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
11102 1qx9 5938 cing 1-original 2 MR format nomenclature mapping



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ILE   1          1HT       ILE   1  -1.727  10.948  -3.869
    2   2H    ILE   1          2HT       ILE   1  -3.411  11.161  -3.943
    3   3H    ILE   1          3HT       ILE   1  -2.694   9.782  -4.631
    4    HA   ILE   1           HA       ILE   1  -2.605  10.415  -1.729
    5    HB   ILE   1           HB       ILE   1  -4.826   9.952  -1.883
    6   1HG1  ILE   1          2HG1      ILE   1  -5.345   7.434  -2.119
    7   2HG1  ILE   1          1HG1      ILE   1  -3.611   7.203  -2.219
    8   1HG2  ILE   1          1HG2      ILE   1  -4.980  10.192  -4.262
    9   2HG2  ILE   1          2HG2      ILE   1  -5.828   8.706  -3.834
   10   3HG2  ILE   1          3HG2      ILE   1  -4.207   8.629  -4.524
   11   1HD1  ILE   1          1HD1      ILE   1  -5.285   7.782   0.099
   12   2HD1  ILE   1          2HD1      ILE   1  -3.961   8.937  -0.050
   13   3HD1  ILE   1          3HD1      ILE   1  -3.618   7.210   0.047
   14    H    CYS   2           H        CYS   2  -2.127   8.443  -0.552
   15    HA   CYS   2           HA       CYS   2   0.102   6.961  -1.841
   16   1HB   CYS   2          2HB       CYS   2   0.496   7.987   0.314
   17   2HB   CYS   2          1HB       CYS   2  -0.933   7.212   0.996
   18    H    LEU   3           H        LEU   3   0.259   4.656  -1.585
   19    HA   LEU   3           HA       LEU   3  -2.139   3.225  -2.312
   20   1HB   LEU   3          2HB       LEU   3   0.174   2.698  -3.042
   21   2HB   LEU   3          1HB       LEU   3   0.595   2.285  -1.380
   22    HG   LEU   3           HG       LEU   3  -0.021   0.330  -2.922
   23   1HD1  LEU   3          1HD1      LEU   3  -0.782  -0.865  -1.090
   24   2HD1  LEU   3          2HD1      LEU   3  -1.894   0.409  -0.589
   25   3HD1  LEU   3          3HD1      LEU   3  -0.165   0.575  -0.280
   26   1HD2  LEU   3          1HD2      LEU   3  -2.324  -0.033  -3.430
   27   2HD2  LEU   3          2HD2      LEU   3  -2.014   1.646  -3.870
   28   3HD2  LEU   3          3HD2      LEU   3  -2.842   1.269  -2.359
   29    H    LYS   4           H        LYS   4  -3.723   2.923  -0.796
   30    HA   LYS   4           HA       LYS   4  -2.929   1.755   1.808
   31   1HB   LYS   4          2HB       LYS   4  -3.947   4.333   1.332
   32   2HB   LYS   4          1HB       LYS   4  -5.311   3.405   1.956
   33   1HG   LYS   4          2HG       LYS   4  -3.344   2.582   3.646
   34   2HG   LYS   4          1HG       LYS   4  -2.812   4.231   3.313
   35   1HD   LYS   4          2HD       LYS   4  -4.367   5.003   4.741
   36   2HD   LYS   4          1HD       LYS   4  -5.627   4.324   3.708
   37   1HE   LYS   4          2HE       LYS   4  -4.820   2.061   4.960
   38   2HE   LYS   4          1HE       LYS   4  -4.484   3.251   6.234
   39   1HZ   LYS   4          1HZ       LYS   4  -7.031   3.038   4.715
   40   2HZ   LYS   4          2HZ       LYS   4  -6.698   4.151   5.953
   41   3HZ   LYS   4          3HZ       LYS   4  -6.797   2.492   6.303
   42    H    LYS   5           H        LYS   5  -3.962   0.712  -0.761
   43    HA   LYS   5           HA       LYS   5  -6.546  -0.444   0.172
   44   1HB   LYS   5          2HB       LYS   5  -7.068  -0.647  -2.224
   45   2HB   LYS   5          1HB       LYS   5  -6.629   1.016  -1.835
   46   1HG   LYS   5          2HG       LYS   5  -4.204  -0.304  -2.422
   47   2HG   LYS   5          1HG       LYS   5  -5.346  -0.810  -3.668
   48   1HD   LYS   5          2HD       LYS   5  -4.746   2.056  -2.876
   49   2HD   LYS   5          1HD       LYS   5  -4.193   1.254  -4.347
   50   1HE   LYS   5          2HE       LYS   5  -6.391   1.122  -5.241
   51   2HE   LYS   5          1HE       LYS   5  -7.137   1.453  -3.664
   52   1HZ   LYS   5          1HZ       LYS   5  -5.634   3.298  -5.415
   53   2HZ   LYS   5          2HZ       LYS   5  -5.764   3.596  -3.748
   54   3HZ   LYS   5          3HZ       LYS   5  -7.162   3.516  -4.711
   55    H    TRP   6           H        TRP   6  -6.906  -2.705  -0.853
   56    HA   TRP   6           HA       TRP   6  -6.200  -4.942  -1.091
   57   1HB   TRP   6          2HB       TRP   6  -3.570  -3.630  -1.844
   58   2HB   TRP   6          1HB       TRP   6  -4.145  -5.220  -2.344
   59    HD1  TRP   6           HD       TRP   6  -7.206  -4.030  -2.818
   60    HE1  TRP   6           1HE      TRP   6  -7.633  -2.794  -5.040
   61    HE3  TRP   6           3HE      TRP   6  -2.406  -2.878  -4.125
   62    HZ2  TRP   6           2HZ      TRP   6  -6.138  -1.491  -7.100
   63    HZ3  TRP   6           3HZ      TRP   6  -1.936  -1.640  -6.219
   64    HH2  TRP   6           HH       TRP   6  -3.794  -0.946  -7.707
   65    HA   PRO   7           HA       PRO   7  -4.387  -4.965   3.062
   66   1HB   PRO   7          2HB       PRO   7  -5.620  -7.302   3.788
   67   2HB   PRO   7          1HB       PRO   7  -6.416  -5.717   3.871
   68   1HG   PRO   7          2HG       PRO   7  -6.640  -7.838   1.787
   69   2HG   PRO   7          1HG       PRO   7  -7.901  -6.813   2.493
   70   1HD   PRO   7          2HD       PRO   7  -6.817  -6.323   0.058
   71   2HD   PRO   7          1HD       PRO   7  -7.407  -5.031   1.124
   72    H    TRP   8           H        TRP   8  -3.920  -6.834   0.306
   73    HA   TRP   8           HA       TRP   8  -1.831  -8.464   1.676
   74   1HB   TRP   8          2HB       TRP   8  -2.277 -10.145  -0.125
   75   2HB   TRP   8          1HB       TRP   8  -3.687  -9.843   0.893
   76    HD1  TRP   8           HD       TRP   8  -5.568  -8.220  -0.090
   77    HE1  TRP   8           1HE      TRP   8  -6.280  -7.737  -2.527
   78    HE3  TRP   8           3HE      TRP   8  -1.461  -9.962  -2.550
   79    HZ2  TRP   8           2HZ      TRP   8  -5.225  -8.052  -5.172
   80    HZ3  TRP   8           3HZ      TRP   8  -1.332  -9.860  -5.023
   81    HH2  TRP   8           HH       TRP   8  -3.208  -8.908  -6.336
   82    H    TRP   9           H        TRP   9  -1.291  -5.863   0.706
   83    HA   TRP   9           HA       TRP   9  -0.114  -6.118  -1.988
   84   1HB   TRP   9          2HB       TRP   9  -1.391  -4.144  -0.967
   85   2HB   TRP   9          1HB       TRP   9   0.044  -3.857   0.001
   86    HD1  TRP   9           HD       TRP   9   1.484  -2.031  -1.059
   87    HE1  TRP   9           1HE      TRP   9   2.121  -1.360  -3.468
   88    HE3  TRP   9           3HE      TRP   9  -1.194  -5.486  -3.633
   89    HZ2  TRP   9           2HZ      TRP   9   1.551  -2.200  -6.155
   90    HZ3  TRP   9           3HZ      TRP   9  -1.145  -5.547  -6.119
   91    HH2  TRP   9           HH       TRP   9   0.225  -3.906  -7.381
   92    HA   PRO  10           HA       PRO  10   3.795  -7.348  -0.295
   93   1HB   PRO  10          2HB       PRO  10   5.282  -6.987  -2.566
   94   2HB   PRO  10          1HB       PRO  10   4.195  -8.370  -2.329
   95   1HG   PRO  10          2HG       PRO  10   3.763  -5.871  -3.887
   96   2HG   PRO  10          1HG       PRO  10   3.285  -7.534  -4.263
   97   1HD   PRO  10          2HD       PRO  10   1.564  -5.660  -3.284
   98   2HD   PRO  10          1HD       PRO  10   1.372  -7.406  -3.010
   99    H    TRP  11           H        TRP  11   4.048  -4.577  -2.570
  100    HA   TRP  11           HA       TRP  11   6.148  -3.317  -0.951
  101   1HB   TRP  11          2HB       TRP  11   4.581  -2.041  -3.179
  102   2HB   TRP  11          1HB       TRP  11   6.269  -1.803  -2.753
  103    HD1  TRP  11           HD       TRP  11   7.623  -4.399  -2.822
  104    HE1  TRP  11           1HE      TRP  11   7.678  -5.963  -4.872
  105    HE3  TRP  11           3HE      TRP  11   3.530  -2.686  -5.341
  106    HZ2  TRP  11           2HZ      TRP  11   6.178  -6.426  -7.264
  107    HZ3  TRP  11           3HZ      TRP  11   2.864  -3.704  -7.500
  108    HH2  TRP  11           HH       TRP  11   4.181  -5.569  -8.464
  109    H    ARG  12           H        ARG  12   5.652  -0.770  -0.824
  110    HA   ARG  12           HA       ARG  12   3.049   0.137  -0.093
  111   1HB   ARG  12          2HB       ARG  12   3.458   0.009   2.445
  112   2HB   ARG  12          1HB       ARG  12   3.080  -1.510   1.635
  113   1HG   ARG  12          2HG       ARG  12   5.163  -2.366   1.984
  114   2HG   ARG  12          1HG       ARG  12   5.953  -0.814   1.697
  115   1HD   ARG  12          2HD       ARG  12   6.099  -0.423   3.922
  116   2HD   ARG  12          1HD       ARG  12   4.360  -0.713   4.128
  117    HE   ARG  12           HE       ARG  12   4.883  -2.915   4.798
  118   1HH1  ARG  12          1HH1      ARG  12   7.701  -1.899   5.373
  119   2HH1  ARG  12          2HH1      ARG  12   8.657  -3.066   4.523
  120   1HH2  ARG  12          1HH2      ARG  12   5.999  -4.271   2.651
  121   2HH2  ARG  12          2HH2      ARG  12   7.693  -4.410   2.982
  122    H    ARG  13           H        ARG  13   5.080   1.020   2.463
  123    HA   ARG  13           HA       ARG  13   6.520   2.844   2.833
  124   1HB   ARG  13          2HB       ARG  13   6.468   3.389  -0.137
  125   2HB   ARG  13          1HB       ARG  13   7.779   3.670   1.007
  126   1HG   ARG  13          2HG       ARG  13   7.478   0.980   1.268
  127   2HG   ARG  13          1HG       ARG  13   7.029   1.189  -0.425
  128   1HD   ARG  13          2HD       ARG  13   9.339   0.984  -0.650
  129   2HD   ARG  13          1HD       ARG  13   9.222   2.740  -0.416
  130    HE   ARG  13           HE       ARG  13   9.486   1.015   1.994
  131   1HH1  ARG  13          1HH1      ARG  13   9.741   4.079   1.816
  132   2HH1  ARG  13          2HH1      ARG  13  11.456   4.265   1.969
  133   1HH2  ARG  13          1HH2      ARG  13  12.143   0.927   1.322
  134   2HH2  ARG  13          2HH2      ARG  13  12.815   2.480   1.690
  135    H    CYS  14           H        CYS  14   4.162   3.274   3.515
  136    HA   CYS  14           HA       CYS  14   3.045   5.640   2.098
  137   1HB   CYS  14          2HB       CYS  14   1.836   3.378   2.732
  138   2HB   CYS  14          1HB       CYS  14   1.702   4.137   4.313
  139    H    LYS  15           H        LYS  15   1.622   5.908   4.821
  140    HA   LYS  15           HA       LYS  15   2.664   8.186   5.867
  141   1HB   LYS  15          2HB       LYS  15   0.656   7.039   6.682
  142   2HB   LYS  15          1HB       LYS  15   1.653   5.766   7.388
  143   1HG   LYS  15          2HG       LYS  15   2.262   8.578   8.178
  144   2HG   LYS  15          1HG       LYS  15   0.800   7.846   8.840
  145   1HD   LYS  15          2HD       LYS  15   2.746   5.851   9.082
  146   2HD   LYS  15          1HD       LYS  15   3.582   7.339   9.529
  147   1HE   LYS  15          2HE       LYS  15   1.273   7.728  10.879
  148   2HE   LYS  15          1HE       LYS  15   1.335   5.954  10.905
  149   1HZ   LYS  15          1HZ       LYS  15   3.617   7.728  11.601
  150   2HZ   LYS  15          2HZ       LYS  15   3.573   6.033  11.723
  151   3HZ   LYS  15          3HZ       LYS  15   2.604   6.987  12.743
  152   1HN   NH2  16          1HN       NH2  16   3.872   4.896   6.720
  153   2HN   NH2  16          2HN       NH2  16   5.339   5.432   7.384
  Start of MODEL    2
    1   1H    ILE   1          1HT       ILE   1  -3.500  11.529  -2.409
    2   2H    ILE   1          2HT       ILE   1  -4.313  12.498  -1.275
    3   3H    ILE   1          3HT       ILE   1  -5.067  11.114  -1.909
    4    HA   ILE   1           HA       ILE   1  -3.082  11.330   0.217
    5    HB   ILE   1           HB       ILE   1  -4.455   9.546   1.076
    6   1HG1  ILE   1          2HG1      ILE   1  -4.733   8.889  -1.659
    7   2HG1  ILE   1          1HG1      ILE   1  -5.403   8.020  -0.286
    8   1HG2  ILE   1          1HG2      ILE   1  -6.577  10.665   1.176
    9   2HG2  ILE   1          2HG2      ILE   1  -6.294  11.467  -0.370
   10   3HG2  ILE   1          3HG2      ILE   1  -5.340  11.916   1.044
   11   1HD1  ILE   1          1HD1      ILE   1  -7.171   8.575  -1.901
   12   2HD1  ILE   1          2HD1      ILE   1  -6.754  10.285  -1.787
   13   3HD1  ILE   1          3HD1      ILE   1  -7.430   9.447  -0.390
   14    H    CYS   2           H        CYS   2  -2.112   9.143   0.787
   15    HA   CYS   2           HA       CYS   2  -0.516   8.202  -1.517
   16   1HB   CYS   2          2HB       CYS   2   0.017   8.744   1.076
   17   2HB   CYS   2          1HB       CYS   2  -0.254   7.010   1.184
   18    H    LEU   3           H        LEU   3  -0.100   5.840  -1.608
   19    HA   LEU   3           HA       LEU   3  -2.442   4.382  -2.270
   20   1HB   LEU   3          2HB       LEU   3  -0.147   4.060  -3.128
   21   2HB   LEU   3          1HB       LEU   3   0.358   3.477  -1.542
   22    HG   LEU   3           HG       LEU   3  -1.948   2.000  -2.250
   23   1HD1  LEU   3          1HD1      LEU   3  -1.109   0.957  -4.370
   24   2HD1  LEU   3          2HD1      LEU   3   0.110   2.228  -4.464
   25   3HD1  LEU   3          3HD1      LEU   3  -1.602   2.638  -4.573
   26   1HD2  LEU   3          1HD2      LEU   3   0.901   1.628  -1.630
   27   2HD2  LEU   3          2HD2      LEU   3   0.221   0.345  -2.630
   28   3HD2  LEU   3          3HD2      LEU   3  -0.499   0.719  -1.063
   29    H    LYS   4           H        LYS   4  -3.953   3.758  -0.768
   30    HA   LYS   4           HA       LYS   4  -2.985   2.514   1.748
   31   1HB   LYS   4          2HB       LYS   4  -3.938   4.767   2.104
   32   2HB   LYS   4          1HB       LYS   4  -5.411   4.266   1.272
   33   1HG   LYS   4          2HG       LYS   4  -4.859   2.335   3.301
   34   2HG   LYS   4          1HG       LYS   4  -4.748   3.934   4.035
   35   1HD   LYS   4          2HD       LYS   4  -6.968   4.407   3.675
   36   2HD   LYS   4          1HD       LYS   4  -7.037   3.458   2.190
   37   1HE   LYS   4          2HE       LYS   4  -6.861   1.368   3.616
   38   2HE   LYS   4          1HE       LYS   4  -7.074   2.410   5.038
   39   1HZ   LYS   4          1HZ       LYS   4  -9.026   3.364   3.645
   40   2HZ   LYS   4          2HZ       LYS   4  -9.245   1.917   4.507
   41   3HZ   LYS   4          3HZ       LYS   4  -8.952   1.877   2.834
   42    H    LYS   5           H        LYS   5  -3.844   1.535  -0.946
   43    HA   LYS   5           HA       LYS   5  -6.246  -0.053  -0.243
   44   1HB   LYS   5          2HB       LYS   5  -6.345  -0.434  -2.678
   45   2HB   LYS   5          1HB       LYS   5  -6.217   1.290  -2.326
   46   1HG   LYS   5          2HG       LYS   5  -3.866   1.301  -2.833
   47   2HG   LYS   5          1HG       LYS   5  -3.820  -0.460  -2.927
   48   1HD   LYS   5          2HD       LYS   5  -4.198  -0.250  -5.140
   49   2HD   LYS   5          1HD       LYS   5  -5.829   0.283  -4.727
   50   1HE   LYS   5          2HE       LYS   5  -3.539   2.251  -4.701
   51   2HE   LYS   5          1HE       LYS   5  -4.383   1.864  -6.213
   52   1HZ   LYS   5          1HZ       LYS   5  -5.938   3.295  -5.534
   53   2HZ   LYS   5          2HZ       LYS   5  -5.307   3.377  -3.958
   54   3HZ   LYS   5          3HZ       LYS   5  -6.386   2.134  -4.380
   55    H    TRP   6           H        TRP   6  -6.164  -2.378  -1.121
   56    HA   TRP   6           HA       TRP   6  -5.167  -4.519  -1.081
   57   1HB   TRP   6          2HB       TRP   6  -2.689  -2.877  -1.703
   58   2HB   TRP   6          1HB       TRP   6  -2.918  -4.592  -2.042
   59    HD1  TRP   6           HD       TRP   6  -6.091  -3.919  -2.935
   60    HE1  TRP   6           1HE      TRP   6  -6.423  -3.089  -5.353
   61    HE3  TRP   6           3HE      TRP   6  -1.344  -2.362  -3.988
   62    HZ2  TRP   6           2HZ      TRP   6  -4.876  -1.918  -7.457
   63    HZ3  TRP   6           3HZ      TRP   6  -0.800  -1.394  -6.203
   64    HH2  TRP   6           HH       TRP   6  -2.558  -1.170  -7.937
   65    HA   PRO   7           HA       PRO   7  -3.688  -3.895   3.182
   66   1HB   PRO   7          2HB       PRO   7  -5.039  -6.048   4.202
   67   2HB   PRO   7          1HB       PRO   7  -5.776  -4.448   3.995
   68   1HG   PRO   7          2HG       PRO   7  -6.041  -6.883   2.317
   69   2HG   PRO   7          1HG       PRO   7  -7.244  -5.649   2.717
   70   1HD   PRO   7          2HD       PRO   7  -5.912  -5.779   0.320
   71   2HD   PRO   7          1HD       PRO   7  -6.611  -4.294   0.992
   72    H    TRP   8           H        TRP   8  -3.322  -6.366   0.837
   73    HA   TRP   8           HA       TRP   8  -1.239  -7.683   2.521
   74   1HB   TRP   8          2HB       TRP   8  -1.714  -9.707   1.145
   75   2HB   TRP   8          1HB       TRP   8  -3.139  -9.150   2.027
   76    HD1  TRP   8           HD       TRP   8  -4.966  -7.803   0.668
   77    HE1  TRP   8           1HE      TRP   8  -5.606  -7.834  -1.836
   78    HE3  TRP   8           3HE      TRP   8  -0.802 -10.016  -1.257
   79    HZ2  TRP   8           2HZ      TRP   8  -4.479  -8.689  -4.326
   80    HZ3  TRP   8           3HZ      TRP   8  -0.603 -10.427  -3.693
   81    HH2  TRP   8           HH       TRP   8  -2.433  -9.767  -5.228
   82    H    TRP   9           H        TRP   9  -0.641  -5.359   1.005
   83    HA   TRP   9           HA       TRP   9   0.439  -6.142  -1.598
   84   1HB   TRP   9          2HB       TRP   9  -0.558  -3.908  -0.788
   85   2HB   TRP   9          1HB       TRP   9   0.978  -3.661   0.019
   86    HD1  TRP   9           HD       TRP   9   2.319  -2.003  -1.441
   87    HE1  TRP   9           1HE      TRP   9   2.866  -1.841  -3.961
   88    HE3  TRP   9           3HE      TRP   9  -0.485  -5.870  -3.192
   89    HZ2  TRP   9           2HZ      TRP   9   2.193  -3.187  -6.405
   90    HZ3  TRP   9           3HZ      TRP   9  -0.525  -6.420  -5.615
   91    HH2  TRP   9           HH       TRP   9   0.812  -5.082  -7.221
   92    HA   PRO  10           HA       PRO  10   4.206  -7.632   0.301
   93   1HB   PRO  10          2HB       PRO  10   5.498  -8.200  -2.050
   94   2HB   PRO  10          1HB       PRO  10   4.254  -9.257  -1.349
   95   1HG   PRO  10          2HG       PRO  10   4.016  -7.258  -3.547
   96   2HG   PRO  10          1HG       PRO  10   3.300  -8.872  -3.408
   97   1HD   PRO  10          2HD       PRO  10   1.900  -6.601  -2.927
   98   2HD   PRO  10          1HD       PRO  10   1.564  -8.135  -2.093
   99    H    TRP  11           H        TRP  11   4.124  -5.330  -2.404
  100    HA   TRP  11           HA       TRP  11   6.694  -4.116  -1.488
  101   1HB   TRP  11          2HB       TRP  11   5.041  -3.411  -3.909
  102   2HB   TRP  11          1HB       TRP  11   6.762  -3.153  -3.660
  103    HD1  TRP  11           HD       TRP  11   8.058  -5.668  -3.055
  104    HE1  TRP  11           1HE      TRP  11   7.901  -7.809  -4.485
  105    HE3  TRP  11           3HE      TRP  11   3.754  -4.695  -5.611
  106    HZ2  TRP  11           2HZ      TRP  11   6.171  -8.954  -6.457
  107    HZ3  TRP  11           3HZ      TRP  11   2.871  -6.324  -7.259
  108    HH2  TRP  11           HH       TRP  11   4.074  -8.450  -7.684
  109    H    ARG  12           H        ARG  12   6.450  -1.605  -2.147
  110    HA   ARG  12           HA       ARG  12   5.805   0.417  -1.088
  111   1HB   ARG  12          2HB       ARG  12   3.834  -0.713  -2.846
  112   2HB   ARG  12          1HB       ARG  12   3.047   0.278  -1.614
  113   1HG   ARG  12          2HG       ARG  12   3.558   1.885  -3.214
  114   2HG   ARG  12          1HG       ARG  12   4.978   1.978  -2.172
  115   1HD   ARG  12          2HD       ARG  12   5.610   1.864  -4.584
  116   2HD   ARG  12          1HD       ARG  12   6.192   0.441  -3.697
  117    HE   ARG  12           HE       ARG  12   4.533  -0.881  -4.791
  118   1HH1  ARG  12          1HH2      ARG  12   4.964   2.031  -6.350
  119   2HH1  ARG  12          2HH2      ARG  12   3.433   2.039  -7.161
  120   1HH2  ARG  12          1HH1      ARG  12   2.191  -0.683  -5.407
  121   2HH2  ARG  12          2HH1      ARG  12   1.863   0.503  -6.627
  122    H    ARG  13           H        ARG  13   3.572   1.275   0.179
  123    HA   ARG  13           HA       ARG  13   2.079   0.072   2.021
  124   1HB   ARG  13          2HB       ARG  13   3.739  -1.437   2.822
  125   2HB   ARG  13          1HB       ARG  13   4.984  -0.187   2.827
  126   1HG   ARG  13          2HG       ARG  13   4.389   0.558   4.890
  127   2HG   ARG  13          1HG       ARG  13   2.665   0.423   4.539
  128   1HD   ARG  13          2HD       ARG  13   3.771  -2.227   4.641
  129   2HD   ARG  13          1HD       ARG  13   4.248  -1.350   6.108
  130    HE   ARG  13           HE       ARG  13   1.427  -1.681   5.176
  131   1HH1  ARG  13          1HH1      ARG  13   1.827   0.777   6.803
  132   2HH1  ARG  13          2HH1      ARG  13   1.559   0.207   8.416
  133   1HH2  ARG  13          1HH2      ARG  13   1.924  -3.139   7.576
  134   2HH2  ARG  13          2HH2      ARG  13   1.614  -2.013   8.855
  135    H    CYS  14           H        CYS  14   1.552   2.349   1.371
  136    HA   CYS  14           HA       CYS  14   2.912   4.440   2.955
  137   1HB   CYS  14          2HB       CYS  14   2.099   4.274   0.381
  138   2HB   CYS  14          1HB       CYS  14   0.675   5.012   1.095
  139    H    LYS  15           H        LYS  15   0.261   5.879   2.605
  140    HA   LYS  15           HA       LYS  15  -0.742   5.950   5.143
  141   1HB   LYS  15          2HB       LYS  15  -1.429   7.340   3.199
  142   2HB   LYS  15          1HB       LYS  15  -2.359   5.975   2.580
  143   1HG   LYS  15          2HG       LYS  15  -3.875   6.040   4.409
  144   2HG   LYS  15          1HG       LYS  15  -2.809   7.078   5.356
  145   1HD   LYS  15          2HD       LYS  15  -3.194   8.565   3.065
  146   2HD   LYS  15          1HD       LYS  15  -4.768   7.802   3.290
  147   1HE   LYS  15          2HE       LYS  15  -4.828   8.617   5.633
  148   2HE   LYS  15          1HE       LYS  15  -3.261   9.415   5.384
  149   1HZ   LYS  15          1HZ       LYS  15  -5.782   9.917   3.893
  150   2HZ   LYS  15          2HZ       LYS  15  -4.270  10.546   3.437
  151   3HZ   LYS  15          3HZ       LYS  15  -4.971  10.998   4.917
  152   1HN   NH2  16          1HN       NH2  16  -1.041   3.998   6.344
  153   2HN   NH2  16          2HN       NH2  16  -2.092   2.750   5.871
  Start of MODEL    3
    1   1H    ILE   1          1HT       ILE   1  -2.129   9.686  -5.049
    2   2H    ILE   1          2HT       ILE   1  -3.058  11.045  -4.632
    3   3H    ILE   1          3HT       ILE   1  -3.803   9.530  -4.827
    4    HA   ILE   1           HA       ILE   1  -2.241  10.553  -2.565
    5    HB   ILE   1           HB       ILE   1  -4.041   9.461  -1.390
    6   1HG1  ILE   1          2HG1      ILE   1  -3.975   7.709  -3.608
    7   2HG1  ILE   1          1HG1      ILE   1  -5.003   7.587  -2.188
    8   1HG2  ILE   1          1HG2      ILE   1  -5.951  10.652  -2.329
    9   2HG2  ILE   1          2HG2      ILE   1  -5.139  10.781  -3.888
   10   3HG2  ILE   1          3HG2      ILE   1  -4.503  11.646  -2.489
   11   1HD1  ILE   1          1HD1      ILE   1  -5.688   9.164  -4.688
   12   2HD1  ILE   1          2HD1      ILE   1  -6.733   8.926  -3.288
   13   3HD1  ILE   1          3HD1      ILE   1  -6.305   7.555  -4.312
   14    H    CYS   2           H        CYS   2  -1.791   8.771  -0.940
   15    HA   CYS   2           HA       CYS   2   0.069   6.848  -2.134
   16   1HB   CYS   2          2HB       CYS   2   0.650   7.961  -0.082
   17   2HB   CYS   2          1HB       CYS   2  -0.871   7.484   0.670
   18    H    LEU   3           H        LEU   3  -0.027   4.566  -1.707
   19    HA   LEU   3           HA       LEU   3  -2.616   3.386  -2.254
   20   1HB   LEU   3          2HB       LEU   3   0.190   2.685  -2.165
   21   2HB   LEU   3          1HB       LEU   3  -0.781   1.420  -1.410
   22    HG   LEU   3           HG       LEU   3  -1.130   2.572  -4.189
   23   1HD1  LEU   3          1HD1      LEU   3   0.608   0.701  -3.509
   24   2HD1  LEU   3          2HD1      LEU   3  -0.362   0.522  -4.971
   25   3HD1  LEU   3          3HD1      LEU   3  -0.824  -0.329  -3.498
   26   1HD2  LEU   3          1HD2      LEU   3  -2.794   0.287  -3.577
   27   2HD2  LEU   3          2HD2      LEU   3  -3.276   1.877  -4.171
   28   3HD2  LEU   3          3HD2      LEU   3  -3.120   1.592  -2.437
   29    H    LYS   4           H        LYS   4  -4.151   3.108  -0.718
   30    HA   LYS   4           HA       LYS   4  -3.308   2.223   1.982
   31   1HB   LYS   4          2HB       LYS   4  -4.669   4.623   1.136
   32   2HB   LYS   4          1HB       LYS   4  -5.740   3.669   2.163
   33   1HG   LYS   4          2HG       LYS   4  -4.389   3.887   4.015
   34   2HG   LYS   4          1HG       LYS   4  -2.912   3.974   3.056
   35   1HD   LYS   4          2HD       LYS   4  -2.954   6.215   3.242
   36   2HD   LYS   4          1HD       LYS   4  -4.480   6.237   2.359
   37   1HE   LYS   4          2HE       LYS   4  -5.669   6.671   4.248
   38   2HE   LYS   4          1HE       LYS   4  -4.803   5.422   5.165
   39   1HZ   LYS   4          1HZ       LYS   4  -2.876   6.917   5.253
   40   2HZ   LYS   4          2HZ       LYS   4  -4.232   7.591   6.024
   41   3HZ   LYS   4          3HZ       LYS   4  -3.778   8.127   4.478
   42    H    LYS   5           H        LYS   5  -4.257   0.887  -0.484
   43    HA   LYS   5           HA       LYS   5  -6.659  -0.465   0.647
   44   1HB   LYS   5          2HB       LYS   5  -7.379  -0.707  -1.743
   45   2HB   LYS   5          1HB       LYS   5  -7.268   0.975  -1.222
   46   1HG   LYS   5          2HG       LYS   5  -5.049   1.174  -2.242
   47   2HG   LYS   5          1HG       LYS   5  -5.096  -0.525  -2.714
   48   1HD   LYS   5          2HD       LYS   5  -5.716   0.985  -4.591
   49   2HD   LYS   5          1HD       LYS   5  -7.033  -0.104  -4.151
   50   1HE   LYS   5          2HE       LYS   5  -7.053   2.426  -2.638
   51   2HE   LYS   5          1HE       LYS   5  -7.304   2.627  -4.383
   52   1HZ   LYS   5          1HZ       LYS   5  -9.330   2.040  -2.949
   53   2HZ   LYS   5          2HZ       LYS   5  -8.669   0.476  -2.887
   54   3HZ   LYS   5          3HZ       LYS   5  -9.091   1.165  -4.382
   55    H    TRP   6           H        TRP   6  -6.935  -2.653  -0.642
   56    HA   TRP   6           HA       TRP   6  -6.065  -4.787  -1.163
   57   1HB   TRP   6          2HB       TRP   6  -3.486  -3.274  -1.667
   58   2HB   TRP   6          1HB       TRP   6  -3.987  -4.802  -2.384
   59    HD1  TRP   6           HD       TRP   6  -7.075  -3.637  -2.803
   60    HE1  TRP   6           1HE      TRP   6  -7.472  -2.148  -4.868
   61    HE3  TRP   6           3HE      TRP   6  -2.271  -2.230  -3.807
   62    HZ2  TRP   6           2HZ      TRP   6  -5.951  -0.568  -6.704
   63    HZ3  TRP   6           3HZ      TRP   6  -1.774  -0.734  -5.720
   64    HH2  TRP   6           HH       TRP   6  -3.605   0.098  -7.168
   65    HA   PRO   7           HA       PRO   7  -4.309  -5.092   3.017
   66   1HB   PRO   7          2HB       PRO   7  -5.592  -7.441   3.602
   67   2HB   PRO   7          1HB       PRO   7  -6.351  -5.847   3.786
   68   1HG   PRO   7          2HG       PRO   7  -6.652  -7.845   1.601
   69   2HG   PRO   7          1HG       PRO   7  -7.867  -6.797   2.348
   70   1HD   PRO   7          2HD       PRO   7  -6.722  -6.275  -0.070
   71   2HD   PRO   7          1HD       PRO   7  -7.339  -5.012   1.015
   72    H    TRP   8           H        TRP   8  -3.885  -6.807   0.148
   73    HA   TRP   8           HA       TRP   8  -1.844  -8.573   1.424
   74   1HB   TRP   8          2HB       TRP   8  -2.306 -10.093  -0.528
   75   2HB   TRP   8          1HB       TRP   8  -3.697  -9.866   0.533
   76    HD1  TRP   8           HD       TRP   8  -5.605  -8.223  -0.282
   77    HE1  TRP   8           1HE      TRP   8  -6.335  -7.484  -2.648
   78    HE3  TRP   8           3HE      TRP   8  -1.474  -9.598  -2.925
   79    HZ2  TRP   8           2HZ      TRP   8  -5.281  -7.480  -5.314
   80    HZ3  TRP   8           3HZ      TRP   8  -1.355  -9.219  -5.371
   81    HH2  TRP   8           HH       TRP   8  -3.253  -8.163  -6.568
   82    H    TRP   9           H        TRP   9  -1.192  -5.936   0.655
   83    HA   TRP   9           HA       TRP   9  -0.046  -6.002  -2.055
   84   1HB   TRP   9          2HB       TRP   9  -1.171  -4.062  -0.815
   85   2HB   TRP   9          1HB       TRP   9   0.294  -3.970   0.146
   86    HD1  TRP   9           HD       TRP   9   1.950  -2.254  -0.772
   87    HE1  TRP   9           1HE      TRP   9   2.550  -1.350  -3.114
   88    HE3  TRP   9           3HE      TRP   9  -1.259  -4.999  -3.588
   89    HZ2  TRP   9           2HZ      TRP   9   1.755  -1.754  -5.844
   90    HZ3  TRP   9           3HZ      TRP   9  -1.335  -4.736  -6.060
   91    HH2  TRP   9           HH       TRP   9   0.169  -3.115  -7.187
   92    HA   PRO  10           HA       PRO  10   3.795  -7.633  -0.572
   93   1HB   PRO  10          2HB       PRO  10   5.259  -7.185  -2.843
   94   2HB   PRO  10          1HB       PRO  10   4.081  -8.503  -2.692
   95   1HG   PRO  10          2HG       PRO  10   3.814  -5.873  -4.050
   96   2HG   PRO  10          1HG       PRO  10   3.177  -7.457  -4.516
   97   1HD   PRO  10          2HD       PRO  10   1.678  -5.488  -3.336
   98   2HD   PRO  10          1HD       PRO  10   1.303  -7.222  -3.236
   99    H    TRP  11           H        TRP  11   4.306  -4.751  -2.656
  100    HA   TRP  11           HA       TRP  11   6.503  -3.773  -1.008
  101   1HB   TRP  11          2HB       TRP  11   4.907  -2.176  -2.997
  102   2HB   TRP  11          1HB       TRP  11   6.626  -2.080  -2.646
  103    HD1  TRP  11           HD       TRP  11   7.721  -4.822  -2.996
  104    HE1  TRP  11           1HE      TRP  11   7.608  -6.125  -5.219
  105    HE3  TRP  11           3HE      TRP  11   3.833  -2.395  -5.236
  106    HZ2  TRP  11           2HZ      TRP  11   6.066  -6.131  -7.631
  107    HZ3  TRP  11           3HZ      TRP  11   3.061  -3.066  -7.493
  108    HH2  TRP  11           HH       TRP  11   4.173  -4.929  -8.692
  109    H    ARG  12           H        ARG  12   6.186  -1.223  -0.600
  110    HA   ARG  12           HA       ARG  12   3.718  -0.196   0.358
  111   1HB   ARG  12          2HB       ARG  12   3.577  -1.989   1.894
  112   2HB   ARG  12          1HB       ARG  12   5.305  -1.941   2.241
  113   1HG   ARG  12          2HG       ARG  12   5.063   0.169   3.424
  114   2HG   ARG  12          1HG       ARG  12   3.362   0.270   2.967
  115   1HD   ARG  12          2HD       ARG  12   4.020  -2.267   4.291
  116   2HD   ARG  12          1HD       ARG  12   4.297  -0.848   5.323
  117    HE   ARG  12           HE       ARG  12   1.970  -0.310   5.160
  118   1HH1  ARG  12          1HH2      ARG  12   1.433  -3.175   5.452
  119   2HH1  ARG  12          2HH2      ARG  12   0.466  -3.545   4.063
  120   1HH2  ARG  12          1HH1      ARG  12   1.356  -0.665   2.348
  121   2HH2  ARG  12          2HH1      ARG  12   0.423  -2.124   2.305
  122    H    ARG  13           H        ARG  13   4.028   1.783   1.621
  123    HA   ARG  13           HA       ARG  13   6.253   2.872   2.748
  124   1HB   ARG  13          2HB       ARG  13   7.639   2.483   0.857
  125   2HB   ARG  13          1HB       ARG  13   6.357   2.921  -0.271
  126   1HG   ARG  13          2HG       ARG  13   6.889   5.121  -0.179
  127   2HG   ARG  13          1HG       ARG  13   7.059   5.089   1.577
  128   1HD   ARG  13          2HD       ARG  13   9.321   4.768   1.470
  129   2HD   ARG  13          1HD       ARG  13   9.188   3.651   0.097
  130    HE   ARG  13           HE       ARG  13   8.759   6.585  -0.289
  131   1HH1  ARG  13          1HH2      ARG  13  11.625   5.657  -0.375
  132   2HH1  ARG  13          2HH2      ARG  13  11.844   5.340  -2.064
  133   1HH2  ARG  13          1HH1      ARG  13   8.448   5.286  -2.765
  134   2HH2  ARG  13          2HH1      ARG  13  10.045   5.131  -3.418
  135    H    CYS  14           H        CYS  14   4.028   3.523   3.520
  136    HA   CYS  14           HA       CYS  14   3.005   5.933   2.101
  137   1HB   CYS  14          2HB       CYS  14   1.699   3.699   2.712
  138   2HB   CYS  14          1HB       CYS  14   1.546   4.491   4.274
  139    H    LYS  15           H        LYS  15   1.564   6.242   4.802
  140    HA   LYS  15           HA       LYS  15   2.737   8.430   5.905
  141   1HB   LYS  15          2HB       LYS  15   0.642   7.445   6.673
  142   2HB   LYS  15          1HB       LYS  15   1.508   6.060   7.340
  143   1HG   LYS  15          2HG       LYS  15   2.837   7.917   8.666
  144   2HG   LYS  15          1HG       LYS  15   1.400   8.887   8.340
  145   1HD   LYS  15          2HD       LYS  15   0.011   7.013   9.291
  146   2HD   LYS  15          1HD       LYS  15   1.511   6.221   9.776
  147   1HE   LYS  15          2HE       LYS  15   2.049   7.923  11.333
  148   2HE   LYS  15          1HE       LYS  15   0.916   9.073  10.594
  149   1HZ   LYS  15          1HZ       LYS  15  -0.920   7.702  11.246
  150   2HZ   LYS  15          2HZ       LYS  15   0.024   8.007  12.625
  151   3HZ   LYS  15          3HZ       LYS  15   0.114   6.500  11.846
  152   1HN   NH2  16          1HN       NH2  16   5.031   8.581   6.138
  153   2HN   NH2  16          2HN       NH2  16   5.956   7.524   7.091
  Start of MODEL    4
    1   1H    ILE   1          1HT       ILE   1  -2.650  10.556  -4.336
    2   2H    ILE   1          2HT       ILE   1  -4.346  10.591  -4.258
    3   3H    ILE   1          3HT       ILE   1  -3.548   9.210  -4.843
    4    HA   ILE   1           HA       ILE   1  -3.233  10.223  -2.069
    5    HB   ILE   1           HB       ILE   1  -5.409   9.588  -1.897
    6   1HG1  ILE   1          2HG1      ILE   1  -5.744   7.028  -1.791
    7   2HG1  ILE   1          1HG1      ILE   1  -4.018   6.909  -2.061
    8   1HG2  ILE   1          1HG2      ILE   1  -6.492   8.009  -3.568
    9   2HG2  ILE   1          2HG2      ILE   1  -4.964   8.044  -4.448
   10   3HG2  ILE   1          3HG2      ILE   1  -5.889   9.530  -4.227
   11   1HD1  ILE   1          1HD1      ILE   1  -5.500   7.711   0.342
   12   2HD1  ILE   1          2HD1      ILE   1  -4.215   8.842  -0.081
   13   3HD1  ILE   1          3HD1      ILE   1  -3.838   7.140   0.193
   14    H    CYS   2           H        CYS   2  -2.478   8.453  -0.723
   15    HA   CYS   2           HA       CYS   2  -0.243   7.014  -2.032
   16   1HB   CYS   2          2HB       CYS   2   0.190   8.242   0.003
   17   2HB   CYS   2          1HB       CYS   2  -1.137   7.432   0.832
   18    H    LEU   3           H        LEU   3   0.123   4.755  -1.593
   19    HA   LEU   3           HA       LEU   3  -2.101   3.054  -2.146
   20   1HB   LEU   3          2HB       LEU   3   0.267   2.598  -2.687
   21   2HB   LEU   3          1HB       LEU   3   0.640   2.483  -0.968
   22    HG   LEU   3           HG       LEU   3   0.254   0.271  -2.212
   23   1HD1  LEU   3          1HD1      LEU   3  -1.719   0.481   0.012
   24   2HD1  LEU   3          2HD1      LEU   3  -0.053   0.940   0.364
   25   3HD1  LEU   3          3HD1      LEU   3  -0.416  -0.682  -0.227
   26   1HD2  LEU   3          1HD2      LEU   3  -2.000  -0.371  -2.695
   27   2HD2  LEU   3          2HD2      LEU   3  -1.796   1.227  -3.412
   28   3HD2  LEU   3          3HD2      LEU   3  -2.653   1.051  -1.881
   29    H    LYS   4           H        LYS   4  -3.761   2.969  -0.660
   30    HA   LYS   4           HA       LYS   4  -3.071   2.072   2.076
   31   1HB   LYS   4          2HB       LYS   4  -4.173   4.582   1.236
   32   2HB   LYS   4          1HB       LYS   4  -5.403   3.710   2.150
   33   1HG   LYS   4          2HG       LYS   4  -3.599   3.277   3.906
   34   2HG   LYS   4          1HG       LYS   4  -2.617   4.467   3.049
   35   1HD   LYS   4          2HD       LYS   4  -3.748   5.687   4.760
   36   2HD   LYS   4          1HD       LYS   4  -4.609   6.057   3.264
   37   1HE   LYS   4          2HE       LYS   4  -6.242   4.212   3.832
   38   2HE   LYS   4          1HE       LYS   4  -5.449   4.084   5.415
   39   1HZ   LYS   4          1HZ       LYS   4  -5.865   6.400   5.819
   40   2HZ   LYS   4          2HZ       LYS   4  -7.338   5.655   5.419
   41   3HZ   LYS   4          3HZ       LYS   4  -6.525   6.607   4.270
   42    H    LYS   5           H        LYS   5  -4.030   0.775  -0.390
   43    HA   LYS   5           HA       LYS   5  -6.539  -0.401   0.696
   44   1HB   LYS   5          2HB       LYS   5  -7.233  -0.556  -1.751
   45   2HB   LYS   5          1HB       LYS   5  -7.160   1.080  -1.093
   46   1HG   LYS   5          2HG       LYS   5  -4.887   1.349  -2.032
   47   2HG   LYS   5          1HG       LYS   5  -4.984  -0.275  -2.713
   48   1HD   LYS   5          2HD       LYS   5  -5.567   1.296  -4.459
   49   2HD   LYS   5          1HD       LYS   5  -7.040   0.457  -3.970
   50   1HE   LYS   5          2HE       LYS   5  -7.956   2.508  -3.634
   51   2HE   LYS   5          1HE       LYS   5  -6.868   2.672  -2.240
   52   1HZ   LYS   5          1HZ       LYS   5  -5.159   3.533  -3.659
   53   2HZ   LYS   5          2HZ       LYS   5  -6.566   4.449  -3.918
   54   3HZ   LYS   5          3HZ       LYS   5  -6.097   3.269  -5.047
   55    H    TRP   6           H        TRP   6  -6.978  -2.552  -0.579
   56    HA   TRP   6           HA       TRP   6  -6.249  -4.718  -1.178
   57   1HB   TRP   6          2HB       TRP   6  -3.593  -3.379  -1.750
   58   2HB   TRP   6          1HB       TRP   6  -4.268  -4.816  -2.517
   59    HD1  TRP   6           HD       TRP   6  -7.247  -3.441  -2.785
   60    HE1  TRP   6           1HE      TRP   6  -7.603  -1.781  -4.724
   61    HE3  TRP   6           3HE      TRP   6  -2.394  -2.217  -3.797
   62    HZ2  TRP   6           2HZ      TRP   6  -6.035  -0.149  -6.474
   63    HZ3  TRP   6           3HZ      TRP   6  -1.854  -0.608  -5.603
   64    HH2  TRP   6           HH       TRP   6  -3.667   0.427  -6.942
   65    HA   PRO   7           HA       PRO   7  -4.369  -5.238   2.921
   66   1HB   PRO   7          2HB       PRO   7  -5.660  -7.600   3.429
   67   2HB   PRO   7          1HB       PRO   7  -6.403  -6.011   3.699
   68   1HG   PRO   7          2HG       PRO   7  -6.755  -7.900   1.424
   69   2HG   PRO   7          1HG       PRO   7  -7.956  -6.898   2.254
   70   1HD   PRO   7          2HD       PRO   7  -6.884  -6.234  -0.154
   71   2HD   PRO   7          1HD       PRO   7  -7.441  -5.030   1.024
   72    H    TRP   8           H        TRP   8  -3.993  -6.776  -0.035
   73    HA   TRP   8           HA       TRP   8  -2.012  -8.693   1.105
   74   1HB   TRP   8          2HB       TRP   8  -2.459  -9.963  -1.047
   75   2HB   TRP   8          1HB       TRP   8  -3.830  -9.875   0.060
   76    HD1  TRP   8           HD       TRP   8  -5.776  -8.181  -0.524
   77    HE1  TRP   8           1HE      TRP   8  -6.543  -7.155  -2.769
   78    HE3  TRP   8           3HE      TRP   8  -1.653  -9.129  -3.364
   79    HZ2  TRP   8           2HZ      TRP   8  -5.523  -6.787  -5.420
   80    HZ3  TRP   8           3HZ      TRP   8  -1.570  -8.435  -5.742
   81    HH2  TRP   8           HH       TRP   8  -3.498  -7.267  -6.773
   82    H    TRP   9           H        TRP   9  -1.296  -5.997   0.606
   83    HA   TRP   9           HA       TRP   9  -0.005  -5.896  -2.047
   84   1HB   TRP   9          2HB       TRP   9  -1.260  -4.042  -0.787
   85   2HB   TRP   9          1HB       TRP   9   0.148  -3.957   0.252
   86    HD1  TRP   9           HD       TRP   9   1.924  -2.297  -0.522
   87    HE1  TRP   9           1HE      TRP   9   2.575  -1.219  -2.775
   88    HE3  TRP   9           3HE      TRP   9  -1.352  -4.681  -3.571
   89    HZ2  TRP   9           2HZ      TRP   9   1.786  -1.364  -5.534
   90    HZ3  TRP   9           3HZ      TRP   9  -1.400  -4.210  -6.013
   91    HH2  TRP   9           HH       TRP   9   0.167  -2.553  -6.994
   92    HA   PRO  10           HA       PRO  10   3.699  -7.600  -0.251
   93   1HB   PRO  10          2HB       PRO  10   5.268  -7.338  -2.477
   94   2HB   PRO  10          1HB       PRO  10   4.055  -8.621  -2.294
   95   1HG   PRO  10          2HG       PRO  10   3.899  -6.072  -3.819
   96   2HG   PRO  10          1HG       PRO  10   3.271  -7.676  -4.230
   97   1HD   PRO  10          2HD       PRO  10   1.724  -5.645  -3.255
   98   2HD   PRO  10          1HD       PRO  10   1.345  -7.369  -3.038
   99    H    TRP  11           H        TRP  11   4.220  -4.810  -2.456
  100    HA   TRP  11           HA       TRP  11   6.473  -3.800  -0.919
  101   1HB   TRP  11          2HB       TRP  11   4.795  -2.220  -2.850
  102   2HB   TRP  11          1HB       TRP  11   6.531  -2.137  -2.585
  103    HD1  TRP  11           HD       TRP  11   7.708  -4.752  -3.052
  104    HE1  TRP  11           1HE      TRP  11   7.427  -6.139  -5.209
  105    HE3  TRP  11           3HE      TRP  11   3.434  -2.657  -4.886
  106    HZ2  TRP  11           2HZ      TRP  11   5.622  -6.329  -7.421
  107    HZ3  TRP  11           3HZ      TRP  11   2.453  -3.458  -7.016
  108    HH2  TRP  11           HH       TRP  11   3.541  -5.289  -8.285
  109    H    ARG  12           H        ARG  12   6.207  -1.257  -0.527
  110    HA   ARG  12           HA       ARG  12   3.744  -0.296   0.619
  111   1HB   ARG  12          2HB       ARG  12   4.207  -0.674   2.960
  112   2HB   ARG  12          1HB       ARG  12   4.403  -2.223   2.138
  113   1HG   ARG  12          2HG       ARG  12   6.862  -1.765   1.978
  114   2HG   ARG  12          1HG       ARG  12   6.614  -0.315   2.952
  115   1HD   ARG  12          2HD       ARG  12   5.423  -2.775   4.093
  116   2HD   ARG  12          1HD       ARG  12   7.197  -2.757   4.028
  117    HE   ARG  12           HE       ARG  12   7.010  -0.446   5.125
  118   1HH1  ARG  12          1HH2      ARG  12   6.063  -3.091   6.650
  119   2HH1  ARG  12          2HH2      ARG  12   4.786  -2.399   7.594
  120   1HH2  ARG  12          1HH1      ARG  12   4.710   0.567   5.800
  121   2HH2  ARG  12          2HH1      ARG  12   4.020  -0.328   7.112
  122    H    ARG  13           H        ARG  13   4.054   1.831   1.615
  123    HA   ARG  13           HA       ARG  13   6.333   3.159   2.311
  124   1HB   ARG  13          2HB       ARG  13   6.817   4.318   0.008
  125   2HB   ARG  13          1HB       ARG  13   7.468   2.704   0.283
  126   1HG   ARG  13          2HG       ARG  13   6.011   1.714  -1.193
  127   2HG   ARG  13          1HG       ARG  13   4.716   2.861  -0.843
  128   1HD   ARG  13          2HD       ARG  13   7.183   3.869  -2.231
  129   2HD   ARG  13          1HD       ARG  13   5.965   2.983  -3.171
  130    HE   ARG  13           HE       ARG  13   4.277   4.631  -2.253
  131   1HH1  ARG  13          1HH2      ARG  13   7.133   5.567  -3.628
  132   2HH1  ARG  13          2HH2      ARG  13   7.147   7.176  -2.987
  133   1HH2  ARG  13          1HH1      ARG  13   4.502   6.618  -0.816
  134   2HH2  ARG  13          2HH1      ARG  13   5.658   7.771  -1.395
  135    H    CYS  14           H        CYS  14   4.183   3.746   3.338
  136    HA   CYS  14           HA       CYS  14   2.903   6.025   1.908
  137   1HB   CYS  14          2HB       CYS  14   1.745   3.750   2.676
  138   2HB   CYS  14          1HB       CYS  14   1.651   4.598   4.213
  139    H    LYS  15           H        LYS  15   1.637   6.360   4.685
  140    HA   LYS  15           HA       LYS  15   2.795   8.621   5.650
  141   1HB   LYS  15          2HB       LYS  15   0.787   7.523   6.557
  142   2HB   LYS  15          1HB       LYS  15   1.793   6.260   7.269
  143   1HG   LYS  15          2HG       LYS  15   1.418   7.761   9.056
  144   2HG   LYS  15          1HG       LYS  15   3.026   8.188   8.470
  145   1HD   LYS  15          2HD       LYS  15   1.394   9.736   6.875
  146   2HD   LYS  15          1HD       LYS  15   0.543   9.758   8.420
  147   1HE   LYS  15          2HE       LYS  15   2.022  11.326   9.120
  148   2HE   LYS  15          1HE       LYS  15   3.287  10.083   9.045
  149   1HZ   LYS  15          1HZ       LYS  15   3.491  12.177   7.554
  150   2HZ   LYS  15          2HZ       LYS  15   2.357  11.381   6.571
  151   3HZ   LYS  15          3HZ       LYS  15   3.858  10.655   6.902
  152   1HN   NH2  16          1HN       NH2  16   4.958   9.076   6.162
  153   2HN   NH2  16          2HN       NH2  16   6.040   7.992   6.896
  Start of MODEL    5
    1   1H    ILE   1          1HT       ILE   1  -3.448   9.636  -4.686
    2   2H    ILE   1          2HT       ILE   1  -4.822  10.221  -3.876
    3   3H    ILE   1          3HT       ILE   1  -4.563   8.548  -4.014
    4    HA   ILE   1           HA       ILE   1  -2.721  10.364  -2.546
    5    HB   ILE   1           HB       ILE   1  -5.276   9.025  -1.862
    6   1HG1  ILE   1          2HG1      ILE   1  -4.605  11.167  -0.153
    7   2HG1  ILE   1          1HG1      ILE   1  -4.092  11.624  -1.776
    8   1HG2  ILE   1          1HG2      ILE   1  -3.155   9.427   0.232
    9   2HG2  ILE   1          2HG2      ILE   1  -3.592   7.853  -0.436
   10   3HG2  ILE   1          3HG2      ILE   1  -4.778   8.786   0.471
   11   1HD1  ILE   1          1HD1      ILE   1  -6.852  10.588  -1.062
   12   2HD1  ILE   1          2HD1      ILE   1  -6.326  11.130  -2.655
   13   3HD1  ILE   1          3HD1      ILE   1  -6.450  12.284  -1.327
   14    H    CYS   2           H        CYS   2  -1.763   8.950  -0.833
   15    HA   CYS   2           HA       CYS   2  -0.051   6.988  -1.968
   16   1HB   CYS   2          2HB       CYS   2   0.487   8.141   0.079
   17   2HB   CYS   2          1HB       CYS   2  -0.961   7.522   0.869
   18    H    LEU   3           H        LEU   3   0.027   4.704  -1.552
   19    HA   LEU   3           HA       LEU   3  -2.389   3.292  -2.149
   20   1HB   LEU   3          2HB       LEU   3   0.354   2.833  -2.055
   21   2HB   LEU   3          1HB       LEU   3  -0.289   1.746  -0.823
   22    HG   LEU   3           HG       LEU   3  -1.841   0.773  -2.423
   23   1HD1  LEU   3          1HD1      LEU   3  -2.561   2.268  -3.987
   24   2HD1  LEU   3          2HD1      LEU   3  -1.193   1.664  -4.919
   25   3HD1  LEU   3          3HD1      LEU   3  -1.035   3.152  -3.986
   26   1HD2  LEU   3          1HD2      LEU   3   0.669   0.885  -4.038
   27   2HD2  LEU   3          2HD2      LEU   3  -0.279  -0.514  -3.533
   28   3HD2  LEU   3          3HD2      LEU   3   0.791   0.289  -2.383
   29    H    LYS   4           H        LYS   4  -4.068   3.103  -0.745
   30    HA   LYS   4           HA       LYS   4  -3.470   2.380   2.067
   31   1HB   LYS   4          2HB       LYS   4  -4.628   4.762   1.053
   32   2HB   LYS   4          1HB       LYS   4  -5.939   3.846   1.798
   33   1HG   LYS   4          2HG       LYS   4  -4.467   3.559   3.831
   34   2HG   LYS   4          1HG       LYS   4  -3.335   4.692   3.091
   35   1HD   LYS   4          2HD       LYS   4  -4.703   6.023   4.514
   36   2HD   LYS   4          1HD       LYS   4  -5.322   6.301   2.885
   37   1HE   LYS   4          2HE       LYS   4  -6.921   4.283   3.441
   38   2HE   LYS   4          1HE       LYS   4  -6.550   4.712   5.124
   39   1HZ   LYS   4          1HZ       LYS   4  -7.299   6.747   3.109
   40   2HZ   LYS   4          2HZ       LYS   4  -7.279   6.901   4.800
   41   3HZ   LYS   4          3HZ       LYS   4  -8.467   5.949   4.045
   42    H    LYS   5           H        LYS   5  -4.180   0.896  -0.391
   43    HA   LYS   5           HA       LYS   5  -6.600  -0.488   0.648
   44   1HB   LYS   5          2HB       LYS   5  -7.385  -0.662  -1.686
   45   2HB   LYS   5          1HB       LYS   5  -7.167   1.026  -1.225
   46   1HG   LYS   5          2HG       LYS   5  -4.844  -0.408  -2.443
   47   2HG   LYS   5          1HG       LYS   5  -6.162   0.089  -3.504
   48   1HD   LYS   5          2HD       LYS   5  -5.443   2.203  -1.638
   49   2HD   LYS   5          1HD       LYS   5  -4.061   1.703  -2.614
   50   1HE   LYS   5          2HE       LYS   5  -5.043   3.287  -4.029
   51   2HE   LYS   5          1HE       LYS   5  -5.856   1.811  -4.587
   52   1HZ   LYS   5          1HZ       LYS   5  -6.892   3.473  -2.361
   53   2HZ   LYS   5          2HZ       LYS   5  -7.695   2.230  -3.195
   54   3HZ   LYS   5          3HZ       LYS   5  -7.372   3.707  -3.971
   55    H    TRP   6           H        TRP   6  -6.803  -2.636  -0.762
   56    HA   TRP   6           HA       TRP   6  -5.859  -4.718  -1.367
   57   1HB   TRP   6          2HB       TRP   6  -3.248  -3.195  -1.574
   58   2HB   TRP   6          1HB       TRP   6  -3.727  -4.641  -2.457
   59    HD1  TRP   6           HD       TRP   6  -6.743  -3.418  -3.026
   60    HE1  TRP   6           1HE      TRP   6  -6.967  -1.729  -4.960
   61    HE3  TRP   6           3HE      TRP   6  -1.879  -1.927  -3.461
   62    HZ2  TRP   6           2HZ      TRP   6  -5.303   0.023  -6.489
   63    HZ3  TRP   6           3HZ      TRP   6  -1.226  -0.249  -5.163
   64    HH2  TRP   6           HH       TRP   6  -2.930   0.727  -6.677
   65    HA   PRO   7           HA       PRO   7  -4.418  -5.218   2.915
   66   1HB   PRO   7          2HB       PRO   7  -5.749  -7.580   3.300
   67   2HB   PRO   7          1HB       PRO   7  -6.512  -5.990   3.503
   68   1HG   PRO   7          2HG       PRO   7  -6.669  -7.887   1.215
   69   2HG   PRO   7          1HG       PRO   7  -7.928  -6.861   1.919
   70   1HD   PRO   7          2HD       PRO   7  -6.605  -6.246  -0.386
   71   2HD   PRO   7          1HD       PRO   7  -7.297  -5.027   0.701
   72    H    TRP   8           H        TRP   8  -3.853  -6.856   0.005
   73    HA   TRP   8           HA       TRP   8  -1.873  -8.648   1.336
   74   1HB   TRP   8          2HB       TRP   8  -2.239 -10.140  -0.642
   75   2HB   TRP   8          1HB       TRP   8  -3.701  -9.901   0.318
   76    HD1  TRP   8           HD       TRP   8  -5.510  -8.204  -0.616
   77    HE1  TRP   8           1HE      TRP   8  -6.061  -7.443  -3.024
   78    HE3  TRP   8           3HE      TRP   8  -1.240  -9.667  -2.975
   79    HZ2  TRP   8           2HZ      TRP   8  -4.826  -7.458  -5.611
   80    HZ3  TRP   8           3HZ      TRP   8  -0.946  -9.285  -5.406
   81    HH2  TRP   8           HH       TRP   8  -2.732  -8.185  -6.726
   82    H    TRP   9           H        TRP   9  -1.201  -5.986   0.653
   83    HA   TRP   9           HA       TRP   9   0.079  -5.982  -1.992
   84   1HB   TRP   9          2HB       TRP   9  -1.100  -4.085  -0.709
   85   2HB   TRP   9          1HB       TRP   9   0.352  -4.019   0.274
   86    HD1  TRP   9           HD       TRP   9   1.772  -2.049  -0.556
   87    HE1  TRP   9           1HE      TRP   9   2.496  -1.165  -2.872
   88    HE3  TRP   9           3HE      TRP   9  -0.814  -5.247  -3.533
   89    HZ2  TRP   9           2HZ      TRP   9   2.024  -1.754  -5.642
   90    HZ3  TRP   9           3HZ      TRP   9  -0.674  -5.080  -6.010
   91    HH2  TRP   9           HH       TRP   9   0.743  -3.337  -7.065
   92    HA   PRO  10           HA       PRO  10   3.774  -7.783  -0.254
   93   1HB   PRO  10          2HB       PRO  10   5.292  -7.604  -2.527
   94   2HB   PRO  10          1HB       PRO  10   4.052  -8.852  -2.286
   95   1HG   PRO  10          2HG       PRO  10   3.907  -6.319  -3.843
   96   2HG   PRO  10          1HG       PRO  10   3.248  -7.917  -4.225
   97   1HD   PRO  10          2HD       PRO  10   1.739  -5.872  -3.250
   98   2HD   PRO  10          1HD       PRO  10   1.364  -7.585  -2.965
   99    H    TRP  11           H        TRP  11   3.930  -4.838  -2.275
  100    HA   TRP  11           HA       TRP  11   6.329  -3.901  -0.782
  101   1HB   TRP  11          2HB       TRP  11   4.864  -2.464  -2.983
  102   2HB   TRP  11          1HB       TRP  11   6.571  -2.383  -2.572
  103    HD1  TRP  11           HD       TRP  11   7.603  -5.165  -2.616
  104    HE1  TRP  11           1HE      TRP  11   7.523  -6.683  -4.700
  105    HE3  TRP  11           3HE      TRP  11   3.848  -2.887  -5.212
  106    HZ2  TRP  11           2HZ      TRP  11   6.054  -6.898  -7.148
  107    HZ3  TRP  11           3HZ      TRP  11   3.127  -3.765  -7.414
  108    HH2  TRP  11           HH       TRP  11   4.224  -5.766  -8.385
  109    H    ARG  12           H        ARG  12   6.076  -1.308  -0.650
  110    HA   ARG  12           HA       ARG  12   3.616  -0.115   0.094
  111   1HB   ARG  12          2HB       ARG  12   4.749  -2.049   1.973
  112   2HB   ARG  12          1HB       ARG  12   4.475  -0.474   2.718
  113   1HG   ARG  12          2HG       ARG  12   2.191  -0.877   1.182
  114   2HG   ARG  12          1HG       ARG  12   2.530  -2.471   1.855
  115   1HD   ARG  12          2HD       ARG  12   2.954  -0.567   3.942
  116   2HD   ARG  12          1HD       ARG  12   1.382  -0.215   3.196
  117    HE   ARG  12           HE       ARG  12   0.733  -2.552   3.606
  118   1HH1  ARG  12          1HH2      ARG  12   1.726  -1.370   6.270
  119   2HH1  ARG  12          2HH2      ARG  12   2.676  -2.688   6.869
  120   1HH2  ARG  12          1HH1      ARG  12   2.818  -4.322   3.814
  121   2HH2  ARG  12          2HH1      ARG  12   3.294  -4.359   5.479
  122    H    ARG  13           H        ARG  13   3.980   1.869   1.494
  123    HA   ARG  13           HA       ARG  13   6.287   2.930   2.467
  124   1HB   ARG  13          2HB       ARG  13   7.540   2.534   0.488
  125   2HB   ARG  13          1HB       ARG  13   6.189   2.987  -0.551
  126   1HG   ARG  13          2HG       ARG  13   6.790   5.164  -0.528
  127   2HG   ARG  13          1HG       ARG  13   6.981   5.163   1.225
  128   1HD   ARG  13          2HD       ARG  13   9.231   4.373   1.086
  129   2HD   ARG  13          1HD       ARG  13   9.045   3.933  -0.624
  130    HE   ARG  13           HE       ARG  13   8.837   6.362  -1.128
  131   1HH1  ARG  13          1HH1      ARG  13  11.477   5.674   0.400
  132   2HH1  ARG  13          2HH1      ARG  13  11.584   7.058   1.436
  133   1HH2  ARG  13          1HH2      ARG  13   8.306   8.048   0.894
  134   2HH2  ARG  13          2HH2      ARG  13   9.789   8.402   1.716
  135    H    CYS  14           H        CYS  14   4.132   3.606   3.393
  136    HA   CYS  14           HA       CYS  14   3.021   6.015   2.044
  137   1HB   CYS  14          2HB       CYS  14   1.772   3.787   2.823
  138   2HB   CYS  14          1HB       CYS  14   1.728   4.643   4.358
  139    H    LYS  15           H        LYS  15   1.823   6.381   4.852
  140    HA   LYS  15           HA       LYS  15   3.085   8.575   5.822
  141   1HB   LYS  15          2HB       LYS  15   1.105   7.706   6.853
  142   2HB   LYS  15          1HB       LYS  15   1.920   6.205   7.296
  143   1HG   LYS  15          2HG       LYS  15   3.331   7.365   8.883
  144   2HG   LYS  15          1HG       LYS  15   2.720   8.930   8.350
  145   1HD   LYS  15          2HD       LYS  15   1.114   8.766   9.920
  146   2HD   LYS  15          1HD       LYS  15   0.438   7.415   9.010
  147   1HE   LYS  15          2HE       LYS  15   2.248   5.980  10.234
  148   2HE   LYS  15          1HE       LYS  15   2.310   7.340  11.373
  149   1HZ   LYS  15          1HZ       LYS  15  -0.247   6.140  10.479
  150   2HZ   LYS  15          2HZ       LYS  15   0.023   7.173  11.801
  151   3HZ   LYS  15          3HZ       LYS  15   0.581   5.569  11.845
  152   1HN   NH2  16          1HN       NH2  16   5.410   8.675   5.736
  153   2HN   NH2  16          2HN       NH2  16   6.420   7.664   6.652
  Start of MODEL    6
    1   1H    ILE   1          1HT       ILE   1  -5.119   9.531  -3.995
    2   2H    ILE   1          2HT       ILE   1  -5.661   8.026  -3.423
    3   3H    ILE   1          3HT       ILE   1  -4.279   8.116  -4.407
    4    HA   ILE   1           HA       ILE   1  -3.516   9.720  -2.414
    5    HB   ILE   1           HB       ILE   1  -4.389   8.831  -0.352
    6   1HG1  ILE   1          2HG1      ILE   1  -4.873   6.543  -1.951
    7   2HG1  ILE   1          1HG1      ILE   1  -5.142   6.712  -0.221
    8   1HG2  ILE   1          1HG2      ILE   1  -5.774  10.554  -1.207
    9   2HG2  ILE   1          2HG2      ILE   1  -6.890   9.266  -0.750
   10   3HG2  ILE   1          3HG2      ILE   1  -6.459   9.501  -2.444
   11   1HD1  ILE   1          1HD1      ILE   1  -7.420   7.652  -0.738
   12   2HD1  ILE   1          2HD1      ILE   1  -7.213   5.977  -1.249
   13   3HD1  ILE   1          3HD1      ILE   1  -7.135   7.278  -2.437
   14    H    CYS   2           H        CYS   2  -2.059   8.532  -0.843
   15    HA   CYS   2           HA       CYS   2  -0.277   6.782  -2.221
   16   1HB   CYS   2          2HB       CYS   2   0.455   8.113  -0.364
   17   2HB   CYS   2          1HB       CYS   2  -0.768   7.415   0.695
   18    H    LEU   3           H        LEU   3   0.222   4.560  -1.684
   19    HA   LEU   3           HA       LEU   3  -1.741   2.666  -2.036
   20   1HB   LEU   3          2HB       LEU   3   0.867   2.565  -1.796
   21   2HB   LEU   3          1HB       LEU   3   0.524   2.198  -0.105
   22    HG   LEU   3           HG       LEU   3   0.668   0.084  -1.200
   23   1HD1  LEU   3          1HD1      LEU   3  -1.282   0.383   0.314
   24   2HD1  LEU   3          2HD1      LEU   3  -1.606  -0.788  -0.966
   25   3HD1  LEU   3          3HD1      LEU   3  -2.264   0.845  -1.077
   26   1HD2  LEU   3          1HD2      LEU   3   0.355  -0.036  -3.429
   27   2HD2  LEU   3          2HD2      LEU   3  -0.325   1.591  -3.435
   28   3HD2  LEU   3          3HD2      LEU   3  -1.375   0.197  -3.182
   29    H    LYS   4           H        LYS   4  -3.658   2.745  -0.906
   30    HA   LYS   4           HA       LYS   4  -3.513   2.269   2.006
   31   1HB   LYS   4          2HB       LYS   4  -4.263   4.686   0.733
   32   2HB   LYS   4          1HB       LYS   4  -5.753   3.957   1.332
   33   1HG   LYS   4          2HG       LYS   4  -5.087   4.082   3.549
   34   2HG   LYS   4          1HG       LYS   4  -3.372   4.001   3.146
   35   1HD   LYS   4          2HD       LYS   4  -3.623   6.245   3.762
   36   2HD   LYS   4          1HD       LYS   4  -3.796   6.321   2.008
   37   1HE   LYS   4          2HE       LYS   4  -6.338   6.021   2.441
   38   2HE   LYS   4          1HE       LYS   4  -5.957   6.479   4.113
   39   1HZ   LYS   4          1HZ       LYS   4  -6.438   8.325   2.373
   40   2HZ   LYS   4          2HZ       LYS   4  -4.837   8.035   1.880
   41   3HZ   LYS   4          3HZ       LYS   4  -5.163   8.526   3.474
   42    H    LYS   5           H        LYS   5  -4.040   0.650  -0.387
   43    HA   LYS   5           HA       LYS   5  -6.666  -0.442   0.438
   44   1HB   LYS   5          2HB       LYS   5  -7.099  -0.693  -2.103
   45   2HB   LYS   5          1HB       LYS   5  -7.266   0.919  -1.410
   46   1HG   LYS   5          2HG       LYS   5  -4.930   1.430  -2.095
   47   2HG   LYS   5          1HG       LYS   5  -4.823  -0.163  -2.847
   48   1HD   LYS   5          2HD       LYS   5  -5.443   1.148  -4.670
   49   2HD   LYS   5          1HD       LYS   5  -7.018   0.605  -4.089
   50   1HE   LYS   5          2HE       LYS   5  -5.839   3.157  -3.003
   51   2HE   LYS   5          1HE       LYS   5  -6.683   3.161  -4.564
   52   1HZ   LYS   5          1HZ       LYS   5  -7.734   2.672  -1.897
   53   2HZ   LYS   5          2HZ       LYS   5  -8.318   1.643  -3.116
   54   3HZ   LYS   5          3HZ       LYS   5  -8.502   3.326  -3.261
   55    H    TRP   6           H        TRP   6  -6.984  -2.670  -0.647
   56    HA   TRP   6           HA       TRP   6  -6.179  -4.841  -1.124
   57   1HB   TRP   6          2HB       TRP   6  -3.558  -3.477  -1.772
   58   2HB   TRP   6          1HB       TRP   6  -4.225  -4.943  -2.485
   59    HD1  TRP   6           HD       TRP   6  -7.207  -3.675  -2.857
   60    HE1  TRP   6           1HE      TRP   6  -7.581  -2.058  -4.829
   61    HE3  TRP   6           3HE      TRP   6  -2.383  -2.266  -3.772
   62    HZ2  TRP   6           2HZ      TRP   6  -6.039  -0.386  -6.563
   63    HZ3  TRP   6           3HZ      TRP   6  -1.866  -0.661  -5.587
   64    HH2  TRP   6           HH       TRP   6  -3.686   0.279  -6.983
   65    HA   PRO   7           HA       PRO   7  -4.262  -5.045   2.986
   66   1HB   PRO   7          2HB       PRO   7  -5.475  -7.409   3.656
   67   2HB   PRO   7          1HB       PRO   7  -6.263  -5.828   3.833
   68   1HG   PRO   7          2HG       PRO   7  -6.582  -7.871   1.690
   69   2HG   PRO   7          1HG       PRO   7  -7.801  -6.844   2.462
   70   1HD   PRO   7          2HD       PRO   7  -6.755  -6.323   0.004
   71   2HD   PRO   7          1HD       PRO   7  -7.354  -5.058   1.096
   72    H    TRP   8           H        TRP   8  -3.905  -6.787   0.133
   73    HA   TRP   8           HA       TRP   8  -1.821  -8.544   1.350
   74   1HB   TRP   8          2HB       TRP   8  -2.261  -9.966  -0.705
   75   2HB   TRP   8          1HB       TRP   8  -3.618  -9.853   0.419
   76    HD1  TRP   8           HD       TRP   8  -5.639  -8.290  -0.247
   77    HE1  TRP   8           1HE      TRP   8  -6.469  -7.430  -2.540
   78    HE3  TRP   8           3HE      TRP   8  -1.504  -9.228  -3.069
   79    HZ2  TRP   8           2HZ      TRP   8  -5.485  -7.175  -5.220
   80    HZ3  TRP   8           3HZ      TRP   8  -1.467  -8.670  -5.483
   81    HH2  TRP   8           HH       TRP   8  -3.451  -7.646  -6.561
   82    H    TRP   9           H        TRP   9  -1.222  -5.867   0.674
   83    HA   TRP   9           HA       TRP   9  -0.032  -5.827  -2.017
   84   1HB   TRP   9          2HB       TRP   9  -1.262  -3.977  -0.706
   85   2HB   TRP   9          1HB       TRP   9   0.215  -3.831   0.225
   86    HD1  TRP   9           HD       TRP   9   1.791  -2.045  -0.695
   87    HE1  TRP   9           1HE      TRP   9   2.272  -1.040  -3.025
   88    HE3  TRP   9           3HE      TRP   9  -1.413  -4.812  -3.487
   89    HZ2  TRP   9           2HZ      TRP   9   1.391  -1.381  -5.736
   90    HZ3  TRP   9           3HZ      TRP   9  -1.592  -4.469  -5.944
   91    HH2  TRP   9           HH       TRP   9  -0.192  -2.757  -7.069
   92    HA   PRO  10           HA       PRO  10   3.771  -7.477  -0.364
   93   1HB   PRO  10          2HB       PRO  10   5.237  -7.202  -2.663
   94   2HB   PRO  10          1HB       PRO  10   4.063  -8.510  -2.414
   95   1HG   PRO  10          2HG       PRO  10   3.763  -5.962  -3.930
   96   2HG   PRO  10          1HG       PRO  10   3.188  -7.588  -4.332
   97   1HD   PRO  10          2HD       PRO  10   1.571  -5.665  -3.307
   98   2HD   PRO  10          1HD       PRO  10   1.318  -7.400  -3.013
   99    H    TRP  11           H        TRP  11   3.837  -4.563  -2.433
  100    HA   TRP  11           HA       TRP  11   6.214  -3.494  -1.054
  101   1HB   TRP  11          2HB       TRP  11   4.384  -2.103  -3.003
  102   2HB   TRP  11          1HB       TRP  11   6.097  -1.818  -2.736
  103    HD1  TRP  11           HD       TRP  11   7.636  -4.181  -3.188
  104    HE1  TRP  11           1HE      TRP  11   7.501  -5.719  -5.252
  105    HE3  TRP  11           3HE      TRP  11   3.002  -2.931  -4.902
  106    HZ2  TRP  11           2HZ      TRP  11   5.663  -6.336  -7.356
  107    HZ3  TRP  11           3HZ      TRP  11   2.079  -4.007  -6.938
  108    HH2  TRP  11           HH       TRP  11   3.403  -5.706  -8.166
  109    H    ARG  12           H        ARG  12   5.765  -0.928  -0.751
  110    HA   ARG  12           HA       ARG  12   3.290  -0.124   0.471
  111   1HB   ARG  12          2HB       ARG  12   3.989  -0.342   2.839
  112   2HB   ARG  12          1HB       ARG  12   3.957  -1.916   2.043
  113   1HG   ARG  12          2HG       ARG  12   6.215  -2.175   2.179
  114   2HG   ARG  12          1HG       ARG  12   6.527  -0.473   1.836
  115   1HD   ARG  12          2HD       ARG  12   7.050  -0.308   4.050
  116   2HD   ARG  12          1HD       ARG  12   5.301  -0.399   4.335
  117    HE   ARG  12           HE       ARG  12   5.572  -2.887   4.485
  118   1HH1  ARG  12          1HH1      ARG  12   8.448  -2.662   3.335
  119   2HH1  ARG  12          2HH1      ARG  12   9.372  -3.030   4.754
  120   1HH2  ARG  12          1HH2      ARG  12   6.706  -2.574   6.927
  121   2HH2  ARG  12          2HH2      ARG  12   8.384  -2.981   6.789
  122    H    ARG  13           H        ARG  13   5.177   1.119   2.716
  123    HA   ARG  13           HA       ARG  13   6.578   3.000   2.944
  124   1HB   ARG  13          2HB       ARG  13   7.446   1.891   0.638
  125   2HB   ARG  13          1HB       ARG  13   6.765   3.383  -0.010
  126   1HG   ARG  13          2HG       ARG  13   8.221   4.740   1.242
  127   2HG   ARG  13          1HG       ARG  13   8.589   3.448   2.385
  128   1HD   ARG  13          2HD       ARG  13   9.637   2.203   0.376
  129   2HD   ARG  13          1HD       ARG  13   9.589   3.773  -0.450
  130    HE   ARG  13           HE       ARG  13  11.060   4.676   1.269
  131   1HH1  ARG  13          1HH2      ARG  13  10.100   2.786   3.469
  132   2HH1  ARG  13          2HH2      ARG  13  11.507   1.802   3.696
  133   1HH2  ARG  13          1HH1      ARG  13  12.993   2.771   0.717
  134   2HH2  ARG  13          2HH1      ARG  13  13.144   1.793   2.138
  135    H    CYS  14           H        CYS  14   4.192   3.465   3.438
  136    HA   CYS  14           HA       CYS  14   3.138   5.632   1.687
  137   1HB   CYS  14          2HB       CYS  14   1.878   3.453   2.369
  138   2HB   CYS  14          1HB       CYS  14   1.683   4.252   3.925
  139    H    LYS  15           H        LYS  15   1.528   6.064   4.339
  140    HA   LYS  15           HA       LYS  15   2.425   8.490   5.184
  141   1HB   LYS  15          2HB       LYS  15   0.430   7.365   6.039
  142   2HB   LYS  15          1HB       LYS  15   1.432   6.184   6.883
  143   1HG   LYS  15          2HG       LYS  15   2.454   8.578   7.795
  144   2HG   LYS  15          1HG       LYS  15   0.731   8.930   7.655
  145   1HD   LYS  15          2HD       LYS  15   0.723   6.416   8.786
  146   2HD   LYS  15          1HD       LYS  15   2.129   7.166   9.544
  147   1HE   LYS  15          2HE       LYS  15   0.359   7.820  10.969
  148   2HE   LYS  15          1HE       LYS  15   0.514   9.218   9.886
  149   1HZ   LYS  15          1HZ       LYS  15  -1.175   6.938   9.101
  150   2HZ   LYS  15          2HZ       LYS  15  -1.280   8.565   8.624
  151   3HZ   LYS  15          3HZ       LYS  15  -1.793   8.097  10.175
  152   1HN   NH2  16          1HN       NH2  16   3.411   5.557   7.049
  153   2HN   NH2  16          2HN       NH2  16   4.956   6.136   7.447
  Start of MODEL    7
    1   1H    ILE   1          1HT       ILE   1   2.018   6.124  -6.495
    2   2H    ILE   1          2HT       ILE   1   2.140   7.762  -6.931
    3   3H    ILE   1          3HT       ILE   1   0.707   6.902  -7.238
    4    HA   ILE   1           HA       ILE   1   1.626   8.144  -4.777
    5    HB   ILE   1           HB       ILE   1  -0.809   7.603  -6.377
    6   1HG1  ILE   1          2HG1      ILE   1  -0.809  10.104  -5.059
    7   2HG1  ILE   1          1HG1      ILE   1   0.837   9.802  -5.610
    8   1HG2  ILE   1          1HG2      ILE   1  -2.352   8.213  -4.648
    9   2HG2  ILE   1          2HG2      ILE   1  -1.038   8.448  -3.500
   10   3HG2  ILE   1          3HG2      ILE   1  -1.425   6.827  -4.080
   11   1HD1  ILE   1          1HD1      ILE   1   0.044   9.401  -7.886
   12   2HD1  ILE   1          2HD1      ILE   1  -0.550  10.967  -7.332
   13   3HD1  ILE   1          3HD1      ILE   1  -1.630   9.571  -7.361
   14    H    CYS   2           H        CYS   2   0.307   7.380  -2.893
   15    HA   CYS   2           HA       CYS   2   0.943   4.509  -2.396
   16   1HB   CYS   2          2HB       CYS   2   1.858   6.134  -0.864
   17   2HB   CYS   2          1HB       CYS   2   0.277   6.879  -0.635
   18    H    LEU   3           H        LEU   3  -0.577   3.203  -1.222
   19    HA   LEU   3           HA       LEU   3  -3.446   4.009  -1.465
   20   1HB   LEU   3          2HB       LEU   3  -3.899   1.794  -2.436
   21   2HB   LEU   3          1HB       LEU   3  -2.763   2.705  -3.431
   22    HG   LEU   3           HG       LEU   3  -1.148   1.385  -1.582
   23   1HD1  LEU   3          1HD1      LEU   3  -2.946  -0.070  -0.885
   24   2HD1  LEU   3          2HD1      LEU   3  -1.880  -1.005  -1.934
   25   3HD1  LEU   3          3HD1      LEU   3  -3.407  -0.381  -2.558
   26   1HD2  LEU   3          1HD2      LEU   3  -0.123   1.043  -3.552
   27   2HD2  LEU   3          2HD2      LEU   3  -1.577   1.586  -4.389
   28   3HD2  LEU   3          3HD2      LEU   3  -1.367  -0.123  -4.006
   29    H    LYS   4           H        LYS   4  -4.656   3.397   0.297
   30    HA   LYS   4           HA       LYS   4  -3.311   1.788   2.374
   31   1HB   LYS   4          2HB       LYS   4  -5.542   3.817   2.326
   32   2HB   LYS   4          1HB       LYS   4  -5.282   2.793   3.738
   33   1HG   LYS   4          2HG       LYS   4  -2.904   4.198   2.608
   34   2HG   LYS   4          1HG       LYS   4  -4.082   5.175   3.485
   35   1HD   LYS   4          2HD       LYS   4  -3.436   4.333   5.475
   36   2HD   LYS   4          1HD       LYS   4  -3.501   2.676   4.871
   37   1HE   LYS   4          2HE       LYS   4  -1.278   3.212   3.662
   38   2HE   LYS   4          1HE       LYS   4  -1.192   4.624   4.736
   39   1HZ   LYS   4          1HZ       LYS   4  -1.338   1.763   5.481
   40   2HZ   LYS   4          2HZ       LYS   4  -1.747   2.992   6.581
   41   3HZ   LYS   4          3HZ       LYS   4  -0.176   2.909   5.941
   42    H    LYS   5           H        LYS   5  -4.912   1.103  -0.149
   43    HA   LYS   5           HA       LYS   5  -6.978  -0.656   1.069
   44   1HB   LYS   5          2HB       LYS   5  -7.941  -0.650  -1.174
   45   2HB   LYS   5          1HB       LYS   5  -7.605   1.011  -0.683
   46   1HG   LYS   5          2HG       LYS   5  -5.472   0.948  -1.922
   47   2HG   LYS   5          1HG       LYS   5  -5.813  -0.709  -2.423
   48   1HD   LYS   5          2HD       LYS   5  -6.482   0.717  -4.238
   49   2HD   LYS   5          1HD       LYS   5  -7.960   0.154  -3.455
   50   1HE   LYS   5          2HE       LYS   5  -8.034   2.280  -2.136
   51   2HE   LYS   5          1HE       LYS   5  -6.623   2.854  -3.049
   52   1HZ   LYS   5          1HZ       LYS   5  -7.787   2.746  -5.057
   53   2HZ   LYS   5          2HZ       LYS   5  -8.904   3.438  -3.979
   54   3HZ   LYS   5          3HZ       LYS   5  -9.032   1.797  -4.404
   55    H    TRP   6           H        TRP   6  -7.252  -2.711  -0.433
   56    HA   TRP   6           HA       TRP   6  -6.346  -4.760  -1.179
   57   1HB   TRP   6          2HB       TRP   6  -3.886  -3.058  -1.696
   58   2HB   TRP   6          1HB       TRP   6  -4.290  -4.589  -2.467
   59    HD1  TRP   6           HD       TRP   6  -7.502  -3.559  -2.613
   60    HE1  TRP   6           1HE      TRP   6  -8.101  -2.056  -4.618
   61    HE3  TRP   6           3HE      TRP   6  -2.835  -1.976  -3.956
   62    HZ2  TRP   6           2HZ      TRP   6  -6.777  -0.403  -6.539
   63    HZ3  TRP   6           3HZ      TRP   6  -2.534  -0.442  -5.878
   64    HH2  TRP   6           HH       TRP   6  -4.497   0.346  -7.171
   65    HA   PRO   7           HA       PRO   7  -4.366  -5.392   2.854
   66   1HB   PRO   7          2HB       PRO   7  -5.480  -7.865   3.231
   67   2HB   PRO   7          1HB       PRO   7  -6.324  -6.352   3.614
   68   1HG   PRO   7          2HG       PRO   7  -6.598  -8.119   1.233
   69   2HG   PRO   7          1HG       PRO   7  -7.843  -7.247   2.142
   70   1HD   PRO   7          2HD       PRO   7  -6.857  -6.378  -0.239
   71   2HD   PRO   7          1HD       PRO   7  -7.480  -5.285   1.012
   72    H    TRP   8           H        TRP   8  -3.924  -6.695  -0.197
   73    HA   TRP   8           HA       TRP   8  -1.809  -8.552   0.794
   74   1HB   TRP   8          2HB       TRP   8  -2.189  -9.677  -1.455
   75   2HB   TRP   8          1HB       TRP   8  -3.543  -9.778  -0.328
   76    HD1  TRP   8           HD       TRP   8  -5.626  -8.215  -0.761
   77    HE1  TRP   8           1HE      TRP   8  -6.505  -7.071  -2.907
   78    HE3  TRP   8           3HE      TRP   8  -1.472  -8.565  -3.695
   79    HZ2  TRP   8           2HZ      TRP   8  -5.554  -6.393  -5.519
   80    HZ3  TRP   8           3HZ      TRP   8  -1.480  -7.664  -6.005
   81    HH2  TRP   8           HH       TRP   8  -3.513  -6.579  -6.920
   82    H    TRP   9           H        TRP   9  -1.276  -5.786   0.498
   83    HA   TRP   9           HA       TRP   9  -0.037  -5.381  -2.146
   84   1HB   TRP   9          2HB       TRP   9  -1.361  -3.733  -0.660
   85   2HB   TRP   9          1HB       TRP   9   0.096  -3.648   0.309
   86    HD1  TRP   9           HD       TRP   9   1.694  -1.783  -0.398
   87    HE1  TRP   9           1HE      TRP   9   2.166  -0.502  -2.592
   88    HE3  TRP   9           3HE      TRP   9  -1.529  -4.187  -3.488
   89    HZ2  TRP   9           2HZ      TRP   9   1.270  -0.512  -5.319
   90    HZ3  TRP   9           3HZ      TRP   9  -1.721  -3.549  -5.884
   91    HH2  TRP   9           HH       TRP   9  -0.324  -1.712  -6.800
   92    HA   PRO  10           HA       PRO  10   3.746  -7.112  -0.502
   93   1HB   PRO  10          2HB       PRO  10   5.226  -6.760  -2.778
   94   2HB   PRO  10          1HB       PRO  10   4.058  -8.081  -2.578
   95   1HG   PRO  10          2HG       PRO  10   3.760  -5.497  -4.026
   96   2HG   PRO  10          1HG       PRO  10   3.188  -7.112  -4.471
   97   1HD   PRO  10          2HD       PRO  10   1.573  -5.203  -3.400
   98   2HD   PRO  10          1HD       PRO  10   1.303  -6.946  -3.179
   99    H    TRP  11           H        TRP  11   3.897  -4.157  -2.533
  100    HA   TRP  11           HA       TRP  11   6.258  -3.143  -1.128
  101   1HB   TRP  11          2HB       TRP  11   4.405  -1.541  -2.867
  102   2HB   TRP  11          1HB       TRP  11   6.152  -1.420  -2.722
  103    HD1  TRP  11           HD       TRP  11   7.294  -4.065  -3.330
  104    HE1  TRP  11           1HE      TRP  11   6.920  -5.324  -5.550
  105    HE3  TRP  11           3HE      TRP  11   3.007  -1.796  -4.915
  106    HZ2  TRP  11           2HZ      TRP  11   5.049  -5.361  -7.711
  107    HZ3  TRP  11           3HZ      TRP  11   1.950  -2.460  -7.057
  108    HH2  TRP  11           HH       TRP  11   2.965  -4.238  -8.456
  109    H    ARG  12           H        ARG  12   5.917  -0.645  -0.575
  110    HA   ARG  12           HA       ARG  12   3.493   0.181   0.736
  111   1HB   ARG  12          2HB       ARG  12   4.072  -0.328   3.036
  112   2HB   ARG  12          1HB       ARG  12   4.219  -1.821   2.109
  113   1HG   ARG  12          2HG       ARG  12   6.717  -0.473   1.926
  114   2HG   ARG  12          1HG       ARG  12   6.241  -0.462   3.625
  115   1HD   ARG  12          2HD       ARG  12   5.946  -3.012   2.058
  116   2HD   ARG  12          1HD       ARG  12   7.545  -2.547   2.673
  117    HE   ARG  12           HE       ARG  12   5.635  -2.165   4.757
  118   1HH1  ARG  12          1HH2      ARG  12   7.930  -4.283   3.459
  119   2HH1  ARG  12          2HH2      ARG  12   7.498  -5.628   4.461
  120   1HH2  ARG  12          1HH1      ARG  12   4.725  -4.059   5.830
  121   2HH2  ARG  12          2HH1      ARG  12   5.684  -5.501   5.804
  122    H    ARG  13           H        ARG  13   5.166   1.292   3.049
  123    HA   ARG  13           HA       ARG  13   6.652   3.074   3.487
  124   1HB   ARG  13          2HB       ARG  13   7.696   1.931   1.241
  125   2HB   ARG  13          1HB       ARG  13   7.268   3.525   0.617
  126   1HG   ARG  13          2HG       ARG  13   8.486   4.528   2.592
  127   2HG   ARG  13          1HG       ARG  13   9.062   2.905   2.978
  128   1HD   ARG  13          2HD       ARG  13  10.396   2.778   1.051
  129   2HD   ARG  13          1HD       ARG  13   9.452   4.018   0.201
  130    HE   ARG  13           HE       ARG  13  10.860   5.613   1.213
  131   1HH1  ARG  13          1HH1      ARG  13  12.800   3.437   2.029
  132   2HH1  ARG  13          2HH1      ARG  13  12.925   3.708   3.735
  133   1HH2  ARG  13          1HH2      ARG  13  10.079   5.682   3.900
  134   2HH2  ARG  13          2HH2      ARG  13  11.385   4.979   4.794
  135    H    CYS  14           H        CYS  14   4.259   3.711   3.690
  136    HA   CYS  14           HA       CYS  14   3.485   5.848   1.784
  137   1HB   CYS  14          2HB       CYS  14   2.047   3.857   2.715
  138   2HB   CYS  14          1HB       CYS  14   1.881   4.889   4.129
  139    H    LYS  15           H        LYS  15   1.890   6.731   4.295
  140    HA   LYS  15           HA       LYS  15   3.013   9.125   4.930
  141   1HB   LYS  15          2HB       LYS  15   0.890   8.322   5.822
  142   2HB   LYS  15          1HB       LYS  15   1.727   7.118   6.803
  143   1HG   LYS  15          2HG       LYS  15   2.317   8.637   8.388
  144   2HG   LYS  15          1HG       LYS  15   2.688   9.880   7.191
  145   1HD   LYS  15          2HD       LYS  15   0.154  10.084   6.846
  146   2HD   LYS  15          1HD       LYS  15  -0.014   9.136   8.324
  147   1HE   LYS  15          2HE       LYS  15   0.858  10.829   9.670
  148   2HE   LYS  15          1HE       LYS  15   1.790  11.544   8.339
  149   1HZ   LYS  15          1HZ       LYS  15  -0.539  12.529   9.128
  150   2HZ   LYS  15          2HZ       LYS  15  -1.099  11.398   7.990
  151   3HZ   LYS  15          3HZ       LYS  15  -0.008  12.614   7.519
  152   1HN   NH2  16          1HN       NH2  16   5.322   9.279   5.148
  153   2HN   NH2  16          2HN       NH2  16   6.198   8.495   6.371
  Start of MODEL    8
    1   1H    ILE   1          1HT       ILE   1  -0.648  10.723  -2.787
    2   2H    ILE   1          2HT       ILE   1  -1.891  11.867  -2.599
    3   3H    ILE   1          3HT       ILE   1  -2.155  10.461  -3.516
    4    HA   ILE   1           HA       ILE   1  -2.119  10.796  -0.603
    5    HB   ILE   1           HB       ILE   1  -4.027   9.343  -0.848
    6   1HG1  ILE   1          2HG1      ILE   1  -2.564   8.345  -3.049
    7   2HG1  ILE   1          1HG1      ILE   1  -4.119   7.773  -2.461
    8   1HG2  ILE   1          1HG2      ILE   1  -4.279  11.745  -1.459
    9   2HG2  ILE   1          2HG2      ILE   1  -5.417  10.703  -2.314
   10   3HG2  ILE   1          3HG2      ILE   1  -3.989  11.318  -3.146
   11   1HD1  ILE   1          1HD1      ILE   1  -5.229   9.502  -3.911
   12   2HD1  ILE   1          2HD1      ILE   1  -4.327   8.293  -4.824
   13   3HD1  ILE   1          3HD1      ILE   1  -3.643   9.899  -4.573
   14    H    CYS   2           H        CYS   2  -2.206   8.618   0.527
   15    HA   CYS   2           HA       CYS   2   0.276   7.131  -0.115
   16   1HB   CYS   2          2HB       CYS   2  -0.055   7.836   2.159
   17   2HB   CYS   2          1HB       CYS   2  -1.687   7.174   2.184
   18    H    LEU   3           H        LEU   3   0.281   4.809  -0.143
   19    HA   LEU   3           HA       LEU   3  -2.033   3.672  -1.591
   20   1HB   LEU   3          2HB       LEU   3   0.382   3.496  -2.310
   21   2HB   LEU   3          1HB       LEU   3   0.676   2.500  -0.885
   22    HG   LEU   3           HG       LEU   3   0.200   1.214  -3.026
   23   1HD1  LEU   3          1HD1      LEU   3  -0.722  -0.484  -1.783
   24   2HD1  LEU   3          2HD1      LEU   3  -1.982   0.551  -1.112
   25   3HD1  LEU   3          3HD1      LEU   3  -0.346   0.615  -0.457
   26   1HD2  LEU   3          1HD2      LEU   3  -1.610   2.856  -3.733
   27   2HD2  LEU   3          2HD2      LEU   3  -2.638   2.132  -2.496
   28   3HD2  LEU   3          3HD2      LEU   3  -2.062   1.154  -3.845
   29    H    LYS   4           H        LYS   4  -3.621   2.953  -0.195
   30    HA   LYS   4           HA       LYS   4  -2.781   1.106   1.965
   31   1HB   LYS   4          2HB       LYS   4  -3.937   3.680   2.201
   32   2HB   LYS   4          1HB       LYS   4  -5.209   2.527   2.605
   33   1HG   LYS   4          2HG       LYS   4  -4.140   1.800   4.493
   34   2HG   LYS   4          1HG       LYS   4  -2.538   1.970   3.773
   35   1HD   LYS   4          2HD       LYS   4  -3.078   4.545   3.887
   36   2HD   LYS   4          1HD       LYS   4  -4.236   4.046   5.121
   37   1HE   LYS   4          2HE       LYS   4  -1.953   2.629   5.822
   38   2HE   LYS   4          1HE       LYS   4  -1.313   4.196   5.287
   39   1HZ   LYS   4          1HZ       LYS   4  -2.938   5.311   6.670
   40   2HZ   LYS   4          2HZ       LYS   4  -1.998   4.262   7.621
   41   3HZ   LYS   4          3HZ       LYS   4  -3.578   3.824   7.175
   42    H    LYS   5           H        LYS   5  -3.815   0.816  -0.806
   43    HA   LYS   5           HA       LYS   5  -6.467  -0.424  -0.359
   44   1HB   LYS   5          2HB       LYS   5  -6.589  -0.382  -2.796
   45   2HB   LYS   5          1HB       LYS   5  -6.032   1.192  -2.228
   46   1HG   LYS   5          2HG       LYS   5  -3.718   0.596  -2.705
   47   2HG   LYS   5          1HG       LYS   5  -4.202  -1.039  -3.157
   48   1HD   LYS   5          2HD       LYS   5  -3.937   0.185  -5.205
   49   2HD   LYS   5          1HD       LYS   5  -5.673   0.008  -4.943
   50   1HE   LYS   5          2HE       LYS   5  -5.975   2.255  -4.642
   51   2HE   LYS   5          1HE       LYS   5  -4.470   2.426  -3.717
   52   1HZ   LYS   5          1HZ       LYS   5  -3.223   2.126  -5.778
   53   2HZ   LYS   5          2HZ       LYS   5  -4.250   3.477  -5.880
   54   3HZ   LYS   5          3HZ       LYS   5  -4.671   2.024  -6.656
   55    H    TRP   6           H        TRP   6  -6.790  -2.622  -1.419
   56    HA   TRP   6           HA       TRP   6  -6.172  -4.884  -1.667
   57   1HB   TRP   6          2HB       TRP   6  -3.427  -3.684  -2.148
   58   2HB   TRP   6          1HB       TRP   6  -4.035  -5.224  -2.753
   59    HD1  TRP   6           HD       TRP   6  -6.978  -3.880  -3.451
   60    HE1  TRP   6           1HE      TRP   6  -7.153  -2.540  -5.645
   61    HE3  TRP   6           3HE      TRP   6  -2.037  -2.889  -4.275
   62    HZ2  TRP   6           2HZ      TRP   6  -5.426  -1.221  -7.505
   63    HZ3  TRP   6           3HZ      TRP   6  -1.330  -1.590  -6.263
   64    HH2  TRP   6           HH       TRP   6  -3.016  -0.756  -7.878
   65    HA   PRO   7           HA       PRO   7  -4.718  -5.126   2.616
   66   1HB   PRO   7          2HB       PRO   7  -6.098  -7.433   3.151
   67   2HB   PRO   7          1HB       PRO   7  -6.835  -5.820   3.228
   68   1HG   PRO   7          2HG       PRO   7  -6.971  -7.859   1.057
   69   2HG   PRO   7          1HG       PRO   7  -8.241  -6.800   1.691
   70   1HD   PRO   7          2HD       PRO   7  -6.932  -6.283  -0.627
   71   2HD   PRO   7          1HD       PRO   7  -7.561  -5.002   0.428
   72    H    TRP   8           H        TRP   8  -4.063  -6.893  -0.161
   73    HA   TRP   8           HA       TRP   8  -2.218  -8.703   1.326
   74   1HB   TRP   8          2HB       TRP   8  -2.468 -10.177  -0.719
   75   2HB   TRP   8          1HB       TRP   8  -3.944  -9.977   0.224
   76    HD1  TRP   8           HD       TRP   8  -5.761  -8.242  -0.714
   77    HE1  TRP   8           1HE      TRP   8  -6.299  -7.511  -3.132
   78    HE3  TRP   8           3HE      TRP   8  -1.487  -9.749  -3.048
   79    HZ2  TRP   8           2HZ      TRP   8  -5.067  -7.564  -5.715
   80    HZ3  TRP   8           3HZ      TRP   8  -1.190  -9.400  -5.484
   81    HH2  TRP   8           HH       TRP   8  -2.973  -8.311  -6.819
   82    H    TRP   9           H        TRP   9  -1.506  -6.038   0.620
   83    HA   TRP   9           HA       TRP   9   0.134  -6.232  -1.839
   84   1HB   TRP   9          2HB       TRP   9  -1.391  -4.306  -1.066
   85   2HB   TRP   9          1HB       TRP   9  -0.149  -3.963   0.122
   86    HD1  TRP   9           HD       TRP   9   1.619  -2.303  -0.668
   87    HE1  TRP   9           1HE      TRP   9   2.530  -1.536  -2.959
   88    HE3  TRP   9           3HE      TRP   9  -1.039  -5.374  -3.699
   89    HZ2  TRP   9           2HZ      TRP   9   2.159  -2.163  -5.739
   90    HZ3  TRP   9           3HZ      TRP   9  -0.761  -5.289  -6.170
   91    HH2  TRP   9           HH       TRP   9   0.836  -3.687  -7.189
   92    HA   PRO  10           HA       PRO  10   3.514  -7.426   0.855
   93   1HB   PRO  10          2HB       PRO  10   5.352  -7.760  -1.145
   94   2HB   PRO  10          1HB       PRO  10   4.105  -8.965  -0.764
   95   1HG   PRO  10          2HG       PRO  10   4.176  -6.939  -2.942
   96   2HG   PRO  10          1HG       PRO  10   3.583  -8.608  -2.970
   97   1HD   PRO  10          2HD       PRO  10   1.951  -6.426  -2.793
   98   2HD   PRO  10          1HD       PRO  10   1.528  -8.029  -2.150
   99    H    TRP  11           H        TRP  11   4.037  -5.145  -1.862
  100    HA   TRP  11           HA       TRP  11   6.250  -3.797  -0.482
  101   1HB   TRP  11          2HB       TRP  11   4.725  -2.757  -2.852
  102   2HB   TRP  11          1HB       TRP  11   6.436  -2.591  -2.492
  103    HD1  TRP  11           HD       TRP  11   7.496  -5.345  -2.115
  104    HE1  TRP  11           1HE      TRP  11   7.411  -7.163  -3.944
  105    HE3  TRP  11           3HE      TRP  11   3.700  -3.517  -4.987
  106    HZ2  TRP  11           2HZ      TRP  11   5.924  -7.758  -6.315
  107    HZ3  TRP  11           3HZ      TRP  11   2.966  -4.724  -7.023
  108    HH2  TRP  11           HH       TRP  11   4.073  -6.840  -7.691
  109    H    ARG  12           H        ARG  12   5.942  -1.240  -0.734
  110    HA   ARG  12           HA       ARG  12   3.352  -0.164   0.040
  111   1HB   ARG  12          2HB       ARG  12   3.795   0.164   2.379
  112   2HB   ARG  12          1HB       ARG  12   4.190  -1.521   2.038
  113   1HG   ARG  12          2HG       ARG  12   6.558  -0.985   1.879
  114   2HG   ARG  12          1HG       ARG  12   6.214   0.735   2.063
  115   1HD   ARG  12          2HD       ARG  12   5.595   0.491   4.337
  116   2HD   ARG  12          1HD       ARG  12   5.371  -1.263   4.174
  117    HE   ARG  12           HE       ARG  12   8.005   0.131   4.222
  118   1HH1  ARG  12          1HH2      ARG  12   8.037  -2.267   2.434
  119   2HH1  ARG  12          2HH2      ARG  12   8.483  -3.534   3.528
  120   1HH2  ARG  12          1HH1      ARG  12   7.739  -1.698   6.374
  121   2HH2  ARG  12          2HH1      ARG  12   8.315  -3.211   5.759
  122    H    ARG  13           H        ARG  13   3.948   2.139   1.233
  123    HA   ARG  13           HA       ARG  13   6.237   3.569   0.901
  124   1HB   ARG  13          2HB       ARG  13   6.487   3.019  -1.396
  125   2HB   ARG  13          1HB       ARG  13   4.757   3.175  -1.702
  126   1HG   ARG  13          2HG       ARG  13   4.887   5.432  -1.993
  127   2HG   ARG  13          1HG       ARG  13   6.082   5.627  -0.710
  128   1HD   ARG  13          2HD       ARG  13   7.271   4.135  -2.872
  129   2HD   ARG  13          1HD       ARG  13   6.569   5.637  -3.505
  130    HE   ARG  13           HE       ARG  13   7.843   6.850  -1.719
  131   1HH1  ARG  13          1HH1      ARG  13   9.699   5.301  -3.656
  132   2HH1  ARG  13          2HH1      ARG  13  10.853   4.663  -2.532
  133   1HH2  ARG  13          1HH2      ARG  13   8.886   5.293   0.253
  134   2HH2  ARG  13          2HH2      ARG  13  10.393   4.659  -0.320
  135    H    CYS  14           H        CYS  14   4.681   4.158   2.682
  136    HA   CYS  14           HA       CYS  14   2.587   6.093   1.875
  137   1HB   CYS  14          2HB       CYS  14   2.468   4.072   3.571
  138   2HB   CYS  14          1HB       CYS  14   3.201   5.227   4.676
  139    H    LYS  15           H        LYS  15   3.138   7.061   4.759
  140    HA   LYS  15           HA       LYS  15   4.144   9.558   4.412
  141   1HB   LYS  15          2HB       LYS  15   3.370   8.770   6.548
  142   2HB   LYS  15          1HB       LYS  15   4.660   7.569   6.633
  143   1HG   LYS  15          2HG       LYS  15   5.963   9.077   7.673
  144   2HG   LYS  15          1HG       LYS  15   5.903  10.092   6.232
  145   1HD   LYS  15          2HD       LYS  15   3.970  11.260   7.019
  146   2HD   LYS  15          1HD       LYS  15   3.713  10.093   8.317
  147   1HE   LYS  15          2HE       LYS  15   5.932  10.785   9.296
  148   2HE   LYS  15          1HE       LYS  15   5.999  12.077   8.081
  149   1HZ   LYS  15          1HZ       LYS  15   3.767  12.775   8.832
  150   2HZ   LYS  15          2HZ       LYS  15   4.946  12.932  10.045
  151   3HZ   LYS  15          3HZ       LYS  15   3.850  11.636  10.085
  152   1HN   NH2  16          1HN       NH2  16   6.111  10.407   3.655
  153   2HN   NH2  16          2HN       NH2  16   7.583   9.562   3.602
  Start of MODEL    9
    1   1H    ILE   1          1HT       ILE   1  -4.460   8.805  -4.688
    2   2H    ILE   1          2HT       ILE   1  -5.436  10.030  -4.028
    3   3H    ILE   1          3HT       ILE   1  -5.562   8.436  -3.451
    4    HA   ILE   1           HA       ILE   1  -3.329  10.350  -3.039
    5    HB   ILE   1           HB       ILE   1  -4.059  10.354  -0.854
    6   1HG1  ILE   1          2HG1      ILE   1  -5.648   8.236  -0.221
    7   2HG1  ILE   1          1HG1      ILE   1  -4.558   7.484  -1.374
    8   1HG2  ILE   1          1HG2      ILE   1  -6.595   9.420  -2.219
    9   2HG2  ILE   1          2HG2      ILE   1  -5.965  11.066  -2.295
   10   3HG2  ILE   1          3HG2      ILE   1  -6.484  10.391  -0.751
   11   1HD1  ILE   1          1HD1      ILE   1  -3.123   9.223   0.460
   12   2HD1  ILE   1          2HD1      ILE   1  -2.863   7.514   0.114
   13   3HD1  ILE   1          3HD1      ILE   1  -4.042   7.996   1.333
   14    H    CYS   2           H        CYS   2  -2.066   9.117  -1.134
   15    HA   CYS   2           HA       CYS   2  -0.299   7.279  -2.389
   16   1HB   CYS   2          2HB       CYS   2   0.319   8.561  -0.437
   17   2HB   CYS   2          1HB       CYS   2  -0.976   7.832   0.511
   18    H    LEU   3           H        LEU   3   0.042   5.027  -1.874
   19    HA   LEU   3           HA       LEU   3  -2.180   3.332  -2.281
   20   1HB   LEU   3          2HB       LEU   3   0.415   3.095  -2.509
   21   2HB   LEU   3          1HB       LEU   3   0.316   2.481  -0.859
   22    HG   LEU   3           HG       LEU   3  -1.306   0.782  -1.565
   23   1HD1  LEU   3          1HD1      LEU   3  -1.060   0.930  -4.398
   24   2HD1  LEU   3          2HD1      LEU   3  -1.542   2.529  -3.834
   25   3HD1  LEU   3          3HD1      LEU   3  -2.522   1.120  -3.431
   26   1HD2  LEU   3          1HD2      LEU   3   0.295  -0.236  -3.457
   27   2HD2  LEU   3          2HD2      LEU   3   0.776  -0.178  -1.760
   28   3HD2  LEU   3          3HD2      LEU   3   1.352   1.054  -2.883
   29    H    LYS   4           H        LYS   4  -0.986   1.613   0.087
   30    HA   LYS   4           HA       LYS   4  -1.516   1.200   2.359
   31   1HB   LYS   4          2HB       LYS   4  -1.789   3.913   2.192
   32   2HB   LYS   4          1HB       LYS   4  -3.454   3.440   2.535
   33   1HG   LYS   4          2HG       LYS   4  -2.575   2.055   4.456
   34   2HG   LYS   4          1HG       LYS   4  -0.994   2.785   4.175
   35   1HD   LYS   4          2HD       LYS   4  -1.622   4.798   5.041
   36   2HD   LYS   4          1HD       LYS   4  -3.246   4.695   4.359
   37   1HE   LYS   4          2HE       LYS   4  -4.105   3.681   6.229
   38   2HE   LYS   4          1HE       LYS   4  -2.627   2.741   6.517
   39   1HZ   LYS   4          1HZ       LYS   4  -1.650   4.431   7.638
   40   2HZ   LYS   4          2HZ       LYS   4  -3.259   4.868   7.963
   41   3HZ   LYS   4          3HZ       LYS   4  -2.402   5.640   6.716
   42    H    LYS   5           H        LYS   5  -2.935   0.607  -0.194
   43    HA   LYS   5           HA       LYS   5  -5.560  -0.239   0.935
   44   1HB   LYS   5          2HB       LYS   5  -6.336  -0.074  -1.449
   45   2HB   LYS   5          1HB       LYS   5  -5.796   1.472  -0.793
   46   1HG   LYS   5          2HG       LYS   5  -3.611   1.197  -1.858
   47   2HG   LYS   5          1HG       LYS   5  -4.082  -0.393  -2.458
   48   1HD   LYS   5          2HD       LYS   5  -4.300   1.431  -4.172
   49   2HD   LYS   5          1HD       LYS   5  -5.811   0.579  -3.851
   50   1HE   LYS   5          2HE       LYS   5  -5.316   2.927  -2.108
   51   2HE   LYS   5          1HE       LYS   5  -5.610   3.296  -3.819
   52   1HZ   LYS   5          1HZ       LYS   5  -7.641   2.231  -3.798
   53   2HZ   LYS   5          2HZ       LYS   5  -7.624   2.944  -2.256
   54   3HZ   LYS   5          3HZ       LYS   5  -7.267   1.292  -2.435
   55    H    TRP   6           H        TRP   6  -6.367  -2.197  -0.545
   56    HA   TRP   6           HA       TRP   6  -6.002  -4.420  -1.267
   57   1HB   TRP   6          2HB       TRP   6  -3.120  -3.543  -1.623
   58   2HB   TRP   6          1HB       TRP   6  -3.971  -4.815  -2.490
   59    HD1  TRP   6           HD       TRP   6  -6.647  -2.874  -2.803
   60    HE1  TRP   6           1HE      TRP   6  -6.603  -1.146  -4.712
   61    HE3  TRP   6           3HE      TRP   6  -1.620  -2.628  -3.648
   62    HZ2  TRP   6           2HZ      TRP   6  -4.689   0.167  -6.381
   63    HZ3  TRP   6           3HZ      TRP   6  -0.714  -1.133  -5.404
   64    HH2  TRP   6           HH       TRP   6  -2.240   0.264  -6.770
   65    HA   PRO   7           HA       PRO   7  -4.596  -5.535   2.884
   66   1HB   PRO   7          2HB       PRO   7  -6.100  -7.827   2.981
   67   2HB   PRO   7          1HB       PRO   7  -6.755  -6.216   3.342
   68   1HG   PRO   7          2HG       PRO   7  -6.931  -7.807   0.821
   69   2HG   PRO   7          1HG       PRO   7  -8.179  -6.848   1.637
   70   1HD   PRO   7          2HD       PRO   7  -6.842  -5.923  -0.518
   71   2HD   PRO   7          1HD       PRO   7  -7.388  -4.852   0.789
   72    H    TRP   8           H        TRP   8  -4.040  -6.862  -0.167
   73    HA   TRP   8           HA       TRP   8  -2.199  -8.894   1.003
   74   1HB   TRP   8          2HB       TRP   8  -2.671 -10.251  -1.021
   75   2HB   TRP   8          1HB       TRP   8  -4.143  -9.920  -0.106
   76    HD1  TRP   8           HD       TRP   8  -5.634  -7.815  -0.996
   77    HE1  TRP   8           1HE      TRP   8  -6.070  -7.026  -3.418
   78    HE3  TRP   8           3HE      TRP   8  -1.735 -10.088  -3.366
   79    HZ2  TRP   8           2HZ      TRP   8  -4.902  -7.324  -6.016
   80    HZ3  TRP   8           3HZ      TRP   8  -1.413  -9.821  -5.808
   81    HH2  TRP   8           HH       TRP   8  -2.990  -8.443  -7.135
   82    H    TRP   9           H        TRP   9  -1.482  -6.180   0.453
   83    HA   TRP   9           HA       TRP   9   0.004  -6.261  -2.114
   84   1HB   TRP   9          2HB       TRP   9  -1.496  -4.380  -1.178
   85   2HB   TRP   9          1HB       TRP   9  -0.174  -4.062  -0.069
   86    HD1  TRP   9           HD       TRP   9   1.087  -2.018  -0.984
   87    HE1  TRP   9           1HE      TRP   9   2.008  -1.325  -3.295
   88    HE3  TRP   9           3HE      TRP   9  -0.706  -5.843  -3.794
   89    HZ2  TRP   9           2HZ      TRP   9   1.975  -2.289  -5.999
   90    HZ3  TRP   9           3HZ      TRP   9  -0.260  -5.952  -6.238
   91    HH2  TRP   9           HH       TRP   9   1.080  -4.178  -7.341
   92    HA   PRO  10           HA       PRO  10   3.589  -7.477   0.252
   93   1HB   PRO  10          2HB       PRO  10   5.365  -7.397  -1.831
   94   2HB   PRO  10          1HB       PRO  10   4.213  -8.727  -1.591
   95   1HG   PRO  10          2HG       PRO  10   4.069  -6.413  -3.455
   96   2HG   PRO  10          1HG       PRO  10   3.584  -8.097  -3.704
   97   1HD   PRO  10          2HD       PRO  10   1.822  -6.081  -3.166
   98   2HD   PRO  10          1HD       PRO  10   1.530  -7.783  -2.747
   99    H    TRP  11           H        TRP  11   3.702  -4.735  -2.038
  100    HA   TRP  11           HA       TRP  11   5.820  -3.432  -0.390
  101   1HB   TRP  11          2HB       TRP  11   4.600  -2.357  -2.916
  102   2HB   TRP  11          1HB       TRP  11   6.233  -2.136  -2.304
  103    HD1  TRP  11           HD       TRP  11   7.518  -4.719  -2.005
  104    HE1  TRP  11           1HE      TRP  11   7.725  -6.499  -3.862
  105    HE3  TRP  11           3HE      TRP  11   3.710  -3.241  -5.058
  106    HZ2  TRP  11           2HZ      TRP  11   6.438  -7.198  -6.322
  107    HZ3  TRP  11           3HZ      TRP  11   3.220  -4.477  -7.149
  108    HH2  TRP  11           HH       TRP  11   4.578  -6.452  -7.784
  109    H    ARG  12           H        ARG  12   5.390  -0.889  -0.568
  110    HA   ARG  12           HA       ARG  12   2.714   0.099  -0.270
  111   1HB   ARG  12          2HB       ARG  12   2.926   0.328   2.311
  112   2HB   ARG  12          1HB       ARG  12   2.503  -1.254   1.659
  113   1HG   ARG  12          2HG       ARG  12   5.366  -1.019   1.710
  114   2HG   ARG  12          1HG       ARG  12   4.731  -0.586   3.297
  115   1HD   ARG  12          2HD       ARG  12   3.262  -2.863   2.397
  116   2HD   ARG  12          1HD       ARG  12   4.989  -3.207   2.171
  117    HE   ARG  12           HE       ARG  12   5.079  -2.128   4.624
  118   1HH1  ARG  12          1HH2      ARG  12   2.023  -3.145   3.928
  119   2HH1  ARG  12          2HH2      ARG  12   1.946  -4.401   5.118
  120   1HH2  ARG  12          1HH1      ARG  12   5.326  -4.252   5.878
  121   2HH2  ARG  12          2HH1      ARG  12   3.816  -5.028   6.221
  122    H    ARG  13           H        ARG  13   4.668   1.212   2.319
  123    HA   ARG  13           HA       ARG  13   6.115   3.055   2.555
  124   1HB   ARG  13          2HB       ARG  13   6.596   2.104  -0.024
  125   2HB   ARG  13          1HB       ARG  13   6.201   3.804  -0.277
  126   1HG   ARG  13          2HG       ARG  13   7.971   3.400   2.016
  127   2HG   ARG  13          1HG       ARG  13   8.676   2.819   0.508
  128   1HD   ARG  13          2HD       ARG  13   7.317   5.430   0.264
  129   2HD   ARG  13          1HD       ARG  13   8.753   5.442   1.308
  130    HE   ARG  13           HE       ARG  13   9.474   3.922  -0.934
  131   1HH1  ARG  13          1HH2      ARG  13   9.440   7.086   0.194
  132   2HH1  ARG  13          2HH2      ARG  13   9.773   7.822  -1.338
  133   1HH2  ARG  13          1HH1      ARG  13   9.443   4.870  -3.125
  134   2HH2  ARG  13          2HH1      ARG  13   9.777   6.566  -3.216
  135    H    CYS  14           H        CYS  14   3.756   3.516   3.234
  136    HA   CYS  14           HA       CYS  14   2.784   5.941   1.789
  137   1HB   CYS  14          2HB       CYS  14   1.451   3.673   1.975
  138   2HB   CYS  14          1HB       CYS  14   1.105   4.244   3.603
  139    H    LYS  15           H        LYS  15   0.953   5.989   4.265
  140    HA   LYS  15           HA       LYS  15   1.970   8.098   5.692
  141   1HB   LYS  15          2HB       LYS  15  -0.274   7.044   5.917
  142   2HB   LYS  15          1HB       LYS  15   0.466   5.717   6.812
  143   1HG   LYS  15          2HG       LYS  15   0.380   6.918   8.712
  144   2HG   LYS  15          1HG       LYS  15   1.332   8.200   7.962
  145   1HD   LYS  15          2HD       LYS  15  -1.391   8.223   6.959
  146   2HD   LYS  15          1HD       LYS  15  -1.369   8.342   8.719
  147   1HE   LYS  15          2HE       LYS  15   0.098  10.269   8.644
  148   2HE   LYS  15          1HE       LYS  15   0.327  10.082   6.894
  149   1HZ   LYS  15          1HZ       LYS  15  -2.110  10.291   6.648
  150   2HZ   LYS  15          2HZ       LYS  15  -1.388  11.699   7.269
  151   3HZ   LYS  15          3HZ       LYS  15  -2.229  10.645   8.302
  152   1HN   NH2  16          1HN       NH2  16   2.278   4.712   6.924
  153   2HN   NH2  16          2HN       NH2  16   3.762   4.965   7.707
  Start of MODEL   10
    1   1H    ILE   1          1HT       ILE   1  -2.789   9.113  -3.695
    2   2H    ILE   1          2HT       ILE   1  -1.511  10.233  -3.707
    3   3H    ILE   1          3HT       ILE   1  -3.088  10.744  -3.337
    4    HA   ILE   1           HA       ILE   1  -1.497  10.445  -1.384
    5    HB   ILE   1           HB       ILE   1  -4.268   9.489  -1.829
    6   1HG1  ILE   1          2HG1      ILE   1  -3.988  11.263   0.351
    7   2HG1  ILE   1          1HG1      ILE   1  -2.895  11.819  -0.915
    8   1HG2  ILE   1          1HG2      ILE   1  -3.351   7.881  -0.150
    9   2HG2  ILE   1          2HG2      ILE   1  -4.665   8.886   0.455
   10   3HG2  ILE   1          3HG2      ILE   1  -3.000   9.264   0.888
   11   1HD1  ILE   1          1HD1      ILE   1  -4.655  12.041  -2.492
   12   2HD1  ILE   1          2HD1      ILE   1  -5.321  12.697  -0.996
   13   3HD1  ILE   1          3HD1      ILE   1  -5.759  11.069  -1.517
   14    H    CYS   2           H        CYS   2  -1.384   8.693   0.282
   15    HA   CYS   2           HA       CYS   2   0.333   6.581  -0.616
   16   1HB   CYS   2          2HB       CYS   2   0.453   7.475   1.620
   17   2HB   CYS   2          1HB       CYS   2  -1.230   7.057   1.931
   18    H    LEU   3           H        LEU   3  -0.044   4.304  -0.497
   19    HA   LEU   3           HA       LEU   3  -2.447   3.411  -1.810
   20   1HB   LEU   3          2HB       LEU   3   0.125   2.416  -0.933
   21   2HB   LEU   3          1HB       LEU   3  -1.137   1.233  -0.585
   22    HG   LEU   3           HG       LEU   3  -0.524   2.512  -3.262
   23   1HD1  LEU   3          1HD1      LEU   3   0.169   0.006  -1.939
   24   2HD1  LEU   3          2HD1      LEU   3   0.814   0.702  -3.426
   25   3HD1  LEU   3          3HD1      LEU   3  -0.659  -0.266  -3.472
   26   1HD2  LEU   3          1HD2      LEU   3  -2.428   0.490  -3.598
   27   2HD2  LEU   3          2HD2      LEU   3  -2.719   2.225  -3.719
   28   3HD2  LEU   3          3HD2      LEU   3  -2.993   1.390  -2.190
   29    H    LYS   4           H        LYS   4  -4.394   3.092  -0.870
   30    HA   LYS   4           HA       LYS   4  -4.477   2.217   1.963
   31   1HB   LYS   4          2HB       LYS   4  -5.388   4.618   0.808
   32   2HB   LYS   4          1HB       LYS   4  -6.839   3.650   1.075
   33   1HG   LYS   4          2HG       LYS   4  -4.755   3.942   3.234
   34   2HG   LYS   4          1HG       LYS   4  -6.017   5.156   3.021
   35   1HD   LYS   4          2HD       LYS   4  -7.190   2.525   2.927
   36   2HD   LYS   4          1HD       LYS   4  -6.224   2.689   4.395
   37   1HE   LYS   4          2HE       LYS   4  -8.420   3.511   4.948
   38   2HE   LYS   4          1HE       LYS   4  -7.406   4.953   4.733
   39   1HZ   LYS   4          1HZ       LYS   4  -9.619   4.824   3.455
   40   2HZ   LYS   4          2HZ       LYS   4  -8.804   3.736   2.436
   41   3HZ   LYS   4          3HZ       LYS   4  -8.234   5.326   2.616
   42    H    LYS   5           H        LYS   5  -4.533   0.848  -0.681
   43    HA   LYS   5           HA       LYS   5  -7.085  -0.636  -0.290
   44   1HB   LYS   5          2HB       LYS   5  -7.109  -0.836  -2.812
   45   2HB   LYS   5          1HB       LYS   5  -7.327   0.811  -2.216
   46   1HG   LYS   5          2HG       LYS   5  -4.845   1.156  -2.494
   47   2HG   LYS   5          1HG       LYS   5  -4.772  -0.419  -3.284
   48   1HD   LYS   5          2HD       LYS   5  -4.999   1.095  -5.081
   49   2HD   LYS   5          1HD       LYS   5  -6.640   0.497  -4.828
   50   1HE   LYS   5          2HE       LYS   5  -6.932   2.846  -4.957
   51   2HE   LYS   5          1HE       LYS   5  -6.865   2.551  -3.208
   52   1HZ   LYS   5          1HZ       LYS   5  -4.509   3.191  -4.903
   53   2HZ   LYS   5          2HZ       LYS   5  -4.520   3.006  -3.214
   54   3HZ   LYS   5          3HZ       LYS   5  -5.323   4.319  -3.932
   55    H    TRP   6           H        TRP   6  -6.939  -2.862  -1.372
   56    HA   TRP   6           HA       TRP   6  -5.838  -4.935  -1.638
   57   1HB   TRP   6          2HB       TRP   6  -3.353  -3.226  -1.954
   58   2HB   TRP   6          1HB       TRP   6  -3.660  -4.817  -2.651
   59    HD1  TRP   6           HD       TRP   6  -6.747  -3.977  -3.469
   60    HE1  TRP   6           1HE      TRP   6  -7.047  -2.575  -5.610
   61    HE3  TRP   6           3HE      TRP   6  -2.030  -2.083  -3.949
   62    HZ2  TRP   6           2HZ      TRP   6  -5.491  -0.875  -7.304
   63    HZ3  TRP   6           3HZ      TRP   6  -1.466  -0.577  -5.835
   64    HH2  TRP   6           HH       TRP   6  -3.190   0.029  -7.512
   65    HA   PRO   7           HA       PRO   7  -4.485  -4.780   2.712
   66   1HB   PRO   7          2HB       PRO   7  -5.771  -7.091   3.420
   67   2HB   PRO   7          1HB       PRO   7  -6.570  -5.506   3.384
   68   1HG   PRO   7          2HG       PRO   7  -6.677  -7.723   1.408
   69   2HG   PRO   7          1HG       PRO   7  -7.950  -6.608   1.926
   70   1HD   PRO   7          2HD       PRO   7  -6.570  -6.361  -0.426
   71   2HD   PRO   7          1HD       PRO   7  -7.335  -5.004   0.420
   72    H    TRP   8           H        TRP   8  -3.856  -6.803   0.067
   73    HA   TRP   8           HA       TRP   8  -1.889  -8.387   1.659
   74   1HB   TRP   8          2HB       TRP   8  -2.131 -10.043  -0.237
   75   2HB   TRP   8          1HB       TRP   8  -3.599  -9.806   0.712
   76    HD1  TRP   8           HD       TRP   8  -5.525  -8.355  -0.342
   77    HE1  TRP   8           1HE      TRP   8  -6.105  -7.769  -2.794
   78    HE3  TRP   8           3HE      TRP   8  -1.120  -9.582  -2.591
   79    HZ2  TRP   8           2HZ      TRP   8  -4.845  -7.815  -5.365
   80    HZ3  TRP   8           3HZ      TRP   8  -0.831  -9.304  -5.035
   81    HH2  TRP   8           HH       TRP   8  -2.686  -8.425  -6.424
   82    H    TRP   9           H        TRP   9  -1.212  -5.798   0.747
   83    HA   TRP   9           HA       TRP   9   0.199  -6.041  -1.819
   84   1HB   TRP   9          2HB       TRP   9  -1.076  -4.047  -0.812
   85   2HB   TRP   9          1HB       TRP   9   0.311  -3.845   0.238
   86    HD1  TRP   9           HD       TRP   9   2.094  -2.273  -0.687
   87    HE1  TRP   9           1HE      TRP   9   2.803  -1.475  -3.039
   88    HE3  TRP   9           3HE      TRP   9  -1.092  -5.032  -3.507
   89    HZ2  TRP   9           2HZ      TRP   9   2.087  -1.958  -5.777
   90    HZ3  TRP   9           3HZ      TRP   9  -1.078  -4.860  -5.989
   91    HH2  TRP   9           HH       TRP   9   0.509  -3.326  -7.123
   92    HA   PRO  10           HA       PRO  10   3.795  -7.607   0.328
   93   1HB   PRO  10          2HB       PRO  10   5.411  -7.731  -1.881
   94   2HB   PRO  10          1HB       PRO  10   4.166  -8.944  -1.522
   95   1HG   PRO  10          2HG       PRO  10   4.079  -6.645  -3.416
   96   2HG   PRO  10          1HG       PRO  10   3.450  -8.290  -3.607
   97   1HD   PRO  10          2HD       PRO  10   1.873  -6.166  -2.990
   98   2HD   PRO  10          1HD       PRO  10   1.513  -7.826  -2.469
   99    H    TRP  11           H        TRP  11   4.300  -5.125  -2.219
  100    HA   TRP  11           HA       TRP  11   6.591  -3.951  -0.831
  101   1HB   TRP  11          2HB       TRP  11   4.941  -2.649  -2.984
  102   2HB   TRP  11          1HB       TRP  11   6.676  -2.540  -2.717
  103    HD1  TRP  11           HD       TRP  11   7.763  -5.279  -2.732
  104    HE1  TRP  11           1HE      TRP  11   7.512  -6.923  -4.705
  105    HE3  TRP  11           3HE      TRP  11   3.698  -3.249  -5.046
  106    HZ2  TRP  11           2HZ      TRP  11   5.804  -7.319  -6.968
  107    HZ3  TRP  11           3HZ      TRP  11   2.777  -4.274  -7.106
  108    HH2  TRP  11           HH       TRP  11   3.824  -6.306  -8.069
  109    H    ARG  12           H        ARG  12   6.312  -1.364  -0.808
  110    HA   ARG  12           HA       ARG  12   3.800  -0.342   0.226
  111   1HB   ARG  12          2HB       ARG  12   4.382  -0.275   2.569
  112   2HB   ARG  12          1HB       ARG  12   4.646  -1.929   2.017
  113   1HG   ARG  12          2HG       ARG  12   6.776  -1.781   2.724
  114   2HG   ARG  12          1HG       ARG  12   7.053  -0.529   1.513
  115   1HD   ARG  12          2HD       ARG  12   6.601   1.222   3.046
  116   2HD   ARG  12          1HD       ARG  12   5.794   0.126   4.186
  117    HE   ARG  12           HE       ARG  12   8.733   0.246   3.709
  118   1HH1  ARG  12          1HH1      ARG  12   7.074   0.650   6.327
  119   2HH1  ARG  12          2HH1      ARG  12   7.494  -0.805   7.168
  120   1HH2  ARG  12          1HH2      ARG  12   8.806  -2.365   4.363
  121   2HH2  ARG  12          2HH2      ARG  12   8.473  -2.511   6.056
  122    H    ARG  13           H        ARG  13   4.290   1.868   1.396
  123    HA   ARG  13           HA       ARG  13   6.608   3.307   1.315
  124   1HB   ARG  13          2HB       ARG  13   7.015   2.862  -0.980
  125   2HB   ARG  13          1HB       ARG  13   5.310   3.028  -1.396
  126   1HG   ARG  13          2HG       ARG  13   5.435   5.307  -1.541
  127   2HG   ARG  13          1HG       ARG  13   6.598   5.429  -0.220
  128   1HD   ARG  13          2HD       ARG  13   7.883   6.015  -2.124
  129   2HD   ARG  13          1HD       ARG  13   8.254   4.292  -1.912
  130    HE   ARG  13           HE       ARG  13   6.138   5.275  -3.793
  131   1HH1  ARG  13          1HH1      ARG  13   6.126   2.363  -3.169
  132   2HH1  ARG  13          2HH1      ARG  13   7.120   1.707  -4.428
  133   1HH2  ARG  13          1HH2      ARG  13   8.514   4.765  -5.283
  134   2HH2  ARG  13          2HH2      ARG  13   8.471   3.067  -5.625
  135    H    CYS  14           H        CYS  14   4.911   3.784   3.006
  136    HA   CYS  14           HA       CYS  14   3.033   5.927   2.139
  137   1HB   CYS  14          2HB       CYS  14   2.446   3.651   3.365
  138   2HB   CYS  14          1HB       CYS  14   2.957   4.541   4.791
  139    H    LYS  15           H        LYS  15   3.009   6.318   5.214
  140    HA   LYS  15           HA       LYS  15   4.234   8.715   5.563
  141   1HB   LYS  15          2HB       LYS  15   3.020   7.778   7.361
  142   2HB   LYS  15          1HB       LYS  15   3.993   6.307   7.359
  143   1HG   LYS  15          2HG       LYS  15   5.551   7.215   8.724
  144   2HG   LYS  15          1HG       LYS  15   5.598   8.715   7.797
  145   1HD   LYS  15          2HD       LYS  15   3.451   9.397   8.895
  146   2HD   LYS  15          1HD       LYS  15   3.560   7.956   9.908
  147   1HE   LYS  15          2HE       LYS  15   6.065   9.465   9.911
  148   2HE   LYS  15          1HE       LYS  15   4.697  10.431  10.502
  149   1HZ   LYS  15          1HZ       LYS  15   5.698   7.840  11.495
  150   2HZ   LYS  15          2HZ       LYS  15   4.071   8.272  11.730
  151   3HZ   LYS  15          3HZ       LYS  15   5.309   9.239  12.373
  152   1HN   NH2  16          1HN       NH2  16   6.254   8.907   4.315
  153   2HN   NH2  16          2HN       NH2  16   7.691   8.165   4.829


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