NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type
622501 5vr1 30291 cing 1-original 2 MR format nomenclature mapping


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ASP   1           H        ASP   1   1.806   0.000   0.856
    2    HA   ASP   1           HA       ASP   1   1.392   0.010  -2.063
    3    HB2  ASP   1           HB2      ASP   1   3.651   1.147  -2.161
    4    HB3  ASP   1           HB3      ASP   1   2.347   2.113  -1.475
    5    H    CYS   2           H        CYS   2   1.325  -2.414  -1.305
    6    HA   CYS   2           HA       CYS   2   3.776  -3.584  -2.212
    7    HB2  CYS   2           HB2      CYS   2   3.791  -5.102  -0.055
    8    HB3  CYS   2           HB3      CYS   2   4.639  -3.559  -0.075
    9    H    CYS   3           H        CYS   3   3.514  -6.160  -1.659
   10    HA   CYS   3           HA       CYS   3   0.740  -6.873  -2.339
   11    HB2  CYS   3           HB2      CYS   3   3.226  -7.395  -3.837
   12    HB3  CYS   3           HB3      CYS   3   2.174  -8.793  -3.638
   13    HA   HYP   4           HA       HYP   4   2.207  -8.007   1.437
   14    HB2  HYP   4           HB2      HYP   4   0.416  -7.707   2.887
   15    HB3  HYP   4           HB3      HYP   4  -0.618  -8.840   2.006
   16    HG   HYP   4           HG       HYP   4  -1.486  -6.825   1.191
   17   HD22  HYP   4           HD2      HYP   4  -0.846  -7.461  -0.950
   18   HD23  HYP   4           HD3      HYP   4   0.469  -6.298  -0.770
   19    HD1  HYP   4           HOD      HYP   4   0.917  -5.547   0.932
   20    H    CYS   5           H        CYS   5   3.490  -9.718   1.661
   21    HA   CYS   5           HA       CYS   5   2.386 -12.421   1.566
   22    HB2  CYS   5           HB2      CYS   5   5.035 -11.215   1.184
   23    HB3  CYS   5           HB3      CYS   5   5.062 -12.707   2.119
   24    HA   HYP   6           HA       HYP   6   1.397 -13.424   4.989
   25    HB2  HYP   6           HB2      HYP   6   1.588 -15.720   5.296
   26    HB3  HYP   6           HB3      HYP   6   3.351 -15.659   5.418
   27    HG   HYP   6           HG       HYP   6   3.154 -16.395   3.206
   28   HD22  HYP   6           HD2      HYP   6   4.240 -14.464   2.508
   29   HD23  HYP   6           HD3      HYP   6   2.649 -13.905   1.987
   30    HD1  HYP   6           HOD      HYP   6   1.045 -14.787   2.542
   31    H    ALA   7           H        ALA   7   4.513 -12.426   5.472
   32    HA   ALA   7           HA       ALA   7   4.636 -12.877   8.332
   33    HB1  ALA   7           HB1      ALA   7   6.796 -12.062   8.257
   34    HB2  ALA   7           HB2      ALA   7   6.615 -12.771   6.653
   35    HB3  ALA   7           HB3      ALA   7   6.470 -11.027   6.867
   36    H    GLY   8           H        GLY   8   4.151 -10.145   6.119
   37    HA2  GLY   8           HA2      GLY   8   2.788  -8.283   6.526
   38    HA3  GLY   8           HA3      GLY   8   2.706  -8.740   8.221
   39    H    ALA   9           H        ALA   9   5.617  -9.006   8.459
   40    HA   ALA   9           HA       ALA   9   6.198  -6.319   9.192
   41    HB1  ALA   9           HB1      ALA   9   8.552  -7.347   9.541
   42    HB2  ALA   9           HB2      ALA   9   7.218  -7.874  10.568
   43    HB3  ALA   9           HB3      ALA   9   7.741  -8.880   9.218
   44    H    VAL  10           H        VAL  10   8.374  -8.319   7.240
   45    HA   VAL  10           HA       VAL  10   8.839  -5.983   5.512
   46    HB   VAL  10           HB       VAL  10  10.800  -6.892   6.762
   47   HG11  VAL  10          HG11      VAL  10  10.773  -9.221   4.879
   48   HG12  VAL  10          HG12      VAL  10  11.678  -9.008   6.379
   49   HG13  VAL  10          HG13      VAL  10   9.941  -9.308   6.431
   50   HG21  VAL  10          HG21      VAL  10  11.731  -7.450   4.101
   51   HG22  VAL  10          HG22      VAL  10  10.604  -6.094   4.084
   52   HG23  VAL  10          HG23      VAL  10  12.031  -6.041   5.118
   53    H    ARG  11           H        ARG  11   7.299  -8.945   5.558
   54    HA   ARG  11           HA       ARG  11   7.836  -9.888   2.937
   55    HB2  ARG  11           HB2      ARG  11   5.846 -10.475   5.062
   56    HB3  ARG  11           HB3      ARG  11   5.418 -10.943   3.422
   57    HG2  ARG  11           HG2      ARG  11   7.885 -11.796   4.924
   58    HG3  ARG  11           HG3      ARG  11   6.458 -12.784   4.607
   59    HD2  ARG  11           HD2      ARG  11   7.374 -11.701   2.140
   60    HD3  ARG  11           HD3      ARG  11   8.751 -12.414   2.980
   61    HE   ARG  11           HE       ARG  11   6.402 -14.085   2.900
   62   HH11  ARG  11          HH11      ARG  11   9.353 -13.168   1.297
   63   HH12  ARG  11          HH12      ARG  11   9.483 -14.649   0.408
   64   HH21  ARG  11          HH21      ARG  11   6.562 -16.039   1.735
   65   HH22  ARG  11          HH22      ARG  11   7.895 -16.281   0.657
   66    H    CYS  12           H        CYS  12   6.159  -7.196   4.028
   67    HA   CYS  12           HA       CYS  12   4.130  -7.126   1.991
   68    HB2  CYS  12           HB2      CYS  12   4.128  -5.986   4.334
   69    HB3  CYS  12           HB3      CYS  12   5.048  -4.717   3.531
   70    H    ARG  13           H        ARG  13   5.572  -7.475   0.161
   71    HA   ARG  13           HA       ARG  13   6.636  -4.927  -0.826
   72    HB2  ARG  13           HB2      ARG  13   8.070  -7.585  -0.897
   73    HB3  ARG  13           HB3      ARG  13   8.550  -6.190  -1.853
   74    HG2  ARG  13           HG2      ARG  13   9.405  -5.082  -0.068
   75    HG3  ARG  13           HG3      ARG  13   8.253  -5.793   1.065
   76    HD2  ARG  13           HD2      ARG  13  10.452  -6.645   1.543
   77    HD3  ARG  13           HD3      ARG  13   9.464  -7.944   0.876
   78    HE   ARG  13           HE       ARG  13  10.752  -6.909  -1.288
   79   HH11  ARG  13          HH11      ARG  13  11.773  -8.174   1.790
   80   HH12  ARG  13          HH12      ARG  13  13.290  -8.760   1.193
   81   HH21  ARG  13          HH21      ARG  13  12.746  -7.677  -2.086
   82   HH22  ARG  13          HH22      ARG  13  13.843  -8.476  -1.012
   83    H    PHE  14           H        PHE  14   6.570  -4.667  -3.079
   84    HA   PHE  14           HA       PHE  14   4.397  -5.893  -4.379
   85    HB2  PHE  14           HB2      PHE  14   5.452  -3.607  -4.854
   86    HB3  PHE  14           HB3      PHE  14   6.651  -4.482  -5.800
   87    HD1  PHE  14           HD1      PHE  14   6.052  -5.555  -7.886
   88    HD2  PHE  14           HD2      PHE  14   3.171  -3.403  -5.608
   89    HE1  PHE  14           HE1      PHE  14   4.542  -5.525  -9.829
   90    HE2  PHE  14           HE2      PHE  14   1.657  -3.372  -7.547
   91    HZ   PHE  14           HZ       PHE  14   2.341  -4.434  -9.661
   92    H    ALA  15           H        ALA  15   7.782  -6.672  -4.240
   93    HA   ALA  15           HA       ALA  15   8.030  -8.271  -6.520
   94    HB1  ALA  15           HB1      ALA  15   9.754  -7.465  -4.653
   95    HB2  ALA  15           HB2      ALA  15   9.484  -9.112  -4.083
   96    HB3  ALA  15           HB3      ALA  15  10.076  -8.832  -5.721
   97    H    CYS  16           H        CYS  16   6.713  -8.968  -3.341
   98    HA   CYS  16           HA       CYS  16   6.635 -11.738  -3.405
   99    HB2  CYS  16           HB2      CYS  16   6.030 -10.647  -1.384
  100    HB3  CYS  16           HB3      CYS  16   4.760  -9.721  -2.177
  101    H    CYS  17           H        CYS  17   4.531  -9.395  -4.958
  102    HA   CYS  17           HA       CYS  17   2.456 -11.124  -5.715
  103    HB2  CYS  17           HB2      CYS  17   3.294  -8.419  -6.311
  104    HB3  CYS  17           HB3      CYS  17   2.701  -9.222  -7.761
  105    HN1  NH2  18           H1       NH2  18   2.560 -12.869  -6.951
  106    HN2  NH2  18           H2       NH2  18   3.579 -13.151  -8.292
  Start of MODEL    2
    1    H1   ASP   1           H        ASP   1   3.376   1.818  -1.075
    2    HA   ASP   1           HA       ASP   1   1.399  -0.118  -0.213
    3    HB2  ASP   1           HB2      ASP   1   2.297   0.855  -2.925
    4    HB3  ASP   1           HB3      ASP   1   1.135  -0.454  -2.725
    5    H    CYS   2           H        CYS   2   1.396  -2.329  -1.054
    6    HA   CYS   2           HA       CYS   2   3.832  -3.487  -2.019
    7    HB2  CYS   2           HB2      CYS   2   3.833  -5.071   0.102
    8    HB3  CYS   2           HB3      CYS   2   4.721  -3.551   0.101
    9    H    CYS   3           H        CYS   3   3.556  -6.077  -1.537
   10    HA   CYS   3           HA       CYS   3   0.773  -6.750  -2.220
   11    HB2  CYS   3           HB2      CYS   3   3.287  -7.379  -3.687
   12    HB3  CYS   3           HB3      CYS   3   2.047  -8.627  -3.629
   13    HA   HYP   4           HA       HYP   4   2.277  -8.000   1.512
   14    HB2  HYP   4           HB2      HYP   4   0.512  -7.711   2.995
   15    HB3  HYP   4           HB3      HYP   4  -0.553  -8.802   2.099
   16    HG   HYP   4           HG       HYP   4  -1.399  -6.753   1.351
   17   HD22  HYP   4           HD2      HYP   4  -0.801  -7.341  -0.815
   18   HD23  HYP   4           HD3      HYP   4   0.536  -6.205  -0.624
   19    HD1  HYP   4           HOD      HYP   4   1.020  -5.507   1.091
   20    H    CYS   5           H        CYS   5   3.499  -9.711   1.864
   21    HA   CYS   5           HA       CYS   5   2.347 -12.401   1.670
   22    HB2  CYS   5           HB2      CYS   5   5.091 -11.279   1.408
   23    HB3  CYS   5           HB3      CYS   5   4.944 -12.910   2.055
   24    HA   HYP   6           HA       HYP   6   1.364 -13.318   5.126
   25    HB2  HYP   6           HB2      HYP   6   1.377 -15.625   5.403
   26    HB3  HYP   6           HB3      HYP   6   3.143 -15.710   5.461
   27    HG   HYP   6           HG       HYP   6   2.805 -16.400   3.251
   28   HD22  HYP   6           HD2      HYP   6   4.020 -14.556   2.531
   29   HD23  HYP   6           HD3      HYP   6   2.463 -13.862   2.075
   30    HD1  HYP   6           HOD      HYP   6   0.813 -14.617   2.681
   31    H    ALA   7           H        ALA   7   4.568 -12.585   5.503
   32    HA   ALA   7           HA       ALA   7   4.812 -13.114   8.330
   33    HB1  ALA   7           HB1      ALA   7   6.987 -12.354   8.164
   34    HB2  ALA   7           HB2      ALA   7   6.694 -12.988   6.544
   35    HB3  ALA   7           HB3      ALA   7   6.612 -11.251   6.839
   36    H    GLY   8           H        GLY   8   4.286 -10.274   6.266
   37    HA2  GLY   8           HA2      GLY   8   3.010  -8.392   6.825
   38    HA3  GLY   8           HA3      GLY   8   2.993  -8.927   8.498
   39    H    ALA   9           H        ALA   9   5.908  -9.291   8.570
   40    HA   ALA   9           HA       ALA   9   6.611  -6.679   9.430
   41    HB1  ALA   9           HB1      ALA   9   8.989  -7.895   9.381
   42    HB2  ALA   9           HB2      ALA   9   7.792  -8.184  10.644
   43    HB3  ALA   9           HB3      ALA   9   7.946  -9.315   9.300
   44    H    VAL  10           H        VAL  10   8.599  -8.574   7.194
   45    HA   VAL  10           HA       VAL  10   8.943  -6.139   5.572
   46    HB   VAL  10           HB       VAL  10  10.987  -7.053   6.709
   47   HG11  VAL  10          HG11      VAL  10  10.625  -9.314   4.745
   48   HG12  VAL  10          HG12      VAL  10  12.027  -9.059   5.786
   49   HG13  VAL  10          HG13      VAL  10  10.456  -9.429   6.497
   50   HG21  VAL  10          HG21      VAL  10  10.948  -5.676   4.575
   51   HG22  VAL  10          HG22      VAL  10  12.412  -6.608   4.885
   52   HG23  VAL  10          HG23      VAL  10  11.228  -7.191   3.716
   53    H    ARG  11           H        ARG  11   7.374  -9.031   5.565
   54    HA   ARG  11           HA       ARG  11   7.865  -9.960   2.924
   55    HB2  ARG  11           HB2      ARG  11   5.936 -10.557   5.090
   56    HB3  ARG  11           HB3      ARG  11   5.412 -10.947   3.457
   57    HG2  ARG  11           HG2      ARG  11   7.924 -11.936   4.791
   58    HG3  ARG  11           HG3      ARG  11   6.445 -12.864   4.532
   59    HD2  ARG  11           HD2      ARG  11   7.149 -11.806   2.031
   60    HD3  ARG  11           HD3      ARG  11   8.647 -12.401   2.745
   61    HE   ARG  11           HE       ARG  11   6.525 -13.970   1.711
   62   HH11  ARG  11          HH11      ARG  11   8.896 -13.875   4.258
   63   HH12  ARG  11          HH12      ARG  11   8.973 -15.598   4.428
   64   HH21  ARG  11          HH21      ARG  11   6.618 -16.239   1.925
   65   HH22  ARG  11          HH22      ARG  11   7.678 -16.941   3.099
   66    H    CYS  12           H        CYS  12   6.291  -7.238   4.066
   67    HA   CYS  12           HA       CYS  12   4.215  -7.098   2.076
   68    HB2  CYS  12           HB2      CYS  12   4.338  -5.972   4.444
   69    HB3  CYS  12           HB3      CYS  12   5.205  -4.705   3.582
   70    H    ARG  13           H        ARG  13   5.568  -7.447   0.196
   71    HA   ARG  13           HA       ARG  13   6.711  -4.925  -0.770
   72    HB2  ARG  13           HB2      ARG  13   8.023  -7.636  -1.046
   73    HB3  ARG  13           HB3      ARG  13   8.571  -6.162  -1.834
   74    HG2  ARG  13           HG2      ARG  13   9.455  -5.302   0.073
   75    HG3  ARG  13           HG3      ARG  13   8.276  -6.104   1.113
   76    HD2  ARG  13           HD2      ARG  13  10.436  -7.091   1.482
   77    HD3  ARG  13           HD3      ARG  13   9.409  -8.260   0.653
   78    HE   ARG  13           HE       ARG  13  10.739  -7.019  -1.364
   79   HH11  ARG  13          HH11      ARG  13  11.725  -8.640   1.554
   80   HH12  ARG  13          HH12      ARG  13  13.234  -9.184   0.897
   81   HH21  ARG  13          HH21      ARG  13  12.721  -7.729  -2.241
   82   HH22  ARG  13          HH22      ARG  13  13.800  -8.664  -1.261
   83    H    PHE  14           H        PHE  14   6.522  -4.574  -2.985
   84    HA   PHE  14           HA       PHE  14   4.293  -5.763  -4.243
   85    HB2  PHE  14           HB2      PHE  14   4.926  -3.486  -4.766
   86    HB3  PHE  14           HB3      PHE  14   6.493  -4.019  -5.365
   87    HD1  PHE  14           HD1      PHE  14   2.848  -4.299  -5.997
   88    HD2  PHE  14           HD2      PHE  14   6.778  -4.564  -7.608
   89    HE1  PHE  14           HE1      PHE  14   1.902  -4.516  -8.258
   90    HE2  PHE  14           HE2      PHE  14   5.839  -4.780  -9.872
   91    HZ   PHE  14           HZ       PHE  14   3.399  -4.756 -10.199
   92    H    ALA  15           H        ALA  15   7.676  -6.510  -4.250
   93    HA   ALA  15           HA       ALA  15   7.909  -7.934  -6.639
   94    HB1  ALA  15           HB1      ALA  15   9.745  -7.255  -5.017
   95    HB2  ALA  15           HB2      ALA  15   9.328  -8.707  -4.106
   96    HB3  ALA  15           HB3      ALA  15   9.895  -8.843  -5.771
   97    H    CYS  16           H        CYS  16   6.500  -8.830  -3.571
   98    HA   CYS  16           HA       CYS  16   6.447 -11.606  -3.835
   99    HB2  CYS  16           HB2      CYS  16   5.261  -9.638  -2.129
  100    HB3  CYS  16           HB3      CYS  16   4.021 -10.794  -2.602
  101    H    CYS  17           H        CYS  17   4.302  -9.137  -5.140
  102    HA   CYS  17           HA       CYS  17   2.229 -10.770  -6.043
  103    HB2  CYS  17           HB2      CYS  17   3.191  -8.055  -6.576
  104    HB3  CYS  17           HB3      CYS  17   2.384  -8.792  -7.956
  105    HN1  NH2  18           H1       NH2  18   5.024  -9.557  -7.901
  106    HN2  NH2  18           H2       NH2  18   5.068 -10.795  -9.076
  Start of MODEL    3
    1    H1   ASP   1           H        ASP   1   2.932   1.797   0.063
    2    HA   ASP   1           HA       ASP   1   1.157  -0.207  -0.706
    3    HB2  ASP   1           HB2      ASP   1   3.250   1.136  -2.429
    4    HB3  ASP   1           HB3      ASP   1   1.804   0.311  -3.003
    5    H    CYS   2           H        CYS   2   1.362  -2.322  -1.014
    6    HA   CYS   2           HA       CYS   2   3.765  -3.515  -2.016
    7    HB2  CYS   2           HB2      CYS   2   3.807  -5.089   0.099
    8    HB3  CYS   2           HB3      CYS   2   4.683  -3.562   0.098
    9    H    CYS   3           H        CYS   3   3.466  -6.099  -1.522
   10    HA   CYS   3           HA       CYS   3   0.661  -6.740  -2.147
   11    HB2  CYS   3           HB2      CYS   3   2.146  -6.730  -4.185
   12    HB3  CYS   3           HB3      CYS   3   3.046  -8.056  -3.456
   13    HA   HYP   4           HA       HYP   4   2.203  -8.000   1.558
   14    HB2  HYP   4           HB2      HYP   4   0.457  -7.703   3.063
   15    HB3  HYP   4           HB3      HYP   4  -0.623  -8.791   2.181
   16    HG   HYP   4           HG       HYP   4  -1.470  -6.739   1.441
   17   HD22  HYP   4           HD2      HYP   4  -0.900  -7.332  -0.731
   18   HD23  HYP   4           HD3      HYP   4   0.443  -6.201  -0.557
   19    HD1  HYP   4           HOD      HYP   4   0.951  -5.503   1.151
   20    H    CYS   5           H        CYS   5   3.461  -9.750   1.652
   21    HA   CYS   5           HA       CYS   5   2.297 -12.423   1.538
   22    HB2  CYS   5           HB2      CYS   5   4.961 -11.262   1.112
   23    HB3  CYS   5           HB3      CYS   5   4.978 -12.788   1.990
   24    HA   HYP   6           HA       HYP   6   1.394 -13.494   4.965
   25    HB2  HYP   6           HB2      HYP   6   1.538 -15.801   5.203
   26    HB3  HYP   6           HB3      HYP   6   3.306 -15.786   5.268
   27    HG   HYP   6           HG       HYP   6   3.017 -16.456   3.045
   28   HD22  HYP   6           HD2      HYP   6   4.127 -14.533   2.362
   29   HD23  HYP   6           HD3      HYP   6   2.534 -13.921   1.910
   30    HD1  HYP   6           HOD      HYP   6   0.927 -14.780   2.496
   31    H    ALA   7           H        ALA   7   4.548 -12.585   5.369
   32    HA   ALA   7           HA       ALA   7   4.762 -13.121   8.207
   33    HB1  ALA   7           HB1      ALA   7   6.576 -11.252   6.745
   34    HB2  ALA   7           HB2      ALA   7   6.934 -12.352   8.076
   35    HB3  ALA   7           HB3      ALA   7   6.678 -12.988   6.451
   36    H    GLY   8           H        GLY   8   4.246 -10.313   6.099
   37    HA2  GLY   8           HA2      GLY   8   2.920  -8.449   6.618
   38    HA3  GLY   8           HA3      GLY   8   2.915  -8.949   8.303
   39    H    ALA   9           H        ALA   9   5.824  -9.257   8.404
   40    HA   ALA   9           HA       ALA   9   6.478  -6.592   9.159
   41    HB1  ALA   9           HB1      ALA   9   8.765  -7.568   9.551
   42    HB2  ALA   9           HB2      ALA   9   7.445  -8.354  10.418
   43    HB3  ALA   9           HB3      ALA   9   8.122  -9.106   8.974
   44    H    VAL  10           H        VAL  10   8.562  -8.582   7.106
   45    HA   VAL  10           HA       VAL  10   9.012  -6.227   5.408
   46    HB   VAL  10           HB       VAL  10  10.709  -8.717   5.587
   47   HG11  VAL  10          HG11      VAL  10  12.187  -6.476   4.758
   48   HG12  VAL  10          HG12      VAL  10  11.727  -7.884   3.798
   49   HG13  VAL  10          HG13      VAL  10  10.690  -6.457   3.826
   50   HG21  VAL  10          HG21      VAL  10  12.222  -7.449   6.992
   51   HG22  VAL  10          HG22      VAL  10  11.155  -6.047   6.920
   52   HG23  VAL  10          HG23      VAL  10  10.626  -7.516   7.740
   53    H    ARG  11           H        ARG  11   7.467  -9.225   5.439
   54    HA   ARG  11           HA       ARG  11   7.811 -10.071   2.773
   55    HB2  ARG  11           HB2      ARG  11   5.908 -10.654   4.974
   56    HB3  ARG  11           HB3      ARG  11   5.370 -11.043   3.345
   57    HG2  ARG  11           HG2      ARG  11   7.890 -12.044   4.654
   58    HG3  ARG  11           HG3      ARG  11   6.401 -12.962   4.425
   59    HD2  ARG  11           HD2      ARG  11   7.080 -11.920   1.907
   60    HD3  ARG  11           HD3      ARG  11   8.578 -12.537   2.603
   61    HE   ARG  11           HE       ARG  11   6.395 -14.074   1.624
   62   HH11  ARG  11          HH11      ARG  11   8.880 -14.014   4.062
   63   HH12  ARG  11          HH12      ARG  11   8.950 -15.738   4.218
   64   HH21  ARG  11          HH21      ARG  11   6.478 -16.345   1.821
   65   HH22  ARG  11          HH22      ARG  11   7.584 -17.063   2.943
   66    H    CYS  12           H        CYS  12   6.212  -7.386   4.046
   67    HA   CYS  12           HA       CYS  12   4.140  -7.183   2.065
   68    HB2  CYS  12           HB2      CYS  12   4.204  -6.154   4.449
   69    HB3  CYS  12           HB3      CYS  12   5.153  -4.874   3.700
   70    H    ARG  13           H        ARG  13   5.654  -7.527   0.236
   71    HA   ARG  13           HA       ARG  13   6.697  -4.940  -0.687
   72    HB2  ARG  13           HB2      ARG  13   8.077  -7.609  -1.027
   73    HB3  ARG  13           HB3      ARG  13   8.608  -6.089  -1.733
   74    HG2  ARG  13           HG2      ARG  13   9.279  -5.226   0.311
   75    HG3  ARG  13           HG3      ARG  13   8.278  -6.355   1.226
   76    HD2  ARG  13           HD2      ARG  13  10.616  -6.964   1.418
   77    HD3  ARG  13           HD3      ARG  13   9.737  -8.199   0.518
   78    HE   ARG  13           HE       ARG  13  10.738  -6.544  -1.404
   79   HH11  ARG  13          HH11      ARG  13  12.107  -8.355   1.236
   80   HH12  ARG  13          HH12      ARG  13  13.629  -8.604   0.447
   81   HH21  ARG  13          HH21      ARG  13  12.738  -6.866  -2.453
   82   HH22  ARG  13          HH22      ARG  13  13.987  -7.755  -1.651
   83    H    PHE  14           H        PHE  14   6.609  -4.594  -2.932
   84    HA   PHE  14           HA       PHE  14   4.383  -5.711  -4.238
   85    HB2  PHE  14           HB2      PHE  14   5.172  -3.473  -4.772
   86    HB3  PHE  14           HB3      PHE  14   6.699  -4.122  -5.359
   87    HD1  PHE  14           HD1      PHE  14   3.035  -4.283  -5.977
   88    HD2  PHE  14           HD2      PHE  14   6.954  -4.603  -7.606
   89    HE1  PHE  14           HE1      PHE  14   2.077  -4.474  -8.236
   90    HE2  PHE  14           HE2      PHE  14   6.003  -4.794  -9.867
   91    HZ   PHE  14           HZ       PHE  14   3.562  -4.728 -10.184
   92    H    ALA  15           H        ALA  15   7.735  -6.605  -4.163
   93    HA   ALA  15           HA       ALA  15   7.912  -8.115  -6.512
   94    HB1  ALA  15           HB1      ALA  15   9.345  -8.333  -3.878
   95    HB2  ALA  15           HB2      ALA  15   9.729  -9.359  -5.261
   96    HB3  ALA  15           HB3      ALA  15   9.920  -7.610  -5.380
   97    H    CYS  16           H        CYS  16   6.629  -8.906  -3.339
   98    HA   CYS  16           HA       CYS  16   6.460 -11.660  -3.496
   99    HB2  CYS  16           HB2      CYS  16   5.880 -10.591  -1.447
  100    HB3  CYS  16           HB3      CYS  16   4.612  -9.646  -2.220
  101    H    CYS  17           H        CYS  17   4.456  -9.221  -5.017
  102    HA   CYS  17           HA       CYS  17   2.335 -10.890  -5.826
  103    HB2  CYS  17           HB2      CYS  17   3.194  -8.171  -6.284
  104    HB3  CYS  17           HB3      CYS  17   2.625  -8.895  -7.785
  105    HN1  NH2  18           H1       NH2  18   1.935 -11.988  -7.734
  106    HN2  NH2  18           H2       NH2  18   3.127 -12.433  -8.872
  Start of MODEL    4
    1    H1   ASP   1           H        ASP   1   3.459   1.689  -0.221
    2    HA   ASP   1           HA       ASP   1   1.442  -0.244  -0.788
    3    HB2  ASP   1           HB2      ASP   1   3.478   0.863  -2.726
    4    HB3  ASP   1           HB3      ASP   1   1.888   0.203  -3.099
    5    H    CYS   2           H        CYS   2   1.606  -2.369  -1.139
    6    HA   CYS   2           HA       CYS   2   4.016  -3.613  -2.059
    7    HB2  CYS   2           HB2      CYS   2   3.964  -5.160   0.080
    8    HB3  CYS   2           HB3      CYS   2   4.878  -3.655   0.076
    9    H    CYS   3           H        CYS   3   3.662  -6.185  -1.543
   10    HA   CYS   3           HA       CYS   3   0.865  -6.790  -2.236
   11    HB2  CYS   3           HB2      CYS   3   2.431  -6.826  -4.226
   12    HB3  CYS   3           HB3      CYS   3   3.249  -8.183  -3.459
   13    HA   HYP   4           HA       HYP   4   2.298  -8.028   1.523
   14    HB2  HYP   4           HB2      HYP   4   0.524  -7.679   2.983
   15    HB3  HYP   4           HB3      HYP   4  -0.556  -8.757   2.090
   16    HG   HYP   4           HG       HYP   4  -1.346  -6.699   1.306
   17   HD22  HYP   4           HD2      HYP   4  -0.738  -7.330  -0.846
   18   HD23  HYP   4           HD3      HYP   4   0.622  -6.222  -0.654
   19    HD1  HYP   4           HOD      HYP   4   1.104  -5.513   1.056
   20    H    CYS   5           H        CYS   5   3.501  -9.780   1.798
   21    HA   CYS   5           HA       CYS   5   2.286 -12.439   1.657
   22    HB2  CYS   5           HB2      CYS   5   5.047 -11.368   1.407
   23    HB3  CYS   5           HB3      CYS   5   4.877 -12.981   2.092
   24    HA   HYP   6           HA       HYP   6   1.245 -13.326   5.103
   25    HB2  HYP   6           HB2      HYP   6   1.222 -15.631   5.394
   26    HB3  HYP   6           HB3      HYP   6   2.986 -15.740   5.479
   27    HG   HYP   6           HG       HYP   6   2.672 -16.439   3.268
   28   HD22  HYP   6           HD2      HYP   6   3.922 -14.615   2.555
   29   HD23  HYP   6           HD3      HYP   6   2.381 -13.903   2.072
   30    HD1  HYP   6           HOD      HYP   6   0.712 -14.633   2.658
   31    H    ALA   7           H        ALA   7   4.450 -12.631   5.523
   32    HA   ALA   7           HA       ALA   7   4.640 -13.143   8.358
   33    HB1  ALA   7           HB1      ALA   7   6.831 -12.427   8.223
   34    HB2  ALA   7           HB2      ALA   7   6.553 -13.071   6.604
   35    HB3  ALA   7           HB3      ALA   7   6.501 -11.330   6.882
   36    H    GLY   8           H        GLY   8   4.203 -10.315   6.259
   37    HA2  GLY   8           HA2      GLY   8   2.949  -8.405   6.780
   38    HA3  GLY   8           HA3      GLY   8   2.905  -8.920   8.459
   39    H    ALA   9           H        ALA   9   5.811  -9.333   8.568
   40    HA   ALA   9           HA       ALA   9   6.549  -6.717   9.395
   41    HB1  ALA   9           HB1      ALA   9   8.042  -9.310   9.160
   42    HB2  ALA   9           HB2      ALA   9   8.847  -7.816   9.643
   43    HB3  ALA   9           HB3      ALA   9   7.523  -8.458  10.615
   44    H    VAL  10           H        VAL  10   8.550  -8.693   7.245
   45    HA   VAL  10           HA       VAL  10   8.990  -6.298   5.590
   46    HB   VAL  10           HB       VAL  10  10.986  -7.270   6.747
   47   HG11  VAL  10          HG11      VAL  10  10.532  -9.568   4.847
   48   HG12  VAL  10          HG12      VAL  10  11.944  -9.345   5.882
   49   HG13  VAL  10          HG13      VAL  10  10.357  -9.625   6.600
   50   HG21  VAL  10          HG21      VAL  10  10.992  -5.968   4.547
   51   HG22  VAL  10          HG22      VAL  10  12.435  -6.902   4.941
   52   HG23  VAL  10          HG23      VAL  10  11.274  -7.526   3.769
   53    H    ARG  11           H        ARG  11   7.374  -9.195   5.598
   54    HA   ARG  11           HA       ARG  11   7.830 -10.125   2.960
   55    HB2  ARG  11           HB2      ARG  11   5.868 -10.658   5.116
   56    HB3  ARG  11           HB3      ARG  11   5.354 -11.052   3.481
   57    HG2  ARG  11           HG2      ARG  11   7.829 -12.084   4.850
   58    HG3  ARG  11           HG3      ARG  11   6.332 -12.980   4.589
   59    HD2  ARG  11           HD2      ARG  11   7.083 -11.965   2.082
   60    HD3  ARG  11           HD3      ARG  11   8.558 -12.593   2.817
   61    HE   ARG  11           HE       ARG  11   6.412 -14.115   1.771
   62   HH11  ARG  11          HH11      ARG  11   8.732 -14.057   4.366
   63   HH12  ARG  11          HH12      ARG  11   8.754 -15.778   4.559
   64   HH21  ARG  11          HH21      ARG  11   6.432 -16.383   2.016
   65   HH22  ARG  11          HH22      ARG  11   7.447 -17.101   3.221
   66    H    CYS  12           H        CYS  12   6.277  -7.379   4.112
   67    HA   CYS  12           HA       CYS  12   4.242  -7.190   2.086
   68    HB2  CYS  12           HB2      CYS  12   4.300  -6.097   4.454
   69    HB3  CYS  12           HB3      CYS  12   5.255  -4.846   3.664
   70    H    ARG  13           H        ARG  13   5.590  -7.524   0.213
   71    HA   ARG  13           HA       ARG  13   6.750  -5.009  -0.730
   72    HB2  ARG  13           HB2      ARG  13   8.145  -7.668  -1.072
   73    HB3  ARG  13           HB3      ARG  13   8.718  -6.099  -1.621
   74    HG2  ARG  13           HG2      ARG  13   9.162  -5.376   0.572
   75    HG3  ARG  13           HG3      ARG  13   8.237  -6.702   1.279
   76    HD2  ARG  13           HD2      ARG  13  10.753  -6.925   1.374
   77    HD3  ARG  13           HD3      ARG  13   9.878  -8.292   0.684
   78    HE   ARG  13           HE       ARG  13  10.860  -7.862  -1.349
   79   HH11  ARG  13          HH11      ARG  13  11.415  -5.188   0.809
   80   HH12  ARG  13          HH12      ARG  13  12.561  -4.414  -0.235
   81   HH21  ARG  13          HH21      ARG  13  12.368  -6.853  -2.732
   82   HH22  ARG  13          HH22      ARG  13  13.101  -5.361  -2.249
   83    H    PHE  14           H        PHE  14   6.650  -4.706  -2.964
   84    HA   PHE  14           HA       PHE  14   4.478  -5.915  -4.280
   85    HB2  PHE  14           HB2      PHE  14   5.419  -3.624  -4.744
   86    HB3  PHE  14           HB3      PHE  14   6.745  -4.411  -5.595
   87    HD1  PHE  14           HD1      PHE  14   6.552  -4.852  -7.853
   88    HD2  PHE  14           HD2      PHE  14   3.030  -4.205  -5.552
   89    HE1  PHE  14           HE1      PHE  14   5.203  -4.899  -9.911
   90    HE2  PHE  14           HE2      PHE  14   1.676  -4.252  -7.606
   91    HZ   PHE  14           HZ       PHE  14   2.762  -4.600  -9.789
   92    H    ALA  15           H        ALA  15   7.866  -6.684  -4.167
   93    HA   ALA  15           HA       ALA  15   8.227  -8.177  -6.461
   94    HB1  ALA  15           HB1      ALA  15   9.348  -8.701  -3.711
   95    HB2  ALA  15           HB2      ALA  15   9.952  -9.411  -5.209
   96    HB3  ALA  15           HB3      ALA  15  10.052  -7.668  -4.956
   97    H    CYS  16           H        CYS  16   6.581  -9.053  -3.485
   98    HA   CYS  16           HA       CYS  16   6.385 -11.811  -3.847
   99    HB2  CYS  16           HB2      CYS  16   5.151  -9.799  -2.174
  100    HB3  CYS  16           HB3      CYS  16   3.969 -11.006  -2.670
  101    H    CYS  17           H        CYS  17   4.506  -9.180  -5.213
  102    HA   CYS  17           HA       CYS  17   2.416 -10.762  -6.285
  103    HB2  CYS  17           HB2      CYS  17   3.279  -7.982  -6.410
  104    HB3  CYS  17           HB3      CYS  17   2.631  -8.547  -7.946
  105    HN1  NH2  18           H1       NH2  18   2.111 -11.609  -8.329
  106    HN2  NH2  18           H2       NH2  18   3.349 -11.862  -9.478
  Start of MODEL    5
    1    H1   ASP   1           H        ASP   1   3.253   1.744  -1.593
    2    HA   ASP   1           HA       ASP   1   1.586  -0.008   0.018
    3    HB2  ASP   1           HB2      ASP   1   0.677  -0.730  -2.199
    4    HB3  ASP   1           HB3      ASP   1   0.523   0.998  -1.893
    5    H    CYS   2           H        CYS   2   1.382  -2.336  -1.006
    6    HA   CYS   2           HA       CYS   2   3.820  -3.503  -1.954
    7    HB2  CYS   2           HB2      CYS   2   3.825  -5.075   0.167
    8    HB3  CYS   2           HB3      CYS   2   4.695  -3.545   0.176
    9    H    CYS   3           H        CYS   3   3.539  -6.090  -1.465
   10    HA   CYS   3           HA       CYS   3   0.757  -6.763  -2.148
   11    HB2  CYS   3           HB2      CYS   3   2.307  -6.732  -4.149
   12    HB3  CYS   3           HB3      CYS   3   3.170  -8.074  -3.404
   13    HA   HYP   4           HA       HYP   4   2.249  -8.006   1.587
   14    HB2  HYP   4           HB2      HYP   4   0.477  -7.724   3.063
   15    HB3  HYP   4           HB3      HYP   4  -0.580  -8.821   2.164
   16    HG   HYP   4           HG       HYP   4  -1.432  -6.777   1.410
   17   HD22  HYP   4           HD2      HYP   4  -0.822  -7.365  -0.753
   18   HD23  HYP   4           HD3      HYP   4   0.509  -6.222  -0.558
   19    HD1  HYP   4           HOD      HYP   4   0.983  -5.520   1.158
   20    H    CYS   5           H        CYS   5   3.507  -9.731   1.802
   21    HA   CYS   5           HA       CYS   5   2.364 -12.419   1.648
   22    HB2  CYS   5           HB2      CYS   5   5.089 -11.266   1.380
   23    HB3  CYS   5           HB3      CYS   5   4.977 -12.888   2.057
   24    HA   HYP   6           HA       HYP   6   1.382 -13.386   5.089
   25    HB2  HYP   6           HB2      HYP   6   1.434 -15.695   5.349
   26    HB3  HYP   6           HB3      HYP   6   3.200 -15.750   5.418
   27    HG   HYP   6           HG       HYP   6   2.890 -16.428   3.200
   28   HD22  HYP   6           HD2      HYP   6   4.076 -14.557   2.502
   29   HD23  HYP   6           HD3      HYP   6   2.510 -13.888   2.041
   30    HD1  HYP   6           HOD      HYP   6   0.870 -14.677   2.631
   31    H    ALA   7           H        ALA   7   4.566 -12.594   5.492
   32    HA   ALA   7           HA       ALA   7   4.792 -13.136   8.321
   33    HB1  ALA   7           HB1      ALA   7   6.592 -11.257   6.849
   34    HB2  ALA   7           HB2      ALA   7   6.963 -12.356   8.178
   35    HB3  ALA   7           HB3      ALA   7   6.691 -12.993   6.556
   36    H    GLY   8           H        GLY   8   4.265 -10.298   6.255
   37    HA2  GLY   8           HA2      GLY   8   2.961  -8.431   6.806
   38    HA3  GLY   8           HA3      GLY   8   2.945  -8.963   8.481
   39    H    ALA   9           H        ALA   9   5.863  -9.296   8.561
   40    HA   ALA   9           HA       ALA   9   6.535  -6.666   9.405
   41    HB1  ALA   9           HB1      ALA   9   7.690  -8.173  10.652
   42    HB2  ALA   9           HB2      ALA   9   7.912  -9.289   9.304
   43    HB3  ALA   9           HB3      ALA   9   8.916  -7.845   9.428
   44    H    VAL  10           H        VAL  10   8.577  -8.572   7.231
   45    HA   VAL  10           HA       VAL  10   8.950  -6.154   5.595
   46    HB   VAL  10           HB       VAL  10  10.974  -7.100   6.724
   47   HG11  VAL  10          HG11      VAL  10  11.964  -9.146   5.824
   48   HG12  VAL  10          HG12      VAL  10  10.390  -9.466   6.556
   49   HG13  VAL  10          HG13      VAL  10  10.548  -9.386   4.801
   50   HG21  VAL  10          HG21      VAL  10  12.050  -6.059   5.086
   51   HG22  VAL  10          HG22      VAL  10  11.886  -7.483   4.058
   52   HG23  VAL  10          HG23      VAL  10  10.639  -6.236   4.043
   53    H    ARG  11           H        ARG  11   7.402  -9.093   5.585
   54    HA   ARG  11           HA       ARG  11   7.848  -9.974   2.928
   55    HB2  ARG  11           HB2      ARG  11   5.922 -10.584   5.097
   56    HB3  ARG  11           HB3      ARG  11   5.406 -10.974   3.462
   57    HG2  ARG  11           HG2      ARG  11   7.920 -11.953   4.800
   58    HG3  ARG  11           HG3      ARG  11   6.445 -12.887   4.543
   59    HD2  ARG  11           HD2      ARG  11   7.145 -11.827   2.040
   60    HD3  ARG  11           HD3      ARG  11   8.644 -12.421   2.755
   61    HE   ARG  11           HE       ARG  11   6.530 -13.992   1.715
   62   HH11  ARG  11          HH11      ARG  11   8.874 -13.894   4.287
   63   HH12  ARG  11          HH12      ARG  11   8.946 -15.616   4.463
   64   HH21  ARG  11          HH21      ARG  11   6.616 -16.261   1.936
   65   HH22  ARG  11          HH22      ARG  11   7.663 -16.961   3.124
   66    H    CYS  12           H        CYS  12   6.225  -7.292   4.146
   67    HA   CYS  12           HA       CYS  12   4.172  -7.126   2.138
   68    HB2  CYS  12           HB2      CYS  12   4.207  -6.078   4.523
   69    HB3  CYS  12           HB3      CYS  12   5.130  -4.787   3.759
   70    H    ARG  13           H        ARG  13   5.481  -7.369   0.236
   71    HA   ARG  13           HA       ARG  13   6.553  -4.808  -0.672
   72    HB2  ARG  13           HB2      ARG  13   8.072  -7.372  -1.144
   73    HB3  ARG  13           HB3      ARG  13   8.589  -5.730  -1.505
   74    HG2  ARG  13           HG2      ARG  13   8.594  -5.265   0.941
   75    HG3  ARG  13           HG3      ARG  13   8.259  -6.976   1.213
   76    HD2  ARG  13           HD2      ARG  13  10.700  -5.727  -0.020
   77    HD3  ARG  13           HD3      ARG  13  10.598  -6.716   1.436
   78    HE   ARG  13           HE       ARG  13   9.692  -8.308  -0.620
   79   HH11  ARG  13          HH11      ARG  13  12.626  -6.603   0.160
   80   HH12  ARG  13          HH12      ARG  13  13.653  -7.725  -0.670
   81   HH21  ARG  13          HH21      ARG  13  11.034  -9.792  -1.716
   82   HH22  ARG  13          HH22      ARG  13  12.746  -9.538  -1.737
   83    H    PHE  14           H        PHE  14   6.444  -4.491  -2.906
   84    HA   PHE  14           HA       PHE  14   4.320  -5.770  -4.231
   85    HB2  PHE  14           HB2      PHE  14   5.003  -3.480  -4.759
   86    HB3  PHE  14           HB3      PHE  14   6.544  -4.068  -5.375
   87    HD1  PHE  14           HD1      PHE  14   2.899  -4.692  -5.890
   88    HD2  PHE  14           HD2      PHE  14   6.751  -4.249  -7.647
   89    HE1  PHE  14           HE1      PHE  14   1.904  -4.940  -8.127
   90    HE2  PHE  14           HE2      PHE  14   5.761  -4.495  -9.886
   91    HZ   PHE  14           HZ       PHE  14   3.335  -4.840 -10.128
   92    H    ALA  15           H        ALA  15   7.734  -6.417  -4.124
   93    HA   ALA  15           HA       ALA  15   8.154  -7.879  -6.424
   94    HB1  ALA  15           HB1      ALA  15   9.930  -9.037  -5.211
   95    HB2  ALA  15           HB2      ALA  15   9.933  -7.309  -4.857
   96    HB3  ALA  15           HB3      ALA  15   9.275  -8.449  -3.683
   97    H    CYS  16           H        CYS  16   6.528  -8.842  -3.464
   98    HA   CYS  16           HA       CYS  16   6.418 -11.602  -3.874
   99    HB2  CYS  16           HB2      CYS  16   5.153  -9.665  -2.144
  100    HB3  CYS  16           HB3      CYS  16   3.988 -10.879  -2.662
  101    H    CYS  17           H        CYS  17   4.459  -9.000  -5.179
  102    HA   CYS  17           HA       CYS  17   2.404 -10.624  -6.264
  103    HB2  CYS  17           HB2      CYS  17   3.173  -7.817  -6.324
  104    HB3  CYS  17           HB3      CYS  17   2.547  -8.363  -7.876
  105    HN1  NH2  18           H1       NH2  18   5.148  -8.990  -7.858
  106    HN2  NH2  18           H2       NH2  18   5.301 -10.052  -9.187
  Start of MODEL    6
    1    H1   ASP   1           H        ASP   1   3.179   1.905  -0.833
    2    HA   ASP   1           HA       ASP   1   1.320  -0.211  -0.481
    3    HB2  ASP   1           HB2      ASP   1   2.635   0.934  -2.948
    4    HB3  ASP   1           HB3      ASP   1   1.403  -0.323  -3.004
    5    H    CYS   2           H        CYS   2   1.460  -2.379  -1.181
    6    HA   CYS   2           HA       CYS   2   3.938  -3.503  -2.074
    7    HB2  CYS   2           HB2      CYS   2   3.914  -5.074   0.053
    8    HB3  CYS   2           HB3      CYS   2   4.771  -3.536   0.070
    9    H    CYS   3           H        CYS   3   3.690  -6.095  -1.580
   10    HA   CYS   3           HA       CYS   3   0.937  -6.816  -2.334
   11    HB2  CYS   3           HB2      CYS   3   3.486  -7.364  -3.748
   12    HB3  CYS   3           HB3      CYS   3   2.334  -8.693  -3.668
   13    HA   HYP   4           HA       HYP   4   2.353  -8.013   1.449
   14    HB2  HYP   4           HB2      HYP   4   0.542  -7.740   2.880
   15    HB3  HYP   4           HB3      HYP   4  -0.480  -8.854   1.963
   16    HG   HYP   4           HG       HYP   4  -1.336  -6.824   1.174
   17   HD22  HYP   4           HD2      HYP   4  -0.667  -7.420  -0.969
   18   HD23  HYP   4           HD3      HYP   4   0.646  -6.262  -0.750
   19    HD1  HYP   4           HOD      HYP   4   1.071  -5.543   0.972
   20    H    CYS   5           H        CYS   5   3.617  -9.717   1.738
   21    HA   CYS   5           HA       CYS   5   2.501 -12.420   1.578
   22    HB2  CYS   5           HB2      CYS   5   5.230 -11.256   1.354
   23    HB3  CYS   5           HB3      CYS   5   5.099 -12.886   2.007
   24    HA   HYP   6           HA       HYP   6   1.479 -13.340   5.021
   25    HB2  HYP   6           HB2      HYP   6   1.528 -15.646   5.310
   26    HB3  HYP   6           HB3      HYP   6   3.294 -15.699   5.397
   27    HG   HYP   6           HG       HYP   6   3.006 -16.405   3.185
   28   HD22  HYP   6           HD2      HYP   6   4.200 -14.542   2.477
   29   HD23  HYP   6           HD3      HYP   6   2.638 -13.878   1.991
   30    HD1  HYP   6           HOD      HYP   6   0.992 -14.661   2.574
   31    H    ALA   7           H        ALA   7   4.653 -12.533   5.447
   32    HA   ALA   7           HA       ALA   7   4.854 -13.045   8.284
   33    HB1  ALA   7           HB1      ALA   7   7.023 -12.256   8.154
   34    HB2  ALA   7           HB2      ALA   7   6.771 -12.917   6.538
   35    HB3  ALA   7           HB3      ALA   7   6.662 -11.177   6.807
   36    H    GLY   8           H        GLY   8   4.337 -10.231   6.183
   37    HA2  GLY   8           HA2      GLY   8   3.020  -8.363   6.702
   38    HA3  GLY   8           HA3      GLY   8   2.994  -8.876   8.382
   39    H    ALA   9           H        ALA   9   5.912  -9.196   8.488
   40    HA   ALA   9           HA       ALA   9   6.567  -6.555   9.307
   41    HB1  ALA   9           HB1      ALA   9   8.005  -9.158   9.197
   42    HB2  ALA   9           HB2      ALA   9   8.942  -7.680   9.415
   43    HB3  ALA   9           HB3      ALA   9   7.681  -8.102  10.573
   44    H    VAL  10           H        VAL  10   8.641  -8.472   7.176
   45    HA   VAL  10           HA       VAL  10   9.011  -6.073   5.512
   46    HB   VAL  10           HB       VAL  10  11.031  -6.993   6.669
   47   HG11  VAL  10          HG11      VAL  10  12.042  -9.043   5.790
   48   HG12  VAL  10          HG12      VAL  10  10.473  -9.362   6.534
   49   HG13  VAL  10          HG13      VAL  10  10.623  -9.307   4.777
   50   HG21  VAL  10          HG21      VAL  10  11.065  -5.664   4.526
   51   HG22  VAL  10          HG22      VAL  10  12.483  -6.671   4.819
   52   HG23  VAL  10          HG23      VAL  10  11.249  -7.197   3.673
   53    H    ARG  11           H        ARG  11   7.472  -9.014   5.524
   54    HA   ARG  11           HA       ARG  11   7.949  -9.930   2.884
   55    HB2  ARG  11           HB2      ARG  11   6.003 -10.517   5.042
   56    HB3  ARG  11           HB3      ARG  11   5.504 -10.929   3.407
   57    HG2  ARG  11           HG2      ARG  11   8.005 -11.885   4.784
   58    HG3  ARG  11           HG3      ARG  11   6.536 -12.826   4.520
   59    HD2  ARG  11           HD2      ARG  11   7.257 -11.798   2.013
   60    HD3  ARG  11           HD3      ARG  11   8.755 -12.365   2.751
   61    HE   ARG  11           HE       ARG  11   6.669 -13.974   1.711
   62   HH11  ARG  11          HH11      ARG  11   8.984 -13.814   4.306
   63   HH12  ARG  11          HH12      ARG  11   9.073 -15.533   4.507
   64   HH21  ARG  11          HH21      ARG  11   6.777 -16.238   1.966
   65   HH22  ARG  11          HH22      ARG  11   7.817 -16.911   3.175
   66    H    CYS  12           H        CYS  12   6.301  -7.239   4.052
   67    HA   CYS  12           HA       CYS  12   4.274  -7.106   2.013
   68    HB2  CYS  12           HB2      CYS  12   4.288  -6.033   4.398
   69    HB3  CYS  12           HB3      CYS  12   5.180  -4.735   3.611
   70    H    ARG  13           H        ARG  13   5.629  -7.362   0.140
   71    HA   ARG  13           HA       ARG  13   6.713  -4.800  -0.762
   72    HB2  ARG  13           HB2      ARG  13   8.209  -7.373  -1.242
   73    HB3  ARG  13           HB3      ARG  13   8.747  -5.732  -1.573
   74    HG2  ARG  13           HG2      ARG  13   8.720  -5.306   0.884
   75    HG3  ARG  13           HG3      ARG  13   8.381  -7.022   1.119
   76    HD2  ARG  13           HD2      ARG  13  10.838  -5.741  -0.043
   77    HD3  ARG  13           HD3      ARG  13  10.714  -6.787   1.370
   78    HE   ARG  13           HE       ARG  13  10.871  -7.603  -1.390
   79   HH11  ARG  13          HH11      ARG  13   9.946  -8.510   1.841
   80   HH12  ARG  13          HH12      ARG  13  10.069 -10.211   1.539
   81   HH21  ARG  13          HH21      ARG  13  11.037  -9.841  -1.801
   82   HH22  ARG  13          HH22      ARG  13  10.691 -10.967  -0.533
   83    H    PHE  14           H        PHE  14   6.624  -4.476  -2.997
   84    HA   PHE  14           HA       PHE  14   4.504  -5.763  -4.338
   85    HB2  PHE  14           HB2      PHE  14   5.539  -3.396  -4.694
   86    HB3  PHE  14           HB3      PHE  14   6.630  -4.227  -5.797
   87    HD1  PHE  14           HD1      PHE  14   5.608  -5.566  -7.699
   88    HD2  PHE  14           HD2      PHE  14   3.408  -2.756  -5.379
   89    HE1  PHE  14           HE1      PHE  14   3.917  -5.425  -9.480
   90    HE2  PHE  14           HE2      PHE  14   1.713  -2.612  -7.156
   91    HZ   PHE  14           HZ       PHE  14   1.965  -3.948  -9.209
   92    H    ALA  15           H        ALA  15   7.903  -6.399  -4.173
   93    HA   ALA  15           HA       ALA  15   8.310  -7.834  -6.528
   94    HB1  ALA  15           HB1      ALA  15  10.053  -7.106  -4.864
   95    HB2  ALA  15           HB2      ALA  15   9.590  -8.499  -3.887
   96    HB3  ALA  15           HB3      ALA  15  10.248  -8.738  -5.505
   97    H    CYS  16           H        CYS  16   6.773  -8.765  -3.526
   98    HA   CYS  16           HA       CYS  16   6.798 -11.543  -3.810
   99    HB2  CYS  16           HB2      CYS  16   5.546  -9.627  -2.109
  100    HB3  CYS  16           HB3      CYS  16   4.312 -10.757  -2.656
  101    H    CYS  17           H        CYS  17   4.662  -9.105  -5.179
  102    HA   CYS  17           HA       CYS  17   2.664 -10.801  -6.170
  103    HB2  CYS  17           HB2      CYS  17   3.529  -8.031  -6.605
  104    HB3  CYS  17           HB3      CYS  17   2.769  -8.764  -8.014
  105    HN1  NH2  18           H1       NH2  18   2.555 -12.148  -7.858
  106    HN2  NH2  18           H2       NH2  18   3.721 -12.366  -9.086
  Start of MODEL    7
    1    H1   ASP   1           H        ASP   1   3.666   1.527  -1.681
    2    HA   ASP   1           HA       ASP   1   1.717   0.005  -0.080
    3    HB2  ASP   1           HB2      ASP   1   1.866  -0.053  -3.086
    4    HB3  ASP   1           HB3      ASP   1   0.520  -0.508  -2.044
    5    H    CYS   2           H        CYS   2   1.496  -2.329  -1.127
    6    HA   CYS   2           HA       CYS   2   3.941  -3.502  -2.050
    7    HB2  CYS   2           HB2      CYS   2   3.890  -5.088   0.071
    8    HB3  CYS   2           HB3      CYS   2   4.793  -3.577   0.083
    9    H    CYS   3           H        CYS   3   3.639  -6.092  -1.571
   10    HA   CYS   3           HA       CYS   3   0.865  -6.745  -2.311
   11    HB2  CYS   3           HB2      CYS   3   3.394  -7.348  -3.743
   12    HB3  CYS   3           HB3      CYS   3   2.203  -8.643  -3.669
   13    HA   HYP   4           HA       HYP   4   2.289  -7.999   1.453
   14    HB2  HYP   4           HB2      HYP   4   0.500  -7.688   2.904
   15    HB3  HYP   4           HB3      HYP   4  -0.560  -8.770   1.991
   16    HG   HYP   4           HG       HYP   4  -1.370  -6.714   1.224
   17   HD22  HYP   4           HD2      HYP   4  -0.739  -7.313  -0.930
   18   HD23  HYP   4           HD3      HYP   4   0.606  -6.191  -0.717
   19    HD1  HYP   4           HOD      HYP   4   1.067  -5.494   1.005
   20    H    CYS   5           H        CYS   5   3.497  -9.728   1.789
   21    HA   CYS   5           HA       CYS   5   2.313 -12.403   1.601
   22    HB2  CYS   5           HB2      CYS   5   5.072 -11.314   1.363
   23    HB3  CYS   5           HB3      CYS   5   4.899 -12.943   2.008
   24    HA   HYP   6           HA       HYP   6   1.293 -13.305   5.050
   25    HB2  HYP   6           HB2      HYP   6   1.282 -15.612   5.332
   26    HB3  HYP   6           HB3      HYP   6   3.046 -15.714   5.406
   27    HG   HYP   6           HG       HYP   6   2.722 -16.405   3.194
   28   HD22  HYP   6           HD2      HYP   6   3.960 -14.573   2.481
   29   HD23  HYP   6           HD3      HYP   6   2.413 -13.866   2.010
   30    HD1  HYP   6           HOD      HYP   6   0.751 -14.605   2.603
   31    H    ALA   7           H        ALA   7   4.493 -12.590   5.454
   32    HA   ALA   7           HA       ALA   7   4.709 -13.118   8.284
   33    HB1  ALA   7           HB1      ALA   7   6.892 -12.368   8.139
   34    HB2  ALA   7           HB2      ALA   7   6.610 -13.021   6.524
   35    HB3  ALA   7           HB3      ALA   7   6.538 -11.280   6.796
   36    H    GLY   8           H        GLY   8   4.229 -10.280   6.208
   37    HA2  GLY   8           HA2      GLY   8   2.951  -8.392   6.756
   38    HA3  GLY   8           HA3      GLY   8   2.941  -8.913   8.435
   39    H    ALA   9           H        ALA   9   5.853  -9.289   8.495
   40    HA   ALA   9           HA       ALA   9   6.572  -6.665   9.316
   41    HB1  ALA   9           HB1      ALA   9   8.058  -9.255   9.080
   42    HB2  ALA   9           HB2      ALA   9   8.898  -7.759   9.489
   43    HB3  ALA   9           HB3      ALA   9   7.606  -8.357  10.530
   44    H    VAL  10           H        VAL  10   8.586  -8.602   7.149
   45    HA   VAL  10           HA       VAL  10   8.969  -6.201   5.490
   46    HB   VAL  10           HB       VAL  10  10.771  -8.618   5.599
   47   HG11  VAL  10          HG11      VAL  10  11.817  -7.646   3.901
   48   HG12  VAL  10          HG12      VAL  10  10.647  -6.325   3.919
   49   HG13  VAL  10          HG13      VAL  10  12.109  -6.222   4.900
   50   HG21  VAL  10          HG21      VAL  10  11.060  -6.009   7.088
   51   HG22  VAL  10          HG22      VAL  10  10.649  -7.565   7.811
   52   HG23  VAL  10          HG23      VAL  10  12.229  -7.329   7.065
   53    H    ARG  11           H        ARG  11   7.421  -9.153   5.511
   54    HA   ARG  11           HA       ARG  11   7.828 -10.059   2.867
   55    HB2  ARG  11           HB2      ARG  11   5.888 -10.597   5.042
   56    HB3  ARG  11           HB3      ARG  11   5.360 -10.992   3.411
   57    HG2  ARG  11           HG2      ARG  11   7.847 -12.020   4.763
   58    HG3  ARG  11           HG3      ARG  11   6.351 -12.919   4.505
   59    HD2  ARG  11           HD2      ARG  11   7.068 -11.911   1.995
   60    HD3  ARG  11           HD3      ARG  11   8.568 -12.493   2.716
   61    HE   ARG  11           HE       ARG  11   6.436 -14.081   1.722
   62   HH11  ARG  11          HH11      ARG  11   8.850 -13.944   4.226
   63   HH12  ARG  11          HH12      ARG  11   8.939 -15.664   4.415
   64   HH21  ARG  11          HH21      ARG  11   6.544 -16.347   1.961
   65   HH22  ARG  11          HH22      ARG  11   7.628 -17.030   3.125
   66    H    CYS  12           H        CYS  12   6.260  -7.325   4.044
   67    HA   CYS  12           HA       CYS  12   4.213  -7.140   2.034
   68    HB2  CYS  12           HB2      CYS  12   4.312  -6.043   4.409
   69    HB3  CYS  12           HB3      CYS  12   5.220  -4.780   3.584
   70    H    ARG  13           H        ARG  13   5.737  -7.549   0.231
   71    HA   ARG  13           HA       ARG  13   6.867  -5.007  -0.721
   72    HB2  ARG  13           HB2      ARG  13   8.130  -7.740  -1.002
   73    HB3  ARG  13           HB3      ARG  13   8.712  -6.276  -1.783
   74    HG2  ARG  13           HG2      ARG  13   9.498  -5.374   0.184
   75    HG3  ARG  13           HG3      ARG  13   8.409  -6.340   1.183
   76    HD2  ARG  13           HD2      ARG  13  10.656  -7.163   1.442
   77    HD3  ARG  13           HD3      ARG  13   9.702  -8.357   0.564
   78    HE   ARG  13           HE       ARG  13  10.948  -6.756  -1.330
   79   HH11  ARG  13          HH11      ARG  13  11.859  -8.975   1.193
   80   HH12  ARG  13          HH12      ARG  13  13.319  -9.474   0.406
   81   HH21  ARG  13          HH21      ARG  13  12.867  -7.405  -2.376
   82   HH22  ARG  13          HH22      ARG  13  13.892  -8.580  -1.624
   83    H    PHE  14           H        PHE  14   6.724  -4.631  -2.938
   84    HA   PHE  14           HA       PHE  14   4.485  -5.759  -4.239
   85    HB2  PHE  14           HB2      PHE  14   5.489  -3.443  -4.595
   86    HB3  PHE  14           HB3      PHE  14   6.699  -4.230  -5.603
   87    HD1  PHE  14           HD1      PHE  14   3.249  -3.130  -5.352
   88    HD2  PHE  14           HD2      PHE  14   6.055  -5.285  -7.720
   89    HE1  PHE  14           HE1      PHE  14   1.720  -3.003  -7.275
   90    HE2  PHE  14           HE2      PHE  14   4.530  -5.160  -9.646
   91    HZ   PHE  14           HZ       PHE  14   2.359  -4.017  -9.426
   92    H    ALA  15           H        ALA  15   7.859  -6.562  -4.222
   93    HA   ALA  15           HA       ALA  15   8.078  -7.974  -6.621
   94    HB1  ALA  15           HB1      ALA  15  10.051  -8.916  -5.754
   95    HB2  ALA  15           HB2      ALA  15   9.923  -7.327  -4.998
   96    HB3  ALA  15           HB3      ALA  15   9.485  -8.774  -4.090
   97    H    CYS  16           H        CYS  16   6.643  -8.862  -3.565
   98    HA   CYS  16           HA       CYS  16   6.562 -11.636  -3.829
   99    HB2  CYS  16           HB2      CYS  16   5.423  -9.672  -2.112
  100    HB3  CYS  16           HB3      CYS  16   4.128 -10.748  -2.627
  101    H    CYS  17           H        CYS  17   4.463  -9.144  -5.162
  102    HA   CYS  17           HA       CYS  17   2.378 -10.756  -6.082
  103    HB2  CYS  17           HB2      CYS  17   3.373  -8.051  -6.605
  104    HB3  CYS  17           HB3      CYS  17   2.570  -8.779  -7.992
  105    HN1  NH2  18           H1       NH2  18   2.469 -12.433  -7.410
  106    HN2  NH2  18           H2       NH2  18   3.485 -12.650  -8.766
  Start of MODEL    8
    1    H1   ASP   1           H        ASP   1   3.329   1.552  -0.115
    2    HA   ASP   1           HA       ASP   1   1.251  -0.285  -0.949
    3    HB2  ASP   1           HB2      ASP   1   3.241   1.458  -2.346
    4    HB3  ASP   1           HB3      ASP   1   2.514   0.118  -3.229
    5    H    CYS   2           H        CYS   2   1.489  -2.404  -1.190
    6    HA   CYS   2           HA       CYS   2   3.945  -3.596  -2.057
    7    HB2  CYS   2           HB2      CYS   2   3.895  -5.124   0.097
    8    HB3  CYS   2           HB3      CYS   2   4.771  -3.597   0.092
    9    H    CYS   3           H        CYS   3   3.645  -6.172  -1.519
   10    HA   CYS   3           HA       CYS   3   0.877  -6.852  -2.255
   11    HB2  CYS   3           HB2      CYS   3   2.474  -6.870  -4.218
   12    HB3  CYS   3           HB3      CYS   3   3.318  -8.195  -3.422
   13    HA   HYP   4           HA       HYP   4   2.275  -8.017   1.542
   14    HB2  HYP   4           HB2      HYP   4   0.468  -7.696   2.968
   15    HB3  HYP   4           HB3      HYP   4  -0.571  -8.809   2.067
   16    HG   HYP   4           HG       HYP   4  -1.396  -6.779   1.248
   17   HD22  HYP   4           HD2      HYP   4  -0.736  -7.417  -0.886
   18   HD23  HYP   4           HD3      HYP   4   0.594  -6.275  -0.683
   19    HD1  HYP   4           HOD      HYP   4   1.029  -5.536   1.028
   20    H    CYS   5           H        CYS   5   3.521  -9.742   1.817
   21    HA   CYS   5           HA       CYS   5   2.372 -12.429   1.697
   22    HB2  CYS   5           HB2      CYS   5   5.108 -11.293   1.473
   23    HB3  CYS   5           HB3      CYS   5   4.969 -12.902   2.174
   24    HA   HYP   6           HA       HYP   6   1.305 -13.315   5.135
   25    HB2  HYP   6           HB2      HYP   6   1.340 -15.618   5.446
   26    HB3  HYP   6           HB3      HYP   6   3.104 -15.679   5.557
   27    HG   HYP   6           HG       HYP   6   2.841 -16.405   3.348
   28   HD22  HYP   6           HD2      HYP   6   4.052 -14.555   2.637
   29   HD23  HYP   6           HD3      HYP   6   2.500 -13.888   2.126
   30    HD1  HYP   6           HOD      HYP   6   0.843 -14.657   2.694
   31    H    ALA   7           H        ALA   7   4.481 -12.524   5.594
   32    HA   ALA   7           HA       ALA   7   4.640 -13.006   8.439
   33    HB1  ALA   7           HB1      ALA   7   6.580 -12.915   6.719
   34    HB2  ALA   7           HB2      ALA   7   6.482 -11.171   6.964
   35    HB3  ALA   7           HB3      ALA   7   6.817 -12.236   8.329
   36    H    GLY   8           H        GLY   8   4.174 -10.213   6.299
   37    HA2  GLY   8           HA2      GLY   8   2.868  -8.327   6.778
   38    HA3  GLY   8           HA3      GLY   8   2.809  -8.823   8.463
   39    H    ALA   9           H        ALA   9   5.722  -9.168   8.622
   40    HA   ALA   9           HA       ALA   9   6.387  -6.525   9.426
   41    HB1  ALA   9           HB1      ALA   9   7.682  -9.168   9.480
   42    HB2  ALA   9           HB2      ALA   9   8.773  -7.782   9.454
   43    HB3  ALA   9           HB3      ALA   9   7.567  -7.931  10.732
   44    H    VAL  10           H        VAL  10   8.471  -8.482   7.340
   45    HA   VAL  10           HA       VAL  10   8.890  -6.100   5.662
   46    HB   VAL  10           HB       VAL  10  10.885  -7.023   6.858
   47   HG11  VAL  10          HG11      VAL  10  10.483  -9.357   4.988
   48   HG12  VAL  10          HG12      VAL  10  11.890  -9.093   6.020
   49   HG13  VAL  10          HG13      VAL  10  10.309  -9.388   6.743
   50   HG21  VAL  10          HG21      VAL  10  11.849  -7.475   4.219
   51   HG22  VAL  10          HG22      VAL  10  10.615  -6.217   4.155
   52   HG23  VAL  10          HG23      VAL  10  12.009  -6.031   5.219
   53    H    ARG  11           H        ARG  11   7.337  -9.036   5.678
   54    HA   ARG  11           HA       ARG  11   7.843  -9.972   3.051
   55    HB2  ARG  11           HB2      ARG  11   5.859 -10.533   5.184
   56    HB3  ARG  11           HB3      ARG  11   5.394 -10.966   3.544
   57    HG2  ARG  11           HG2      ARG  11   7.850 -11.912   5.007
   58    HG3  ARG  11           HG3      ARG  11   6.396 -12.855   4.675
   59    HD2  ARG  11           HD2      ARG  11   7.291 -11.771   2.218
   60    HD3  ARG  11           HD3      ARG  11   8.693 -12.464   3.033
   61    HE   ARG  11           HE       ARG  11   6.370 -14.172   2.987
   62   HH11  ARG  11          HH11      ARG  11   9.282 -13.205   1.341
   63   HH12  ARG  11          HH12      ARG  11   9.422 -14.682   0.447
   64   HH21  ARG  11          HH21      ARG  11   6.544 -16.121   1.815
   65   HH22  ARG  11          HH22      ARG  11   7.864 -16.340   0.716
   66    H    CYS  12           H        CYS  12   6.198  -7.263   4.175
   67    HA   CYS  12           HA       CYS  12   4.190  -7.138   2.118
   68    HB2  CYS  12           HB2      CYS  12   4.168  -6.042   4.480
   69    HB3  CYS  12           HB3      CYS  12   5.115  -4.769   3.716
   70    H    ARG  13           H        ARG  13   5.543  -7.421   0.253
   71    HA   ARG  13           HA       ARG  13   6.639  -4.880  -0.683
   72    HB2  ARG  13           HB2      ARG  13   8.165  -7.454  -1.066
   73    HB3  ARG  13           HB3      ARG  13   8.692  -5.821  -1.451
   74    HG2  ARG  13           HG2      ARG  13   8.639  -5.303   0.985
   75    HG3  ARG  13           HG3      ARG  13   8.301  -7.009   1.285
   76    HD2  ARG  13           HD2      ARG  13  10.767  -5.780   0.080
   77    HD3  ARG  13           HD3      ARG  13  10.635  -6.737   1.555
   78    HE   ARG  13           HE       ARG  13   9.778  -8.374  -0.489
   79   HH11  ARG  13          HH11      ARG  13  12.691  -6.652   0.329
   80   HH12  ARG  13          HH12      ARG  13  13.738  -7.791  -0.451
   81   HH21  ARG  13          HH21      ARG  13  11.146  -9.880  -1.519
   82   HH22  ARG  13          HH22      ARG  13  12.859  -9.626  -1.503
   83    H    PHE  14           H        PHE  14   6.583  -4.609  -2.925
   84    HA   PHE  14           HA       PHE  14   4.488  -5.912  -4.273
   85    HB2  PHE  14           HB2      PHE  14   5.489  -3.586  -4.712
   86    HB3  PHE  14           HB3      PHE  14   6.706  -4.427  -5.666
   87    HD1  PHE  14           HD1      PHE  14   6.085  -5.590  -7.726
   88    HD2  PHE  14           HD2      PHE  14   3.246  -3.337  -5.495
   89    HE1  PHE  14           HE1      PHE  14   4.572  -5.583  -9.666
   90    HE2  PHE  14           HE2      PHE  14   1.728  -3.327  -7.431
   91    HZ   PHE  14           HZ       PHE  14   2.389  -4.451  -9.520
   92    H    ALA  15           H        ALA  15   7.897  -6.563  -4.074
   93    HA   ALA  15           HA       ALA  15   8.366  -8.075  -6.331
   94    HB1  ALA  15           HB1      ALA  15  10.179  -9.082  -5.166
   95    HB2  ALA  15           HB2      ALA  15  10.034  -7.426  -4.574
   96    HB3  ALA  15           HB3      ALA  15   9.429  -8.767  -3.601
   97    H    CYS  16           H        CYS  16   6.668  -8.971  -3.390
   98    HA   CYS  16           HA       CYS  16   6.560 -11.739  -3.743
   99    HB2  CYS  16           HB2      CYS  16   5.256  -9.760  -2.089
  100    HB3  CYS  16           HB3      CYS  16   4.105 -10.988  -2.607
  101    H    CYS  17           H        CYS  17   4.641  -9.162  -5.152
  102    HA   CYS  17           HA       CYS  17   2.610 -10.807  -6.252
  103    HB2  CYS  17           HB2      CYS  17   3.385  -8.002  -6.354
  104    HB3  CYS  17           HB3      CYS  17   2.789  -8.581  -7.906
  105    HN1  NH2  18           H1       NH2  18   2.470 -11.872  -8.155
  106    HN2  NH2  18           H2       NH2  18   3.694 -12.008  -9.337
  Start of MODEL    9
    1    H1   ASP   1           H        ASP   1   3.282   1.869  -0.809
    2    HA   ASP   1           HA       ASP   1   1.420  -0.223  -0.545
    3    HB2  ASP   1           HB2      ASP   1   2.838   0.769  -3.028
    4    HB3  ASP   1           HB3      ASP   1   1.407  -0.258  -3.014
    5    H    CYS   2           H        CYS   2   1.499  -2.390  -1.184
    6    HA   CYS   2           HA       CYS   2   3.921  -3.603  -2.114
    7    HB2  CYS   2           HB2      CYS   2   3.896  -5.150   0.027
    8    HB3  CYS   2           HB3      CYS   2   4.793  -3.635   0.017
    9    H    CYS   3           H        CYS   3   3.602  -6.180  -1.592
   10    HA   CYS   3           HA       CYS   3   0.812  -6.820  -2.281
   11    HB2  CYS   3           HB2      CYS   3   2.434  -6.840  -4.254
   12    HB3  CYS   3           HB3      CYS   3   3.183  -8.238  -3.490
   13    HA   HYP   4           HA       HYP   4   2.263  -8.030   1.482
   14    HB2  HYP   4           HB2      HYP   4   0.488  -7.695   2.943
   15    HB3  HYP   4           HB3      HYP   4  -0.582  -8.787   2.055
   16    HG   HYP   4           HG       HYP   4  -1.395  -6.740   1.265
   17   HD22  HYP   4           HD2      HYP   4  -0.784  -7.371  -0.885
   18   HD23  HYP   4           HD3      HYP   4   0.566  -6.249  -0.699
   19    HD1  HYP   4           HOD      HYP   4   1.042  -5.529   1.008
   20    H    CYS   5           H        CYS   5   3.489  -9.772   1.733
   21    HA   CYS   5           HA       CYS   5   2.300 -12.442   1.615
   22    HB2  CYS   5           HB2      CYS   5   5.052 -11.346   1.352
   23    HB3  CYS   5           HB3      CYS   5   4.895 -12.963   2.031
   24    HA   HYP   6           HA       HYP   6   1.289 -13.330   5.069
   25    HB2  HYP   6           HB2      HYP   6   1.292 -15.635   5.367
   26    HB3  HYP   6           HB3      HYP   6   3.057 -15.725   5.441
   27    HG   HYP   6           HG       HYP   6   2.736 -16.433   3.234
   28   HD22  HYP   6           HD2      HYP   6   3.963 -14.599   2.508
   29   HD23  HYP   6           HD3      HYP   6   2.412 -13.904   2.033
   30    HD1  HYP   6           HOD      HYP   6   0.754 -14.649   2.631
   31    H    ALA   7           H        ALA   7   4.484 -12.591   5.467
   32    HA   ALA   7           HA       ALA   7   4.698 -13.096   8.303
   33    HB1  ALA   7           HB1      ALA   7   6.602 -13.013   6.542
   34    HB2  ALA   7           HB2      ALA   7   6.529 -11.270   6.803
   35    HB3  ALA   7           HB3      ALA   7   6.881 -12.350   8.152
   36    H    GLY   8           H        GLY   8   4.218 -10.280   6.198
   37    HA2  GLY   8           HA2      GLY   8   2.937  -8.388   6.726
   38    HA3  GLY   8           HA3      GLY   8   2.926  -8.891   8.409
   39    H    ALA   9           H        ALA   9   5.839  -9.263   8.477
   40    HA   ALA   9           HA       ALA   9   6.552  -6.627   9.267
   41    HB1  ALA   9           HB1      ALA   9   7.959  -9.252   9.145
   42    HB2  ALA   9           HB2      ALA   9   8.902  -7.779   9.380
   43    HB3  ALA   9           HB3      ALA   9   7.636  -8.209  10.530
   44    H    VAL  10           H        VAL  10   8.574  -8.597   7.137
   45    HA   VAL  10           HA       VAL  10   8.979  -6.220   5.452
   46    HB   VAL  10           HB       VAL  10  10.751  -8.657   5.591
   47   HG11  VAL  10          HG11      VAL  10  12.122  -6.295   4.852
   48   HG12  VAL  10          HG12      VAL  10  11.799  -7.726   3.870
   49   HG13  VAL  10          HG13      VAL  10  10.655  -6.383   3.879
   50   HG21  VAL  10          HG21      VAL  10  11.077  -6.029   7.035
   51   HG22  VAL  10          HG22      VAL  10  10.641  -7.564   7.786
   52   HG23  VAL  10          HG23      VAL  10  12.226  -7.368   7.036
   53    H    ARG  11           H        ARG  11   7.432  -9.186   5.499
   54    HA   ARG  11           HA       ARG  11   7.818 -10.096   2.857
   55    HB2  ARG  11           HB2      ARG  11   5.881 -10.619   5.040
   56    HB3  ARG  11           HB3      ARG  11   5.354 -11.026   3.412
   57    HG2  ARG  11           HG2      ARG  11   7.844 -12.041   4.768
   58    HG3  ARG  11           HG3      ARG  11   6.347 -12.944   4.526
   59    HD2  ARG  11           HD2      ARG  11   7.065 -11.952   2.005
   60    HD3  ARG  11           HD3      ARG  11   8.557 -12.551   2.729
   61    HE   ARG  11           HE       ARG  11   6.419 -14.115   1.726
   62   HH11  ARG  11          HH11      ARG  11   8.772 -13.994   4.290
   63   HH12  ARG  11          HH12      ARG  11   8.822 -15.713   4.501
   64   HH21  ARG  11          HH21      ARG  11   6.476 -16.379   1.996
   65   HH22  ARG  11          HH22      ARG  11   7.516 -17.069   3.195
   66    H    CYS  12           H        CYS  12   6.238  -7.365   4.040
   67    HA   CYS  12           HA       CYS  12   4.198  -7.184   2.023
   68    HB2  CYS  12           HB2      CYS  12   4.254  -6.102   4.394
   69    HB3  CYS  12           HB3      CYS  12   5.197  -4.839   3.608
   70    H    ARG  13           H        ARG  13   5.727  -7.577   0.222
   71    HA   ARG  13           HA       ARG  13   6.824  -5.022  -0.729
   72    HB2  ARG  13           HB2      ARG  13   8.163  -7.721  -0.994
   73    HB3  ARG  13           HB3      ARG  13   8.725  -6.230  -1.738
   74    HG2  ARG  13           HG2      ARG  13   9.378  -5.313   0.294
   75    HG3  ARG  13           HG3      ARG  13   8.371  -6.423   1.226
   76    HD2  ARG  13           HD2      ARG  13  10.685  -7.058   1.459
   77    HD3  ARG  13           HD3      ARG  13   9.834  -8.284   0.520
   78    HE   ARG  13           HE       ARG  13  10.903  -6.564  -1.332
   79   HH11  ARG  13          HH11      ARG  13  12.136  -8.556   1.243
   80   HH12  ARG  13          HH12      ARG  13  13.665  -8.829   0.476
   81   HH21  ARG  13          HH21      ARG  13  12.913  -6.916  -2.353
   82   HH22  ARG  13          HH22      ARG  13  14.106  -7.895  -1.569
   83    H    PHE  14           H        PHE  14   6.727  -4.685  -2.962
   84    HA   PHE  14           HA       PHE  14   4.520  -5.834  -4.280
   85    HB2  PHE  14           HB2      PHE  14   5.681  -3.542  -4.657
   86    HB3  PHE  14           HB3      PHE  14   6.739  -4.434  -5.745
   87    HD1  PHE  14           HD1      PHE  14   5.749  -5.614  -7.713
   88    HD2  PHE  14           HD2      PHE  14   3.513  -2.907  -5.307
   89    HE1  PHE  14           HE1      PHE  14   4.086  -5.393  -9.513
   90    HE2  PHE  14           HE2      PHE  14   1.846  -2.683  -7.102
   91    HZ   PHE  14           HZ       PHE  14   2.131  -3.928  -9.208
   92    H    ALA  15           H        ALA  15   7.898  -6.649  -4.208
   93    HA   ALA  15           HA       ALA  15   8.197  -8.112  -6.539
   94    HB1  ALA  15           HB1      ALA  15  10.213  -8.095  -5.574
   95    HB2  ALA  15           HB2      ALA  15   9.536  -7.982  -3.949
   96    HB3  ALA  15           HB3      ALA  15   9.673  -9.552  -4.739
   97    H    CYS  16           H        CYS  16   6.622  -8.997  -3.532
   98    HA   CYS  16           HA       CYS  16   6.419 -11.754  -3.887
   99    HB2  CYS  16           HB2      CYS  16   5.249  -9.753  -2.177
  100    HB3  CYS  16           HB3      CYS  16   4.016 -10.905  -2.680
  101    H    CYS  17           H        CYS  17   4.546  -9.128  -5.257
  102    HA   CYS  17           HA       CYS  17   2.421 -10.700  -6.276
  103    HB2  CYS  17           HB2      CYS  17   3.284  -7.935  -6.404
  104    HB3  CYS  17           HB3      CYS  17   2.692  -8.489  -7.967
  105    HN1  NH2  18           H1       NH2  18   2.517 -12.183  -7.816
  106    HN2  NH2  18           H2       NH2  18   3.579 -12.249  -9.151
  Start of MODEL   10
    1    H1   ASP   1           H        ASP   1   3.492   1.468  -0.120
    2    HA   ASP   1           HA       ASP   1   1.224  -0.267  -0.749
    3    HB2  ASP   1           HB2      ASP   1   3.179   1.268  -2.458
    4    HB3  ASP   1           HB3      ASP   1   2.068   0.081  -3.136
    5    H    CYS   2           H        CYS   2   1.421  -2.387  -1.091
    6    HA   CYS   2           HA       CYS   2   3.836  -3.588  -2.053
    7    HB2  CYS   2           HB2      CYS   2   3.840  -5.143   0.083
    8    HB3  CYS   2           HB3      CYS   2   4.733  -3.626   0.067
    9    H    CYS   3           H        CYS   3   3.531  -6.168  -1.537
   10    HA   CYS   3           HA       CYS   3   0.735  -6.814  -2.195
   11    HB2  CYS   3           HB2      CYS   3   2.338  -6.823  -4.186
   12    HB3  CYS   3           HB3      CYS   3   3.093  -8.226  -3.436
   13    HA   HYP   4           HA       HYP   4   2.234  -8.033   1.547
   14    HB2  HYP   4           HB2      HYP   4   0.475  -7.708   3.030
   15    HB3  HYP   4           HB3      HYP   4  -0.603  -8.800   2.150
   16    HG   HYP   4           HG       HYP   4  -1.430  -6.753   1.377
   17   HD22  HYP   4           HD2      HYP   4  -0.843  -7.375  -0.782
   18   HD23  HYP   4           HD3      HYP   4   0.506  -6.249  -0.609
   19    HD1  HYP   4           HOD      HYP   4   1.000  -5.533   1.096
   20    H    CYS   5           H        CYS   5   3.468  -9.772   1.776
   21    HA   CYS   5           HA       CYS   5   2.285 -12.445   1.663
   22    HB2  CYS   5           HB2      CYS   5   5.029 -11.340   1.371
   23    HB3  CYS   5           HB3      CYS   5   4.886 -12.959   2.047
   24    HA   HYP   6           HA       HYP   6   1.317 -13.349   5.126
   25    HB2  HYP   6           HB2      HYP   6   1.332 -15.655   5.415
   26    HB3  HYP   6           HB3      HYP   6   3.097 -15.740   5.468
   27    HG   HYP   6           HG       HYP   6   2.754 -16.441   3.263
   28   HD22  HYP   6           HD2      HYP   6   3.966 -14.600   2.529
   29   HD23  HYP   6           HD3      HYP   6   2.407 -13.909   2.074
   30    HD1  HYP   6           HOD      HYP   6   0.759 -14.662   2.689
   31    H    ALA   7           H        ALA   7   4.514 -12.601   5.489
   32    HA   ALA   7           HA       ALA   7   4.763 -13.114   8.321
   33    HB1  ALA   7           HB1      ALA   7   6.571 -11.277   6.807
   34    HB2  ALA   7           HB2      ALA   7   6.942 -12.362   8.148
   35    HB3  ALA   7           HB3      ALA   7   6.646 -13.019   6.538
   36    H    GLY   8           H        GLY   8   4.250 -10.293   6.230
   37    HA2  GLY   8           HA2      GLY   8   2.971  -8.406   6.778
   38    HA3  GLY   8           HA3      GLY   8   2.980  -8.915   8.460
   39    H    ALA   9           H        ALA   9   5.894  -9.278   8.495
   40    HA   ALA   9           HA       ALA   9   6.609  -6.643   9.284
   41    HB1  ALA   9           HB1      ALA   9   8.901  -7.665   9.563
   42    HB2  ALA   9           HB2      ALA   9   7.599  -8.430  10.475
   43    HB3  ALA   9           HB3      ALA   9   8.198  -9.180   8.996
   44    H    VAL  10           H        VAL  10   8.612  -8.601   7.125
   45    HA   VAL  10           HA       VAL  10   8.991  -6.217   5.443
   46    HB   VAL  10           HB       VAL  10  10.771  -8.651   5.554
   47   HG11  VAL  10          HG11      VAL  10  12.130  -6.286   4.805
   48   HG12  VAL  10          HG12      VAL  10  11.794  -7.713   3.822
   49   HG13  VAL  10          HG13      VAL  10  10.649  -6.370   3.851
   50   HG21  VAL  10          HG21      VAL  10  12.259  -7.362   6.984
   51   HG22  VAL  10          HG22      VAL  10  11.111  -6.024   7.001
   52   HG23  VAL  10          HG23      VAL  10  10.684  -7.561   7.752
   53    H    ARG  11           H        ARG  11   7.453  -9.188   5.498
   54    HA   ARG  11           HA       ARG  11   7.811 -10.088   2.848
   55    HB2  ARG  11           HB2      ARG  11   5.901 -10.624   5.052
   56    HB3  ARG  11           HB3      ARG  11   5.356 -11.028   3.429
   57    HG2  ARG  11           HG2      ARG  11   7.865 -12.039   4.753
   58    HG3  ARG  11           HG3      ARG  11   6.368 -12.945   4.525
   59    HD2  ARG  11           HD2      ARG  11   7.055 -11.943   1.999
   60    HD3  ARG  11           HD3      ARG  11   8.557 -12.541   2.704
   61    HE   ARG  11           HE       ARG  11   6.411 -14.106   1.721
   62   HH11  ARG  11          HH11      ARG  11   8.792 -13.989   4.257
   63   HH12  ARG  11          HH12      ARG  11   8.849 -15.708   4.462
   64   HH21  ARG  11          HH21      ARG  11   6.476 -16.371   1.981
   65   HH22  ARG  11          HH22      ARG  11   7.531 -17.063   3.166
   66    H    CYS  12           H        CYS  12   6.236  -7.365   4.060
   67    HA   CYS  12           HA       CYS  12   4.172  -7.184   2.068
   68    HB2  CYS  12           HB2      CYS  12   4.253  -6.110   4.442
   69    HB3  CYS  12           HB3      CYS  12   5.183  -4.842   3.650
   70    H    ARG  13           H        ARG  13   5.682  -7.566   0.248
   71    HA   ARG  13           HA       ARG  13   6.760  -5.004  -0.706
   72    HB2  ARG  13           HB2      ARG  13   8.103  -7.699  -0.991
   73    HB3  ARG  13           HB3      ARG  13   8.651  -6.208  -1.746
   74    HG2  ARG  13           HG2      ARG  13   9.323  -5.282   0.279
   75    HG3  ARG  13           HG3      ARG  13   8.340  -6.403   1.224
   76    HD2  ARG  13           HD2      ARG  13  10.665  -7.015   1.418
   77    HD3  ARG  13           HD3      ARG  13   9.809  -8.250   0.495
   78    HE   ARG  13           HE       ARG  13  10.823  -6.537  -1.385
   79   HH11  ARG  13          HH11      ARG  13  12.143  -8.459   1.200
   80   HH12  ARG  13          HH12      ARG  13  13.667  -8.705   0.414
   81   HH21  ARG  13          HH21      ARG  13  12.825  -6.855  -2.431
   82   HH22  ARG  13          HH22      ARG  13  14.054  -7.792  -1.651
   83    H    PHE  14           H        PHE  14   6.637  -4.660  -2.937
   84    HA   PHE  14           HA       PHE  14   4.417  -5.811  -4.234
   85    HB2  PHE  14           HB2      PHE  14   5.229  -3.538  -4.721
   86    HB3  PHE  14           HB3      PHE  14   6.693  -4.214  -5.428
   87    HD1  PHE  14           HD1      PHE  14   6.700  -3.921  -7.699
   88    HD2  PHE  14           HD2      PHE  14   3.065  -5.018  -5.776
   89    HE1  PHE  14           HE1      PHE  14   5.585  -4.049  -9.888
   90    HE2  PHE  14           HE2      PHE  14   1.944  -5.148  -7.962
   91    HZ   PHE  14           HZ       PHE  14   3.204  -4.665 -10.022
   92    H    ALA  15           H        ALA  15   7.796  -6.620  -4.200
   93    HA   ALA  15           HA       ALA  15   8.074  -8.073  -6.541
   94    HB1  ALA  15           HB1      ALA  15   9.824  -9.357  -5.325
   95    HB2  ALA  15           HB2      ALA  15   9.977  -7.607  -5.158
   96    HB3  ALA  15           HB3      ALA  15   9.308  -8.564  -3.836
   97    H    CYS  16           H        CYS  16   6.532  -8.974  -3.521
   98    HA   CYS  16           HA       CYS  16   6.328 -11.729  -3.887
   99    HB2  CYS  16           HB2      CYS  16   5.169  -9.736  -2.157
  100    HB3  CYS  16           HB3      CYS  16   3.939 -10.896  -2.648
  101    H    CYS  17           H        CYS  17   4.439  -9.098  -5.224
  102    HA   CYS  17           HA       CYS  17   2.304 -10.668  -6.228
  103    HB2  CYS  17           HB2      CYS  17   3.161  -7.901  -6.350
  104    HB3  CYS  17           HB3      CYS  17   2.554  -8.447  -7.910
  105    HN1  NH2  18           H1       NH2  18   1.844 -11.124  -8.483
  106    HN2  NH2  18           H2       NH2  18   3.085 -11.544  -9.579
  Start of MODEL   11
    1    H1   ASP   1           H        ASP   1   2.711   1.459   0.429
    2    HA   ASP   1           HA       ASP   1   1.081  -0.272  -1.096
    3    HB2  ASP   1           HB2      ASP   1   1.991   1.935  -1.870
    4    HB3  ASP   1           HB3      ASP   1   3.570   1.170  -2.026
    5    H    CYS   2           H        CYS   2   1.326  -2.412  -1.063
    6    HA   CYS   2           HA       CYS   2   3.747  -3.593  -2.036
    7    HB2  CYS   2           HB2      CYS   2   3.775  -5.148   0.099
    8    HB3  CYS   2           HB3      CYS   2   4.653  -3.623   0.080
    9    H    CYS   3           H        CYS   3   3.466  -6.175  -1.518
   10    HA   CYS   3           HA       CYS   3   0.673  -6.846  -2.164
   11    HB2  CYS   3           HB2      CYS   3   2.270  -6.841  -4.161
   12    HB3  CYS   3           HB3      CYS   3   3.036  -8.239  -3.415
   13    HA   HYP   4           HA       HYP   4   2.199  -8.051   1.571
   14    HB2  HYP   4           HB2      HYP   4   0.444  -7.741   3.062
   15    HB3  HYP   4           HB3      HYP   4  -0.628  -8.842   2.187
   16    HG   HYP   4           HG       HYP   4  -1.476  -6.802   1.418
   17   HD22  HYP   4           HD2      HYP   4  -0.893  -7.420  -0.744
   18   HD23  HYP   4           HD3      HYP   4   0.446  -6.282  -0.577
   19    HD1  HYP   4           HOD      HYP   4   0.942  -5.562   1.125
   20    H    CYS   5           H        CYS   5   3.450  -9.780   1.793
   21    HA   CYS   5           HA       CYS   5   2.289 -12.463   1.686
   22    HB2  CYS   5           HB2      CYS   5   5.025 -11.335   1.386
   23    HB3  CYS   5           HB3      CYS   5   4.893 -12.959   2.055
   24    HA   HYP   6           HA       HYP   6   1.344 -13.372   5.154
   25    HB2  HYP   6           HB2      HYP   6   1.376 -15.678   5.443
   26    HB3  HYP   6           HB3      HYP   6   3.142 -15.750   5.487
   27    HG   HYP   6           HG       HYP   6   2.793 -16.454   3.284
   28   HD22  HYP   6           HD2      HYP   6   3.988 -14.605   2.544
   29   HD23  HYP   6           HD3      HYP   6   2.422 -13.924   2.097
   30    HD1  HYP   6           HOD      HYP   6   0.782 -14.689   2.720
   31    H    ALA   7           H        ALA   7   4.537 -12.602   5.501
   32    HA   ALA   7           HA       ALA   7   4.805 -13.114   8.331
   33    HB1  ALA   7           HB1      ALA   7   6.676 -13.002   6.538
   34    HB2  ALA   7           HB2      ALA   7   6.589 -11.261   6.809
   35    HB3  ALA   7           HB3      ALA   7   6.976 -12.343   8.146
   36    H    GLY   8           H        GLY   8   4.257 -10.295   6.246
   37    HA2  GLY   8           HA2      GLY   8   2.965  -8.419   6.802
   38    HA3  GLY   8           HA3      GLY   8   2.986  -8.930   8.484
   39    H    ALA   9           H        ALA   9   5.904  -9.270   8.503
   40    HA   ALA   9           HA       ALA   9   6.601  -6.630   9.294
   41    HB1  ALA   9           HB1      ALA   9   8.224  -9.145   8.981
   42    HB2  ALA   9           HB2      ALA   9   8.895  -7.626   9.577
   43    HB3  ALA   9           HB3      ALA   9   7.604  -8.429  10.469
   44    H    VAL  10           H        VAL  10   8.606  -8.568   7.118
   45    HA   VAL  10           HA       VAL  10   8.955  -6.177   5.439
   46    HB   VAL  10           HB       VAL  10  10.760  -8.593   5.541
   47   HG11  VAL  10          HG11      VAL  10  10.607  -6.311   3.839
   48   HG12  VAL  10          HG12      VAL  10  12.097  -6.221   4.782
   49   HG13  VAL  10          HG13      VAL  10  11.758  -7.647   3.799
   50   HG21  VAL  10          HG21      VAL  10  12.243  -7.286   6.961
   51   HG22  VAL  10          HG22      VAL  10  11.078  -5.962   6.985
   52   HG23  VAL  10          HG23      VAL  10  10.675  -7.505   7.739
   53    H    ARG  11           H        ARG  11   7.447  -9.163   5.498
   54    HA   ARG  11           HA       ARG  11   7.801 -10.057   2.846
   55    HB2  ARG  11           HB2      ARG  11   5.906 -10.613   5.057
   56    HB3  ARG  11           HB3      ARG  11   5.358 -11.020   3.437
   57    HG2  ARG  11           HG2      ARG  11   7.882 -12.009   4.749
   58    HG3  ARG  11           HG3      ARG  11   6.393 -12.929   4.527
   59    HD2  ARG  11           HD2      ARG  11   7.061 -11.917   1.999
   60    HD3  ARG  11           HD3      ARG  11   8.569 -12.506   2.697
   61    HE   ARG  11           HE       ARG  11   6.431 -14.084   1.718
   62   HH11  ARG  11          HH11      ARG  11   8.818 -13.955   4.249
   63   HH12  ARG  11          HH12      ARG  11   8.886 -15.675   4.451
   64   HH21  ARG  11          HH21      ARG  11   6.511 -16.349   1.975
   65   HH22  ARG  11          HH22      ARG  11   7.574 -17.035   3.157
   66    H    CYS  12           H        CYS  12   6.207  -7.350   4.067
   67    HA   CYS  12           HA       CYS  12   4.132  -7.187   2.083
   68    HB2  CYS  12           HB2      CYS  12   4.212  -6.114   4.457
   69    HB3  CYS  12           HB3      CYS  12   5.130  -4.837   3.664
   70    H    ARG  13           H        ARG  13   5.635  -7.553   0.256
   71    HA   ARG  13           HA       ARG  13   6.684  -4.981  -0.703
   72    HB2  ARG  13           HB2      ARG  13   8.055  -7.655  -1.043
   73    HB3  ARG  13           HB3      ARG  13   8.599  -6.125  -1.719
   74    HG2  ARG  13           HG2      ARG  13   9.250  -5.296   0.347
   75    HG3  ARG  13           HG3      ARG  13   8.244  -6.444   1.232
   76    HD2  ARG  13           HD2      ARG  13  10.580  -7.056   1.431
   77    HD3  ARG  13           HD3      ARG  13   9.711  -8.272   0.494
   78    HE   ARG  13           HE       ARG  13  10.776  -6.473  -1.323
   79   HH11  ARG  13          HH11      ARG  13  11.944  -8.710   1.075
   80   HH12  ARG  13          HH12      ARG  13  13.431  -9.026   0.245
   81   HH21  ARG  13          HH21      ARG  13  12.730  -6.881  -2.426
   82   HH22  ARG  13          HH22      ARG  13  13.878  -7.984  -1.746
   83    H    PHE  14           H        PHE  14   6.553  -4.642  -2.935
   84    HA   PHE  14           HA       PHE  14   4.338  -5.808  -4.223
   85    HB2  PHE  14           HB2      PHE  14   5.122  -3.538  -4.731
   86    HB3  PHE  14           HB3      PHE  14   6.606  -4.196  -5.412
   87    HD1  PHE  14           HD1      PHE  14   6.675  -5.062  -7.617
   88    HD2  PHE  14           HD2      PHE  14   2.965  -3.913  -5.876
   89    HE1  PHE  14           HE1      PHE  14   5.594  -5.223  -9.821
   90    HE2  PHE  14           HE2      PHE  14   1.878  -4.073  -8.077
   91    HZ   PHE  14           HZ       PHE  14   3.192  -4.729 -10.053
   92    H    ALA  15           H        ALA  15   7.725  -6.595  -4.207
   93    HA   ALA  15           HA       ALA  15   8.011  -8.054  -6.536
   94    HB1  ALA  15           HB1      ALA  15   9.832  -7.514  -4.945
   95    HB2  ALA  15           HB2      ALA  15   9.219  -8.769  -3.868
   96    HB3  ALA  15           HB3      ALA  15   9.834  -9.200  -5.463
   97    H    CYS  16           H        CYS  16   6.458  -8.963  -3.522
   98    HA   CYS  16           HA       CYS  16   6.251 -11.717  -3.903
   99    HB2  CYS  16           HB2      CYS  16   5.058  -9.719  -2.183
  100    HB3  CYS  16           HB3      CYS  16   3.867 -10.926  -2.655
  101    H    CYS  17           H        CYS  17   4.372  -9.077  -5.233
  102    HA   CYS  17           HA       CYS  17   2.243 -10.654  -6.254
  103    HB2  CYS  17           HB2      CYS  17   3.073  -7.873  -6.334
  104    HB3  CYS  17           HB3      CYS  17   2.454  -8.404  -7.895
  105    HN1  NH2  18           H1       NH2  18   4.910  -9.034  -7.991
  106    HN2  NH2  18           H2       NH2  18   5.046 -10.145  -9.280
  Start of MODEL   12
    1    H1   ASP   1           H        ASP   1   3.736   0.804   0.373
    2    HA   ASP   1           HA       ASP   1   1.370  -0.290  -0.973
    3    HB2  ASP   1           HB2      ASP   1   3.560   1.355  -2.221
    4    HB3  ASP   1           HB3      ASP   1   2.622   0.209  -3.174
    5    H    CYS   2           H        CYS   2   1.563  -2.414  -1.142
    6    HA   CYS   2           HA       CYS   2   3.970  -3.657  -2.072
    7    HB2  CYS   2           HB2      CYS   2   3.928  -5.201   0.070
    8    HB3  CYS   2           HB3      CYS   2   4.843  -3.697   0.058
    9    H    CYS   3           H        CYS   3   3.619  -6.229  -1.545
   10    HA   CYS   3           HA       CYS   3   0.821  -6.836  -2.232
   11    HB2  CYS   3           HB2      CYS   3   2.470  -6.880  -4.197
   12    HB3  CYS   3           HB3      CYS   3   3.157  -8.311  -3.435
   13    HA   HYP   4           HA       HYP   4   2.259  -8.057   1.533
   14    HB2  HYP   4           HB2      HYP   4   0.488  -7.698   2.994
   15    HB3  HYP   4           HB3      HYP   4  -0.596  -8.778   2.108
   16    HG   HYP   4           HG       HYP   4  -1.384  -6.723   1.315
   17   HD22  HYP   4           HD2      HYP   4  -0.781  -7.365  -0.835
   18   HD23  HYP   4           HD3      HYP   4   0.582  -6.259  -0.651
   19    HD1  HYP   4           HOD      HYP   4   1.068  -5.542   1.055
   20    H    CYS   5           H        CYS   5   3.466  -9.817   1.767
   21    HA   CYS   5           HA       CYS   5   2.243 -12.471   1.660
   22    HB2  CYS   5           HB2      CYS   5   5.006 -11.408   1.390
   23    HB3  CYS   5           HB3      CYS   5   4.833 -13.021   2.074
   24    HA   HYP   6           HA       HYP   6   1.228 -13.346   5.117
   25    HB2  HYP   6           HB2      HYP   6   1.206 -15.650   5.416
   26    HB3  HYP   6           HB3      HYP   6   2.969 -15.760   5.488
   27    HG   HYP   6           HG       HYP   6   2.638 -16.467   3.282
   28   HD22  HYP   6           HD2      HYP   6   3.884 -14.647   2.553
   29   HD23  HYP   6           HD3      HYP   6   2.340 -13.935   2.079
   30    HD1  HYP   6           HOD      HYP   6   0.675 -14.661   2.681
   31    H    ALA   7           H        ALA   7   4.431 -12.640   5.509
   32    HA   ALA   7           HA       ALA   7   4.643 -13.145   8.346
   33    HB1  ALA   7           HB1      ALA   7   6.545 -13.088   6.583
   34    HB2  ALA   7           HB2      ALA   7   6.495 -11.344   6.841
   35    HB3  ALA   7           HB3      ALA   7   6.835 -12.426   8.191
   36    H    GLY   8           H        GLY   8   4.195 -10.326   6.237
   37    HA2  GLY   8           HA2      GLY   8   2.937  -8.418   6.763
   38    HA3  GLY   8           HA3      GLY   8   2.923  -8.919   8.448
   39    H    ALA   9           H        ALA   9   5.831  -9.325   8.510
   40    HA   ALA   9           HA       ALA   9   6.577  -6.694   9.291
   41    HB1  ALA   9           HB1      ALA   9   8.910  -7.865   9.419
   42    HB2  ALA   9           HB2      ALA   9   7.634  -8.296  10.558
   43    HB3  ALA   9           HB3      ALA   9   7.964  -9.333   9.170
   44    H    VAL  10           H        VAL  10   8.574  -8.698   7.168
   45    HA   VAL  10           HA       VAL  10   9.012  -6.332   5.476
   46    HB   VAL  10           HB       VAL  10  10.741  -8.801   5.626
   47   HG11  VAL  10          HG11      VAL  10  12.431  -7.175   4.667
   48   HG12  VAL  10          HG12      VAL  10  11.122  -7.665   3.589
   49   HG13  VAL  10          HG13      VAL  10  11.075  -6.086   4.374
   50   HG21  VAL  10          HG21      VAL  10  10.657  -7.675   7.806
   51   HG22  VAL  10          HG22      VAL  10  12.244  -7.526   7.052
   52   HG23  VAL  10          HG23      VAL  10  11.128  -6.161   7.035
   53    H    ARG  11           H        ARG  11   7.431  -9.287   5.531
   54    HA   ARG  11           HA       ARG  11   7.791 -10.200   2.888
   55    HB2  ARG  11           HB2      ARG  11   5.853 -10.693   5.077
   56    HB3  ARG  11           HB3      ARG  11   5.316 -11.095   3.452
   57    HG2  ARG  11           HG2      ARG  11   7.794 -12.143   4.804
   58    HG3  ARG  11           HG3      ARG  11   6.285 -13.025   4.564
   59    HD2  ARG  11           HD2      ARG  11   7.013 -12.045   2.042
   60    HD3  ARG  11           HD3      ARG  11   8.498 -12.662   2.764
   61    HE   ARG  11           HE       ARG  11   6.338 -14.199   1.767
   62   HH11  ARG  11          HH11      ARG  11   8.699 -14.108   4.323
   63   HH12  ARG  11          HH12      ARG  11   8.728 -15.827   4.536
   64   HH21  ARG  11          HH21      ARG  11   6.367 -16.464   2.037
   65   HH22  ARG  11          HH22      ARG  11   7.402 -17.166   3.234
   66    H    CYS  12           H        CYS  12   6.245  -7.449   4.080
   67    HA   CYS  12           HA       CYS  12   4.206  -7.241   2.063
   68    HB2  CYS  12           HB2      CYS  12   4.273  -6.165   4.435
   69    HB3  CYS  12           HB3      CYS  12   5.234  -4.913   3.656
   70    H    ARG  13           H        ARG  13   5.735  -7.649   0.264
   71    HA   ARG  13           HA       ARG  13   6.858  -5.104  -0.684
   72    HB2  ARG  13           HB2      ARG  13   8.170  -7.816  -0.943
   73    HB3  ARG  13           HB3      ARG  13   8.746  -6.335  -1.697
   74    HG2  ARG  13           HG2      ARG  13   9.326  -5.383   0.376
   75    HG3  ARG  13           HG3      ARG  13   8.424  -6.605   1.275
   76    HD2  ARG  13           HD2      ARG  13  10.922  -6.891   1.272
   77    HD3  ARG  13           HD3      ARG  13   9.999  -8.292   0.731
   78    HE   ARG  13           HE       ARG  13  10.910  -8.052  -1.364
   79   HH11  ARG  13          HH11      ARG  13  11.569  -5.206   0.530
   80   HH12  ARG  13          HH12      ARG  13  12.678  -4.538  -0.622
   81   HH21  ARG  13          HH21      ARG  13  12.367  -7.182  -2.888
   82   HH22  ARG  13          HH22      ARG  13  13.130  -5.662  -2.566
   83    H    PHE  14           H        PHE  14   6.778  -4.771  -2.922
   84    HA   PHE  14           HA       PHE  14   4.556  -5.887  -4.243
   85    HB2  PHE  14           HB2      PHE  14   5.578  -3.616  -4.668
   86    HB3  PHE  14           HB3      PHE  14   6.857  -4.437  -5.557
   87    HD1  PHE  14           HD1      PHE  14   3.213  -3.815  -5.477
   88    HD2  PHE  14           HD2      PHE  14   6.548  -5.104  -7.786
   89    HE1  PHE  14           HE1      PHE  14   1.821  -3.770  -7.506
   90    HE2  PHE  14           HE2      PHE  14   5.163  -5.060  -9.818
   91    HZ   PHE  14           HZ       PHE  14   2.796  -4.392  -9.680
   92    H    ALA  15           H        ALA  15   7.917  -6.763  -4.154
   93    HA   ALA  15           HA       ALA  15   8.207  -8.233  -6.480
   94    HB1  ALA  15           HB1      ALA  15   9.582  -9.690  -4.548
   95    HB2  ALA  15           HB2      ALA  15  10.217  -8.380  -5.544
   96    HB3  ALA  15           HB3      ALA  15   9.566  -8.033  -3.943
   97    H    CYS  16           H        CYS  16   6.589  -9.092  -3.487
   98    HA   CYS  16           HA       CYS  16   6.326 -11.843  -3.863
   99    HB2  CYS  16           HB2      CYS  16   5.182  -9.822  -2.147
  100    HB3  CYS  16           HB3      CYS  16   3.947 -10.974  -2.644
  101    H    CYS  17           H        CYS  17   4.530  -9.163  -5.223
  102    HA   CYS  17           HA       CYS  17   2.366 -10.679  -6.254
  103    HB2  CYS  17           HB2      CYS  17   3.280  -7.931  -6.342
  104    HB3  CYS  17           HB3      CYS  17   2.692  -8.451  -7.918
  105    HN1  NH2  18           H1       NH2  18   1.941 -11.259  -8.441
  106    HN2  NH2  18           H2       NH2  18   3.179 -11.646  -9.552
  Start of MODEL   13
    1    H1   ASP   1           H        ASP   1   3.768   0.790   0.518
    2    HA   ASP   1           HA       ASP   1   1.404  -0.092  -0.934
    3    HB2  ASP   1           HB2      ASP   1   2.175   1.979  -2.086
    4    HB3  ASP   1           HB3      ASP   1   3.731   1.202  -2.369
    5    H    CYS   2           H        CYS   2   1.551  -2.218  -1.116
    6    HA   CYS   2           HA       CYS   2   3.921  -3.502  -2.083
    7    HB2  CYS   2           HB2      CYS   2   3.869  -5.068   0.044
    8    HB3  CYS   2           HB3      CYS   2   4.813  -3.582   0.038
    9    H    CYS   3           H        CYS   3   3.519  -6.073  -1.574
   10    HA   CYS   3           HA       CYS   3   0.702  -6.612  -2.238
   11    HB2  CYS   3           HB2      CYS   3   3.144  -7.261  -3.765
   12    HB3  CYS   3           HB3      CYS   3   1.994  -8.583  -3.594
   13    HA   HYP   4           HA       HYP   4   2.150  -7.903   1.498
   14    HB2  HYP   4           HB2      HYP   4   0.401  -7.522   2.980
   15    HB3  HYP   4           HB3      HYP   4  -0.713  -8.571   2.093
   16    HG   HYP   4           HG       HYP   4  -1.466  -6.492   1.329
   17   HD22  HYP   4           HD2      HYP   4  -0.897  -7.124  -0.832
   18   HD23  HYP   4           HD3      HYP   4   0.490  -6.048  -0.651
   19    HD1  HYP   4           HOD      HYP   4   1.007  -5.359   1.058
   20    H    CYS   5           H        CYS   5   3.334  -9.703   1.612
   21    HA   CYS   5           HA       CYS   5   2.061 -12.326   1.506
   22    HB2  CYS   5           HB2      CYS   5   4.774 -11.278   1.098
   23    HB3  CYS   5           HB3      CYS   5   4.722 -12.793   1.993
   24    HA   HYP   6           HA       HYP   6   1.081 -13.343   4.927
   25    HB2  HYP   6           HB2      HYP   6   1.139 -15.652   5.183
   26    HB3  HYP   6           HB3      HYP   6   2.905 -15.701   5.269
   27    HG   HYP   6           HG       HYP   6   2.619 -16.375   3.047
   28   HD22  HYP   6           HD2      HYP   6   3.806 -14.499   2.366
   29   HD23  HYP   6           HD3      HYP   6   2.242 -13.833   1.890
   30    HD1  HYP   6           HOD      HYP   6   0.598 -14.629   2.461
   31    H    ALA   7           H        ALA   7   4.441 -12.968   5.388
   32    HA   ALA   7           HA       ALA   7   4.581 -13.382   8.196
   33    HB1  ALA   7           HB1      ALA   7   6.401 -11.556   6.660
   34    HB2  ALA   7           HB2      ALA   7   6.761 -12.541   8.078
   35    HB3  ALA   7           HB3      ALA   7   6.503 -13.311   6.513
   36    H    GLY   8           H        GLY   8   4.102 -10.506   6.173
   37    HA2  GLY   8           HA2      GLY   8   2.858  -8.611   6.743
   38    HA3  GLY   8           HA3      GLY   8   2.789  -9.182   8.403
   39    H    ALA   9           H        ALA   9   5.696  -9.595   8.538
   40    HA   ALA   9           HA       ALA   9   6.422  -7.032   9.499
   41    HB1  ALA   9           HB1      ALA   9   8.726  -8.103   9.680
   42    HB2  ALA   9           HB2      ALA   9   7.416  -8.862  10.584
   43    HB3  ALA   9           HB3      ALA   9   7.967  -9.571   9.066
   44    H    VAL  10           H        VAL  10   8.404  -8.844   7.189
   45    HA   VAL  10           HA       VAL  10   8.765  -6.345   5.670
   46    HB   VAL  10           HB       VAL  10  10.800  -7.279   6.813
   47   HG11  VAL  10          HG11      VAL  10  10.923  -9.358   4.676
   48   HG12  VAL  10          HG12      VAL  10  11.739  -9.301   6.239
   49   HG13  VAL  10          HG13      VAL  10  10.021  -9.688   6.154
   50   HG21  VAL  10          HG21      VAL  10  11.119  -7.308   3.826
   51   HG22  VAL  10          HG22      VAL  10  10.759  -5.826   4.712
   52   HG23  VAL  10          HG23      VAL  10  12.244  -6.716   5.049
   53    H    ARG  11           H        ARG  11   7.202  -9.225   5.538
   54    HA   ARG  11           HA       ARG  11   7.755 -10.076   2.880
   55    HB2  ARG  11           HB2      ARG  11   5.749 -10.728   4.970
   56    HB3  ARG  11           HB3      ARG  11   5.319 -11.112   3.309
   57    HG2  ARG  11           HG2      ARG  11   7.849 -12.030   4.655
   58    HG3  ARG  11           HG3      ARG  11   6.369 -12.985   4.550
   59    HD2  ARG  11           HD2      ARG  11   7.415 -13.786   2.701
   60    HD3  ARG  11           HD3      ARG  11   6.640 -12.380   1.972
   61    HE   ARG  11           HE       ARG  11   8.706 -11.403   1.717
   62   HH11  ARG  11          HH11      ARG  11   8.972 -14.194   3.780
   63   HH12  ARG  11          HH12      ARG  11  10.705 -14.198   3.771
   64   HH21  ARG  11          HH21      ARG  11  10.987 -11.398   1.696
   65   HH22  ARG  11          HH22      ARG  11  11.850 -12.607   2.586
   66    H    CYS  12           H        CYS  12   6.209  -7.368   4.039
   67    HA   CYS  12           HA       CYS  12   4.134  -7.176   2.052
   68    HB2  CYS  12           HB2      CYS  12   4.189  -6.095   4.405
   69    HB3  CYS  12           HB3      CYS  12   5.196  -4.862   3.653
   70    H    ARG  13           H        ARG  13   5.580  -7.568   0.209
   71    HA   ARG  13           HA       ARG  13   6.720  -5.038  -0.750
   72    HB2  ARG  13           HB2      ARG  13   8.088  -7.632  -0.416
   73    HB3  ARG  13           HB3      ARG  13   8.351  -6.838  -1.963
   74    HG2  ARG  13           HG2      ARG  13   9.638  -5.238  -1.068
   75    HG3  ARG  13           HG3      ARG  13   8.629  -5.090   0.373
   76    HD2  ARG  13           HD2      ARG  13  10.807  -5.905   1.005
   77    HD3  ARG  13           HD3      ARG  13   9.616  -7.185   1.233
   78    HE   ARG  13           HE       ARG  13  10.601  -7.629  -1.266
   79   HH11  ARG  13          HH11      ARG  13  12.017  -7.282   1.895
   80   HH12  ARG  13          HH12      ARG  13  13.356  -8.327   1.553
   81   HH21  ARG  13          HH21      ARG  13  12.359  -9.006  -1.729
   82   HH22  ARG  13          HH22      ARG  13  13.550  -9.307  -0.509
   83    H    PHE  14           H        PHE  14   6.639  -4.728  -3.002
   84    HA   PHE  14           HA       PHE  14   4.374  -5.803  -4.282
   85    HB2  PHE  14           HB2      PHE  14   5.472  -3.565  -4.742
   86    HB3  PHE  14           HB3      PHE  14   6.691  -4.442  -5.661
   87    HD1  PHE  14           HD1      PHE  14   3.213  -3.336  -5.564
   88    HD2  PHE  14           HD2      PHE  14   6.155  -5.459  -7.788
   89    HE1  PHE  14           HE1      PHE  14   1.764  -3.255  -7.551
   90    HE2  PHE  14           HE2      PHE  14   4.712  -5.381  -9.779
   91    HZ   PHE  14           HZ       PHE  14   2.514  -4.277  -9.662
   92    H    ALA  15           H        ALA  15   7.712  -6.766  -4.224
   93    HA   ALA  15           HA       ALA  15   7.841  -8.315  -6.547
   94    HB1  ALA  15           HB1      ALA  15   9.278  -9.327  -4.173
   95    HB2  ALA  15           HB2      ALA  15   9.868  -8.982  -5.799
   96    HB3  ALA  15           HB3      ALA  15   9.620  -7.665  -4.653
   97    H    CYS  16           H        CYS  16   6.507  -9.016  -3.380
   98    HA   CYS  16           HA       CYS  16   6.279 -11.777  -3.509
   99    HB2  CYS  16           HB2      CYS  16   5.749 -10.709  -1.456
  100    HB3  CYS  16           HB3      CYS  16   4.531  -9.689  -2.215
  101    H    CYS  17           H        CYS  17   4.288  -9.282  -4.977
  102    HA   CYS  17           HA       CYS  17   2.118 -10.875  -5.761
  103    HB2  CYS  17           HB2      CYS  17   3.111  -8.207  -6.313
  104    HB3  CYS  17           HB3      CYS  17   2.430  -8.944  -7.760
  105    HN1  NH2  18           H1       NH2  18   2.075 -12.559  -7.081
  106    HN2  NH2  18           H2       NH2  18   3.081 -12.873  -8.424
  Start of MODEL   14
    1    H1   ASP   1           H        ASP   1   3.934   1.041  -0.003
    2    HA   ASP   1           HA       ASP   1   1.344  -0.113  -0.419
    3    HB2  ASP   1           HB2      ASP   1   1.466   1.663  -2.197
    4    HB3  ASP   1           HB3      ASP   1   2.841   0.799  -2.881
    5    H    CYS   2           H        CYS   2   1.445  -2.264  -1.043
    6    HA   CYS   2           HA       CYS   2   3.864  -3.464  -1.995
    7    HB2  CYS   2           HB2      CYS   2   3.870  -5.029   0.125
    8    HB3  CYS   2           HB3      CYS   2   4.743  -3.500   0.137
    9    H    CYS   3           H        CYS   3   3.554  -6.045  -1.497
   10    HA   CYS   3           HA       CYS   3   0.760  -6.686  -2.168
   11    HB2  CYS   3           HB2      CYS   3   2.270  -6.685  -4.183
   12    HB3  CYS   3           HB3      CYS   3   3.169  -8.000  -3.434
   13    HA   HYP   4           HA       HYP   4   2.234  -7.935   1.568
   14    HB2  HYP   4           HB2      HYP   4   0.461  -7.635   3.039
   15    HB3  HYP   4           HB3      HYP   4  -0.602  -8.726   2.141
   16    HG   HYP   4           HG       HYP   4  -1.436  -6.677   1.380
   17   HD22  HYP   4           HD2      HYP   4  -0.827  -7.276  -0.780
   18   HD23  HYP   4           HD3      HYP   4   0.513  -6.143  -0.585
   19    HD1  HYP   4           HOD      HYP   4   0.989  -5.440   1.129
   20    H    CYS   5           H        CYS   5   3.491  -9.683   1.697
   21    HA   CYS   5           HA       CYS   5   2.332 -12.358   1.564
   22    HB2  CYS   5           HB2      CYS   5   5.000 -11.193   1.186
   23    HB3  CYS   5           HB3      CYS   5   5.007 -12.709   2.081
   24    HA   HYP   6           HA       HYP   6   1.359 -13.429   4.971
   25    HB2  HYP   6           HB2      HYP   6   1.510 -15.735   5.218
   26    HB3  HYP   6           HB3      HYP   6   3.276 -15.709   5.324
   27    HG   HYP   6           HG       HYP   6   3.042 -16.386   3.096
   28   HD22  HYP   6           HD2      HYP   6   4.157 -14.458   2.435
   29   HD23  HYP   6           HD3      HYP   6   2.572 -13.857   1.945
   30    HD1  HYP   6           HOD      HYP   6   0.957 -14.724   2.495
   31    H    ALA   7           H        ALA   7   4.494 -12.495   5.446
   32    HA   ALA   7           HA       ALA   7   4.638 -13.021   8.293
   33    HB1  ALA   7           HB1      ALA   7   6.491 -11.170   6.853
   34    HB2  ALA   7           HB2      ALA   7   6.812 -12.242   8.216
   35    HB3  ALA   7           HB3      ALA   7   6.602 -12.911   6.598
   36    H    GLY   8           H        GLY   8   4.181 -10.227   6.153
   37    HA2  GLY   8           HA2      GLY   8   2.851  -8.355   6.622
   38    HA3  GLY   8           HA3      GLY   8   2.789  -8.848   8.308
   39    H    ALA   9           H        ALA   9   5.695  -9.166   8.499
   40    HA   ALA   9           HA       ALA   9   6.333  -6.503   9.273
   41    HB1  ALA   9           HB1      ALA   9   7.815  -9.097   9.246
   42    HB2  ALA   9           HB2      ALA   9   8.676  -7.590   9.563
   43    HB3  ALA   9           HB3      ALA   9   7.348  -8.085  10.613
   44    H    VAL  10           H        VAL  10   8.461  -8.501   7.271
   45    HA   VAL  10           HA       VAL  10   8.957  -6.144   5.584
   46    HB   VAL  10           HB       VAL  10  10.669  -8.619   5.824
   47   HG11  VAL  10          HG11      VAL  10  11.743  -7.775   4.075
   48   HG12  VAL  10          HG12      VAL  10  10.687  -6.361   4.062
   49   HG13  VAL  10          HG13      VAL  10  12.151  -6.361   5.046
   50   HG21  VAL  10          HG21      VAL  10  12.120  -7.347   7.283
   51   HG22  VAL  10          HG22      VAL  10  11.054  -5.947   7.171
   52   HG23  VAL  10          HG23      VAL  10  10.499  -7.416   7.973
   53    H    ARG  11           H        ARG  11   7.388  -9.113   5.582
   54    HA   ARG  11           HA       ARG  11   7.836  -9.978   2.927
   55    HB2  ARG  11           HB2      ARG  11   5.863 -10.574   5.067
   56    HB3  ARG  11           HB3      ARG  11   5.409 -10.996   3.422
   57    HG2  ARG  11           HG2      ARG  11   7.874 -11.930   4.876
   58    HG3  ARG  11           HG3      ARG  11   6.424 -12.883   4.554
   59    HD2  ARG  11           HD2      ARG  11   7.336 -11.763   2.102
   60    HD3  ARG  11           HD3      ARG  11   8.705 -12.524   2.910
   61    HE   ARG  11           HE       ARG  11   6.321 -14.142   2.818
   62   HH11  ARG  11          HH11      ARG  11   9.273 -13.251   1.203
   63   HH12  ARG  11          HH12      ARG  11   9.363 -14.714   0.279
   64   HH21  ARG  11          HH21      ARG  11   6.427 -16.072   1.606
   65   HH22  ARG  11          HH22      ARG  11   7.743 -16.317   0.508
   66    H    CYS  12           H        CYS  12   6.213  -7.293   4.135
   67    HA   CYS  12           HA       CYS  12   4.169  -7.120   2.119
   68    HB2  CYS  12           HB2      CYS  12   4.181  -6.071   4.494
   69    HB3  CYS  12           HB3      CYS  12   5.142  -4.794   3.754
   70    H    ARG  13           H        ARG  13   5.703  -7.467   0.314
   71    HA   ARG  13           HA       ARG  13   6.759  -4.885  -0.608
   72    HB2  ARG  13           HB2      ARG  13   8.175  -7.466  -1.223
   73    HB3  ARG  13           HB3      ARG  13   8.774  -5.820  -1.382
   74    HG2  ARG  13           HG2      ARG  13   8.720  -5.631   1.100
   75    HG3  ARG  13           HG3      ARG  13   8.305  -7.346   1.167
   76    HD2  ARG  13           HD2      ARG  13  10.828  -6.088   0.115
   77    HD3  ARG  13           HD3      ARG  13  10.654  -7.181   1.487
   78    HE   ARG  13           HE       ARG  13   9.732  -8.550  -0.732
   79   HH11  ARG  13          HH11      ARG  13  12.716  -7.114   0.340
   80   HH12  ARG  13          HH12      ARG  13  13.717  -8.229  -0.529
   81   HH21  ARG  13          HH21      ARG  13  11.039 -10.025  -1.881
   82   HH22  ARG  13          HH22      ARG  13  12.762  -9.884  -1.793
   83    H    PHE  14           H        PHE  14   6.719  -4.561  -2.860
   84    HA   PHE  14           HA       PHE  14   4.512  -5.691  -4.194
   85    HB2  PHE  14           HB2      PHE  14   5.489  -3.424  -4.641
   86    HB3  PHE  14           HB3      PHE  14   6.830  -4.219  -5.459
   87    HD1  PHE  14           HD1      PHE  14   3.143  -3.827  -5.537
   88    HD2  PHE  14           HD2      PHE  14   6.673  -4.793  -7.709
   89    HE1  PHE  14           HE1      PHE  14   1.847  -3.845  -7.629
   90    HE2  PHE  14           HE2      PHE  14   5.384  -4.812  -9.804
   91    HZ   PHE  14           HZ       PHE  14   2.968  -4.337  -9.766
   92    H    ALA  15           H        ALA  15   7.865  -6.576  -4.055
   93    HA   ALA  15           HA       ALA  15   8.085  -8.101  -6.391
   94    HB1  ALA  15           HB1      ALA  15   9.912  -7.391  -4.742
   95    HB2  ALA  15           HB2      ALA  15   9.468  -8.835  -3.832
   96    HB3  ALA  15           HB3      ALA  15  10.052  -8.982  -5.490
   97    H    CYS  16           H        CYS  16   6.737  -8.867  -3.241
   98    HA   CYS  16           HA       CYS  16   6.583 -11.625  -3.378
   99    HB2  CYS  16           HB2      CYS  16   5.964 -10.549  -1.347
  100    HB3  CYS  16           HB3      CYS  16   4.713  -9.602  -2.147
  101    H    CYS  17           H        CYS  17   4.598  -9.201  -4.951
  102    HA   CYS  17           HA       CYS  17   2.494 -10.876  -5.783
  103    HB2  CYS  17           HB2      CYS  17   3.368  -8.164  -6.258
  104    HB3  CYS  17           HB3      CYS  17   2.821  -8.905  -7.759
  105    HN1  NH2  18           H1       NH2  18   2.579 -12.565  -7.096
  106    HN2  NH2  18           H2       NH2  18   3.630 -12.822  -8.417
  Start of MODEL   15
    1    H1   ASP   1           H        ASP   1   3.802   0.918   0.010
    2    HA   ASP   1           HA       ASP   1   1.237  -0.249  -0.562
    3    HB2  ASP   1           HB2      ASP   1   2.861   0.964  -2.808
    4    HB3  ASP   1           HB3      ASP   1   1.503  -0.135  -3.038
    5    H    CYS   2           H        CYS   2   1.391  -2.392  -1.061
    6    HA   CYS   2           HA       CYS   2   3.825  -3.572  -2.020
    7    HB2  CYS   2           HB2      CYS   2   3.802  -5.130   0.121
    8    HB3  CYS   2           HB3      CYS   2   4.704  -3.618   0.102
    9    H    CYS   3           H        CYS   3   3.532  -6.155  -1.503
   10    HA   CYS   3           HA       CYS   3   0.751  -6.821  -2.202
   11    HB2  CYS   3           HB2      CYS   3   3.260  -7.427  -3.660
   12    HB3  CYS   3           HB3      CYS   3   2.093  -8.740  -3.541
   13    HA   HYP   4           HA       HYP   4   2.218  -8.020   1.564
   14    HB2  HYP   4           HB2      HYP   4   0.446  -7.689   3.031
   15    HB3  HYP   4           HB3      HYP   4  -0.624  -8.784   2.146
   16    HG   HYP   4           HG       HYP   4  -1.444  -6.740   1.358
   17   HD22  HYP   4           HD2      HYP   4  -0.837  -7.370  -0.794
   18   HD23  HYP   4           HD3      HYP   4   0.510  -6.244  -0.612
   19    HD1  HYP   4           HOD      HYP   4   0.990  -5.522   1.094
   20    H    CYS   5           H        CYS   5   3.434  -9.746   1.895
   21    HA   CYS   5           HA       CYS   5   2.248 -12.424   1.764
   22    HB2  CYS   5           HB2      CYS   5   5.008 -11.338   1.487
   23    HB3  CYS   5           HB3      CYS   5   4.835 -12.964   2.140
   24    HA   HYP   6           HA       HYP   6   1.268 -13.274   5.238
   25    HB2  HYP   6           HB2      HYP   6   1.257 -15.577   5.551
   26    HB3  HYP   6           HB3      HYP   6   3.021 -15.681   5.604
   27    HG   HYP   6           HG       HYP   6   2.668 -16.402   3.406
   28   HD22  HYP   6           HD2      HYP   6   3.901 -14.582   2.653
   29   HD23  HYP   6           HD3      HYP   6   2.350 -13.878   2.192
   30    HD1  HYP   6           HOD      HYP   6   0.693 -14.606   2.816
   31    H    ALA   7           H        ALA   7   4.471 -12.553   5.591
   32    HA   ALA   7           HA       ALA   7   4.723 -13.045   8.426
   33    HB1  ALA   7           HB1      ALA   7   6.535 -11.229   6.889
   34    HB2  ALA   7           HB2      ALA   7   6.905 -12.299   8.242
   35    HB3  ALA   7           HB3      ALA   7   6.603 -12.974   6.641
   36    H    GLY   8           H        GLY   8   4.219 -10.235   6.318
   37    HA2  GLY   8           HA2      GLY   8   2.950  -8.338   6.856
   38    HA3  GLY   8           HA3      GLY   8   2.961  -8.836   8.541
   39    H    ALA   9           H        ALA   9   5.873  -9.214   8.573
   40    HA   ALA   9           HA       ALA   9   6.604  -6.581   9.350
   41    HB1  ALA   9           HB1      ALA   9   7.656  -8.256  10.570
   42    HB2  ALA   9           HB2      ALA   9   8.085  -9.175   9.127
   43    HB3  ALA   9           HB3      ALA   9   8.933  -7.675   9.502
   44    H    VAL  10           H        VAL  10   8.591  -8.543   7.180
   45    HA   VAL  10           HA       VAL  10   8.950  -6.164   5.486
   46    HB   VAL  10           HB       VAL  10  10.754  -8.579   5.609
   47   HG11  VAL  10          HG11      VAL  10  12.384  -6.882   4.655
   48   HG12  VAL  10          HG12      VAL  10  11.093  -7.425   3.581
   49   HG13  VAL  10          HG13      VAL  10  10.983  -5.850   4.368
   50   HG21  VAL  10          HG21      VAL  10  12.232  -7.267   7.028
   51   HG22  VAL  10          HG22      VAL  10  11.070  -5.940   7.039
   52   HG23  VAL  10          HG23      VAL  10  10.661  -7.478   7.801
   53    H    ARG  11           H        ARG  11   7.417  -9.128   5.565
   54    HA   ARG  11           HA       ARG  11   7.785 -10.061   2.927
   55    HB2  ARG  11           HB2      ARG  11   5.868 -10.571   5.130
   56    HB3  ARG  11           HB3      ARG  11   5.331 -10.997   3.511
   57    HG2  ARG  11           HG2      ARG  11   7.816 -11.997   4.885
   58    HG3  ARG  11           HG3      ARG  11   6.330 -12.907   4.603
   59    HD2  ARG  11           HD2      ARG  11   7.146 -11.856   2.114
   60    HD3  ARG  11           HD3      ARG  11   8.579 -12.544   2.877
   61    HE   ARG  11           HE       ARG  11   6.254 -14.249   2.940
   62   HH11  ARG  11          HH11      ARG  11   9.095 -13.299   1.167
   63   HH12  ARG  11          HH12      ARG  11   9.197 -14.784   0.279
   64   HH21  ARG  11          HH21      ARG  11   6.377 -16.208   1.778
   65   HH22  ARG  11          HH22      ARG  11   7.650 -16.437   0.627
   66    H    CYS  12           H        CYS  12   6.223  -7.318   4.094
   67    HA   CYS  12           HA       CYS  12   4.152  -7.160   2.106
   68    HB2  CYS  12           HB2      CYS  12   4.269  -6.040   4.467
   69    HB3  CYS  12           HB3      CYS  12   5.172  -4.785   3.626
   70    H    ARG  13           H        ARG  13   5.658  -7.584   0.291
   71    HA   ARG  13           HA       ARG  13   6.768  -5.048  -0.701
   72    HB2  ARG  13           HB2      ARG  13   8.036  -7.777  -0.996
   73    HB3  ARG  13           HB3      ARG  13   8.614  -6.300  -1.756
   74    HG2  ARG  13           HG2      ARG  13   9.440  -5.448   0.201
   75    HG3  ARG  13           HG3      ARG  13   8.307  -6.359   1.202
   76    HD2  ARG  13           HD2      ARG  13  10.468  -7.307   1.526
   77    HD3  ARG  13           HD3      ARG  13   9.537  -8.438   0.545
   78    HE   ARG  13           HE       ARG  13  10.882  -6.890  -1.263
   79   HH11  ARG  13          HH11      ARG  13  11.785  -8.896   1.435
   80   HH12  ARG  13          HH12      ARG  13  13.325  -9.326   0.767
   81   HH21  ARG  13          HH21      ARG  13  12.906  -7.449  -2.153
   82   HH22  ARG  13          HH22      ARG  13  13.962  -8.502  -1.273
   83    H    PHE  14           H        PHE  14   6.594  -4.692  -2.918
   84    HA   PHE  14           HA       PHE  14   4.345  -5.839  -4.181
   85    HB2  PHE  14           HB2      PHE  14   5.051  -3.566  -4.684
   86    HB3  PHE  14           HB3      PHE  14   6.581  -4.155  -5.327
   87    HD1  PHE  14           HD1      PHE  14   2.908  -4.364  -5.853
   88    HD2  PHE  14           HD2      PHE  14   6.786  -4.632  -7.586
   89    HE1  PHE  14           HE1      PHE  14   1.894  -4.536  -8.088
   90    HE2  PHE  14           HE2      PHE  14   5.778  -4.803  -9.823
   91    HZ   PHE  14           HZ       PHE  14   3.329  -4.755 -10.077
   92    H    ALA  15           H        ALA  15   7.722  -6.632  -4.200
   93    HA   ALA  15           HA       ALA  15   7.909  -8.074  -6.586
   94    HB1  ALA  15           HB1      ALA  15   9.562  -7.556  -4.388
   95    HB2  ALA  15           HB2      ALA  15   9.477  -9.313  -4.522
   96    HB3  ALA  15           HB3      ALA  15  10.002  -8.348  -5.902
   97    H    CYS  16           H        CYS  16   6.541  -8.931  -3.489
   98    HA   CYS  16           HA       CYS  16   6.468 -11.706  -3.710
   99    HB2  CYS  16           HB2      CYS  16   5.351  -9.727  -2.004
  100    HB3  CYS  16           HB3      CYS  16   4.043 -10.799  -2.493
  101    H    CYS  17           H        CYS  17   4.345  -9.251  -5.067
  102    HA   CYS  17           HA       CYS  17   2.260 -10.901  -5.933
  103    HB2  CYS  17           HB2      CYS  17   3.211  -8.188  -6.494
  104    HB3  CYS  17           HB3      CYS  17   2.401  -8.940  -7.865
  105    HN1  NH2  18           H1       NH2  18   5.281  -9.975  -7.536
  106    HN2  NH2  18           H2       NH2  18   5.240 -11.125  -8.798
  Start of MODEL   16
    1    H1   ASP   1           H        ASP   1   2.290   0.873   0.877
    2    HA   ASP   1           HA       ASP   1   1.375  -0.061  -1.680
    3    HB2  ASP   1           HB2      ASP   1   4.074   1.162  -1.138
    4    HB3  ASP   1           HB3      ASP   1   3.116   1.231  -2.616
    5    H    CYS   2           H        CYS   2   1.427  -2.362  -1.159
    6    HA   CYS   2           HA       CYS   2   3.840  -3.577  -2.111
    7    HB2  CYS   2           HB2      CYS   2   3.800  -5.141   0.026
    8    HB3  CYS   2           HB3      CYS   2   4.726  -3.644   0.008
    9    H    CYS   3           H        CYS   3   3.510  -6.158  -1.600
   10    HA   CYS   3           HA       CYS   3   0.716  -6.781  -2.286
   11    HB2  CYS   3           HB2      CYS   3   3.225  -7.496  -3.729
   12    HB3  CYS   3           HB3      CYS   3   1.936  -8.694  -3.678
   13    HA   HYP   4           HA       HYP   4   2.190  -8.020   1.463
   14    HB2  HYP   4           HB2      HYP   4   0.432  -7.675   2.942
   15    HB3  HYP   4           HB3      HYP   4  -0.658  -8.751   2.058
   16    HG   HYP   4           HG       HYP   4  -1.456  -6.691   1.286
   17   HD22  HYP   4           HD2      HYP   4  -0.871  -7.317  -0.873
   18   HD23  HYP   4           HD3      HYP   4   0.492  -6.210  -0.693
   19    HD1  HYP   4           HOD      HYP   4   0.992  -5.504   1.014
   20    H    CYS   5           H        CYS   5   3.387  -9.765   1.770
   21    HA   CYS   5           HA       CYS   5   2.181 -12.428   1.607
   22    HB2  CYS   5           HB2      CYS   5   4.937 -11.347   1.364
   23    HB3  CYS   5           HB3      CYS   5   4.776 -12.956   2.061
   24    HA   HYP   6           HA       HYP   6   1.131 -13.342   5.042
   25    HB2  HYP   6           HB2      HYP   6   1.130 -15.649   5.325
   26    HB3  HYP   6           HB3      HYP   6   2.894 -15.740   5.422
   27    HG   HYP   6           HG       HYP   6   2.602 -16.435   3.207
   28   HD22  HYP   6           HD2      HYP   6   3.838 -14.596   2.508
   29   HD23  HYP   6           HD3      HYP   6   2.293 -13.898   2.016
   30    HD1  HYP   6           HOD      HYP   6   0.628 -14.647   2.589
   31    H    ALA   7           H        ALA   7   4.322 -12.609   5.485
   32    HA   ALA   7           HA       ALA   7   4.475 -13.115   8.330
   33    HB1  ALA   7           HB1      ALA   7   6.672 -12.257   8.231
   34    HB2  ALA   7           HB2      ALA   7   6.446 -13.181   6.745
   35    HB3  ALA   7           HB3      ALA   7   6.357 -11.420   6.710
   36    H    GLY   8           H        GLY   8   4.111 -10.304   6.193
   37    HA2  GLY   8           HA2      GLY   8   2.888  -8.366   6.667
   38    HA3  GLY   8           HA3      GLY   8   2.780  -8.872   8.346
   39    H    ALA   9           H        ALA   9   5.672  -9.335   8.556
   40    HA   ALA   9           HA       ALA   9   6.437  -6.761   9.440
   41    HB1  ALA   9           HB1      ALA   9   7.592  -8.272  10.651
   42    HB2  ALA   9           HB2      ALA   9   7.673  -9.434   9.326
   43    HB3  ALA   9           HB3      ALA   9   8.789  -8.069   9.371
   44    H    VAL  10           H        VAL  10   8.420  -8.663   7.206
   45    HA   VAL  10           HA       VAL  10   8.823  -6.215   5.615
   46    HB   VAL  10           HB       VAL  10  10.836  -7.125   6.814
   47   HG11  VAL  10          HG11      VAL  10  10.323  -9.503   6.569
   48   HG12  VAL  10          HG12      VAL  10  10.550  -9.374   4.823
   49   HG13  VAL  10          HG13      VAL  10  11.914  -9.120   5.913
   50   HG21  VAL  10          HG21      VAL  10  11.906  -5.989   5.235
   51   HG22  VAL  10          HG22      VAL  10  11.872  -7.412   4.194
   52   HG23  VAL  10          HG23      VAL  10  10.559  -6.237   4.123
   53    H    ARG  11           H        ARG  11   7.249  -9.095   5.556
   54    HA   ARG  11           HA       ARG  11   7.828 -10.005   2.916
   55    HB2  ARG  11           HB2      ARG  11   5.785 -10.628   4.996
   56    HB3  ARG  11           HB3      ARG  11   5.448 -11.112   3.339
   57    HG2  ARG  11           HG2      ARG  11   7.982 -11.845   4.780
   58    HG3  ARG  11           HG3      ARG  11   6.531 -12.850   4.791
   59    HD2  ARG  11           HD2      ARG  11   7.617 -13.784   3.018
   60    HD3  ARG  11           HD3      ARG  11   6.723 -12.520   2.175
   61    HE   ARG  11           HE       ARG  11   8.705 -11.439   1.741
   62   HH11  ARG  11          HH11      ARG  11   9.230 -13.960   4.084
   63   HH12  ARG  11          HH12      ARG  11  10.958 -13.843   4.015
   64   HH21  ARG  11          HH21      ARG  11  10.978 -11.276   1.641
   65   HH22  ARG  11          HH22      ARG  11  11.950 -12.316   2.626
   66    H    CYS  12           H        CYS  12   6.256  -7.292   4.012
   67    HA   CYS  12           HA       CYS  12   4.164  -7.177   2.036
   68    HB2  CYS  12           HB2      CYS  12   4.271  -6.027   4.379
   69    HB3  CYS  12           HB3      CYS  12   5.182  -4.783   3.530
   70    H    ARG  13           H        ARG  13   5.565  -7.580   0.178
   71    HA   ARG  13           HA       ARG  13   6.703  -5.067  -0.830
   72    HB2  ARG  13           HB2      ARG  13   7.972  -7.802  -1.053
   73    HB3  ARG  13           HB3      ARG  13   8.520  -6.374  -1.921
   74    HG2  ARG  13           HG2      ARG  13   9.539  -5.502  -0.116
   75    HG3  ARG  13           HG3      ARG  13   8.292  -6.072   0.995
   76    HD2  ARG  13           HD2      ARG  13  10.300  -7.243   1.515
   77    HD3  ARG  13           HD3      ARG  13   9.219  -8.380   0.710
   78    HE   ARG  13           HE       ARG  13  10.864  -7.219  -1.227
   79   HH11  ARG  13          HH11      ARG  13  11.107  -9.342   1.522
   80   HH12  ARG  13          HH12      ARG  13  12.482 -10.197   0.904
   81   HH21  ARG  13          HH21      ARG  13  12.674  -8.338  -2.051
   82   HH22  ARG  13          HH22      ARG  13  13.372  -9.625  -1.127
   83    H    PHE  14           H        PHE  14   6.514  -4.736  -3.052
   84    HA   PHE  14           HA       PHE  14   4.254  -5.900  -4.282
   85    HB2  PHE  14           HB2      PHE  14   4.954  -3.624  -4.804
   86    HB3  PHE  14           HB3      PHE  14   6.470  -4.220  -5.471
   87    HD1  PHE  14           HD1      PHE  14   6.524  -5.354  -7.623
   88    HD2  PHE  14           HD2      PHE  14   2.900  -3.784  -6.035
   89    HE1  PHE  14           HE1      PHE  14   5.476  -5.539  -9.841
   90    HE2  PHE  14           HE2      PHE  14   1.846  -3.968  -8.251
   91    HZ   PHE  14           HZ       PHE  14   3.133  -4.847 -10.157
   92    H    ALA  15           H        ALA  15   7.621  -6.703  -4.297
   93    HA   ALA  15           HA       ALA  15   7.822  -8.141  -6.682
   94    HB1  ALA  15           HB1      ALA  15   9.835  -7.692  -5.587
   95    HB2  ALA  15           HB2      ALA  15   9.257  -8.352  -4.056
   96    HB3  ALA  15           HB3      ALA  15   9.625  -9.434  -5.399
   97    H    CYS  16           H        CYS  16   6.382  -8.983  -3.620
   98    HA   CYS  16           HA       CYS  16   6.295 -11.765  -3.862
   99    HB2  CYS  16           HB2      CYS  16   5.153  -9.769  -2.159
  100    HB3  CYS  16           HB3      CYS  16   3.889 -10.905  -2.621
  101    H    CYS  17           H        CYS  17   4.192  -9.266  -5.174
  102    HA   CYS  17           HA       CYS  17   2.075 -10.848  -6.051
  103    HB2  CYS  17           HB2      CYS  17   3.121  -8.176  -6.636
  104    HB3  CYS  17           HB3      CYS  17   2.294  -8.913  -8.004
  105    HN1  NH2  18           H1       NH2  18   1.593 -11.835  -8.029
  106    HN2  NH2  18           H2       NH2  18   2.773 -12.357  -9.148
  Start of MODEL   17
    1    H1   ASP   1           H        ASP   1   0.523   0.511  -0.172
    2    HA   ASP   1           HA       ASP   1   1.759   0.174  -2.174
    3    HB2  ASP   1           HB2      ASP   1   3.888   1.307  -1.798
    4    HB3  ASP   1           HB3      ASP   1   2.608   2.091  -0.876
    5    H    CYS   2           H        CYS   2   1.434  -2.381  -1.298
    6    HA   CYS   2           HA       CYS   2   3.840  -3.625  -2.232
    7    HB2  CYS   2           HB2      CYS   2   3.790  -5.155  -0.069
    8    HB3  CYS   2           HB3      CYS   2   4.727  -3.665  -0.112
    9    H    CYS   3           H        CYS   3   3.495  -6.195  -1.679
   10    HA   CYS   3           HA       CYS   3   0.697  -6.812  -2.355
   11    HB2  CYS   3           HB2      CYS   3   3.202  -7.572  -3.784
   12    HB3  CYS   3           HB3      CYS   3   1.899  -8.754  -3.718
   13    HA   HYP   4           HA       HYP   4   2.167  -8.001   1.413
   14    HB2  HYP   4           HB2      HYP   4   0.412  -7.620   2.888
   15    HB3  HYP   4           HB3      HYP   4  -0.686  -8.704   2.022
   16    HG   HYP   4           HG       HYP   4  -1.471  -6.651   1.218
   17   HD22  HYP   4           HD2      HYP   4  -0.892  -7.315  -0.931
   18   HD23  HYP   4           HD3      HYP   4   0.478  -6.214  -0.770
   19    HD1  HYP   4           HOD      HYP   4   0.984  -5.484   0.925
   20    H    CYS   5           H        CYS   5   3.351  -9.747   1.753
   21    HA   CYS   5           HA       CYS   5   2.128 -12.405   1.632
   22    HB2  CYS   5           HB2      CYS   5   4.890 -11.347   1.369
   23    HB3  CYS   5           HB3      CYS   5   4.720 -12.942   2.093
   24    HA   HYP   6           HA       HYP   6   1.074 -13.257   5.082
   25    HB2  HYP   6           HB2      HYP   6   1.059 -15.558   5.403
   26    HB3  HYP   6           HB3      HYP   6   2.822 -15.659   5.500
   27    HG   HYP   6           HG       HYP   6   2.524 -16.388   3.297
   28   HD22  HYP   6           HD2      HYP   6   3.772 -14.569   2.567
   29   HD23  HYP   6           HD3      HYP   6   2.231 -13.869   2.065
   30    HD1  HYP   6           HOD      HYP   6   0.561 -14.598   2.651
   31    H    ALA   7           H        ALA   7   4.271 -12.537   5.511
   32    HA   ALA   7           HA       ALA   7   4.423 -12.998   8.364
   33    HB1  ALA   7           HB1      ALA   7   6.314 -11.342   6.714
   34    HB2  ALA   7           HB2      ALA   7   6.625 -12.155   8.248
   35    HB3  ALA   7           HB3      ALA   7   6.392 -13.103   6.779
   36    H    GLY   8           H        GLY   8   4.075 -10.220   6.182
   37    HA2  GLY   8           HA2      GLY   8   2.865  -8.267   6.624
   38    HA3  GLY   8           HA3      GLY   8   2.756  -8.744   8.312
   39    H    ALA   9           H        ALA   9   5.644  -9.222   8.527
   40    HA   ALA   9           HA       ALA   9   6.427  -6.640   9.369
   41    HB1  ALA   9           HB1      ALA   9   8.772  -7.987   9.289
   42    HB2  ALA   9           HB2      ALA   9   7.599  -8.112  10.601
   43    HB3  ALA   9           HB3      ALA   9   7.622  -9.325   9.320
   44    H    VAL  10           H        VAL  10   8.397  -8.587   7.163
   45    HA   VAL  10           HA       VAL  10   8.810  -6.167   5.533
   46    HB   VAL  10           HB       VAL  10  10.820  -7.069   6.744
   47   HG11  VAL  10          HG11      VAL  10  10.294  -9.448   6.536
   48   HG12  VAL  10          HG12      VAL  10  10.520  -9.348   4.789
   49   HG13  VAL  10          HG13      VAL  10  11.887  -9.083   5.872
   50   HG21  VAL  10          HG21      VAL  10  10.851  -5.707   4.606
   51   HG22  VAL  10          HG22      VAL  10  12.300  -6.651   4.952
   52   HG23  VAL  10          HG23      VAL  10  11.137  -7.227   3.757
   53    H    ARG  11           H        ARG  11   7.221  -9.039   5.521
   54    HA   ARG  11           HA       ARG  11   7.792  -9.995   2.896
   55    HB2  ARG  11           HB2      ARG  11   5.747 -10.573   4.987
   56    HB3  ARG  11           HB3      ARG  11   5.408 -11.082   3.339
   57    HG2  ARG  11           HG2      ARG  11   7.939 -11.804   4.788
   58    HG3  ARG  11           HG3      ARG  11   6.483 -12.801   4.821
   59    HD2  ARG  11           HD2      ARG  11   7.560 -13.772   3.062
   60    HD3  ARG  11           HD3      ARG  11   6.670 -12.519   2.198
   61    HE   ARG  11           HE       ARG  11   8.656 -11.455   1.741
   62   HH11  ARG  11          HH11      ARG  11   9.175 -13.938   4.125
   63   HH12  ARG  11          HH12      ARG  11  10.903 -13.832   4.049
   64   HH21  ARG  11          HH21      ARG  11  10.929 -11.306   1.632
   65   HH22  ARG  11          HH22      ARG  11  11.900 -12.334   2.631
   66    H    CYS  12           H        CYS  12   6.237  -7.256   3.949
   67    HA   CYS  12           HA       CYS  12   4.142  -7.161   1.975
   68    HB2  CYS  12           HB2      CYS  12   4.262  -5.971   4.297
   69    HB3  CYS  12           HB3      CYS  12   5.180  -4.748   3.425
   70    H    ARG  13           H        ARG  13   5.560  -7.615   0.132
   71    HA   ARG  13           HA       ARG  13   6.708  -5.125  -0.924
   72    HB2  ARG  13           HB2      ARG  13   7.949  -7.876  -1.085
   73    HB3  ARG  13           HB3      ARG  13   8.500  -6.485  -2.010
   74    HG2  ARG  13           HG2      ARG  13   9.539  -5.551  -0.244
   75    HG3  ARG  13           HG3      ARG  13   8.308  -6.089   0.901
   76    HD2  ARG  13           HD2      ARG  13  10.264  -7.277   1.463
   77    HD3  ARG  13           HD3      ARG  13   9.242  -8.423   0.595
   78    HE   ARG  13           HE       ARG  13  10.845  -7.331  -1.329
   79   HH11  ARG  13          HH11      ARG  13  11.380  -8.997   1.681
   80   HH12  ARG  13          HH12      ARG  13  12.883  -9.696   1.178
   81   HH21  ARG  13          HH21      ARG  13  12.823  -8.245  -2.003
   82   HH22  ARG  13          HH22      ARG  13  13.704  -9.267  -0.918
   83    H    PHE  14           H        PHE  14   6.518  -4.828  -3.151
   84    HA   PHE  14           HA       PHE  14   4.242  -5.989  -4.357
   85    HB2  PHE  14           HB2      PHE  14   5.134  -3.697  -4.843
   86    HB3  PHE  14           HB3      PHE  14   6.451  -4.452  -5.734
   87    HD1  PHE  14           HD1      PHE  14   6.188  -5.052  -7.972
   88    HD2  PHE  14           HD2      PHE  14   2.761  -4.124  -5.624
   89    HE1  PHE  14           HE1      PHE  14   4.793  -5.096  -9.998
   90    HE2  PHE  14           HE2      PHE  14   1.360  -4.168  -7.646
   91    HZ   PHE  14           HZ       PHE  14   2.375  -4.655  -9.837
   92    H    ALA  15           H        ALA  15   7.601  -6.824  -4.366
   93    HA   ALA  15           HA       ALA  15   7.785  -8.298  -6.730
   94    HB1  ALA  15           HB1      ALA  15   9.717  -7.683  -5.348
   95    HB2  ALA  15           HB2      ALA  15   9.194  -8.836  -4.119
   96    HB3  ALA  15           HB3      ALA  15   9.688  -9.409  -5.712
   97    H    CYS  16           H        CYS  16   6.339  -9.081  -3.656
   98    HA   CYS  16           HA       CYS  16   6.225 -11.865  -3.856
   99    HB2  CYS  16           HB2      CYS  16   5.092  -9.830  -2.189
  100    HB3  CYS  16           HB3      CYS  16   3.828 -10.974  -2.628
  101    H    CYS  17           H        CYS  17   4.144  -9.367  -5.205
  102    HA   CYS  17           HA       CYS  17   2.012 -10.940  -6.058
  103    HB2  CYS  17           HB2      CYS  17   3.088  -8.290  -6.689
  104    HB3  CYS  17           HB3      CYS  17   2.249  -9.041  -8.043
  105    HN1  NH2  18           H1       NH2  18   4.911  -9.977  -7.897
  106    HN2  NH2  18           H2       NH2  18   4.878 -11.237  -9.049
  Start of MODEL   18
    1    H1   ASP   1           H        ASP   1   3.560   1.409  -0.677
    2    HA   ASP   1           HA       ASP   1   1.166  -0.309  -0.665
    3    HB2  ASP   1           HB2      ASP   1   2.547   1.179  -2.869
    4    HB3  ASP   1           HB3      ASP   1   1.657  -0.294  -3.243
    5    H    CYS   2           H        CYS   2   1.376  -2.460  -1.111
    6    HA   CYS   2           HA       CYS   2   3.859  -3.561  -2.080
    7    HB2  CYS   2           HB2      CYS   2   3.832  -5.130   0.055
    8    HB3  CYS   2           HB3      CYS   2   4.692  -3.594   0.061
    9    H    CYS   3           H        CYS   3   3.629  -6.156  -1.575
   10    HA   CYS   3           HA       CYS   3   0.887  -6.898  -2.347
   11    HB2  CYS   3           HB2      CYS   3   3.323  -7.183  -3.875
   12    HB3  CYS   3           HB3      CYS   3   2.612  -8.761  -3.550
   13    HA   HYP   4           HA       HYP   4   2.284  -8.061   1.457
   14    HB2  HYP   4           HB2      HYP   4   0.464  -7.781   2.875
   15    HB3  HYP   4           HB3      HYP   4  -0.551  -8.903   1.960
   16    HG   HYP   4           HG       HYP   4  -1.405  -6.881   1.152
   17   HD22  HYP   4           HD2      HYP   4  -0.723  -7.491  -0.983
   18   HD23  HYP   4           HD3      HYP   4   0.587  -6.329  -0.765
   19    HD1  HYP   4           HOD      HYP   4   1.001  -5.597   0.954
   20    H    CYS   5           H        CYS   5   3.557  -9.767   1.729
   21    HA   CYS   5           HA       CYS   5   2.445 -12.470   1.591
   22    HB2  CYS   5           HB2      CYS   5   5.176 -11.302   1.388
   23    HB3  CYS   5           HB3      CYS   5   5.038 -12.933   2.036
   24    HA   HYP   6           HA       HYP   6   1.397 -13.367   5.033
   25    HB2  HYP   6           HB2      HYP   6   1.439 -15.671   5.334
   26    HB3  HYP   6           HB3      HYP   6   3.204 -15.728   5.433
   27    HG   HYP   6           HG       HYP   6   2.929 -16.444   3.222
   28   HD22  HYP   6           HD2      HYP   6   4.130 -14.588   2.512
   29   HD23  HYP   6           HD3      HYP   6   2.573 -13.923   2.014
   30    HD1  HYP   6           HOD      HYP   6   0.922 -14.699   2.589
   31    H    ALA   7           H        ALA   7   4.585 -12.593   5.476
   32    HA   ALA   7           HA       ALA   7   4.770 -13.086   8.312
   33    HB1  ALA   7           HB1      ALA   7   6.938 -12.303   8.187
   34    HB2  ALA   7           HB2      ALA   7   6.689 -12.946   6.563
   35    HB3  ALA   7           HB3      ALA   7   6.578 -11.209   6.851
   36    H    GLY   8           H        GLY   8   4.250 -10.275   6.209
   37    HA2  GLY   8           HA2      GLY   8   2.937  -8.404   6.718
   38    HA3  GLY   8           HA3      GLY   8   2.886  -8.925   8.396
   39    H    ALA   9           H        ALA   9   5.803  -9.248   8.543
   40    HA   ALA   9           HA       ALA   9   6.448  -6.617   9.393
   41    HB1  ALA   9           HB1      ALA   9   8.818  -7.716   9.533
   42    HB2  ALA   9           HB2      ALA   9   7.537  -8.211  10.641
   43    HB3  ALA   9           HB3      ALA   9   7.921  -9.205   9.236
   44    H    VAL  10           H        VAL  10   8.512  -8.515   7.228
   45    HA   VAL  10           HA       VAL  10   8.877  -6.092   5.592
   46    HB   VAL  10           HB       VAL  10  10.900  -6.977   6.786
   47   HG11  VAL  10          HG11      VAL  10  10.101  -9.415   6.235
   48   HG12  VAL  10          HG12      VAL  10  11.046  -9.165   4.766
   49   HG13  VAL  10          HG13      VAL  10  11.819  -9.034   6.346
   50   HG21  VAL  10          HG21      VAL  10  10.878  -5.642   4.607
   51   HG22  VAL  10          HG22      VAL  10  12.358  -6.514   5.007
   52   HG23  VAL  10          HG23      VAL  10  11.244  -7.171   3.808
   53    H    ARG  11           H        ARG  11   7.346  -9.012   5.576
   54    HA   ARG  11           HA       ARG  11   7.902  -9.944   2.949
   55    HB2  ARG  11           HB2      ARG  11   5.940 -10.561   5.080
   56    HB3  ARG  11           HB3      ARG  11   5.454 -10.968   3.440
   57    HG2  ARG  11           HG2      ARG  11   7.957 -11.909   4.826
   58    HG3  ARG  11           HG3      ARG  11   6.497 -12.861   4.549
   59    HD2  ARG  11           HD2      ARG  11   7.235 -11.804   2.053
   60    HD3  ARG  11           HD3      ARG  11   8.722 -12.387   2.799
   61    HE   ARG  11           HE       ARG  11   6.639 -13.974   1.722
   62   HH11  ARG  11          HH11      ARG  11   8.926 -13.853   4.344
   63   HH12  ARG  11          HH12      ARG  11   9.003 -15.574   4.528
   64   HH21  ARG  11          HH21      ARG  11   6.731 -16.241   1.955
   65   HH22  ARG  11          HH22      ARG  11   7.755 -16.931   3.169
   66    H    CYS  12           H        CYS  12   6.245  -7.251   4.057
   67    HA   CYS  12           HA       CYS  12   4.219  -7.153   2.014
   68    HB2  CYS  12           HB2      CYS  12   4.251  -6.029   4.384
   69    HB3  CYS  12           HB3      CYS  12   5.121  -4.744   3.552
   70    H    ARG  13           H        ARG  13   5.769  -7.525   0.234
   71    HA   ARG  13           HA       ARG  13   6.879  -4.964  -0.698
   72    HB2  ARG  13           HB2      ARG  13   8.144  -7.699  -0.909
   73    HB3  ARG  13           HB3      ARG  13   8.690  -6.300  -1.823
   74    HG2  ARG  13           HG2      ARG  13   9.622  -5.297  -0.004
   75    HG3  ARG  13           HG3      ARG  13   8.480  -6.032   1.123
   76    HD2  ARG  13           HD2      ARG  13  10.604  -7.026   1.523
   77    HD3  ARG  13           HD3      ARG  13   9.614  -8.226   0.693
   78    HE   ARG  13           HE       ARG  13  11.003  -6.915  -1.285
   79   HH11  ARG  13          HH11      ARG  13  11.801  -8.765   1.554
   80   HH12  ARG  13          HH12      ARG  13  13.293  -9.362   0.905
   81   HH21  ARG  13          HH21      ARG  13  12.965  -7.694  -2.150
   82   HH22  ARG  13          HH22      ARG  13  13.954  -8.751  -1.202
   83    H    PHE  14           H        PHE  14   6.771  -4.582  -2.925
   84    HA   PHE  14           HA       PHE  14   4.515  -5.633  -4.239
   85    HB2  PHE  14           HB2      PHE  14   5.633  -3.372  -4.616
   86    HB3  PHE  14           HB3      PHE  14   6.808  -4.231  -5.607
   87    HD1  PHE  14           HD1      PHE  14   3.511  -2.805  -5.451
   88    HD2  PHE  14           HD2      PHE  14   6.030  -5.435  -7.654
   89    HE1  PHE  14           HE1      PHE  14   2.000  -2.627  -7.385
   90    HE2  PHE  14           HE2      PHE  14   4.524  -5.260  -9.591
   91    HZ   PHE  14           HZ       PHE  14   2.506  -3.855  -9.459
   92    H    ALA  15           H        ALA  15   7.885  -6.526  -4.269
   93    HA   ALA  15           HA       ALA  15   8.054  -7.991  -6.617
   94    HB1  ALA  15           HB1      ALA  15  10.117  -8.069  -5.782
   95    HB2  ALA  15           HB2      ALA  15   9.541  -7.813  -4.134
   96    HB3  ALA  15           HB3      ALA  15   9.571  -9.440  -4.815
   97    H    CYS  16           H        CYS  16   6.537  -8.806  -3.576
   98    HA   CYS  16           HA       CYS  16   6.293 -11.584  -3.943
   99    HB2  CYS  16           HB2      CYS  16   5.287  -9.584  -2.115
  100    HB3  CYS  16           HB3      CYS  16   4.023 -10.739  -2.524
  101    H    CYS  17           H        CYS  17   4.642  -8.923  -5.377
  102    HA   CYS  17           HA       CYS  17   2.167  -9.860  -6.030
  103    HB2  CYS  17           HB2      CYS  17   4.135  -8.218  -7.600
  104    HB3  CYS  17           HB3      CYS  17   2.563  -8.629  -8.279
  105    HN1  NH2  18           H1       NH2  18   1.622 -11.827  -6.706
  106    HN2  NH2  18           H2       NH2  18   2.348 -12.745  -7.949
  Start of MODEL   19
    1    H1   ASP   1           H        ASP   1   3.638   1.339   0.211
    2    HA   ASP   1           HA       ASP   1   1.358  -0.157  -0.870
    3    HB2  ASP   1           HB2      ASP   1   3.632   1.249  -2.285
    4    HB3  ASP   1           HB3      ASP   1   2.315   0.399  -3.087
    5    H    CYS   2           H        CYS   2   1.513  -2.282  -1.064
    6    HA   CYS   2           HA       CYS   2   3.884  -3.555  -2.046
    7    HB2  CYS   2           HB2      CYS   2   3.847  -5.119   0.085
    8    HB3  CYS   2           HB3      CYS   2   4.793  -3.635   0.066
    9    H    CYS   3           H        CYS   3   3.501  -6.126  -1.544
   10    HA   CYS   3           HA       CYS   3   0.681  -6.683  -2.175
   11    HB2  CYS   3           HB2      CYS   3   2.163  -6.718  -4.214
   12    HB3  CYS   3           HB3      CYS   3   3.028  -8.067  -3.483
   13    HA   HYP   4           HA       HYP   4   2.202  -7.988   1.529
   14    HB2  HYP   4           HB2      HYP   4   0.476  -7.630   3.043
   15    HB3  HYP   4           HB3      HYP   4  -0.646  -8.680   2.168
   16    HG   HYP   4           HG       HYP   4  -1.426  -6.601   1.432
   17   HD22  HYP   4           HD2      HYP   4  -0.890  -7.214  -0.744
   18   HD23  HYP   4           HD3      HYP   4   0.493  -6.130  -0.579
   19    HD1  HYP   4           HOD      HYP   4   1.035  -5.449   1.126
   20    H    CYS   5           H        CYS   5   3.379  -9.757   1.777
   21    HA   CYS   5           HA       CYS   5   2.134 -12.398   1.608
   22    HB2  CYS   5           HB2      CYS   5   4.895 -11.348   1.337
   23    HB3  CYS   5           HB3      CYS   5   4.734 -12.954   2.040
   24    HA   HYP   6           HA       HYP   6   1.106 -13.349   5.039
   25    HB2  HYP   6           HB2      HYP   6   1.084 -15.659   5.293
   26    HB3  HYP   6           HB3      HYP   6   2.847 -15.768   5.374
   27    HG   HYP   6           HG       HYP   6   2.530 -16.432   3.152
   28   HD22  HYP   6           HD2      HYP   6   3.779 -14.597   2.467
   29   HD23  HYP   6           HD3      HYP   6   2.237 -13.878   1.997
   30    HD1  HYP   6           HOD      HYP   6   0.569 -14.617   2.574
   31    H    ALA   7           H        ALA   7   4.316 -12.668   5.464
   32    HA   ALA   7           HA       ALA   7   4.489 -13.210   8.299
   33    HB1  ALA   7           HB1      ALA   7   6.442 -13.266   6.692
   34    HB2  ALA   7           HB2      ALA   7   6.368 -11.504   6.687
   35    HB3  ALA   7           HB3      ALA   7   6.691 -12.369   8.190
   36    H    GLY   8           H        GLY   8   4.124 -10.364   6.210
   37    HA2  GLY   8           HA2      GLY   8   2.920  -8.425   6.725
   38    HA3  GLY   8           HA3      GLY   8   2.827  -8.955   8.398
   39    H    ALA   9           H        ALA   9   5.716  -9.441   8.571
   40    HA   ALA   9           HA       ALA   9   6.509  -6.883   9.479
   41    HB1  ALA   9           HB1      ALA   9   7.509  -8.627  10.628
   42    HB2  ALA   9           HB2      ALA   9   7.908  -9.507   9.152
   43    HB3  ALA   9           HB3      ALA   9   8.815  -8.059   9.587
   44    H    VAL  10           H        VAL  10   8.460  -8.777   7.210
   45    HA   VAL  10           HA       VAL  10   8.877  -6.315   5.646
   46    HB   VAL  10           HB       VAL  10  10.888  -7.271   6.810
   47   HG11  VAL  10          HG11      VAL  10  10.335  -9.638   6.536
   48   HG12  VAL  10          HG12      VAL  10  10.551  -9.488   4.791
   49   HG13  VAL  10          HG13      VAL  10  11.927  -9.269   5.873
   50   HG21  VAL  10          HG21      VAL  10  11.954  -6.126   5.235
   51   HG22  VAL  10          HG22      VAL  10  11.897  -7.537   4.179
   52   HG23  VAL  10          HG23      VAL  10  10.597  -6.346   4.131
   53    H    ARG  11           H        ARG  11   7.268  -9.179   5.563
   54    HA   ARG  11           HA       ARG  11   7.803 -10.056   2.905
   55    HB2  ARG  11           HB2      ARG  11   5.774 -10.680   4.997
   56    HB3  ARG  11           HB3      ARG  11   5.413 -11.135   3.337
   57    HG2  ARG  11           HG2      ARG  11   7.945 -11.927   4.752
   58    HG3  ARG  11           HG3      ARG  11   6.482 -12.914   4.741
   59    HD2  ARG  11           HD2      ARG  11   7.547 -13.823   2.945
   60    HD3  ARG  11           HD3      ARG  11   6.683 -12.520   2.130
   61    HE   ARG  11           HE       ARG  11   8.689 -11.471   1.731
   62   HH11  ARG  11          HH11      ARG  11   9.152 -14.062   4.010
   63   HH12  ARG  11          HH12      ARG  11  10.881 -13.981   3.950
   64   HH21  ARG  11          HH21      ARG  11  10.965 -11.354   1.643
   65   HH22  ARG  11          HH22      ARG  11  11.912 -12.440   2.604
   66    H    CYS  12           H        CYS  12   6.268  -7.344   4.064
   67    HA   CYS  12           HA       CYS  12   4.165  -7.170   2.104
   68    HB2  CYS  12           HB2      CYS  12   4.268  -6.071   4.456
   69    HB3  CYS  12           HB3      CYS  12   5.233  -4.832   3.659
   70    H    ARG  13           H        ARG  13   5.502  -7.534   0.211
   71    HA   ARG  13           HA       ARG  13   6.630  -5.017  -0.778
   72    HB2  ARG  13           HB2      ARG  13   7.985  -7.714  -0.905
   73    HB3  ARG  13           HB3      ARG  13   8.471  -6.333  -1.879
   74    HG2  ARG  13           HG2      ARG  13   9.479  -5.299  -0.152
   75    HG3  ARG  13           HG3      ARG  13   8.279  -5.850   1.019
   76    HD2  ARG  13           HD2      ARG  13  10.359  -6.894   1.555
   77    HD3  ARG  13           HD3      ARG  13   9.295  -8.124   0.875
   78    HE   ARG  13           HE       ARG  13  10.783  -7.115  -1.228
   79   HH11  ARG  13          HH11      ARG  13  11.370  -8.797   1.763
   80   HH12  ARG  13          HH12      ARG  13  12.795  -9.596   1.185
   81   HH21  ARG  13          HH21      ARG  13  12.658  -8.160  -2.000
   82   HH22  ARG  13          HH22      ARG  13  13.527  -9.232  -0.955
   83    H    PHE  14           H        PHE  14   6.450  -4.704  -3.003
   84    HA   PHE  14           HA       PHE  14   4.229  -5.902  -4.249
   85    HB2  PHE  14           HB2      PHE  14   4.905  -3.655  -4.839
   86    HB3  PHE  14           HB3      PHE  14   6.469  -4.233  -5.406
   87    HD1  PHE  14           HD1      PHE  14   2.844  -4.255  -6.097
   88    HD2  PHE  14           HD2      PHE  14   6.745  -5.065  -7.594
   89    HE1  PHE  14           HE1      PHE  14   1.916  -4.525  -8.360
   90    HE2  PHE  14           HE2      PHE  14   5.823  -5.336  -9.859
   91    HZ   PHE  14           HZ       PHE  14   3.406  -5.065 -10.245
   92    H    ALA  15           H        ALA  15   7.618  -6.673  -4.259
   93    HA   ALA  15           HA       ALA  15   7.904  -8.146  -6.573
   94    HB1  ALA  15           HB1      ALA  15   9.773  -7.658  -5.113
   95    HB2  ALA  15           HB2      ALA  15   9.103  -8.707  -3.863
   96    HB3  ALA  15           HB3      ALA  15   9.662  -9.397  -5.387
   97    H    CYS  16           H        CYS  16   6.326  -9.038  -3.570
   98    HA   CYS  16           HA       CYS  16   6.113 -11.795  -3.945
   99    HB2  CYS  16           HB2      CYS  16   4.918  -9.788  -2.233
  100    HB3  CYS  16           HB3      CYS  16   3.731 -11.000  -2.704
  101    H    CYS  17           H        CYS  17   4.203  -9.147  -5.238
  102    HA   CYS  17           HA       CYS  17   2.082 -10.708  -6.272
  103    HB2  CYS  17           HB2      CYS  17   2.971  -7.935  -6.415
  104    HB3  CYS  17           HB3      CYS  17   2.276  -8.493  -7.934
  105    HN1  NH2  18           H1       NH2  18   2.269 -12.243  -7.756
  106    HN2  NH2  18           H2       NH2  18   3.281 -12.258  -9.132
  Start of MODEL   20
    1    H1   ASP   1           H        ASP   1   3.419   1.577   0.013
    2    HA   ASP   1           HA       ASP   1   1.467  -0.189  -1.076
    3    HB2  ASP   1           HB2      ASP   1   3.752   1.361  -2.287
    4    HB3  ASP   1           HB3      ASP   1   2.717   0.310  -3.250
    5    H    CYS   2           H        CYS   2   1.607  -2.320  -1.201
    6    HA   CYS   2           HA       CYS   2   3.972  -3.630  -2.147
    7    HB2  CYS   2           HB2      CYS   2   3.903  -5.163   0.006
    8    HB3  CYS   2           HB3      CYS   2   4.865  -3.688  -0.028
    9    H    CYS   3           H        CYS   3   3.561  -6.189  -1.612
   10    HA   CYS   3           HA       CYS   3   0.740  -6.728  -2.256
   11    HB2  CYS   3           HB2      CYS   3   2.228  -6.808  -4.284
   12    HB3  CYS   3           HB3      CYS   3   3.087  -8.146  -3.527
   13    HA   HYP   4           HA       HYP   4   2.220  -7.993   1.478
   14    HB2  HYP   4           HB2      HYP   4   0.487  -7.595   2.974
   15    HB3  HYP   4           HB3      HYP   4  -0.640  -8.647   2.107
   16    HG   HYP   4           HG       HYP   4  -1.393  -6.571   1.333
   17   HD22  HYP   4           HD2      HYP   4  -0.847  -7.222  -0.829
   18   HD23  HYP   4           HD3      HYP   4   0.546  -6.149  -0.669
   19    HD1  HYP   4           HOD      HYP   4   1.082  -5.449   1.029
   20    H    CYS   5           H        CYS   5   3.377  -9.769   1.766
   21    HA   CYS   5           HA       CYS   5   2.106 -12.401   1.625
   22    HB2  CYS   5           HB2      CYS   5   4.879 -11.382   1.359
   23    HB3  CYS   5           HB3      CYS   5   4.697 -12.976   2.085
   24    HA   HYP   6           HA       HYP   6   1.043 -13.289   5.063
   25    HB2  HYP   6           HB2      HYP   6   0.996 -15.594   5.352
   26    HB3  HYP   6           HB3      HYP   6   2.758 -15.720   5.446
   27    HG   HYP   6           HG       HYP   6   2.450 -16.414   3.233
   28   HD22  HYP   6           HD2      HYP   6   3.722 -14.603   2.529
   29   HD23  HYP   6           HD3      HYP   6   2.191 -13.875   2.038
   30    HD1  HYP   6           HOD      HYP   6   0.511 -14.588   2.614
   31    H    ALA   7           H        ALA   7   4.258 -12.637   5.501
   32    HA   ALA   7           HA       ALA   7   4.406 -13.137   8.345
   33    HB1  ALA   7           HB1      ALA   7   6.616 -12.318   8.240
   34    HB2  ALA   7           HB2      ALA   7   6.370 -13.235   6.753
   35    HB3  ALA   7           HB3      ALA   7   6.312 -11.473   6.722
   36    H    GLY   8           H        GLY   8   4.082 -10.319   6.211
   37    HA2  GLY   8           HA2      GLY   8   2.894  -8.361   6.690
   38    HA3  GLY   8           HA3      GLY   8   2.785  -8.865   8.370
   39    H    ALA   9           H        ALA   9   5.668  -9.377   8.570
   40    HA   ALA   9           HA       ALA   9   6.480  -6.814   9.446
   41    HB1  ALA   9           HB1      ALA   9   7.836  -9.463   9.180
   42    HB2  ALA   9           HB2      ALA   9   8.778  -8.022   9.567
   43    HB3  ALA   9           HB3      ALA   9   7.468  -8.531  10.632
   44    H    VAL  10           H        VAL  10   8.428  -8.759   7.219
   45    HA   VAL  10           HA       VAL  10   8.879  -6.324   5.622
   46    HB   VAL  10           HB       VAL  10  10.873  -7.280   6.813
   47   HG11  VAL  10          HG11      VAL  10  10.537  -9.524   4.826
   48   HG12  VAL  10          HG12      VAL  10  11.897  -9.304   5.929
   49   HG13  VAL  10          HG13      VAL  10  10.288  -9.647   6.567
   50   HG21  VAL  10          HG21      VAL  10  10.929  -5.891   4.695
   51   HG22  VAL  10          HG22      VAL  10  12.358  -6.871   5.021
   52   HG23  VAL  10          HG23      VAL  10  11.178  -7.404   3.823
   53    H    ARG  11           H        ARG  11   7.244  -9.174   5.570
   54    HA   ARG  11           HA       ARG  11   7.790 -10.095   2.929
   55    HB2  ARG  11           HB2      ARG  11   5.740 -10.669   5.015
   56    HB3  ARG  11           HB3      ARG  11   5.386 -11.146   3.360
   57    HG2  ARG  11           HG2      ARG  11   7.900 -11.941   4.803
   58    HG3  ARG  11           HG3      ARG  11   6.428 -12.913   4.797
   59    HD2  ARG  11           HD2      ARG  11   7.496 -13.860   3.023
   60    HD3  ARG  11           HD3      ARG  11   6.650 -12.561   2.182
   61    HE   ARG  11           HE       ARG  11   8.668 -11.536   1.782
   62   HH11  ARG  11          HH11      ARG  11   9.092 -14.099   4.099
   63   HH12  ARG  11          HH12      ARG  11  10.822 -14.035   4.048
   64   HH21  ARG  11          HH21      ARG  11  10.946 -11.443   1.706
   65   HH22  ARG  11          HH22      ARG  11  11.876 -12.524   2.687
   66    H    CYS  12           H        CYS  12   6.273  -7.351   4.035
   67    HA   CYS  12           HA       CYS  12   4.185  -7.187   2.060
   68    HB2  CYS  12           HB2      CYS  12   4.287  -6.051   4.395
   69    HB3  CYS  12           HB3      CYS  12   5.267  -4.835   3.583
   70    H    ARG  13           H        ARG  13   5.556  -7.607   0.191
   71    HA   ARG  13           HA       ARG  13   6.713  -5.115  -0.832
   72    HB2  ARG  13           HB2      ARG  13   8.024  -7.835  -0.975
   73    HB3  ARG  13           HB3      ARG  13   8.560  -6.424  -1.877
   74    HG2  ARG  13           HG2      ARG  13   9.491  -5.442  -0.062
   75    HG3  ARG  13           HG3      ARG  13   8.300  -6.116   1.052
   76    HD2  ARG  13           HD2      ARG  13  10.415  -7.131   1.519
   77    HD3  ARG  13           HD3      ARG  13   9.383  -8.339   0.756
   78    HE   ARG  13           HE       ARG  13  10.801  -7.209  -1.299
   79   HH11  ARG  13          HH11      ARG  13  11.587  -8.850   1.669
   80   HH12  ARG  13          HH12      ARG  13  13.068  -9.514   1.063
   81   HH21  ARG  13          HH21      ARG  13  12.749  -8.078  -2.109
   82   HH22  ARG  13          HH22      ARG  13  13.728  -9.073  -1.086
   83    H    PHE  14           H        PHE  14   6.546  -4.827  -3.060
   84    HA   PHE  14           HA       PHE  14   4.315  -6.012  -4.302
   85    HB2  PHE  14           HB2      PHE  14   5.429  -3.728  -4.765
   86    HB3  PHE  14           HB3      PHE  14   6.510  -4.628  -5.823
   87    HD1  PHE  14           HD1      PHE  14   3.176  -3.281  -5.381
   88    HD2  PHE  14           HD2      PHE  14   5.630  -5.760  -7.821
   89    HE1  PHE  14           HE1      PHE  14   1.513  -3.141  -7.190
   90    HE2  PHE  14           HE2      PHE  14   3.971  -5.623  -9.634
   91    HZ   PHE  14           HZ       PHE  14   1.910  -4.312  -9.319
   92    H    ALA  15           H        ALA  15   7.695  -6.821  -4.289
   93    HA   ALA  15           HA       ALA  15   7.971  -8.326  -6.585
   94    HB1  ALA  15           HB1      ALA  15   9.987  -8.620  -5.713
   95    HB2  ALA  15           HB2      ALA  15   9.418  -7.961  -4.179
   96    HB3  ALA  15           HB3      ALA  15   9.316  -9.695  -4.486
   97    H    CYS  16           H        CYS  16   6.380  -9.161  -3.572
   98    HA   CYS  16           HA       CYS  16   6.144 -11.920  -3.901
   99    HB2  CYS  16           HB2      CYS  16   4.961  -9.876  -2.231
  100    HB3  CYS  16           HB3      CYS  16   3.757 -11.074  -2.695
  101    H    CYS  17           H        CYS  17   4.258  -9.282  -5.251
  102    HA   CYS  17           HA       CYS  17   2.134 -10.844  -6.273
  103    HB2  CYS  17           HB2      CYS  17   3.050  -8.082  -6.466
  104    HB3  CYS  17           HB3      CYS  17   2.354  -8.665  -7.975
  105    HN1  NH2  18           H1       NH2  18   5.015  -9.489  -7.880
  106    HN2  NH2  18           H2       NH2  18   5.076 -10.581  -9.191


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