17    HG   SER   4           HG       SER   4  14.100   8.711  -0.183
   18    H    ASP   5           H        ASP   5  18.166   9.823  -1.630
   19    HA   ASP   5           HA       ASP   5  19.127  12.506  -0.967
   20    HB2  ASP   5           HB2      ASP   5  20.322  10.480  -2.139
   21    HB3  ASP   5           HB3      ASP   5  19.645  11.068  -3.638
   22    HD2  ASP   5           HD2      ASP   5  21.792  13.785  -3.758
   23    H    ALA   6           H        ALA   6  17.451  11.699  -4.091
   24    HA   ALA   6           HA       ALA   6  17.272  14.465  -4.903
   25    HB1  ALA   6           HB1      ALA   6  17.156  12.557  -6.479
   26    HB2  ALA   6           HB2      ALA   6  15.565  12.063  -5.844
   27    HB3  ALA   6           HB3      ALA   6  15.758  13.609  -6.706
   28    H    ARG   7           H        ARG   7  14.549  12.605  -3.507
   29    HA   ARG   7           HA       ARG   7  12.912  15.189  -3.341
   30    HB2  ARG   7           HB2      ARG   7  12.002  12.297  -2.916
   31    HB3  ARG   7           HB3      ARG   7  10.956  13.690  -2.821
   32    HG2  ARG   7           HG2      ARG   7  12.472  12.832  -5.371
   33    HG3  ARG   7           HG3      ARG   7  10.807  12.438  -5.000
   34    HD2  ARG   7           HD2      ARG   7  10.144  14.841  -5.008
   35    HD3  ARG   7           HD3      ARG   7  11.798  15.359  -5.277
   36   HH11  ARG   7          HH11      ARG   7  13.141  15.304  -6.697
   37   HH12  ARG   7          HH12      ARG   7  13.515  15.353  -8.499
   38   HH21  ARG   7          HH21      ARG   7  10.496  13.962  -9.234
   39   HH22  ARG   7          HH22      ARG   7  12.110  14.624  -9.836
   40    H    CYS   8           H        CYS   8  14.021  12.706  -0.996
   41    HA   CYS   8           HA       CYS   8  12.589  13.978   1.258
   42    HB2  CYS   8           HB2      CYS   8  13.019  11.542   1.032
   43    HB3  CYS   8           HB3      CYS   8  14.752  11.814   1.211
   44    H    ALA   9           H        ALA   9  16.144  13.538   1.354
   45    HA   ALA   9           HA       ALA   9  16.946  16.173   0.979
   46    HB1  ALA   9           HB1      ALA   9  17.545  17.150   3.246
   47    HB2  ALA   9           HB2      ALA   9  15.808  17.036   3.025
   48    HB3  ALA   9           HB3      ALA   9  16.652  15.843   4.048
   49    H    TRP  10           H        TRP  10  19.099  16.673   1.456
   50    HA   TRP  10           HA       TRP  10  20.876  14.475   2.619
   51    HB2  TRP  10           HB2      TRP  10  22.773  15.312   1.327
   52    HB3  TRP  10           HB3      TRP  10  21.510  14.664   0.330
   53    HD1  TRP  10           HD1      TRP  10  22.898  18.166   1.409
   54    HE1  TRP  10           HE1      TRP  10  22.394  20.028  -0.446
   55    HE3  TRP  10           HE3      TRP  10  20.000  15.235  -1.511
   56    HZ2  TRP  10           HZ2      TRP  10  20.786  20.009  -2.779
   57    HZ3  TRP  10           HZ3      TRP  10  18.916  16.209  -3.520
   58    HH2  TRP  10           HH2      TRP  10  19.301  18.560  -4.146
   59    H    ARG  11           H        ARG  11  20.091  17.940   2.861
   60    HA   ARG  11           HA       ARG  11  22.215  18.435   4.935
   61    HB2  ARG  11           HB2      ARG  11  19.834  20.133   3.972
   62    HB3  ARG  11           HB3      ARG  11  20.968  20.674   5.191
   63    HG2  ARG  11           HG2      ARG  11  22.888  20.552   3.581
   64    HG3  ARG  11           HG3      ARG  11  21.799  19.942   2.327
   65    HD2  ARG  11           HD2      ARG  11  20.399  22.003   2.448
   66    HD3  ARG  11           HD3      ARG  11  21.445  22.685   3.701
   67   HH11  ARG  11          HH11      ARG  11  20.440  24.063   1.850
   68   HH12  ARG  11          HH12      ARG  11  21.065  25.146   0.495
   69   HH21  ARG  11          HH21      ARG  11  23.822  23.222   0.101
   70   HH22  ARG  11          HH22      ARG  11  22.846  24.680  -0.453
   71    H    CYS  12           H        CYS  12  22.000  17.638   6.955
   72    HA   CYS  12           HA       CYS  12  19.441  18.292   8.512
   73    HB2  CYS  12           HB2      CYS  12  20.954  15.598   8.410
   74    HB3  CYS  12           HB3      CYS  12  19.914  16.045   9.769
   75    HN1  NH2  13           HN1      NH2  13  21.241  19.232  11.431
   76    HN2  NH2  13           HN2      NH2  13  19.679  18.446  10.853
  Start of MODEL    8
    1    H1   GLY   1           H1       GLY   1  13.980  15.229   9.296
    2    H2   GLY   1           H2       GLY   1  15.261  15.762   8.445
    3    HA2  GLY   1           HA2      GLY   1  15.054  13.254   8.641
    4    HA3  GLY   1           HA3      GLY   1  13.599  13.385   7.682
    5    H    CYS   2           H        CYS   2  17.019  13.349   7.583
    6    HA   CYS   2           HA       CYS   2  17.095  13.578   4.541
    7    HB2  CYS   2           HB2      CYS   2  19.298  13.343   6.703
    8    HB3  CYS   2           HB3      CYS   2  19.614  13.364   4.965
    9    H    CYS   3           H        CYS   3  15.584  11.634   4.620
   10    HA   CYS   3           HA       CYS   3  16.894   8.984   5.023
   11    HB2  CYS   3           HB2      CYS   3  14.726   8.029   4.716
   12    HB3  CYS   3           HB3      CYS   3  14.638   9.415   5.788
   13    H    SER   4           H        SER   4  15.169   9.749   2.007
   14    HA   SER   4           HA       SER   4  17.538   8.638   0.418
   15    HB2  SER   4           HB2      SER   4  16.122   8.624  -1.536
   16    HB3  SER   4           HB3      SER   4  15.302   7.772  -0.241
   17    HG   SER   4           HG       SER   4  13.771   9.249  -0.205
   18    H    ASP   5           H        ASP   5  18.202   9.929  -1.514
   19    HA   ASP   5           HA       ASP   5  19.092  12.581  -0.545
   20    HB2  ASP   5           HB2      ASP   5  20.540  10.903  -1.667
   21    HB3  ASP   5           HB3      ASP   5  19.666  11.089  -3.180
   22    HD2  ASP   5           HD2      ASP   5  21.197  14.007  -4.066
   23    H    ALA   6           H        ALA   6  17.721  12.060  -3.837
   24    HA   ALA   6           HA       ALA   6  17.430  14.869  -4.323
   25    HB1  ALA   6           HB1      ALA   6  17.646  13.142  -6.084
   26    HB2  ALA   6           HB2      ALA   6  15.997  12.541  -5.741
   27    HB3  ALA   6           HB3      ALA   6  16.253  14.175  -6.394
   28    H    ARG   7           H        ARG   7  14.781  12.743  -3.264
   29    HA   ARG   7           HA       ARG   7  12.948  15.197  -3.041
   30    HB2  ARG   7           HB2      ARG   7  12.172  12.258  -2.861
   31    HB3  ARG   7           HB3      ARG   7  11.066  13.612  -2.809
   32    HG2  ARG   7           HG2      ARG   7  12.802  12.798  -5.227
   33    HG3  ARG   7           HG3      ARG   7  11.082  12.487  -5.032
   34    HD2  ARG   7           HD2      ARG   7  10.540  14.896  -5.104
   35    HD3  ARG   7           HD3      ARG   7  12.229  15.368  -5.096
   36   HH11  ARG   7          HH11      ARG   7  13.813  15.267  -6.291
   37   HH12  ARG   7          HH12      ARG   7  14.426  15.386  -8.028
   38   HH21  ARG   7          HH21      ARG   7  11.463  14.277  -9.219
   39   HH22  ARG   7          HH22      ARG   7  13.209  14.764  -9.587
   40    H    CYS   8           H        CYS   8  14.002  12.539  -0.839
   41    HA   CYS   8           HA       CYS   8  12.549  13.700   1.479
   42    HB2  CYS   8           HB2      CYS   8  13.021  11.279   1.141
   43    HB3  CYS   8           HB3      CYS   8  14.748  11.568   1.351
   44    H    ALA   9           H        ALA   9  16.110  13.298   1.536
   45    HA   ALA   9           HA       ALA   9  16.870  15.898   1.038
   46    HB1  ALA   9           HB1      ALA   9  17.564  16.967   3.274
   47    HB2  ALA   9           HB2      ALA   9  15.835  16.938   2.994
   48    HB3  ALA   9           HB3      ALA   9  16.571  15.756   4.111
   49    H    TRP  10           H        TRP  10  19.015  16.436   1.371
   50    HA   TRP  10           HA       TRP  10  20.845  14.392   2.730
   51    HB2  TRP  10           HB2      TRP  10  22.728  15.100   1.432
   52    HB3  TRP  10           HB3      TRP  10  21.472  14.477   0.406
   53    HD1  TRP  10           HD1      TRP  10  23.128  17.839   1.386
   54    HE1  TRP  10           HE1      TRP  10  22.681  19.741  -0.427
   55    HE3  TRP  10           HE3      TRP  10  19.709  15.288  -1.253
   56    HZ2  TRP  10           HZ2      TRP  10  21.023  19.896  -2.679
   57    HZ3  TRP  10           HZ3      TRP  10  18.528  16.427  -3.121
   58    HH2  TRP  10           HH2      TRP  10  19.181  18.681  -3.832
   59    H    ARG  11           H        ARG  11  20.053  17.893   2.543
   60    HA   ARG  11           HA       ARG  11  22.030  18.592   4.693
   61    HB2  ARG  11           HB2      ARG  11  19.755  20.200   3.384
   62    HB3  ARG  11           HB3      ARG  11  20.798  20.858   4.626
   63    HG2  ARG  11           HG2      ARG  11  22.837  20.560   3.209
   64    HG3  ARG  11           HG3      ARG  11  21.864  19.781   1.961
   65    HD2  ARG  11           HD2      ARG  11  20.483  21.849   1.656
   66    HD3  ARG  11           HD3      ARG  11  21.441  22.683   2.892
   67   HH11  ARG  11          HH11      ARG  11  20.779  23.996   1.011
   68   HH12  ARG  11          HH12      ARG  11  21.614  24.981  -0.308
   69   HH21  ARG  11          HH21      ARG  11  24.180  22.820  -0.509
   70   HH22  ARG  11          HH22      ARG  11  23.386  24.405  -1.034
   71    H    CYS  12           H        CYS  12  21.725  18.096   6.749
   72    HA   CYS  12           HA       CYS  12  19.113  18.782   8.152
   73    HB2  CYS  12           HB2      CYS  12  20.392  15.969   8.342
   74    HB3  CYS  12           HB3      CYS  12  19.227  16.624   9.501
   75    HN1  NH2  13           HN1      NH2  13  21.445  20.165  10.507
   76    HN2  NH2  13           HN2      NH2  13  19.981  20.445   9.434
  Start of MODEL    9
    1    H1   GLY   1           H1       GLY   1  15.535  16.699   7.045
    2    H2   GLY   1           H2       GLY   1  14.220  16.365   6.148
    3    HA2  GLY   1           HA2      GLY   1  15.249  14.664   8.382
    4    HA3  GLY   1           HA3      GLY   1  13.770  14.330   7.501
    5    H    CYS   2           H        CYS   2  17.074  13.745   7.558
    6    HA   CYS   2           HA       CYS   2  17.402  13.378   4.562
    7    HB2  CYS   2           HB2      CYS   2  19.437  13.184   6.877
    8    HB3  CYS   2           HB3      CYS   2  19.814  13.120   5.151
    9    H    CYS   3           H        CYS   3  15.716  11.609   4.732
   10    HA   CYS   3           HA       CYS   3  16.962   8.883   5.166
   11    HB2  CYS   3           HB2      CYS   3  14.814   7.944   4.720
   12    HB3  CYS   3           HB3      CYS   3  14.746   9.226   5.917
   13    H    SER   4           H        SER   4  15.237   9.246   2.125
   14    HA   SER   4           HA       SER   4  17.757   8.580   0.584
   15    HB2  SER   4           HB2      SER   4  16.355   8.512  -1.404
   16    HB3  SER   4           HB3      SER   4  15.610   7.577  -0.126
   17    HG   SER   4           HG       SER   4  14.072   9.092   0.165
   18    H    ASP   5           H        ASP   5  18.125   9.993  -1.502
   19    HA   ASP   5           HA       ASP   5  19.027  12.625  -0.374
   20    HB2  ASP   5           HB2      ASP   5  20.437  10.845  -1.630
   21    HB3  ASP   5           HB3      ASP   5  19.716  11.420  -3.120
   22    HD2  ASP   5           HD2      ASP   5  21.454  14.441  -3.051
   23    H    ALA   6           H        ALA   6  17.786  12.157  -3.735
   24    HA   ALA   6           HA       ALA   6  17.308  14.934  -4.168
   25    HB1  ALA   6           HB1      ALA   6  17.575  13.065  -5.904
   26    HB2  ALA   6           HB2      ALA   6  15.902  12.579  -5.595
   27    HB3  ALA   6           HB3      ALA   6  16.253  14.184  -6.265
   28    H    ARG   7           H        ARG   7  14.791  12.588  -3.223
   29    HA   ARG   7           HA       ARG   7  12.715  14.835  -3.047
   30    HB2  ARG   7           HB2      ARG   7  12.331  11.805  -2.810
   31    HB3  ARG   7           HB3      ARG   7  11.043  12.989  -2.796
   32    HG2  ARG   7           HG2      ARG   7  12.948  12.486  -5.177
   33    HG3  ARG   7           HG3      ARG   7  11.346  11.803  -5.029
   34    HD2  ARG   7           HD2      ARG   7  10.223  13.899  -5.304
   35    HD3  ARG   7           HD3      ARG   7  11.616  14.875  -4.926
   36   HH11  ARG   7          HH11      ARG   7  13.433  15.240  -5.722
   37   HH12  ARG   7          HH12      ARG   7  14.349  15.729  -7.246
   38   HH21  ARG   7          HH21      ARG   7  12.118  14.048  -9.178
   39   HH22  ARG   7          HH22      ARG   7  13.613  15.123  -9.100
   40    H    CYS   8           H        CYS   8  14.166  12.470  -0.790
   41    HA   CYS   8           HA       CYS   8  12.650  13.591   1.559
   42    HB2  CYS   8           HB2      CYS   8  13.140  11.173   1.270
   43    HB3  CYS   8           HB3      CYS   8  14.871  11.476   1.400
   44    H    ALA   9           H        ALA   9  16.208  13.237   1.723
   45    HA   ALA   9           HA       ALA   9  16.818  15.968   1.190
   46    HB1  ALA   9           HB1      ALA   9  17.508  16.936   3.409
   47    HB2  ALA   9           HB2      ALA   9  15.763  16.662   3.330
   48    HB3  ALA   9           HB3      ALA   9  16.803  15.549   4.250
   49    H    TRP  10           H        TRP  10  18.920  16.552   1.292
   50    HA   TRP  10           HA       TRP  10  21.020  14.507   2.195
   51    HB2  TRP  10           HB2      TRP  10  22.598  15.382   0.631
   52    HB3  TRP  10           HB3      TRP  10  21.167  14.860  -0.196
   53    HD1  TRP  10           HD1      TRP  10  22.972  18.143   0.838
   54    HE1  TRP  10           HE1      TRP  10  22.048  20.253  -0.491
   55    HE3  TRP  10           HE3      TRP  10  19.236  15.713  -1.530
   56    HZ2  TRP  10           HZ2      TRP  10  19.899  20.613  -2.269
   57    HZ3  TRP  10           HZ3      TRP  10  17.644  17.015  -2.922
   58    HH2  TRP  10           HH2      TRP  10  17.936  19.434  -3.228
   59    H    ARG  11           H        ARG  11  20.259  18.038   2.396
   60    HA   ARG  11           HA       ARG  11  22.402  18.483   4.462
   61    HB2  ARG  11           HB2      ARG  11  20.015  20.302   3.800
   62    HB3  ARG  11           HB3      ARG  11  21.337  20.726   4.824
   63    HG2  ARG  11           HG2      ARG  11  22.643  21.445   3.168
   64    HG3  ARG  11           HG3      ARG  11  22.464  19.994   2.196
   65    HD2  ARG  11           HD2      ARG  11  20.246  20.782   1.335
   66    HD3  ARG  11           HD3      ARG  11  20.292  22.199   2.377
   67   HH11  ARG  11          HH11      ARG  11  19.288  22.539   0.233
   68   HH12  ARG  11          HH12      ARG  11  19.621  23.432  -1.356
   69   HH21  ARG  11          HH21      ARG  11  22.938  23.170  -1.013
   70   HH22  ARG  11          HH22      ARG  11  21.489  23.763  -1.988
   71    H    CYS  12           H        CYS  12  22.185  17.844   6.518
   72    HA   CYS  12           HA       CYS  12  19.643  18.635   8.021
   73    HB2  CYS  12           HB2      CYS  12  21.062  15.913   8.214
   74    HB3  CYS  12           HB3      CYS  12  20.066  16.556   9.521
   75    HN1  NH2  13           HN1      NH2  13  21.823  20.257  10.326
   76    HN2  NH2  13           HN2      NH2  13  20.180  20.168   9.512
  Start of MODEL   10
    1    H1   GLY   1           H1       GLY   1  15.912  16.524   7.680
    2    H2   GLY   1           H2       GLY   1  14.678  16.738   6.631
    3    HA2  GLY   1           HA2      GLY   1  15.014  14.350   8.417
    4    HA3  GLY   1           HA3      GLY   1  13.637  14.602   7.374
    5    H    CYS   2           H        CYS   2  17.070  14.017   7.407
    6    HA   CYS   2           HA       CYS   2  17.232  13.452   4.442
    7    HB2  CYS   2           HB2      CYS   2  19.363  13.269   6.668
    8    HB3  CYS   2           HB3      CYS   2  19.661  13.092   4.943
    9    H    CYS   3           H        CYS   3  15.938  11.728   4.095
   10    HA   CYS   3           HA       CYS   3  16.964   9.007   5.090
   11    HB2  CYS   3           HB2      CYS   3  14.808   8.088   4.901
   12    HB3  CYS   3           HB3      CYS   3  14.743   9.546   5.866
   13    H    SER   4           H        SER   4  15.218   9.519   2.017
   14    HA   SER   4           HA       SER   4  17.713   8.735   0.451
   15    HB2  SER   4           HB2      SER   4  16.412   8.955  -1.572
   16    HB3  SER   4           HB3      SER   4  15.561   7.928  -0.449
   17    HG   SER   4           HG       SER   4  13.994   9.376  -0.288
   18    H    ASP   5           H        ASP   5  17.905  10.477  -1.604
   19    HA   ASP   5           HA       ASP   5  19.074  12.878  -0.091
   20    HB2  ASP   5           HB2      ASP   5  20.597  11.141  -1.256
   21    HB3  ASP   5           HB3      ASP   5  20.032  11.762  -2.795
   22    HD2  ASP   5           HD2      ASP   5  21.857  14.704  -2.540
   23    H    ALA   6           H        ALA   6  17.899  12.406  -3.471
   24    HA   ALA   6           HA       ALA   6  17.098  15.302  -3.684
   25    HB1  ALA   6           HB1      ALA   6  18.026  14.129  -5.676
   26    HB2  ALA   6           HB2      ALA   6  16.715  12.923  -5.624
   27    HB3  ALA   6           HB3      ALA   6  16.379  14.626  -6.002
   28    H    ARG   7           H        ARG   7  15.342  12.229  -3.269
   29    HA   ARG   7           HA       ARG   7  12.656  13.699  -3.198
   30    HB2  ARG   7           HB2      ARG   7  13.304  10.694  -3.056
   31    HB3  ARG   7           HB3      ARG   7  11.693  11.362  -3.121
   32    HG2  ARG   7           HG2      ARG   7  13.783  11.658  -5.371
   33    HG3  ARG   7           HG3      ARG   7  12.523  10.459  -5.314
   34    HD2  ARG   7           HD2      ARG   7  10.731  12.085  -5.527
   35    HD3  ARG   7           HD3      ARG   7  11.778  13.457  -5.222
   36   HH11  ARG   7          HH11      ARG   7  13.746  13.920  -5.997
   37   HH12  ARG   7          HH12      ARG   7  14.598  14.481  -7.547
   38   HH21  ARG   7          HH21      ARG   7  12.485  12.777  -9.513
   39   HH22  ARG   7          HH22      ARG   7  13.954  13.873  -9.304
   40    H    CYS   8           H        CYS   8  14.856  13.184  -0.806
   41    HA   CYS   8           HA       CYS   8  12.656  13.489   1.308
   42    HB2  CYS   8           HB2      CYS   8  13.453  11.104   1.175
   43    HB3  CYS   8           HB3      CYS   8  15.079  11.632   1.579
   44    H    ALA   9           H        ALA   9  16.184  13.461   1.714
   45    HA   ALA   9           HA       ALA   9  16.528  16.241   1.188
   46    HB1  ALA   9           HB1      ALA   9  17.135  17.199   3.450
   47    HB2  ALA   9           HB2      ALA   9  15.418  16.775   3.366
   48    HB3  ALA   9           HB3      ALA   9  16.564  15.728   4.246
   49    H    TRP  10           H        TRP  10  18.599  16.979   1.265
   50    HA   TRP  10           HA       TRP  10  20.841  15.002   1.952
   51    HB2  TRP  10           HB2      TRP  10  22.279  16.113   0.421
   52    HB3  TRP  10           HB3      TRP  10  20.836  15.577  -0.373
   53    HD1  TRP  10           HD1      TRP  10  22.776  18.756   0.489
   54    HE1  TRP  10           HE1      TRP  10  22.000  20.796  -1.062
   55    HE3  TRP  10           HE3      TRP  10  18.565  16.558  -1.260
   56    HZ2  TRP  10           HZ2      TRP  10  19.737  21.188  -2.732
   57    HZ3  TRP  10           HZ3      TRP  10  17.061  17.826  -2.777
   58    HH2  TRP  10           HH2      TRP  10  17.646  20.104  -3.502
   59    H    ARG  11           H        ARG  11  19.868  18.400   2.575
   60    HA   ARG  11           HA       ARG  11  22.233  18.870   4.342
   61    HB2  ARG  11           HB2      ARG  11  19.695  20.578   3.991
   62    HB3  ARG  11           HB3      ARG  11  21.148  21.062   4.835
   63    HG2  ARG  11           HG2      ARG  11  22.463  20.843   2.644
   64    HG3  ARG  11           HG3      ARG  11  20.950  20.468   1.815
   65    HD2  ARG  11           HD2      ARG  11  19.957  22.690   2.666
   66    HD3  ARG  11           HD3      ARG  11  21.516  23.051   3.392
   67   HH11  ARG  11          HH11      ARG  11  19.244  22.345   0.756
   68   HH12  ARG  11          HH12      ARG  11  19.315  22.869  -1.008
   69   HH21  ARG  11          HH21      ARG  11  22.509  23.898  -0.713
   70   HH22  ARG  11          HH22      ARG  11  21.000  23.736  -1.760
   71    H    CYS  12           H        CYS  12  22.229  17.531   6.159
   72    HA   CYS  12           HA       CYS  12  20.318  18.425   8.372
   73    HB2  CYS  12           HB2      CYS  12  21.023  15.467   7.800
   74    HB3  CYS  12           HB3      CYS  12  20.150  16.057   9.221
   75    HN1  NH2  13           HN1      NH2  13  23.104  18.325  10.630
   76    HN2  NH2  13           HN2      NH2  13  21.288  18.558  10.457
  Start of MODEL   11
    1    H1   GLY   1           H1       GLY   1  16.088  16.462   8.143
    2    H2   GLY   1           H2       GLY   1  15.053  16.834   6.935
    3    HA2  GLY   1           HA2      GLY   1  15.071  14.306   8.540
    4    HA3  GLY   1           HA3      GLY   1  13.769  14.721   7.447
    5    H    CYS   2           H        CYS   2  17.214  14.054   7.573
    6    HA   CYS   2           HA       CYS   2  17.379  13.619   4.569
    7    HB2  CYS   2           HB2      CYS   2  19.563  13.458   6.742
    8    HB3  CYS   2           HB3      CYS   2  19.814  13.349   4.998
    9    H    CYS   3           H        CYS   3  15.899  11.895   4.502
   10    HA   CYS   3           HA       CYS   3  17.049   9.168   5.276
   11    HB2  CYS   3           HB2      CYS   3  14.912   8.222   4.983
   12    HB3  CYS   3           HB3      CYS   3  14.828   9.626   6.031
   13    H    SER   4           H        SER   4  15.296   9.537   2.236
   14    HA   SER   4           HA       SER   4  17.770   8.774   0.658
   15    HB2  SER   4           HB2      SER   4  16.349   8.695  -1.282
   16    HB3  SER   4           HB3      SER   4  15.515   7.884   0.028
   17    HG   SER   4           HG       SER   4  13.951   9.188  -0.629
   18    H    ASP   5           H        ASP   5  17.906  10.268  -1.513
   19    HA   ASP   5           HA       ASP   5  18.954  12.900  -0.339
   20    HB2  ASP   5           HB2      ASP   5  20.469  11.023  -1.485
   21    HB3  ASP   5           HB3      ASP   5  19.900  11.677  -3.001
   22    HD2  ASP   5           HD2      ASP   5  21.729  14.621  -2.598
   23    H    ALA   6           H        ALA   6  17.610  11.837  -3.513
   24    HA   ALA   6           HA       ALA   6  16.939  14.620  -4.333
   25    HB1  ALA   6           HB1      ALA   6  17.593  12.789  -5.940
   26    HB2  ALA   6           HB2      ALA   6  16.086  11.920  -5.578
   27    HB3  ALA   6           HB3      ALA   6  16.045  13.520  -6.360
   28    H    ARG   7           H        ARG   7  14.819  11.902  -3.350
   29    HA   ARG   7           HA       ARG   7  12.483  13.897  -3.016
   30    HB2  ARG   7           HB2      ARG   7  12.344  10.844  -3.228
   31    HB3  ARG   7           HB3      ARG   7  10.986  11.936  -3.162
   32    HG2  ARG   7           HG2      ARG   7  12.956  11.620  -5.498
   33    HG3  ARG   7           HG3      ARG   7  11.278  11.129  -5.433
   34    HD2  ARG   7           HD2      ARG   7  10.527  13.525  -5.310
   35    HD3  ARG   7           HD3      ARG   7  12.192  14.092  -5.331
   36   HH11  ARG   7          HH11      ARG   7  13.716  14.103  -6.606
   37   HH12  ARG   7          HH12      ARG   7  14.318  14.191  -8.349
   38   HH21  ARG   7          HH21      ARG   7  11.449  12.763  -9.428
   39   HH22  ARG   7          HH22      ARG   7  13.150  13.337  -9.841
   40    H    CYS   8           H        CYS   8  14.682  13.108  -0.924
   41    HA   CYS   8           HA       CYS   8  12.670  13.533   1.352
   42    HB2  CYS   8           HB2      CYS   8  13.364  11.111   1.259
   43    HB3  CYS   8           HB3      CYS   8  15.038  11.592   1.490
   44    H    ALA   9           H        ALA   9  16.181  13.378   1.855
   45    HA   ALA   9           HA       ALA   9  16.658  16.131   1.127
   46    HB1  ALA   9           HB1      ALA   9  17.113  17.226   3.331
   47    HB2  ALA   9           HB2      ALA   9  15.416  16.742   3.234
   48    HB3  ALA   9           HB3      ALA   9  16.570  15.790   4.205
   49    H    TRP  10           H        TRP  10  18.706  16.887   1.377
   50    HA   TRP  10           HA       TRP  10  20.904  14.887   2.141
   51    HB2  TRP  10           HB2      TRP  10  22.382  15.936   0.574
   52    HB3  TRP  10           HB3      TRP  10  20.957  15.337  -0.213
   53    HD1  TRP  10           HD1      TRP  10  22.825  18.590   0.520
   54    HE1  TRP  10           HE1      TRP  10  21.915  20.629  -0.927
   55    HE3  TRP  10           HE3      TRP  10  18.629  16.296  -1.091
   56    HZ2  TRP  10           HZ2      TRP  10  19.645  20.949  -2.604
   57    HZ3  TRP  10           HZ3      TRP  10  17.017  17.556  -2.507
   58    HH2  TRP  10           HH2      TRP  10  17.518  19.850  -3.240
   59    H    ARG  11           H        ARG  11  19.981  18.345   2.596
   60    HA   ARG  11           HA       ARG  11  22.378  18.844   4.299
   61    HB2  ARG  11           HB2      ARG  11  19.875  20.593   3.942
   62    HB3  ARG  11           HB3      ARG  11  21.376  21.069   4.708
   63    HG2  ARG  11           HG2      ARG  11  22.595  20.727   2.463
   64    HG3  ARG  11           HG3      ARG  11  21.028  20.382   1.722
   65    HD2  ARG  11           HD2      ARG  11  20.152  22.649   2.565
   66    HD3  ARG  11           HD3      ARG  11  21.749  22.974   3.212
   67   HH11  ARG  11          HH11      ARG  11  19.391  22.218   0.703
   68   HH12  ARG  11          HH12      ARG  11  19.311  22.761  -1.054
   69   HH21  ARG  11          HH21      ARG  11  22.508  23.912  -0.880
   70   HH22  ARG  11          HH22      ARG  11  20.985  23.688  -1.896
   71    H    CYS  12           H        CYS  12  22.368  17.573   6.174
   72    HA   CYS  12           HA       CYS  12  20.487  18.631   8.361
   73    HB2  CYS  12           HB2      CYS  12  21.218  15.661   7.958
   74    HB3  CYS  12           HB3      CYS  12  20.394  16.330   9.373
   75    HN1  NH2  13           HN1      NH2  13  23.503  19.179  10.200
   76    HN2  NH2  13           HN2      NH2  13  21.839  19.784   9.685
  Start of MODEL   12
    1    H1   GLY   1           H1       GLY   1  16.502  14.729  11.031
    2    H2   GLY   1           H2       GLY   1  17.153  15.408   9.709
    3    HA2  GLY   1           HA2      GLY   1  17.263  12.902   9.766
    4    HA3  GLY   1           HA3      GLY   1  15.527  12.903   9.621
    5    H    CYS   2           H        CYS   2  18.450  13.204   7.974
    6    HA   CYS   2           HA       CYS   2  17.235  13.901   5.267
    7    HB2  CYS   2           HB2      CYS   2  20.125  13.436   6.290
    8    HB3  CYS   2           HB3      CYS   2  19.722  13.589   4.578
    9    H    CYS   3           H        CYS   3  16.886  12.436   3.673
   10    HA   CYS   3           HA       CYS   3  17.614   9.546   3.976
   11    HB2  CYS   3           HB2      CYS   3  15.167   8.762   3.913
   12    HB3  CYS   3           HB3      CYS   3  15.873   9.319   5.418
   13    H    SER   4           H        SER   4  14.905  10.222   1.930
   14    HA   SER   4           HA       SER   4  16.548   9.129  -0.285
   15    HB2  SER   4           HB2      SER   4  14.452   8.758  -1.407
   16    HB3  SER   4           HB3      SER   4  14.331   8.262   0.271
   17    HG   SER   4           HG       SER   4  12.935   9.852   0.691
   18    H    ASP   5           H        ASP   5  17.575  11.647   0.065
   19    HA   ASP   5           HA       ASP   5  18.631  13.237  -1.272
   20    HB2  ASP   5           HB2      ASP   5  19.317  10.987  -2.085
   21    HB3  ASP   5           HB3      ASP   5  18.146  11.081  -3.375
   22    HD2  ASP   5           HD2      ASP   5  20.034  13.250  -5.317
   23    H    ALA   6           H        ALA   6  16.513  12.451  -4.029
   24    HA   ALA   6           HA       ALA   6  15.939  15.305  -4.621
   25    HB1  ALA   6           HB1      ALA   6  15.955  13.515  -6.368
   26    HB2  ALA   6           HB2      ALA   6  14.536  12.736  -5.621
   27    HB3  ALA   6           HB3      ALA   6  14.397  14.359  -6.332
   28    H    ARG   7           H        ARG   7  13.975  12.804  -2.987
   29    HA   ARG   7           HA       ARG   7  11.735  14.780  -2.439
   30    HB2  ARG   7           HB2      ARG   7  11.910  11.873  -1.491
   31    HB3  ARG   7           HB3      ARG   7  10.525  12.928  -1.395
   32    HG2  ARG   7           HG2      ARG   7  11.736  11.746  -3.965
   33    HG3  ARG   7           HG3      ARG   7  10.241  11.295  -3.178
   34    HD2  ARG   7           HD2      ARG   7   9.360  13.698  -3.616
   35    HD3  ARG   7           HD3      ARG   7  10.801  14.010  -4.574
   36   HH11  ARG   7          HH11      ARG   7  11.807  12.866  -6.097
   37   HH12  ARG   7          HH12      ARG   7  11.582  12.057  -7.744
   38   HH21  ARG   7          HH21      ARG   7   8.323  11.451  -7.112
   39   HH22  ARG   7          HH22      ARG   7   9.756  11.330  -8.279
   40    H    CYS   8           H        CYS   8  13.781  12.755  -0.283
   41    HA   CYS   8           HA       CYS   8  13.394  14.815   1.990
   42    HB2  CYS   8           HB2      CYS   8  12.377  12.725   2.573
   43    HB3  CYS   8           HB3      CYS   8  13.694  11.762   1.912
   44    H    ALA   9           H        ALA   9  15.054  16.129   1.209
   45    HA   ALA   9           HA       ALA   9  17.436  15.165   0.073
   46    HB1  ALA   9           HB1      ALA   9  18.014  17.559  -0.139
   47    HB2  ALA   9           HB2      ALA   9  16.277  17.373  -0.365
   48    HB3  ALA   9           HB3      ALA   9  16.914  18.007   1.182
   49    H    TRP  10           H        TRP  10  19.587  15.997   0.354
   50    HA   TRP  10           HA       TRP  10  20.846  14.536   2.530
   51    HB2  TRP  10           HB2      TRP  10  22.952  15.133   1.351
   52    HB3  TRP  10           HB3      TRP  10  21.735  14.458   0.323
   53    HD1  TRP  10           HD1      TRP  10  23.421  17.910   1.091
   54    HE1  TRP  10           HE1      TRP  10  23.021  19.662  -0.861
   55    HE3  TRP  10           HE3      TRP  10  20.355  14.951  -1.680
   56    HZ2  TRP  10           HZ2      TRP  10  21.425  19.591  -3.219
   57    HZ3  TRP  10           HZ3      TRP  10  19.305  15.887  -3.717
   58    HH2  TRP  10           HH2      TRP  10  19.809  18.181  -4.457
   59    H    ARG  11           H        ARG  11  20.420  18.070   2.430
   60    HA   ARG  11           HA       ARG  11  22.559  18.551   4.476
   61    HB2  ARG  11           HB2      ARG  11  20.384  20.400   3.348
   62    HB3  ARG  11           HB3      ARG  11  21.532  20.901   4.571
   63    HG2  ARG  11           HG2      ARG  11  23.471  20.367   3.023
   64    HG3  ARG  11           HG3      ARG  11  22.316  19.954   1.757
   65    HD2  ARG  11           HD2      ARG  11  21.306  22.318   1.937
   66    HD3  ARG  11           HD3      ARG  11  22.488  22.697   3.168
   67   HH11  ARG  11          HH11      ARG  11  21.309  21.797   0.007
   68   HH12  ARG  11          HH12      ARG  11  22.027  22.116  -1.669
   69   HH21  ARG  11          HH21      ARG  11  24.901  23.197  -0.308
   70   HH22  ARG  11          HH22      ARG  11  23.929  22.846  -1.832
   71    H    CYS  12           H        CYS  12  22.240  17.678   6.452
   72    HA   CYS  12           HA       CYS  12  19.887  18.800   8.100
   73    HB2  CYS  12           HB2      CYS  12  21.119  15.978   8.275
   74    HB3  CYS  12           HB3      CYS  12  20.076  16.696   9.518
   75    HN1  NH2  13           HN1      NH2  13  22.476  20.402   9.994
   76    HN2  NH2  13           HN2      NH2  13  21.063  20.626   8.842
  Start of MODEL   13
    1    H1   GLY   1           H1       GLY   1  15.904  15.201  10.094
    2    H2   GLY   1           H2       GLY   1  16.778  14.604  11.332
    3    HA2  GLY   1           HA2      GLY   1  17.930  13.000   9.935
    4    HA3  GLY   1           HA3      GLY   1  16.196  12.783   9.843
    5    H    CYS   2           H        CYS   2  18.934  13.126   8.036
    6    HA   CYS   2           HA       CYS   2  17.428  13.852   5.443
    7    HB2  CYS   2           HB2      CYS   2  20.434  13.911   6.201
    8    HB3  CYS   2           HB3      CYS   2  19.836  14.082   4.546
    9    H    CYS   3           H        CYS   3  17.375  12.447   3.722
   10    HA   CYS   3           HA       CYS   3  18.646   9.744   3.871
   11    HB2  CYS   3           HB2      CYS   3  16.414   8.482   3.922
   12    HB3  CYS   3           HB3      CYS   3  17.015   9.199   5.406
   13    H    SER   4           H        SER   4  15.899   9.438   1.923
   14    HA   SER   4           HA       SER   4  17.723   9.195  -0.403
   15    HB2  SER   4           HB2      SER   4  15.884   8.236  -1.621
   16    HB3  SER   4           HB3      SER   4  16.025   7.527  -0.021
   17    HG   SER   4           HG       SER   4  14.279   8.725   0.682
   18    H    ASP   5           H        ASP   5  18.352  11.441  -0.325
   19    HA   ASP   5           HA       ASP   5  18.358  13.625  -1.372
   20    HB2  ASP   5           HB2      ASP   5  19.956  12.003  -2.210
   21    HB3  ASP   5           HB3      ASP   5  18.846  11.406  -3.412
   22    HD2  ASP   5           HD2      ASP   5  21.169  13.192  -5.245
   23    H    ALA   6           H        ALA   6  16.680  12.149  -4.157
   24    HA   ALA   6           HA       ALA   6  15.338  14.672  -4.865
   25    HB1  ALA   6           HB1      ALA   6  15.996  12.883  -6.492
   26    HB2  ALA   6           HB2      ALA   6  14.794  11.771  -5.791
   27    HB3  ALA   6           HB3      ALA   6  14.272  13.247  -6.626
   28    H    ARG   7           H        ARG   7  14.274  12.408  -2.541
   29    HA   ARG   7           HA       ARG   7  11.570  13.869  -2.345
   30    HB2  ARG   7           HB2      ARG   7  12.069  11.003  -1.337
   31    HB3  ARG   7           HB3      ARG   7  10.598  11.925  -1.158
   32    HG2  ARG   7           HG2      ARG   7  11.761  10.795  -3.768
   33    HG3  ARG   7           HG3      ARG   7  10.357  10.212  -2.899
   34    HD2  ARG   7           HD2      ARG   7   9.195  12.479  -3.357
   35    HD3  ARG   7           HD3      ARG   7  10.582  12.970  -4.306
   36   HH11  ARG   7          HH11      ARG   7  11.704  12.071  -5.837
   37   HH12  ARG   7          HH12      ARG   7  11.617  11.362  -7.537
   38   HH21  ARG   7          HH21      ARG   7   8.498  10.152  -6.927
   39   HH22  ARG   7          HH22      ARG   7   9.912  10.318  -8.096
   40    H    CYS   8           H        CYS   8  13.828  12.045  -0.224
   41    HA   CYS   8           HA       CYS   8  13.298  13.973   2.089
   42    HB2  CYS   8           HB2      CYS   8  13.003  11.601   2.526
   43    HB3  CYS   8           HB3      CYS   8  14.546  11.176   1.791
   44    H    ALA   9           H        ALA   9  14.527  15.770   1.804
   45    HA   ALA   9           HA       ALA   9  16.852  15.812   0.119
   46    HB1  ALA   9           HB1      ALA   9  16.937  18.233   0.628
   47    HB2  ALA   9           HB2      ALA   9  15.278  17.712   0.358
   48    HB3  ALA   9           HB3      ALA   9  15.858  18.027   2.025
   49    H    TRP  10           H        TRP  10  18.877  16.680   0.421
   50    HA   TRP  10           HA       TRP  10  20.381  14.880   2.183
   51    HB2  TRP  10           HB2      TRP  10  22.345  15.625   0.820
   52    HB3  TRP  10           HB3      TRP  10  21.002  15.013  -0.096
   53    HD1  TRP  10           HD1      TRP  10  22.768  18.392   0.695
   54    HE1  TRP  10           HE1      TRP  10  22.004  20.332  -0.944
   55    HE3  TRP  10           HE3      TRP  10  19.164  15.745  -1.656
   56    HZ2  TRP  10           HZ2      TRP  10  20.007  20.508  -2.917
   57    HZ3  TRP  10           HZ3      TRP  10  17.683  16.900  -3.234
   58    HH2  TRP  10           HH2      TRP  10  18.089  19.267  -3.867
   59    H    ARG  11           H        ARG  11  20.219  18.491   2.387
   60    HA   ARG  11           HA       ARG  11  22.567  18.591   4.249
   61    HB2  ARG  11           HB2      ARG  11  20.445  20.740   3.658
   62    HB3  ARG  11           HB3      ARG  11  21.898  20.978   4.621
   63    HG2  ARG  11           HG2      ARG  11  23.338  20.448   2.585
   64    HG3  ARG  11           HG3      ARG  11  21.845  20.300   1.639
   65    HD2  ARG  11           HD2      ARG  11  21.195  22.659   2.289
   66    HD3  ARG  11           HD3      ARG  11  22.750  22.858   3.118
   67   HH11  ARG  11          HH11      ARG  11  21.424  24.535   1.485
   68   HH12  ARG  11          HH12      ARG  11  21.740  25.420  -0.098
   69   HH21  ARG  11          HH21      ARG  11  23.831  22.958  -1.143
   70   HH22  ARG  11          HH22      ARG  11  23.035  24.584  -1.480
   71    H    CYS  12           H        CYS  12  22.415  17.800   6.302
   72    HA   CYS  12           HA       CYS  12  20.138  18.897   8.086
   73    HB2  CYS  12           HB2      CYS  12  21.416  16.106   8.202
   74    HB3  CYS  12           HB3      CYS  12  20.561  16.846   9.570
   75    HN1  NH2  13           HN1      NH2  13  22.919  20.698   9.466
   76    HN2  NH2  13           HN2      NH2  13  21.470  20.785   8.331
  Start of MODEL   14
    1    H1   GLY   1           H1       GLY   1  14.651  15.824   7.991
    2    H2   GLY   1           H2       GLY   1  14.794  14.970   9.374
    3    HA2  GLY   1           HA2      GLY   1  15.785  13.081   8.323
    4    HA3  GLY   1           HA3      GLY   1  14.363  13.522   7.403
    5    H    CYS   2           H        CYS   2  17.738  13.199   7.323
    6    HA   CYS   2           HA       CYS   2  17.898  14.214   4.404
    7    HB2  CYS   2           HB2      CYS   2  20.054  14.138   6.616
    8    HB3  CYS   2           HB3      CYS   2  20.336  14.590   4.937
    9    H    CYS   3           H        CYS   3  17.548  12.445   3.200
   10    HA   CYS   3           HA       CYS   3  19.263   9.982   3.484
   11    HB2  CYS   3           HB2      CYS   3  17.243   8.479   3.879
   12    HB3  CYS   3           HB3      CYS   3  17.831   9.462   5.210
   13    H    SER   4           H        SER   4  16.204   9.656   1.859
   14    HA   SER   4           HA       SER   4  17.666   8.849  -0.596
   15    HB2  SER   4           HB2      SER   4  15.500   8.094  -1.405
   16    HB3  SER   4           HB3      SER   4  15.849   7.514   0.212
   17    HG   SER   4           HG       SER   4  14.243   8.651   1.026
   18    H    ASP   5           H        ASP   5  18.593  10.993  -0.896
   19    HA   ASP   5           HA       ASP   5  18.489  13.268  -1.688
   20    HB2  ASP   5           HB2      ASP   5  19.978  11.549  -2.830
   21    HB3  ASP   5           HB3      ASP   5  18.850  11.504  -4.163
   22    HD2  ASP   5           HD2      ASP   5  21.691  13.571  -4.923
   23    H    ALA   6           H        ALA   6  16.704  12.027  -4.545
   24    HA   ALA   6           HA       ALA   6  15.238  14.594  -4.836
   25    HB1  ALA   6           HB1      ALA   6  15.943  13.120  -6.745
   26    HB2  ALA   6           HB2      ALA   6  14.799  11.858  -6.213
   27    HB3  ALA   6           HB3      ALA   6  14.205  13.435  -6.775
   28    H    ARG   7           H        ARG   7  14.518  12.319  -2.570
   29    HA   ARG   7           HA       ARG   7  11.663  13.429  -2.264
   30    HB2  ARG   7           HB2      ARG   7  12.648  10.617  -1.438
   31    HB3  ARG   7           HB3      ARG   7  11.107  11.293  -0.979
   32    HG2  ARG   7           HG2      ARG   7  11.964  10.710  -3.892
   33    HG3  ARG   7           HG3      ARG   7  11.020   9.639  -2.869
   34    HD2  ARG   7           HD2      ARG   7   9.192  11.321  -2.657
   35    HD3  ARG   7           HD3      ARG   7  10.104  12.511  -3.566
   36   HH11  ARG   7          HH11      ARG   7  11.016  12.589  -5.427
   37   HH12  ARG   7          HH12      ARG   7  10.598  12.501  -7.215
   38   HH21  ARG   7          HH21      ARG   7   8.321  10.050  -6.651
   39   HH22  ARG   7          HH22      ARG   7   9.134  11.178  -7.854
   40    H    CYS   8           H        CYS   8  13.937  11.689  -0.122
   41    HA   CYS   8           HA       CYS   8  13.639  13.843   2.028
   42    HB2  CYS   8           HB2      CYS   8  13.189  11.561   2.691
   43    HB3  CYS   8           HB3      CYS   8  14.624  10.917   1.891
   44    H    ALA   9           H        ALA   9  15.045  15.500   1.695
   45    HA   ALA   9           HA       ALA   9  17.328  15.266  -0.055
   46    HB1  ALA   9           HB1      ALA   9  17.452  17.700   0.220
   47    HB2  ALA   9           HB2      ALA   9  15.758  17.221   0.149
   48    HB3  ALA   9           HB3      ALA   9  16.499  17.641   1.717
   49    H    TRP  10           H        TRP  10  18.809  17.337   1.847
   50    HA   TRP  10           HA       TRP  10  20.844  15.282   2.847
   51    HB2  TRP  10           HB2      TRP  10  22.601  16.265   1.389
   52    HB3  TRP  10           HB3      TRP  10  21.339  15.400   0.565
   53    HD1  TRP  10           HD1      TRP  10  22.546  19.058   1.141
   54    HE1  TRP  10           HE1      TRP  10  21.643  20.700  -0.749
   55    HE3  TRP  10           HE3      TRP  10  19.570  15.647  -1.172
   56    HZ2  TRP  10           HZ2      TRP  10  19.711  20.375  -2.799
   57    HZ3  TRP  10           HZ3      TRP  10  18.115  16.392  -3.036
   58    HH2  TRP  10           HH2      TRP  10  18.194  18.710  -3.851
   59    H    ARG  11           H        ARG  11  20.029  18.756   3.056
   60    HA   ARG  11           HA       ARG  11  22.330  19.274   4.921
   61    HB2  ARG  11           HB2      ARG  11  19.917  21.034   4.164
   62    HB3  ARG  11           HB3      ARG  11  21.244  21.539   5.204
   63    HG2  ARG  11           HG2      ARG  11  22.904  21.195   3.372
   64    HG3  ARG  11           HG3      ARG  11  21.602  20.691   2.289
   65    HD2  ARG  11           HD2      ARG  11  20.469  22.941   2.624
   66    HD3  ARG  11           HD3      ARG  11  21.874  23.486   3.561
   67   HH11  ARG  11          HH11      ARG  11  20.292  24.541   1.460
   68   HH12  ARG  11          HH12      ARG  11  20.736  25.374  -0.125
   69   HH21  ARG  11          HH21      ARG  11  23.489  23.444  -0.467
   70   HH22  ARG  11          HH22      ARG  11  22.400  24.765  -1.163
   71    H    CYS  12           H        CYS  12  22.142  18.005   6.710
   72    HA   CYS  12           HA       CYS  12  20.049  18.923   8.788
   73    HB2  CYS  12           HB2      CYS  12  21.136  16.052   8.421
   74    HB3  CYS  12           HB3      CYS  12  20.298  16.620   9.864
   75    HN1  NH2  13           HN1      NH2  13  22.994  19.919  10.582
   76    HN2  NH2  13           HN2      NH2  13  21.270  20.314  10.084
  Start of MODEL   15
    1    H1   GLY   1           H1       GLY   1  15.276  15.694   8.820
    2    H2   GLY   1           H2       GLY   1  16.866  15.379   8.614
    3    HA2  GLY   1           HA2      GLY   1  15.512  13.657   7.510
    4    HA3  GLY   1           HA3      GLY   1  14.721  14.922   6.583
    5    H    CYS   2           H        CYS   2  17.784  13.272   7.082
    6    HA   CYS   2           HA       CYS   2  18.656  14.046   4.235
    7    HB2  CYS   2           HB2      CYS   2  20.344  13.417   6.723
    8    HB3  CYS   2           HB3      CYS   2  20.982  13.714   5.099
    9    H    CYS   3           H        CYS   3  17.586  12.453   3.211
   10    HA   CYS   3           HA       CYS   3  18.689   9.626   3.401
   11    HB2  CYS   3           HB2      CYS   3  16.261   8.728   3.649
   12    HB3  CYS   3           HB3      CYS   3  17.109   9.379   5.035
   13    H    SER   4           H        SER   4  15.864   9.404   1.637
   14    HA   SER   4           HA       SER   4  17.525   8.829  -0.727
   15    HB2  SER   4           HB2      SER   4  15.635   7.852  -1.733
   16    HB3  SER   4           HB3      SER   4  15.622   7.413  -0.040
   17    HG   SER   4           HG       SER   4  13.965   8.927   0.340
   18    H    ASP   5           H        ASP   5  18.457  10.600  -1.410
   19    HA   ASP   5           HA       ASP   5  18.155  13.101  -1.434
   20    HB2  ASP   5           HB2      ASP   5  19.938  11.672  -2.675
   21    HB3  ASP   5           HB3      ASP   5  19.042  11.968  -4.148
   22    HD2  ASP   5           HD2      ASP   5  20.534  14.988  -4.566
   23    H    ALA   6           H        ALA   6  16.510  11.942  -4.451
   24    HA   ALA   6           HA       ALA   6  15.318  14.604  -5.019
   25    HB1  ALA   6           HB1      ALA   6  15.689  12.898  -6.783
   26    HB2  ALA   6           HB2      ALA   6  14.522  11.787  -6.016
   27    HB3  ALA   6           HB3      ALA   6  13.972  13.328  -6.711
   28    H    ARG   7           H        ARG   7  14.084  11.923  -3.137
   29    HA   ARG   7           HA       ARG   7  11.387  13.267  -2.611
   30    HB2  ARG   7           HB2      ARG   7  12.499  10.575  -1.595
   31    HB3  ARG   7           HB3      ARG   7  10.903  11.184  -1.256
   32    HG2  ARG   7           HG2      ARG   7  11.942  10.375  -4.049
   33    HG3  ARG   7           HG3      ARG   7  10.876   9.427  -3.029
   34    HD2  ARG   7           HD2      ARG   7   9.075  11.121  -3.175
   35    HD3  ARG   7           HD3      ARG   7  10.093  12.240  -4.062
   36   HH11  ARG   7          HH11      ARG   7  11.247  12.144  -5.784
   37   HH12  ARG   7          HH12      ARG   7  11.157  11.817  -7.600
   38   HH21  ARG   7          HH21      ARG   7   8.742   9.483  -7.147
   39   HH22  ARG   7          HH22      ARG   7   9.875  10.378  -8.302
   40    H    CYS   8           H        CYS   8  14.299  12.341  -0.772
   41    HA   CYS   8           HA       CYS   8  13.429  14.175   1.551
   42    HB2  CYS   8           HB2      CYS   8  13.234  11.885   2.234
   43    HB3  CYS   8           HB3      CYS   8  14.736  11.389   1.445
   44    H    ALA   9           H        ALA   9  14.889  15.610   2.300
   45    HA   ALA   9           HA       ALA   9  16.911  16.499   0.350
   46    HB1  ALA   9           HB1      ALA   9  16.844  18.538   1.778
   47    HB2  ALA   9           HB2      ALA   9  15.217  17.940   1.509
   48    HB3  ALA   9           HB3      ALA   9  16.022  17.656   3.080
   49    H    TRP  10           H        TRP  10  18.697  17.856   2.212
   50    HA   TRP  10           HA       TRP  10  20.665  15.693   3.040
   51    HB2  TRP  10           HB2      TRP  10  22.268  16.293   1.224
   52    HB3  TRP  10           HB3      TRP  10  20.798  15.597   0.630
   53    HD1  TRP  10           HD1      TRP  10  22.328  19.215   1.039
   54    HE1  TRP  10           HE1      TRP  10  21.654  20.754  -1.025
   55    HE3  TRP  10           HE3      TRP  10  19.146  15.890  -1.129
   56    HZ2  TRP  10           HZ2      TRP  10  20.007  20.319  -3.299
   57    HZ3  TRP  10           HZ3      TRP  10  18.050  16.494  -3.265
   58    HH2  TRP  10           HH2      TRP  10  18.477  18.660  -4.330
   59    H    ARG  11           H        ARG  11  19.695  18.098   4.552
   60    HA   ARG  11           HA       ARG  11  22.503  18.923   5.468
   61    HB2  ARG  11           HB2      ARG  11  20.292  21.007   5.025
   62    HB3  ARG  11           HB3      ARG  11  21.846  21.288   5.780
   63    HG2  ARG  11           HG2      ARG  11  22.998  20.614   3.568
   64    HG3  ARG  11           HG3      ARG  11  21.399  20.475   2.843
   65    HD2  ARG  11           HD2      ARG  11  20.937  22.931   3.547
   66    HD3  ARG  11           HD3      ARG  11  22.612  23.029   4.052
   67   HH11  ARG  11          HH11      ARG  11  19.940  22.436   1.829
   68   HH12  ARG  11          HH12      ARG  11  19.794  22.828   0.037
   69   HH21  ARG  11          HH21      ARG  11  23.114  23.470  -0.137
   70   HH22  ARG  11          HH22      ARG  11  21.483  23.458  -1.001
   71    H    CYS  12           H        CYS  12  22.301  17.599   7.220
   72    HA   CYS  12           HA       CYS  12  20.193  18.337   9.367
   73    HB2  CYS  12           HB2      CYS  12  21.375  15.552   8.737
   74    HB3  CYS  12           HB3      CYS  12  20.185  15.935   9.991
   75    HN1  NH2  13           HN1      NH2  13  22.920  18.946  11.622
   76    HN2  NH2  13           HN2      NH2  13  21.356  19.557  10.865