*HEADER    NEUROPEPTIDE                            02-AUG-19   6KN3              
*TITLE     STRUCTURE OF SINGLE DISULFIDE PEPTIDE CZON1107-WT (MINOR CONFORMER)   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CZON1107-WT(CONFORMER B);                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: CONUS ZONATUS;                                  
*SOURCE   4 ORGANISM_TAXID: 754466                                               
*KEYWDS    NACHR ANTAGONIST NMR, NEUROPEPTIDE                                    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    23                                                                    
*AUTHOR    S.P.SARMA,M.MADHAN KUMAR                                              
*REVDAT   1   08-APR-20 6KN3    0                                                
# Restraints file 1: czon1107_wt_minor_ccc_noe.upl
 12 PHE  H      12 PHE  HA      3.50
 12 PHE  H      12 PHE  HB2     5.00
 12 PHE  H      12 PHE  HB3     0.00
 12 PHE  H      12 PHE  QD      5.00
 12 PHE  H      13 ARG  HD3     5.00
 12 PHE  H      13 ARG  HD2     5.00
 12 PHE  HA     12 PHE  QD      5.50
 12 PHE  HB2    12 PHE  HA      3.50
 12 PHE  HB2    12 PHE  QD      5.00
 12 PHE  HB3    12 PHE  HA      3.50
 12 PHE  HB3    12 PHE  QD      5.00
 13 ARG  H      13 ARG  HA      3.50
 13 ARG  H      13 ARG  HB2     5.00
 13 ARG  H      13 ARG  HD3     5.00
 13 ARG  H      13 ARG  HG2     5.00
 13 ARG  H      13 ARG  HG3     0.00
 13 ARG  H      14 SER  H       4.20
 13 ARG  HA     13 ARG  HB2     3.50
 13 ARG  HA     13 ARG  HD2     5.00
 13 ARG  HA     13 ARG  HG2     5.00
 13 ARG  HA     13 ARG  HG3     0.00
 13 ARG  HB2    13 ARG  HE      5.00
 13 ARG  HD2    13 ARG  HB2     5.00
 13 ARG  HD2    13 ARG  HE      3.50
 13 ARG  HG2    13 ARG  HB2     3.50
 13 ARG  HG2    13 ARG  HD2     3.50
 13 ARG  HG2    13 ARG  HE      5.00
 13 ARG  HG2    13 ARG  HG3     0.00
 13 ARG  HG3    13 ARG  HD2     3.50
 13 ARG  HG3    13 ARG  HE      5.00
 14 SER  H      13 ARG  HA      3.50
 14 SER  H      13 ARG  HB2     5.00
 14 SER  H      13 ARG  HG3     5.00
 14 SER  H      14 SER  HA      3.50
 14 SER  H      14 SER  HB2     5.00
 14 SER  H      14 SER  HB3     0.00
 15 PRO  HB2    16 CYSS H       5.00
 16 CYSS H      15 PRO  HG2     5.00
 16 CYSS H      16 CYSS HA      3.50
 16 CYSS H      16 CYSS HB2     5.00
 16 CYSS H      16 CYSS HB3     0.00
 17 PRO  HD2    12 PHE  QR      5.00
 17 PRO  HG2    12 PHE  H       7.00
 17 PRO  HG2    12 PHE  QR      2.50
 17 PRO  HG3    12 PHE  QR      0.00
 20 CYSS H      19 PHE  HA      2.80
 20 CYSS HB2    20 CYSS H       5.00
 20 CYSS HB2    20 CYSS HB3     0.00
 20 CYSS HB3    15 PRO  HB2     5.00
 20 CYSS HB3    15 PRO  HG2     5.50  
 20 CYSS HB3    21 CTN  H1      5.00
 21 CTN  H1     21 CTN  H2      3.50
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY  11           HT1      GLY  11   2.126   4.923  -3.436
    2    H2   GLY  11           HT2      GLY  11   2.536   4.846  -1.799
    3    H3   GLY  11           HT3      GLY  11   0.990   4.401  -2.302
    4    HA2  GLY  11           HA1      GLY  11   3.496   2.990  -2.976
    5    HA3  GLY  11           HA2      GLY  11   2.295   2.456  -1.811
    6    H    PHE  12           HN       PHE  12   2.607   3.388  -5.203
    7    HA   PHE  12           HA       PHE  12   0.403   1.583  -5.838
    8    HB2  PHE  12           HB2      PHE  12   1.644   3.913  -7.274
    9    HB3  PHE  12           HB1      PHE  12   0.713   2.715  -8.169
   10    HD1  PHE  12           HD1      PHE  12   0.396   4.699  -5.014
   11    HD2  PHE  12           HD2      PHE  12  -1.489   3.193  -8.512
   12    HE1  PHE  12           HE1      PHE  12  -1.703   5.796  -4.352
   13    HE2  PHE  12           HE2      PHE  12  -3.589   4.287  -7.855
   14    HZ   PHE  12           HZ       PHE  12  -3.698   5.586  -5.772
   15    H    ARG  13           HN       ARG  13   0.659   0.032  -7.531
   16    HA   ARG  13           HA       ARG  13   3.147  -0.598  -8.539
   17    HB2  ARG  13           HB2      ARG  13   3.938  -2.457  -7.203
   18    HB3  ARG  13           HB1      ARG  13   3.760  -1.061  -6.166
   19    HG2  ARG  13           HG2      ARG  13   1.495  -3.020  -6.274
   20    HG3  ARG  13           HG1      ARG  13   2.978  -3.514  -5.477
   21    HD2  ARG  13           HD2      ARG  13   2.818  -1.599  -3.924
   22    HD3  ARG  13           HD1      ARG  13   1.365  -1.038  -4.716
   23    HE   ARG  13           HE       ARG  13   1.140  -3.736  -3.741
   24   HH11  ARG  13          HH11      ARG  13   0.815  -0.341  -2.877
   25   HH12  ARG  13          HH12      ARG  13  -0.286  -0.652  -1.585
   26   HH21  ARG  13          HH21      ARG  13  -0.333  -4.137  -2.029
   27   HH22  ARG  13          HH22      ARG  13  -0.947  -2.811  -1.104
   28    H    SER  14           HN       SER  14   3.161  -3.142  -9.214
   29    HA   SER  14           HA       SER  14   0.497  -3.514 -10.349
   30    HB2  SER  14           HB2      SER  14   2.536  -3.308 -11.855
   31    HB3  SER  14           HB1      SER  14   3.082  -4.850 -11.201
   32    HG   SER  14           HG       SER  14   1.781  -5.799 -12.518
   33    HA   PRO  15           HA       PRO  15  -0.559  -4.960 -11.306
   34    HB2  PRO  15           HB2      PRO  15  -2.733  -6.490 -11.028
   35    HB3  PRO  15           HB1      PRO  15  -1.226  -7.137 -11.693
   36    HG2  PRO  15           HG2      PRO  15  -2.416  -7.494  -8.987
   37    HG3  PRO  15           HG1      PRO  15  -1.468  -8.632  -9.957
   38    HD2  PRO  15           HD2      PRO  15  -0.503  -7.049  -7.845
   39    HD3  PRO  15           HD1      PRO  15   0.482  -7.913  -9.038
   40    H    CYS  16           HN       CYS  16  -1.233  -4.898  -7.962
   41    HA   CYS  16           HA       CYS  16  -3.271  -2.815  -8.386
   42    HB2  CYS  16           HB2      CYS  16  -3.846  -4.730  -6.128
   43    HB3  CYS  16           HB1      CYS  16  -4.933  -3.788  -7.122
   44    HA   PRO  17           HA       PRO  17  -4.389  -1.457  -7.314
   45    HB2  PRO  17           HB2      PRO  17  -4.518   1.006  -6.336
   46    HB3  PRO  17           HB1      PRO  17  -4.806  -0.373  -5.264
   47    HG2  PRO  17           HG2      PRO  17  -2.323   1.255  -5.618
   48    HG3  PRO  17           HG1      PRO  17  -3.101   0.767  -4.114
   49    HD2  PRO  17           HD2      PRO  17  -0.968  -0.546  -5.271
   50    HD3  PRO  17           HD1      PRO  17  -2.132  -1.324  -4.182
   51    HA   PRO  18           HA       PRO  18  -5.607   0.369  -7.795
   52    HB2  PRO  18           HB2      PRO  18  -6.606   2.326  -9.240
   53    HB3  PRO  18           HB1      PRO  18  -5.418   2.689  -7.979
   54    HG2  PRO  18           HG2      PRO  18  -5.093   2.691 -10.924
   55    HG3  PRO  18           HG1      PRO  18  -4.220   3.626  -9.710
   56    HD2  PRO  18           HD2      PRO  18  -3.423   1.134 -10.957
   57    HD3  PRO  18           HD1      PRO  18  -2.519   2.098  -9.774
   58    H    PHE  19           HN       PHE  19  -4.317  -0.658 -10.705
   59    HA   PHE  19           HA       PHE  19  -6.900  -1.055 -12.002
   60    HB2  PHE  19           HB2      PHE  19  -4.136  -1.733 -13.034
   61    HB3  PHE  19           HB1      PHE  19  -5.634  -1.770 -13.956
   62    HD1  PHE  19           HD1      PHE  19  -2.783   0.105 -13.288
   63    HD2  PHE  19           HD2      PHE  19  -6.971   0.537 -13.890
   64    HE1  PHE  19           HE1      PHE  19  -2.444   2.457 -13.905
   65    HE2  PHE  19           HE2      PHE  19  -6.639   2.890 -14.514
   66    HZ   PHE  19           HZ       PHE  19  -4.372   3.854 -14.521
   67    H    CYS  20           HN       CYS  20  -7.679  -2.536 -10.468
   68    HA   CYS  20           HA       CYS  20  -6.388  -5.170 -10.616
   69    HB2  CYS  20           HB2      CYS  20  -6.465  -3.767  -8.386
   70    HB3  CYS  20           HB1      CYS  20  -8.103  -4.406  -8.295
   71    HN1  NH2  21           H1       CYS  20  -7.624  -5.968 -12.260
   72    HN2  NH2  21           H2       CYS  20  -9.328  -6.217 -12.155
  Start of MODEL    2
    1    H1   GLY  11           HT1      GLY  11   3.019   3.449  -2.162
    2    H2   GLY  11           HT2      GLY  11   2.766   3.572  -0.493
    3    H3   GLY  11           HT3      GLY  11   1.509   3.915  -1.567
    4    HA2  GLY  11           HA1      GLY  11   2.772   1.258  -1.213
    5    HA3  GLY  11           HA2      GLY  11   1.226   1.746  -0.530
    6    H    PHE  12           HN       PHE  12   2.922   1.579  -3.645
    7    HA   PHE  12           HA       PHE  12   0.415   0.649  -4.855
    8    HB2  PHE  12           HB2      PHE  12   2.243   2.833  -5.751
    9    HB3  PHE  12           HB1      PHE  12   1.485   1.836  -6.985
   10    HD1  PHE  12           HD1      PHE  12   0.385   3.471  -3.792
   11    HD2  PHE  12           HD2      PHE  12  -0.358   2.800  -7.932
   12    HE1  PHE  12           HE1      PHE  12  -1.659   4.815  -3.640
   13    HE2  PHE  12           HE2      PHE  12  -2.409   4.147  -7.779
   14    HZ   PHE  12           HZ       PHE  12  -3.059   5.153  -5.628
   15    H    ARG  13           HN       ARG  13   0.541  -1.029  -6.194
   16    HA   ARG  13           HA       ARG  13   3.179  -1.994  -7.025
   17    HB2  ARG  13           HB2      ARG  13   1.032  -3.755  -5.706
   18    HB3  ARG  13           HB1      ARG  13   2.242  -4.395  -6.746
   19    HG2  ARG  13           HG2      ARG  13   2.807  -4.803  -4.407
   20    HG3  ARG  13           HG1      ARG  13   4.050  -3.858  -5.187
   21    HD2  ARG  13           HD2      ARG  13   3.776  -2.971  -3.027
   22    HD3  ARG  13           HD1      ARG  13   2.980  -1.816  -4.067
   23    HE   ARG  13           HE       ARG  13   0.994  -3.557  -3.160
   24   HH11  ARG  13          HH11      ARG  13   3.325  -1.420  -1.665
   25   HH12  ARG  13          HH12      ARG  13   2.298  -1.053  -0.318
   26   HH21  ARG  13          HH21      ARG  13  -0.358  -3.068  -1.425
   27   HH22  ARG  13          HH22      ARG  13   0.186  -1.995  -0.181
   28    H    SER  14           HN       SER  14   2.728  -3.879  -8.818
   29    HA   SER  14           HA       SER  14   0.495  -2.855 -10.392
   30    HB2  SER  14           HB2      SER  14   3.087  -4.088 -11.353
   31    HB3  SER  14           HB1      SER  14   1.773  -3.530 -12.390
   32    HG   SER  14           HG       SER  14   3.627  -2.064 -10.889
   33    HA   PRO  15           HA       PRO  15  -0.866  -3.181 -11.580
   34    HB2  PRO  15           HB2      PRO  15  -3.255  -4.089 -12.270
   35    HB3  PRO  15           HB1      PRO  15  -1.817  -4.569 -13.178
   36    HG2  PRO  15           HG2      PRO  15  -3.408  -6.115 -11.190
   37    HG3  PRO  15           HG1      PRO  15  -2.561  -6.683 -12.639
   38    HD2  PRO  15           HD2      PRO  15  -1.613  -6.790  -9.973
   39    HD3  PRO  15           HD1      PRO  15  -0.679  -7.116 -11.445
   40    H    CYS  16           HN       CYS  16  -1.574  -4.858  -8.770
   41    HA   CYS  16           HA       CYS  16  -3.838  -3.087  -8.089
   42    HB2  CYS  16           HB2      CYS  16  -3.134  -5.370  -6.224
   43    HB3  CYS  16           HB1      CYS  16  -4.657  -4.593  -6.550
   44    HA   PRO  17           HA       PRO  17  -4.460  -1.561  -7.467
   45    HB2  PRO  17           HB2      PRO  17  -4.752   0.763  -6.252
   46    HB3  PRO  17           HB1      PRO  17  -4.970  -0.728  -5.326
   47    HG2  PRO  17           HG2      PRO  17  -2.693   1.173  -5.338
   48    HG3  PRO  17           HG1      PRO  17  -3.334   0.247  -3.997
   49    HD2  PRO  17           HD2      PRO  17  -1.104  -0.412  -5.634
   50    HD3  PRO  17           HD1      PRO  17  -1.861  -1.443  -4.406
   51    HA   PRO  18           HA       PRO  18  -5.772   0.278  -7.873
   52    HB2  PRO  18           HB2      PRO  18  -6.770   2.290  -9.222
   53    HB3  PRO  18           HB1      PRO  18  -5.628   2.628  -7.911
   54    HG2  PRO  18           HG2      PRO  18  -5.191   2.708 -10.861
   55    HG3  PRO  18           HG1      PRO  18  -4.467   3.717  -9.604
   56    HD2  PRO  18           HD2      PRO  18  -3.361   1.361 -10.804
   57    HD3  PRO  18           HD1      PRO  18  -2.676   2.318  -9.475
   58    H    PHE  19           HN       PHE  19  -4.282  -0.932 -10.407
   59    HA   PHE  19           HA       PHE  19  -6.533  -1.013 -12.291
   60    HB2  PHE  19           HB2      PHE  19  -3.742  -2.122 -12.649
   61    HB3  PHE  19           HB1      PHE  19  -4.957  -1.900 -13.898
   62    HD1  PHE  19           HD1      PHE  19  -2.105  -0.548 -12.380
   63    HD2  PHE  19           HD2      PHE  19  -5.775   0.574 -14.210
   64    HE1  PHE  19           HE1      PHE  19  -1.185   1.684 -12.844
   65    HE2  PHE  19           HE2      PHE  19  -4.863   2.808 -14.679
   66    HZ   PHE  19           HZ       PHE  19  -2.565   3.365 -13.997
   67    H    CYS  20           HN       CYS  20  -6.828  -2.421  -9.846
   68    HA   CYS  20           HA       CYS  20  -6.277  -5.203 -10.514
   69    HB2  CYS  20           HB2      CYS  20  -5.965  -3.988  -8.184
   70    HB3  CYS  20           HB1      CYS  20  -7.663  -4.419  -7.998
   71    HN1  NH2  21           H1       CYS  20  -7.798  -5.340 -12.219
   72    HN2  NH2  21           H2       CYS  20  -9.488  -5.504 -11.904
  Start of MODEL    3
    1    H1   GLY  11           HT1      GLY  11   0.040   1.832  -0.873
    2    H2   GLY  11           HT2      GLY  11   1.438   1.854   0.076
    3    H3   GLY  11           HT3      GLY  11   1.042   0.477  -0.822
    4    HA2  GLY  11           HA1      GLY  11   1.780   3.118  -1.940
    5    HA3  GLY  11           HA2      GLY  11   2.818   1.699  -1.890
    6    H    PHE  12           HN       PHE  12   2.504   2.712  -4.296
    7    HA   PHE  12           HA       PHE  12   0.302   1.281  -5.578
    8    HB2  PHE  12           HB2      PHE  12   1.918   3.676  -6.356
    9    HB3  PHE  12           HB1      PHE  12   1.203   2.685  -7.623
   10    HD1  PHE  12           HD1      PHE  12   0.170   4.155  -4.342
   11    HD2  PHE  12           HD2      PHE  12  -0.838   3.362  -8.403
   12    HE1  PHE  12           HE1      PHE  12  -2.000   5.258  -4.017
   13    HE2  PHE  12           HE2      PHE  12  -3.010   4.469  -8.080
   14    HZ   PHE  12           HZ       PHE  12  -3.593   5.416  -5.883
   15    H    ARG  13           HN       ARG  13   0.657  -0.007  -7.405
   16    HA   ARG  13           HA       ARG  13   3.149  -0.741  -8.319
   17    HB2  ARG  13           HB2      ARG  13   3.543  -2.956  -7.327
   18    HB3  ARG  13           HB1      ARG  13   3.595  -1.713  -6.100
   19    HG2  ARG  13           HG2      ARG  13   1.022  -3.198  -6.496
   20    HG3  ARG  13           HG1      ARG  13   2.371  -4.044  -5.765
   21    HD2  ARG  13           HD2      ARG  13   2.516  -2.428  -3.965
   22    HD3  ARG  13           HD1      ARG  13   1.288  -1.413  -4.684
   23    HE   ARG  13           HE       ARG  13  -0.205  -3.476  -4.355
   24   HH11  ARG  13          HH11      ARG  13   2.449  -2.579  -2.241
   25   HH12  ARG  13          HH12      ARG  13   1.740  -3.292  -0.834
   26   HH21  ARG  13          HH21      ARG  13  -1.157  -4.408  -2.481
   27   HH22  ARG  13          HH22      ARG  13  -0.324  -4.323  -0.969
   28    H    SER  14           HN       SER  14   2.919  -3.111  -9.497
   29    HA   SER  14           HA       SER  14   0.259  -2.936 -10.698
   30    HB2  SER  14           HB2      SER  14   2.332  -2.506 -12.121
   31    HB3  SER  14           HB1      SER  14   2.693  -4.223 -11.947
   32    HG   SER  14           HG       SER  14   1.286  -4.605 -13.439
   33    HA   PRO  15           HA       PRO  15  -1.053  -3.832 -11.722
   34    HB2  PRO  15           HB2      PRO  15  -3.335  -5.206 -11.816
   35    HB3  PRO  15           HB1      PRO  15  -1.926  -5.704 -12.760
   36    HG2  PRO  15           HG2      PRO  15  -3.034  -6.867 -10.255
   37    HG3  PRO  15           HG1      PRO  15  -2.231  -7.674 -11.610
   38    HD2  PRO  15           HD2      PRO  15  -1.056  -6.947  -9.156
   39    HD3  PRO  15           HD1      PRO  15  -0.200  -7.475 -10.613
   40    H    CYS  16           HN       CYS  16  -1.569  -4.935  -8.500
   41    HA   CYS  16           HA       CYS  16  -3.711  -2.920  -8.147
   42    HB2  CYS  16           HB2      CYS  16  -3.476  -5.077  -6.057
   43    HB3  CYS  16           HB1      CYS  16  -4.865  -4.206  -6.652
   44    HA   PRO  17           HA       PRO  17  -4.420  -1.468  -7.346
   45    HB2  PRO  17           HB2      PRO  17  -4.565   0.927  -6.265
   46    HB3  PRO  17           HB1      PRO  17  -4.767  -0.492  -5.225
   47    HG2  PRO  17           HG2      PRO  17  -2.377   1.245  -5.613
   48    HG3  PRO  17           HG1      PRO  17  -3.040   0.624  -4.104
   49    HD2  PRO  17           HD2      PRO  17  -0.923  -0.510  -5.534
   50    HD3  PRO  17           HD1      PRO  17  -1.898  -1.358  -4.319
   51    HA   PRO  18           HA       PRO  18  -5.651   0.350  -7.800
   52    HB2  PRO  18           HB2      PRO  18  -6.692   2.256  -9.294
   53    HB3  PRO  18           HB1      PRO  18  -5.550   2.672  -8.008
   54    HG2  PRO  18           HG2      PRO  18  -5.142   2.639 -10.951
   55    HG3  PRO  18           HG1      PRO  18  -4.359   3.649  -9.730
   56    HD2  PRO  18           HD2      PRO  18  -3.375   1.208 -10.906
   57    HD3  PRO  18           HD1      PRO  18  -2.596   2.206  -9.662
   58    H    PHE  19           HN       PHE  19  -4.277  -0.621 -10.690
   59    HA   PHE  19           HA       PHE  19  -6.777  -1.063 -12.116
   60    HB2  PHE  19           HB2      PHE  19  -3.956  -1.789 -12.935
   61    HB3  PHE  19           HB1      PHE  19  -5.381  -1.827 -13.964
   62    HD1  PHE  19           HD1      PHE  19  -2.573   0.025 -13.089
   63    HD2  PHE  19           HD2      PHE  19  -6.686   0.490 -14.066
   64    HE1  PHE  19           HE1      PHE  19  -2.150   2.359 -13.726
   65    HE2  PHE  19           HE2      PHE  19  -6.272   2.828 -14.706
   66    HZ   PHE  19           HZ       PHE  19  -4.000   3.766 -14.537
   67    H    CYS  20           HN       CYS  20  -7.347  -2.455 -10.184
   68    HA   CYS  20           HA       CYS  20  -6.251  -5.161 -10.480
   69    HB2  CYS  20           HB2      CYS  20  -6.246  -3.815  -8.230
   70    HB3  CYS  20           HB1      CYS  20  -7.931  -4.314  -8.155
   71    HN1  NH2  21           H1       CYS  20  -7.499  -6.050 -12.024
   72    HN2  NH2  21           H2       CYS  20  -9.221  -6.183 -11.955
  Start of MODEL    4
    1    H1   GLY  11           HT1      GLY  11  -0.521   1.757  -0.603
    2    H2   GLY  11           HT2      GLY  11   0.550   1.141   0.557
    3    H3   GLY  11           HT3      GLY  11  -0.203   0.100  -0.540
    4    HA2  GLY  11           HA1      GLY  11   1.748   2.209  -1.235
    5    HA3  GLY  11           HA2      GLY  11   2.091   0.486  -1.161
    6    H    PHE  12           HN       PHE  12   2.758   1.182  -3.445
    7    HA   PHE  12           HA       PHE  12   0.452   0.729  -5.186
    8    HB2  PHE  12           HB2      PHE  12   2.643   2.735  -5.455
    9    HB3  PHE  12           HB1      PHE  12   1.973   2.019  -6.919
   10    HD1  PHE  12           HD1      PHE  12   0.878   3.654  -3.751
   11    HD2  PHE  12           HD2      PHE  12   0.122   2.977  -7.882
   12    HE1  PHE  12           HE1      PHE  12  -1.033   5.195  -3.648
   13    HE2  PHE  12           HE2      PHE  12  -1.789   4.517  -7.787
   14    HZ   PHE  12           HZ       PHE  12  -2.371   5.628  -5.667
   15    H    ARG  13           HN       ARG  13   0.694  -0.673  -6.851
   16    HA   ARG  13           HA       ARG  13   3.177  -1.825  -7.546
   17    HB2  ARG  13           HB2      ARG  13   2.087  -2.893  -5.209
   18    HB3  ARG  13           HB1      ARG  13   1.342  -3.919  -6.404
   19    HG2  ARG  13           HG2      ARG  13   3.160  -5.126  -5.627
   20    HG3  ARG  13           HG1      ARG  13   3.750  -4.539  -7.160
   21    HD2  ARG  13           HD2      ARG  13   4.953  -2.684  -5.862
   22    HD3  ARG  13           HD1      ARG  13   4.395  -3.469  -4.394
   23    HE   ARG  13           HE       ARG  13   5.672  -5.482  -5.530
   24   HH11  ARG  13          HH11      ARG  13   6.632  -2.116  -5.310
   25   HH12  ARG  13          HH12      ARG  13   8.320  -2.466  -5.222
   26   HH21  ARG  13          HH21      ARG  13   7.912  -5.954  -5.421
   27   HH22  ARG  13          HH22      ARG  13   9.054  -4.665  -5.275
   28    H    SER  14           HN       SER  14   2.723  -3.478  -9.451
   29    HA   SER  14           HA       SER  14   0.109  -2.883 -10.557
   30    HB2  SER  14           HB2      SER  14   2.173  -2.389 -11.924
   31    HB3  SER  14           HB1      SER  14   2.502  -4.121 -11.954
   32    HG   SER  14           HG       SER  14   0.676  -4.454 -13.138
   33    HA   PRO  15           HA       PRO  15  -1.300  -3.432 -11.632
   34    HB2  PRO  15           HB2      PRO  15  -3.633  -4.605 -12.077
   35    HB3  PRO  15           HB1      PRO  15  -2.211  -5.033 -13.037
   36    HG2  PRO  15           HG2      PRO  15  -3.554  -6.558 -10.871
   37    HG3  PRO  15           HG1      PRO  15  -2.660  -7.154 -12.278
   38    HD2  PRO  15           HD2      PRO  15  -1.693  -6.838  -9.603
   39    HD3  PRO  15           HD1      PRO  15  -0.767  -7.330 -11.033
   40    H    CYS  16           HN       CYS  16  -1.507  -4.702  -8.620
   41    HA   CYS  16           HA       CYS  16  -3.868  -3.051  -7.948
   42    HB2  CYS  16           HB2      CYS  16  -3.177  -5.308  -6.072
   43    HB3  CYS  16           HB1      CYS  16  -4.707  -4.557  -6.437
   44    HA   PRO  17           HA       PRO  17  -4.429  -1.478  -7.335
   45    HB2  PRO  17           HB2      PRO  17  -4.537   0.929  -6.309
   46    HB3  PRO  17           HB1      PRO  17  -4.713  -0.452  -5.215
   47    HG2  PRO  17           HG2      PRO  17  -2.319   1.246  -5.748
   48    HG3  PRO  17           HG1      PRO  17  -2.945   0.707  -4.189
   49    HD2  PRO  17           HD2      PRO  17  -0.891  -0.535  -5.626
   50    HD3  PRO  17           HD1      PRO  17  -1.844  -1.311  -4.349
   51    HA   PRO  18           HA       PRO  18  -5.641   0.290  -7.816
   52    HB2  PRO  18           HB2      PRO  18  -6.642   2.283  -9.215
   53    HB3  PRO  18           HB1      PRO  18  -5.475   2.615  -7.928
   54    HG2  PRO  18           HG2      PRO  18  -5.110   2.719 -10.870
   55    HG3  PRO  18           HG1      PRO  18  -4.254   3.617  -9.613
   56    HD2  PRO  18           HD2      PRO  18  -3.446   1.173 -10.940
   57    HD3  PRO  18           HD1      PRO  18  -2.554   2.103  -9.717
   58    H    PHE  19           HN       PHE  19  -4.325  -0.739 -10.672
   59    HA   PHE  19           HA       PHE  19  -6.834  -0.967 -12.160
   60    HB2  PHE  19           HB2      PHE  19  -4.016  -1.726 -12.961
   61    HB3  PHE  19           HB1      PHE  19  -5.423  -1.728 -14.017
   62    HD1  PHE  19           HD1      PHE  19  -2.609   0.073 -13.082
   63    HD2  PHE  19           HD2      PHE  19  -6.715   0.610 -14.039
   64    HE1  PHE  19           HE1      PHE  19  -2.165   2.422 -13.645
   65    HE2  PHE  19           HE2      PHE  19  -6.279   2.961 -14.610
   66    HZ   PHE  19           HZ       PHE  19  -4.001   3.869 -14.412
   67    H    CYS  20           HN       CYS  20  -7.018  -2.436  -9.946
   68    HA   CYS  20           HA       CYS  20  -6.153  -5.151 -10.566
   69    HB2  CYS  20           HB2      CYS  20  -5.901  -3.964  -8.269
   70    HB3  CYS  20           HB1      CYS  20  -7.609  -4.336  -8.072
   71    HN1  NH2  21           H1       CYS  20  -7.630  -5.491 -12.277
   72    HN2  NH2  21           H2       CYS  20  -9.303  -5.804 -11.974
  Start of MODEL    5
    1    H1   GLY  11           HT1      GLY  11   0.448   3.124  -1.219
    2    H2   GLY  11           HT2      GLY  11   1.656   2.898  -0.060
    3    H3   GLY  11           HT3      GLY  11   0.758   1.581  -0.616
    4    HA2  GLY  11           HA1      GLY  11   2.615   3.198  -2.256
    5    HA3  GLY  11           HA2      GLY  11   2.950   1.598  -1.607
    6    H    PHE  12           HN       PHE  12   2.986   2.306  -4.367
    7    HA   PHE  12           HA       PHE  12   0.604   0.920  -5.349
    8    HB2  PHE  12           HB2      PHE  12   2.443   2.927  -6.593
    9    HB3  PHE  12           HB1      PHE  12   1.588   1.790  -7.631
   10    HD1  PHE  12           HD1      PHE  12   0.777   3.928  -4.671
   11    HD2  PHE  12           HD2      PHE  12  -0.339   2.593  -8.554
   12    HE1  PHE  12           HE1      PHE  12  -1.243   5.317  -4.566
   13    HE2  PHE  12           HE2      PHE  12  -2.361   3.985  -8.452
   14    HZ   PHE  12           HZ       PHE  12  -2.815   5.346  -6.453
   15    H    ARG  13           HN       ARG  13   0.703  -0.910  -6.424
   16    HA   ARG  13           HA       ARG  13   3.328  -2.018  -7.068
   17    HB2  ARG  13           HB2      ARG  13   1.152  -3.552  -5.519
   18    HB3  ARG  13           HB1      ARG  13   2.386  -4.337  -6.423
   19    HG2  ARG  13           HG2      ARG  13   2.879  -4.332  -4.012
   20    HG3  ARG  13           HG1      ARG  13   4.161  -3.601  -4.943
   21    HD2  ARG  13           HD2      ARG  13   3.934  -2.294  -3.007
   22    HD3  ARG  13           HD1      ARG  13   3.143  -1.329  -4.228
   23    HE   ARG  13           HE       ARG  13   1.041  -2.598  -3.152
   24   HH11  ARG  13          HH11      ARG  13   3.783  -1.125  -1.536
   25   HH12  ARG  13          HH12      ARG  13   2.871  -0.729  -0.122
   26   HH21  ARG  13          HH21      ARG  13  -0.148  -2.072  -1.304
   27   HH22  ARG  13          HH22      ARG  13   0.641  -1.258   0.008
   28    H    SER  14           HN       SER  14   2.854  -4.159  -8.545
   29    HA   SER  14           HA       SER  14   0.774  -3.244 -10.365
   30    HB2  SER  14           HB2      SER  14   3.274  -4.828 -10.967
   31    HB3  SER  14           HB1      SER  14   2.083  -4.297 -12.154
   32    HG   SER  14           HG       SER  14   2.577  -2.142 -11.583
   33    HA   PRO  15           HA       PRO  15  -0.567  -3.602 -11.514
   34    HB2  PRO  15           HB2      PRO  15  -3.022  -4.388 -12.160
   35    HB3  PRO  15           HB1      PRO  15  -1.603  -5.064 -12.967
   36    HG2  PRO  15           HG2      PRO  15  -3.375  -6.286 -10.918
   37    HG3  PRO  15           HG1      PRO  15  -2.468  -7.060 -12.228
   38    HD2  PRO  15           HD2      PRO  15  -1.717  -6.867  -9.489
   39    HD3  PRO  15           HD1      PRO  15  -0.735  -7.491 -10.829
   40    H    CYS  16           HN       CYS  16  -1.772  -4.982  -8.632
   41    HA   CYS  16           HA       CYS  16  -3.699  -2.772  -8.232
   42    HB2  CYS  16           HB2      CYS  16  -3.635  -4.977  -6.179
   43    HB3  CYS  16           HB1      CYS  16  -4.965  -4.060  -6.832
   44    HA   PRO  17           HA       PRO  17  -4.412  -1.346  -7.315
   45    HB2  PRO  17           HB2      PRO  17  -4.413   1.069  -6.246
   46    HB3  PRO  17           HB1      PRO  17  -4.716  -0.333  -5.207
   47    HG2  PRO  17           HG2      PRO  17  -2.211   1.235  -5.586
   48    HG3  PRO  17           HG1      PRO  17  -2.930   0.689  -4.080
   49    HD2  PRO  17           HD2      PRO  17  -0.879  -0.618  -5.422
   50    HD3  PRO  17           HD1      PRO  17  -1.979  -1.401  -4.272
   51    HA   PRO  18           HA       PRO  18  -5.566   0.482  -7.776
   52    HB2  PRO  18           HB2      PRO  18  -6.577   2.355  -9.345
   53    HB3  PRO  18           HB1      PRO  18  -5.437   2.795  -8.067
   54    HG2  PRO  18           HG2      PRO  18  -5.019   2.673 -10.998
   55    HG3  PRO  18           HG1      PRO  18  -4.208   3.684  -9.801
   56    HD2  PRO  18           HD2      PRO  18  -3.298   1.186 -10.919
   57    HD3  PRO  18           HD1      PRO  18  -2.480   2.202  -9.713
   58    H    PHE  19           HN       PHE  19  -4.212  -0.694 -10.564
   59    HA   PHE  19           HA       PHE  19  -6.729  -1.175 -11.956
   60    HB2  PHE  19           HB2      PHE  19  -3.927  -1.955 -12.790
   61    HB3  PHE  19           HB1      PHE  19  -5.374  -2.000 -13.791
   62    HD1  PHE  19           HD1      PHE  19  -2.517  -0.165 -13.000
   63    HD2  PHE  19           HD2      PHE  19  -6.624   0.322 -13.984
   64    HE1  PHE  19           HE1      PHE  19  -2.063   2.138 -13.729
   65    HE2  PHE  19           HE2      PHE  19  -6.181   2.628 -14.714
   66    HZ   PHE  19           HZ       PHE  19  -3.897   3.540 -14.587
   67    H    CYS  20           HN       CYS  20  -7.739  -2.671 -10.674
   68    HA   CYS  20           HA       CYS  20  -6.380  -5.265 -10.548
   69    HB2  CYS  20           HB2      CYS  20  -6.552  -3.797  -8.354
   70    HB3  CYS  20           HB1      CYS  20  -8.182  -4.461  -8.316
   71    HN1  NH2  21           H1       CYS  20  -7.540  -6.131 -12.188
   72    HN2  NH2  21           H2       CYS  20  -9.250  -6.375 -12.145
  Start of MODEL    6
    1    H1   GLY  11           HT1      GLY  11   0.131   3.298  -1.531
    2    H2   GLY  11           HT2      GLY  11   1.051   2.736  -0.229
    3    H3   GLY  11           HT3      GLY  11  -0.053   1.710  -0.986
    4    HA2  GLY  11           HA1      GLY  11   2.376   2.846  -2.237
    5    HA3  GLY  11           HA2      GLY  11   2.211   1.200  -1.641
    6    H    PHE  12           HN       PHE  12   2.199   2.981  -4.351
    7    HA   PHE  12           HA       PHE  12   0.134   1.400  -5.678
    8    HB2  PHE  12           HB2      PHE  12   1.501   3.980  -6.345
    9    HB3  PHE  12           HB1      PHE  12   0.783   3.021  -7.636
   10    HD1  PHE  12           HD1      PHE  12  -0.110   4.253  -4.228
   11    HD2  PHE  12           HD2      PHE  12  -1.377   3.501  -8.217
   12    HE1  PHE  12           HE1      PHE  12  -2.332   5.155  -3.687
   13    HE2  PHE  12           HE2      PHE  12  -3.602   4.402  -7.683
   14    HZ   PHE  12           HZ       PHE  12  -4.081   5.228  -5.415
   15    H    ARG  13           HN       ARG  13   0.552   0.081  -7.391
   16    HA   ARG  13           HA       ARG  13   3.032  -0.260  -8.554
   17    HB2  ARG  13           HB2      ARG  13   3.931  -2.290  -7.586
   18    HB3  ARG  13           HB1      ARG  13   3.756  -1.100  -6.318
   19    HG2  ARG  13           HG2      ARG  13   1.536  -3.082  -6.655
   20    HG3  ARG  13           HG1      ARG  13   3.078  -3.678  -6.064
   21    HD2  ARG  13           HD2      ARG  13   2.996  -2.016  -4.205
   22    HD3  ARG  13           HD1      ARG  13   1.422  -1.477  -4.758
   23    HE   ARG  13           HE       ARG  13   1.689  -4.307  -4.120
   24   HH11  ARG  13          HH11      ARG  13   0.584  -1.129  -3.105
   25   HH12  ARG  13          HH12      ARG  13  -0.408  -1.752  -1.838
   26   HH21  ARG  13          HH21      ARG  13   0.359  -5.118  -2.452
   27   HH22  ARG  13          HH22      ARG  13  -0.536  -4.018  -1.463
   28    H    SER  14           HN       SER  14   3.066  -2.695  -9.654
   29    HA   SER  14           HA       SER  14   0.390  -2.801 -10.791
   30    HB2  SER  14           HB2      SER  14   2.983  -3.932 -11.857
   31    HB3  SER  14           HB1      SER  14   1.446  -3.855 -12.717
   32    HG   SER  14           HG       SER  14   3.266  -1.831 -12.105
   33    HA   PRO  15           HA       PRO  15  -0.855  -3.799 -11.749
   34    HB2  PRO  15           HB2      PRO  15  -3.037  -5.329 -11.838
   35    HB3  PRO  15           HB1      PRO  15  -1.570  -5.771 -12.720
   36    HG2  PRO  15           HG2      PRO  15  -2.693  -6.923 -10.224
   37    HG3  PRO  15           HG1      PRO  15  -1.734  -7.704 -11.490
   38    HD2  PRO  15           HD2      PRO  15  -0.802  -6.714  -8.993
   39    HD3  PRO  15           HD1      PRO  15   0.184  -7.325 -10.334
   40    H    CYS  16           HN       CYS  16  -1.402  -4.830  -8.519
   41    HA   CYS  16           HA       CYS  16  -3.646  -2.915  -8.252
   42    HB2  CYS  16           HB2      CYS  16  -3.440  -5.100  -6.188
   43    HB3  CYS  16           HB1      CYS  16  -4.832  -4.294  -6.862
   44    HA   PRO  17           HA       PRO  17  -4.418  -1.490  -7.411
   45    HB2  PRO  17           HB2      PRO  17  -4.677   0.848  -6.218
   46    HB3  PRO  17           HB1      PRO  17  -4.902  -0.631  -5.275
   47    HG2  PRO  17           HG2      PRO  17  -2.562   1.207  -5.389
   48    HG3  PRO  17           HG1      PRO  17  -3.262   0.404  -3.986
   49    HD2  PRO  17           HD2      PRO  17  -1.032  -0.475  -5.464
   50    HD3  PRO  17           HD1      PRO  17  -1.960  -1.452  -4.309
   51    HA   PRO  18           HA       PRO  18  -5.726   0.275  -7.830
   52    HB2  PRO  18           HB2      PRO  18  -6.792   2.237  -9.198
   53    HB3  PRO  18           HB1      PRO  18  -5.652   2.624  -7.900
   54    HG2  PRO  18           HG2      PRO  18  -5.239   2.677 -10.853
   55    HG3  PRO  18           HG1      PRO  18  -4.535   3.723  -9.611
   56    HD2  PRO  18           HD2      PRO  18  -3.372   1.383 -10.795
   57    HD3  PRO  18           HD1      PRO  18  -2.701   2.375  -9.484
   58    H    PHE  19           HN       PHE  19  -4.228  -0.879 -10.422
   59    HA   PHE  19           HA       PHE  19  -6.593  -1.115 -12.133
   60    HB2  PHE  19           HB2      PHE  19  -3.733  -1.915 -12.725
   61    HB3  PHE  19           HB1      PHE  19  -5.071  -1.916 -13.869
   62    HD1  PHE  19           HD1      PHE  19  -2.345  -0.082 -12.615
   63    HD2  PHE  19           HD2      PHE  19  -6.263   0.377 -14.197
   64    HE1  PHE  19           HE1      PHE  19  -1.833   2.254 -13.197
   65    HE2  PHE  19           HE2      PHE  19  -5.759   2.710 -14.784
   66    HZ   PHE  19           HZ       PHE  19  -3.540   3.650 -14.283
   67    H    CYS  20           HN       CYS  20  -7.422  -2.506 -10.322
   68    HA   CYS  20           HA       CYS  20  -6.501  -5.267 -10.738
   69    HB2  CYS  20           HB2      CYS  20  -6.014  -3.993  -8.469
   70    HB3  CYS  20           HB1      CYS  20  -7.678  -4.447  -8.127
   71    HN1  NH2  21           H1       CYS  20  -8.163  -5.517 -12.279
   72    HN2  NH2  21           H2       CYS  20  -9.821  -5.653 -11.814
  Start of MODEL    7
    1    H1   GLY  11           HT1      GLY  11   0.721   2.033  -1.197
    2    H2   GLY  11           HT2      GLY  11   1.851   1.644   0.000
    3    H3   GLY  11           HT3      GLY  11   0.897   0.434  -0.694
    4    HA2  GLY  11           HA1      GLY  11   2.932   2.030  -2.129
    5    HA3  GLY  11           HA2      GLY  11   3.137   0.374  -1.576
    6    H    PHE  12           HN       PHE  12   3.362   1.220  -4.271
    7    HA   PHE  12           HA       PHE  12   0.894   0.246  -5.479
    8    HB2  PHE  12           HB2      PHE  12   3.154   1.916  -6.473
    9    HB3  PHE  12           HB1      PHE  12   2.264   0.940  -7.640
   10    HD1  PHE  12           HD1      PHE  12   1.483   3.179  -4.744
   11    HD2  PHE  12           HD2      PHE  12   0.562   2.007  -8.735
   12    HE1  PHE  12           HE1      PHE  12  -0.293   4.870  -4.828
   13    HE2  PHE  12           HE2      PHE  12  -1.218   3.703  -8.822
   14    HZ   PHE  12           HZ       PHE  12  -1.649   5.135  -6.866
   15    H    ARG  13           HN       ARG  13   0.807  -1.459  -6.869
   16    HA   ARG  13           HA       ARG  13   3.129  -3.112  -7.232
   17    HB2  ARG  13           HB2      ARG  13   0.721  -4.169  -5.655
   18    HB3  ARG  13           HB1      ARG  13   2.011  -5.172  -6.266
   19    HG2  ARG  13           HG2      ARG  13   2.782  -5.020  -4.138
   20    HG3  ARG  13           HG1      ARG  13   3.471  -3.498  -4.653
   21    HD2  ARG  13           HD2      ARG  13   2.373  -3.145  -2.572
   22    HD3  ARG  13           HD1      ARG  13   1.400  -2.349  -3.785
   23    HE   ARG  13           HE       ARG  13   0.641  -5.058  -2.913
   24   HH11  ARG  13          HH11      ARG  13  -0.016  -1.595  -2.870
   25   HH12  ARG  13          HH12      ARG  13  -1.628  -1.794  -2.285
   26   HH21  ARG  13          HH21      ARG  13  -1.483  -5.298  -2.140
   27   HH22  ARG  13          HH22      ARG  13  -2.472  -3.904  -1.873
   28    H    SER  14           HN       SER  14   2.299  -5.247  -8.495
   29    HA   SER  14           HA       SER  14   0.296  -4.281 -10.382
   30    HB2  SER  14           HB2      SER  14   2.534  -6.284 -10.791
   31    HB3  SER  14           HB1      SER  14   1.389  -5.759 -12.024
   32    HG   SER  14           HG       SER  14   2.364  -3.868 -12.167
   33    HA   PRO  15           HA       PRO  15  -1.164  -4.632 -11.431
   34    HB2  PRO  15           HB2      PRO  15  -3.714  -5.191 -11.888
   35    HB3  PRO  15           HB1      PRO  15  -2.432  -6.175 -12.602
   36    HG2  PRO  15           HG2      PRO  15  -4.235  -6.791 -10.319
   37    HG3  PRO  15           HG1      PRO  15  -3.535  -7.881 -11.526
   38    HD2  PRO  15           HD2      PRO  15  -2.579  -7.404  -8.894
   39    HD3  PRO  15           HD1      PRO  15  -1.768  -8.328 -10.172
   40    H    CYS  16           HN       CYS  16  -2.114  -5.308  -8.305
   41    HA   CYS  16           HA       CYS  16  -3.894  -2.941  -8.156
   42    HB2  CYS  16           HB2      CYS  16  -3.890  -4.845  -5.824
   43    HB3  CYS  16           HB1      CYS  16  -5.184  -3.926  -6.550
   44    HA   PRO  17           HA       PRO  17  -4.439  -1.364  -7.347
   45    HB2  PRO  17           HB2      PRO  17  -4.304   1.060  -6.349
   46    HB3  PRO  17           HB1      PRO  17  -4.515  -0.296  -5.227
   47    HG2  PRO  17           HG2      PRO  17  -2.036   1.220  -5.917
   48    HG3  PRO  17           HG1      PRO  17  -2.603   0.731  -4.323
   49    HD2  PRO  17           HD2      PRO  17  -0.744  -0.661  -5.883
   50    HD3  PRO  17           HD1      PRO  17  -1.659  -1.354  -4.529
   51    HA   PRO  18           HA       PRO  18  -5.512   0.541  -7.785
   52    HB2  PRO  18           HB2      PRO  18  -6.518   2.421  -9.367
   53    HB3  PRO  18           HB1      PRO  18  -5.337   2.833  -8.118
   54    HG2  PRO  18           HG2      PRO  18  -5.006   2.693 -11.047
   55    HG3  PRO  18           HG1      PRO  18  -4.108   3.662  -9.880
   56    HD2  PRO  18           HD2      PRO  18  -3.346   1.135 -11.042
   57    HD3  PRO  18           HD1      PRO  18  -2.447   2.099  -9.854
   58    H    PHE  19           HN       PHE  19  -4.426  -0.378 -10.905
   59    HA   PHE  19           HA       PHE  19  -7.076  -1.022 -11.917
   60    HB2  PHE  19           HB2      PHE  19  -4.398  -1.662 -13.174
   61    HB3  PHE  19           HB1      PHE  19  -5.972  -1.688 -13.958
   62    HD1  PHE  19           HD1      PHE  19  -3.047   0.144 -13.516
   63    HD2  PHE  19           HD2      PHE  19  -7.260   0.635 -13.853
   64    HE1  PHE  19           HE1      PHE  19  -2.713   2.478 -14.207
   65    HE2  PHE  19           HE2      PHE  19  -6.935   2.973 -14.544
   66    HZ   PHE  19           HZ       PHE  19  -4.659   3.897 -14.721
   67    H    CYS  20           HN       CYS  20  -7.357  -2.422 -10.006
   68    HA   CYS  20           HA       CYS  20  -5.811  -4.825  -9.844
   69    HB2  CYS  20           HB2      CYS  20  -6.971  -3.573  -7.927
   70    HB3  CYS  20           HB1      CYS  20  -8.450  -4.350  -8.483
   71    HN1  NH2  21           H1       CYS  20  -6.051  -5.885 -11.784
   72    HN2  NH2  21           H2       CYS  20  -7.531  -6.624 -12.285
  Start of MODEL    8
    1    H1   GLY  11           HT1      GLY  11   1.498   4.357  -1.866
    2    H2   GLY  11           HT2      GLY  11   2.416   4.129  -0.467
    3    H3   GLY  11           HT3      GLY  11   1.012   3.221  -0.711
    4    HA2  GLY  11           HA1      GLY  11   3.477   3.085  -2.339
    5    HA3  GLY  11           HA2      GLY  11   2.985   1.907  -1.134
    6    H    PHE  12           HN       PHE  12   2.744   2.896  -4.355
    7    HA   PHE  12           HA       PHE  12   0.492   1.109  -4.889
    8    HB2  PHE  12           HB2      PHE  12   1.730   3.405  -6.341
    9    HB3  PHE  12           HB1      PHE  12   0.961   2.144  -7.299
   10    HD1  PHE  12           HD1      PHE  12   0.174   3.988  -4.131
   11    HD2  PHE  12           HD2      PHE  12  -1.163   2.647  -7.949
   12    HE1  PHE  12           HE1      PHE  12  -2.036   4.961  -3.699
   13    HE2  PHE  12           HE2      PHE  12  -3.376   3.623  -7.516
   14    HZ   PHE  12           HZ       PHE  12  -3.813   4.778  -5.387
   15    H    ARG  13           HN       ARG  13   0.625  -0.521  -6.447
   16    HA   ARG  13           HA       ARG  13   3.267  -1.269  -7.353
   17    HB2  ARG  13           HB2      ARG  13   1.584  -3.166  -5.605
   18    HB3  ARG  13           HB1      ARG  13   2.902  -3.699  -6.602
   19    HG2  ARG  13           HG2      ARG  13   3.685  -3.653  -4.370
   20    HG3  ARG  13           HG1      ARG  13   4.483  -2.314  -5.168
   21    HD2  ARG  13           HD2      ARG  13   3.030  -0.729  -4.060
   22    HD3  ARG  13           HD1      ARG  13   1.995  -2.022  -3.445
   23    HE   ARG  13           HE       ARG  13   4.791  -2.009  -2.599
   24   HH11  ARG  13          HH11      ARG  13   1.448  -1.251  -1.833
   25   HH12  ARG  13          HH12      ARG  13   1.725  -1.205  -0.127
   26   HH21  ARG  13          HH21      ARG  13   5.145  -1.957  -0.356
   27   HH22  ARG  13          HH22      ARG  13   3.833  -1.605   0.718
   28    H    SER  14           HN       SER  14   2.942  -3.366  -8.890
   29    HA   SER  14           HA       SER  14   0.424  -2.851 -10.270
   30    HB2  SER  14           HB2      SER  14   3.009  -3.972 -11.365
   31    HB3  SER  14           HB1      SER  14   1.551  -3.636 -12.299
   32    HG   SER  14           HG       SER  14   1.938  -1.406 -11.166
   33    HA   PRO  15           HA       PRO  15  -0.774  -3.544 -11.598
   34    HB2  PRO  15           HB2      PRO  15  -3.112  -4.733 -12.060
   35    HB3  PRO  15           HB1      PRO  15  -1.643  -5.260 -12.889
   36    HG2  PRO  15           HG2      PRO  15  -3.092  -6.531 -10.617
   37    HG3  PRO  15           HG1      PRO  15  -2.217  -7.289 -11.957
   38    HD2  PRO  15           HD2      PRO  15  -1.241  -6.863  -9.346
   39    HD3  PRO  15           HD1      PRO  15  -0.283  -7.329 -10.763
   40    H    CYS  16           HN       CYS  16  -1.622  -4.889  -8.586
   41    HA   CYS  16           HA       CYS  16  -3.751  -2.873  -8.179
   42    HB2  CYS  16           HB2      CYS  16  -3.503  -5.089  -6.153
   43    HB3  CYS  16           HB1      CYS  16  -4.905  -4.266  -6.784
   44    HA   PRO  17           HA       PRO  17  -4.402  -1.399  -7.356
   45    HB2  PRO  17           HB2      PRO  17  -4.214   1.123  -6.253
   46    HB3  PRO  17           HB1      PRO  17  -5.008  -0.245  -5.475
   47    HG2  PRO  17           HG2      PRO  17  -2.598   1.091  -4.658
   48    HG3  PRO  17           HG1      PRO  17  -3.412  -0.233  -3.873
   49    HD2  PRO  17           HD2      PRO  17  -1.074  -0.270  -5.671
   50    HD3  PRO  17           HD1      PRO  17  -1.585  -1.471  -4.470
   51    HA   PRO  18           HA       PRO  18  -5.597   0.408  -7.779
   52    HB2  PRO  18           HB2      PRO  18  -6.635   2.317  -9.266
   53    HB3  PRO  18           HB1      PRO  18  -5.471   2.732  -8.001
   54    HG2  PRO  18           HG2      PRO  18  -5.106   2.662 -10.947
   55    HG3  PRO  18           HG1      PRO  18  -4.301   3.685  -9.751
   56    HD2  PRO  18           HD2      PRO  18  -3.337   1.228 -10.905
   57    HD3  PRO  18           HD1      PRO  18  -2.544   2.233  -9.675
   58    H    PHE  19           HN       PHE  19  -4.233  -0.741 -10.551
   59    HA   PHE  19           HA       PHE  19  -6.745  -1.120 -12.001
   60    HB2  PHE  19           HB2      PHE  19  -3.929  -1.828 -12.852
   61    HB3  PHE  19           HB1      PHE  19  -5.370  -1.899 -13.858
   62    HD1  PHE  19           HD1      PHE  19  -2.577   0.018 -12.990
   63    HD2  PHE  19           HD2      PHE  19  -6.680   0.387 -14.050
   64    HE1  PHE  19           HE1      PHE  19  -2.184   2.343 -13.689
   65    HE2  PHE  19           HE2      PHE  19  -6.292   2.711 -14.750
   66    HZ   PHE  19           HZ       PHE  19  -4.042   3.692 -14.571
   67    H    CYS  20           HN       CYS  20  -7.537  -2.581 -10.347
   68    HA   CYS  20           HA       CYS  20  -6.359  -5.258 -10.646
   69    HB2  CYS  20           HB2      CYS  20  -6.255  -3.955  -8.356
   70    HB3  CYS  20           HB1      CYS  20  -7.915  -4.519  -8.212
   71    HN1  NH2  21           H1       CYS  20  -7.755  -5.709 -12.358
   72    HN2  NH2  21           H2       CYS  20  -9.446  -5.977 -12.125
  Start of MODEL    9
    1    H1   GLY  11           HT1      GLY  11  -0.609   1.998  -0.926
    2    H2   GLY  11           HT2      GLY  11   0.734   1.817   0.083
    3    H3   GLY  11           HT3      GLY  11   0.239   0.543  -0.911
    4    HA2  GLY  11           HA1      GLY  11   1.235   3.150  -1.883
    5    HA3  GLY  11           HA2      GLY  11   2.199   1.684  -1.787
    6    H    PHE  12           HN       PHE  12   1.795   3.057  -4.164
    7    HA   PHE  12           HA       PHE  12  -0.176   1.471  -5.625
    8    HB2  PHE  12           HB2      PHE  12   1.212   4.071  -6.201
    9    HB3  PHE  12           HB1      PHE  12   0.513   3.133  -7.519
   10    HD1  PHE  12           HD1      PHE  12  -0.438   4.313  -4.111
   11    HD2  PHE  12           HD2      PHE  12  -1.630   3.643  -8.134
   12    HE1  PHE  12           HE1      PHE  12  -2.666   5.211  -3.591
   13    HE2  PHE  12           HE2      PHE  12  -3.861   4.539  -7.626
   14    HZ   PHE  12           HZ       PHE  12  -4.382   5.322  -5.350
   15    H    ARG  13           HN       ARG  13   0.369   0.279  -7.453
   16    HA   ARG  13           HA       ARG  13   2.967  -0.076  -8.344
   17    HB2  ARG  13           HB2      ARG  13   3.638  -2.230  -7.367
   18    HB3  ARG  13           HB1      ARG  13   3.488  -1.013  -6.121
   19    HG2  ARG  13           HG2      ARG  13   1.151  -2.829  -6.619
   20    HG3  ARG  13           HG1      ARG  13   2.575  -3.494  -5.848
   21    HD2  ARG  13           HD2      ARG  13   2.422  -2.032  -3.988
   22    HD3  ARG  13           HD1      ARG  13   1.248  -0.992  -4.750
   23    HE   ARG  13           HE       ARG  13  -0.027  -3.398  -4.620
   24   HH11  ARG  13          HH11      ARG  13   1.630  -1.409  -2.256
   25   HH12  ARG  13          HH12      ARG  13   0.600  -1.885  -0.949
   26   HH21  ARG  13          HH21      ARG  13  -1.388  -4.032  -2.894
   27   HH22  ARG  13          HH22      ARG  13  -1.113  -3.385  -1.314
   28    H    SER  14           HN       SER  14   3.103  -2.405  -9.588
   29    HA   SER  14           HA       SER  14   0.480  -2.641 -10.811
   30    HB2  SER  14           HB2      SER  14   1.977  -3.954 -12.547
   31    HB3  SER  14           HB1      SER  14   1.947  -2.193 -12.534
   32    HG   SER  14           HG       SER  14   3.902  -3.906 -11.395
   33    HA   PRO  15           HA       PRO  15  -0.723  -3.693 -11.764
   34    HB2  PRO  15           HB2      PRO  15  -2.855  -5.315 -11.786
   35    HB3  PRO  15           HB1      PRO  15  -1.402  -5.668 -12.723
   36    HG2  PRO  15           HG2      PRO  15  -2.397  -6.946 -10.245
   37    HG3  PRO  15           HG1      PRO  15  -1.371  -7.614 -11.521
   38    HD2  PRO  15           HD2      PRO  15  -0.550  -6.566  -8.987
   39    HD3  PRO  15           HD1      PRO  15   0.486  -7.157 -10.298
   40    H    CYS  16           HN       CYS  16  -1.313  -4.776  -8.514
   41    HA   CYS  16           HA       CYS  16  -3.554  -2.854  -8.308
   42    HB2  CYS  16           HB2      CYS  16  -3.460  -5.082  -6.283
   43    HB3  CYS  16           HB1      CYS  16  -4.810  -4.220  -6.971
   44    HA   PRO  17           HA       PRO  17  -4.427  -1.501  -7.437
   45    HB2  PRO  17           HB2      PRO  17  -4.739   0.829  -6.237
   46    HB3  PRO  17           HB1      PRO  17  -4.969  -0.658  -5.304
   47    HG2  PRO  17           HG2      PRO  17  -2.622   1.174  -5.399
   48    HG3  PRO  17           HG1      PRO  17  -3.375   0.436  -3.989
   49    HD2  PRO  17           HD2      PRO  17  -1.112  -0.526  -5.310
   50    HD3  PRO  17           HD1      PRO  17  -2.148  -1.489  -4.240
   51    HA   PRO  18           HA       PRO  18  -5.712   0.386  -7.828
   52    HB2  PRO  18           HB2      PRO  18  -6.720   2.273  -9.357
   53    HB3  PRO  18           HB1      PRO  18  -5.637   2.713  -8.028
   54    HG2  PRO  18           HG2      PRO  18  -5.101   2.649 -10.957
   55    HG3  PRO  18           HG1      PRO  18  -4.423   3.718  -9.722
   56    HD2  PRO  18           HD2      PRO  18  -3.264   1.321 -10.793
   57    HD3  PRO  18           HD1      PRO  18  -2.620   2.343  -9.493
   58    H    PHE  19           HN       PHE  19  -4.179  -0.780 -10.478
   59    HA   PHE  19           HA       PHE  19  -6.569  -1.169 -12.112
   60    HB2  PHE  19           HB2      PHE  19  -3.730  -2.039 -12.693
   61    HB3  PHE  19           HB1      PHE  19  -5.075  -2.008 -13.827
   62    HD1  PHE  19           HD1      PHE  19  -2.286  -0.251 -12.581
   63    HD2  PHE  19           HD2      PHE  19  -6.162   0.313 -14.234
   64    HE1  PHE  19           HE1      PHE  19  -1.678   2.047 -13.210
   65    HE2  PHE  19           HE2      PHE  19  -5.561   2.609 -14.870
   66    HZ   PHE  19           HZ       PHE  19  -3.318   3.479 -14.357
   67    H    CYS  20           HN       CYS  20  -7.636  -2.582 -10.624
   68    HA   CYS  20           HA       CYS  20  -6.608  -5.309 -10.794
   69    HB2  CYS  20           HB2      CYS  20  -6.064  -3.950  -8.580
   70    HB3  CYS  20           HB1      CYS  20  -7.707  -4.427  -8.174
   71    HN1  NH2  21           H1       CYS  20  -8.373  -5.353 -12.351
   72    HN2  NH2  21           H2       CYS  20  -9.997  -5.561 -11.802
  Start of MODEL   10
    1    H1   GLY  11           HT1      GLY  11   1.273   2.897  -1.556
    2    H2   GLY  11           HT2      GLY  11   2.856   3.027  -0.963
    3    H3   GLY  11           HT3      GLY  11   2.287   1.544  -1.550
    4    HA2  GLY  11           HA1      GLY  11   2.674   3.995  -3.162
    5    HA3  GLY  11           HA2      GLY  11   3.755   2.609  -3.140
    6    H    PHE  12           HN       PHE  12   2.719   3.397  -5.498
    7    HA   PHE  12           HA       PHE  12   0.474   1.602  -6.022
    8    HB2  PHE  12           HB2      PHE  12   1.609   3.960  -7.493
    9    HB3  PHE  12           HB1      PHE  12   0.601   2.788  -8.335
   10    HD1  PHE  12           HD1      PHE  12   0.513   4.585  -5.055
   11    HD2  PHE  12           HD2      PHE  12  -1.581   3.410  -8.566
   12    HE1  PHE  12           HE1      PHE  12  -1.512   5.687  -4.211
   13    HE2  PHE  12           HE2      PHE  12  -3.610   4.511  -7.726
   14    HZ   PHE  12           HZ       PHE  12  -3.576   5.648  -5.544
   15    H    ARG  13           HN       ARG  13   0.568   0.190  -7.874
   16    HA   ARG  13           HA       ARG  13   2.947  -0.402  -9.131
   17    HB2  ARG  13           HB2      ARG  13   3.714  -2.474  -8.055
   18    HB3  ARG  13           HB1      ARG  13   3.825  -1.123  -6.952
   19    HG2  ARG  13           HG2      ARG  13   1.396  -2.887  -6.789
   20    HG3  ARG  13           HG1      ARG  13   2.933  -3.526  -6.240
   21    HD2  ARG  13           HD2      ARG  13   3.157  -1.622  -4.639
   22    HD3  ARG  13           HD1      ARG  13   1.604  -0.998  -5.153
   23    HE   ARG  13           HE       ARG  13   1.621  -3.727  -4.142
   24   HH11  ARG  13          HH11      ARG  13   1.022  -0.327  -3.426
   25   HH12  ARG  13          HH12      ARG  13   0.013  -0.681  -2.067
   26   HH21  ARG  13          HH21      ARG  13   0.276  -4.158  -2.332
   27   HH22  ARG  13          HH22      ARG  13  -0.403  -2.836  -1.444
   28    H    SER  14           HN       SER  14   2.795  -2.850 -10.104
   29    HA   SER  14           HA       SER  14   0.028  -2.991 -10.965
   30    HB2  SER  14           HB2      SER  14   1.113  -4.440 -12.814
   31    HB3  SER  14           HB1      SER  14   1.403  -2.700 -12.836
   32    HG   SER  14           HG       SER  14   3.150  -4.785 -12.418
   33    HA   PRO  15           HA       PRO  15  -1.292  -4.056 -11.776
   34    HB2  PRO  15           HB2      PRO  15  -3.464  -5.751 -11.328
   35    HB3  PRO  15           HB1      PRO  15  -2.312  -5.877 -12.658
   36    HG2  PRO  15           HG2      PRO  15  -2.658  -7.720 -10.527
   37    HG3  PRO  15           HG1      PRO  15  -1.373  -7.730 -11.745
   38    HD2  PRO  15           HD2      PRO  15  -1.334  -6.700  -8.953
   39    HD3  PRO  15           HD1      PRO  15  -0.017  -7.401  -9.917
   40    H    CYS  16           HN       CYS  16  -1.454  -4.745  -8.445
   41    HA   CYS  16           HA       CYS  16  -3.675  -2.824  -8.139
   42    HB2  CYS  16           HB2      CYS  16  -3.536  -5.019  -6.083
   43    HB3  CYS  16           HB1      CYS  16  -4.899  -4.114  -6.697
   44    HA   PRO  17           HA       PRO  17  -4.397  -1.391  -7.238
   45    HB2  PRO  17           HB2      PRO  17  -4.414   1.041  -6.227
   46    HB3  PRO  17           HB1      PRO  17  -4.656  -0.338  -5.143
   47    HG2  PRO  17           HG2      PRO  17  -2.174   1.250  -5.650
   48    HG3  PRO  17           HG1      PRO  17  -2.854   0.757  -4.100
   49    HD2  PRO  17           HD2      PRO  17  -0.829  -0.584  -5.441
   50    HD3  PRO  17           HD1      PRO  17  -1.902  -1.339  -4.245
   51    HA   PRO  18           HA       PRO  18  -5.603   0.310  -7.774
   52    HB2  PRO  18           HB2      PRO  18  -6.665   2.167  -9.309
   53    HB3  PRO  18           HB1      PRO  18  -5.518   2.621  -8.041
   54    HG2  PRO  18           HG2      PRO  18  -5.137   2.537 -10.985
   55    HG3  PRO  18           HG1      PRO  18  -4.325   3.553  -9.788
   56    HD2  PRO  18           HD2      PRO  18  -3.403   1.067 -10.937
   57    HD3  PRO  18           HD1      PRO  18  -2.569   2.102  -9.760
   58    H    PHE  19           HN       PHE  19  -4.299  -0.588 -10.799
   59    HA   PHE  19           HA       PHE  19  -6.834  -1.038 -12.135
   60    HB2  PHE  19           HB2      PHE  19  -4.048  -1.804 -13.029
   61    HB3  PHE  19           HB1      PHE  19  -5.500  -1.819 -14.022
   62    HD1  PHE  19           HD1      PHE  19  -2.660   0.025 -13.115
   63    HD2  PHE  19           HD2      PHE  19  -6.755   0.489 -14.175
   64    HE1  PHE  19           HE1      PHE  19  -2.225   2.360 -13.755
   65    HE2  PHE  19           HE2      PHE  19  -6.327   2.825 -14.820
   66    HZ   PHE  19           HZ       PHE  19  -4.059   3.762 -14.611
   67    H    CYS  20           HN       CYS  20  -7.307  -2.441 -10.133
   68    HA   CYS  20           HA       CYS  20  -6.272  -5.158 -10.478
   69    HB2  CYS  20           HB2      CYS  20  -6.410  -3.778  -8.221
   70    HB3  CYS  20           HB1      CYS  20  -8.060  -4.387  -8.216
   71    HN1  NH2  21           H1       CYS  20  -7.503  -5.754 -12.260
   72    HN2  NH2  21           H2       CYS  20  -9.211  -6.003 -12.180
  Start of MODEL   11
    1    H1   GLY  11           HT1      GLY  11   0.420   3.024  -1.517
    2    H2   GLY  11           HT2      GLY  11   1.596   2.559  -0.394
    3    H3   GLY  11           HT3      GLY  11   0.657   1.387  -1.169
    4    HA2  GLY  11           HA1      GLY  11   2.613   3.178  -2.483
    5    HA3  GLY  11           HA2      GLY  11   2.868   1.479  -2.123
    6    H    PHE  12           HN       PHE  12   3.270   1.637  -4.553
    7    HA   PHE  12           HA       PHE  12   0.779   0.958  -5.912
    8    HB2  PHE  12           HB2      PHE  12   2.690   3.113  -6.709
    9    HB3  PHE  12           HB1      PHE  12   1.923   2.165  -7.976
   10    HD1  PHE  12           HD1      PHE  12   1.190   4.281  -5.017
   11    HD2  PHE  12           HD2      PHE  12  -0.244   2.641  -8.669
   12    HE1  PHE  12           HE1      PHE  12  -0.839   5.659  -4.835
   13    HE2  PHE  12           HE2      PHE  12  -2.276   4.015  -8.492
   14    HZ   PHE  12           HZ       PHE  12  -2.575   5.523  -6.572
   15    H    ARG  13           HN       ARG  13   0.919  -0.876  -6.907
   16    HA   ARG  13           HA       ARG  13   3.434  -1.804  -7.995
   17    HB2  ARG  13           HB2      ARG  13   1.932  -3.398  -5.849
   18    HB3  ARG  13           HB1      ARG  13   3.228  -4.035  -6.834
   19    HG2  ARG  13           HG2      ARG  13   4.895  -2.797  -5.696
   20    HG3  ARG  13           HG1      ARG  13   3.742  -1.621  -5.072
   21    HD2  ARG  13           HD2      ARG  13   4.506  -3.007  -3.285
   22    HD3  ARG  13           HD1      ARG  13   2.821  -3.382  -3.589
   23    HE   ARG  13           HE       ARG  13   4.948  -5.095  -4.727
   24   HH11  ARG  13          HH11      ARG  13   2.208  -4.715  -2.561
   25   HH12  ARG  13          HH12      ARG  13   2.062  -6.402  -2.242
   26   HH21  ARG  13          HH21      ARG  13   4.761  -7.333  -4.294
   27   HH22  ARG  13          HH22      ARG  13   3.521  -7.905  -3.236
   28    H    SER  14           HN       SER  14   2.912  -4.156  -9.093
   29    HA   SER  14           HA       SER  14   0.414  -3.646 -10.501
   30    HB2  SER  14           HB2      SER  14   2.676  -5.486 -11.302
   31    HB3  SER  14           HB1      SER  14   1.330  -4.955 -12.309
   32    HG   SER  14           HG       SER  14   3.374  -3.317 -11.209
   33    HA   PRO  15           HA       PRO  15  -0.971  -4.355 -11.521
   34    HB2  PRO  15           HB2      PRO  15  -3.418  -5.364 -11.807
   35    HB3  PRO  15           HB1      PRO  15  -2.013  -6.161 -12.522
   36    HG2  PRO  15           HG2      PRO  15  -3.614  -6.934 -10.148
   37    HG3  PRO  15           HG1      PRO  15  -2.709  -7.957 -11.274
   38    HD2  PRO  15           HD2      PRO  15  -1.873  -7.045  -8.699
   39    HD3  PRO  15           HD1      PRO  15  -0.917  -7.960  -9.880
   40    H    CYS  16           HN       CYS  16  -1.946  -5.060  -8.335
   41    HA   CYS  16           HA       CYS  16  -3.807  -2.745  -8.288
   42    HB2  CYS  16           HB2      CYS  16  -4.075  -4.786  -6.084
   43    HB3  CYS  16           HB1      CYS  16  -5.280  -3.827  -6.905
   44    HA   PRO  17           HA       PRO  17  -4.418  -1.134  -7.391
   45    HB2  PRO  17           HB2      PRO  17  -4.057   1.334  -6.465
   46    HB3  PRO  17           HB1      PRO  17  -4.572   0.054  -5.356
   47    HG2  PRO  17           HG2      PRO  17  -1.849   1.187  -5.810
   48    HG3  PRO  17           HG1      PRO  17  -2.656   0.875  -4.279
   49    HD2  PRO  17           HD2      PRO  17  -0.826  -0.816  -5.462
   50    HD3  PRO  17           HD1      PRO  17  -2.073  -1.352  -4.319
   51    HA   PRO  18           HA       PRO  18  -5.220   1.128  -7.845
   52    HB2  PRO  18           HB2      PRO  18  -5.995   2.853  -9.707
   53    HB3  PRO  18           HB1      PRO  18  -4.746   3.295  -8.538
   54    HG2  PRO  18           HG2      PRO  18  -4.483   2.580 -11.404
   55    HG3  PRO  18           HG1      PRO  18  -3.505   3.687 -10.440
   56    HD2  PRO  18           HD2      PRO  18  -2.893   0.988 -11.102
   57    HD3  PRO  18           HD1      PRO  18  -2.007   2.040  -9.982
   58    H    PHE  19           HN       PHE  19  -4.297  -0.566 -10.577
   59    HA   PHE  19           HA       PHE  19  -7.014  -1.042 -11.527
   60    HB2  PHE  19           HB2      PHE  19  -4.474  -2.396 -12.461
   61    HB3  PHE  19           HB1      PHE  19  -6.002  -2.259 -13.323
   62    HD1  PHE  19           HD1      PHE  19  -2.758  -0.995 -13.031
   63    HD2  PHE  19           HD2      PHE  19  -6.754   0.218 -13.816
   64    HE1  PHE  19           HE1      PHE  19  -1.917   1.022 -14.159
   65    HE2  PHE  19           HE2      PHE  19  -5.923   2.238 -14.948
   66    HZ   PHE  19           HZ       PHE  19  -3.502   2.641 -15.120
   67    H    CYS  20           HN       CYS  20  -7.504  -3.507 -11.857
   68    HA   CYS  20           HA       CYS  20  -6.167  -5.448 -10.369
   69    HB2  CYS  20           HB2      CYS  20  -7.290  -3.815  -8.568
   70    HB3  CYS  20           HB1      CYS  20  -8.681  -4.848  -8.883
   71    HN1  NH2  21           H1       CYS  20  -6.646  -6.550 -12.263
   72    HN2  NH2  21           H2       CYS  20  -8.220  -7.177 -12.605
  Start of MODEL   12
    1    H1   GLY  11           HT1      GLY  11  -0.278   1.593  -0.313
    2    H2   GLY  11           HT2      GLY  11   0.717   0.991   0.912
    3    H3   GLY  11           HT3      GLY  11  -0.145  -0.071  -0.080
    4    HA2  GLY  11           HA1      GLY  11   2.045   1.711  -0.951
    5    HA3  GLY  11           HA2      GLY  11   2.159  -0.028  -0.713
    6    H    PHE  12           HN       PHE  12   2.538   1.647  -3.128
    7    HA   PHE  12           HA       PHE  12   0.402   0.543  -4.781
    8    HB2  PHE  12           HB2      PHE  12   2.041   3.019  -5.035
    9    HB3  PHE  12           HB1      PHE  12   1.469   2.237  -6.508
   10    HD1  PHE  12           HD1      PHE  12   0.268   3.498  -3.220
   11    HD2  PHE  12           HD2      PHE  12  -0.665   2.651  -7.285
   12    HE1  PHE  12           HE1      PHE  12  -1.952   4.508  -2.915
   13    HE2  PHE  12           HE2      PHE  12  -2.888   3.658  -6.989
   14    HZ   PHE  12           HZ       PHE  12  -3.534   4.586  -4.798
   15    H    ARG  13           HN       ARG  13   0.855  -0.477  -6.712
   16    HA   ARG  13           HA       ARG  13   3.381  -1.140  -7.579
   17    HB2  ARG  13           HB2      ARG  13   3.627  -3.509  -6.878
   18    HB3  ARG  13           HB1      ARG  13   3.712  -2.424  -5.510
   19    HG2  ARG  13           HG2      ARG  13   1.078  -3.718  -6.153
   20    HG3  ARG  13           HG1      ARG  13   2.351  -4.696  -5.456
   21    HD2  ARG  13           HD2      ARG  13   2.427  -3.442  -3.455
   22    HD3  ARG  13           HD1      ARG  13   1.531  -2.098  -4.114
   23    HE   ARG  13           HE       ARG  13  -0.254  -4.144  -4.230
   24   HH11  ARG  13          HH11      ARG  13   1.780  -2.890  -1.665
   25   HH12  ARG  13          HH12      ARG  13   0.650  -3.276  -0.415
   26   HH21  ARG  13          HH21      ARG  13  -1.737  -4.657  -2.583
   27   HH22  ARG  13          HH22      ARG  13  -1.358  -4.290  -0.936
   28    H    SER  14           HN       SER  14   3.152  -3.291  -9.113
   29    HA   SER  14           HA       SER  14   0.571  -2.884 -10.392
   30    HB2  SER  14           HB2      SER  14   3.103  -4.142 -11.475
   31    HB3  SER  14           HB1      SER  14   1.632  -3.832 -12.393
   32    HG   SER  14           HG       SER  14   2.677  -1.652 -11.041
   33    HA   PRO  15           HA       PRO  15  -0.696  -3.632 -11.601
   34    HB2  PRO  15           HB2      PRO  15  -3.052  -4.848 -11.952
   35    HB3  PRO  15           HB1      PRO  15  -1.601  -5.363 -12.818
   36    HG2  PRO  15           HG2      PRO  15  -3.005  -6.663 -10.556
   37    HG3  PRO  15           HG1      PRO  15  -2.017  -7.385 -11.833
   38    HD2  PRO  15           HD2      PRO  15  -1.224  -6.762  -9.163
   39    HD3  PRO  15           HD1      PRO  15  -0.204  -7.380 -10.475
   40    H    CYS  16           HN       CYS  16  -1.671  -4.906  -8.547
   41    HA   CYS  16           HA       CYS  16  -3.657  -2.730  -8.245
   42    HB2  CYS  16           HB2      CYS  16  -3.679  -4.930  -6.195
   43    HB3  CYS  16           HB1      CYS  16  -4.981  -3.994  -6.880
   44    HA   PRO  17           HA       PRO  17  -4.397  -1.325  -7.293
   45    HB2  PRO  17           HB2      PRO  17  -3.919   1.232  -6.174
   46    HB3  PRO  17           HB1      PRO  17  -5.009  -0.002  -5.542
   47    HG2  PRO  17           HG2      PRO  17  -2.673   0.902  -4.291
   48    HG3  PRO  17           HG1      PRO  17  -3.561  -0.544  -3.884
   49    HD2  PRO  17           HD2      PRO  17  -1.120  -0.238  -5.571
   50    HD3  PRO  17           HD1      PRO  17  -1.551  -1.544  -4.445
   51    HA   PRO  18           HA       PRO  18  -5.536   0.513  -7.766
   52    HB2  PRO  18           HB2      PRO  18  -6.530   2.369  -9.355
   53    HB3  PRO  18           HB1      PRO  18  -5.363   2.817  -8.103
   54    HG2  PRO  18           HG2      PRO  18  -4.984   2.590 -11.041
   55    HG3  PRO  18           HG1      PRO  18  -4.170   3.662  -9.896
   56    HD2  PRO  18           HD2      PRO  18  -3.228   1.143 -10.914
   57    HD3  PRO  18           HD1      PRO  18  -2.442   2.187  -9.712
   58    H    PHE  19           HN       PHE  19  -4.214  -0.692 -10.605
   59    HA   PHE  19           HA       PHE  19  -6.777  -1.161 -11.934
   60    HB2  PHE  19           HB2      PHE  19  -3.995  -1.924 -12.853
   61    HB3  PHE  19           HB1      PHE  19  -5.470  -2.005 -13.809
   62    HD1  PHE  19           HD1      PHE  19  -2.613  -0.126 -13.153
   63    HD2  PHE  19           HD2      PHE  19  -6.767   0.310 -13.967
   64    HE1  PHE  19           HE1      PHE  19  -2.215   2.173 -13.931
   65    HE2  PHE  19           HE2      PHE  19  -6.377   2.610 -14.747
   66    HZ   PHE  19           HZ       PHE  19  -4.098   3.543 -14.730
   67    H    CYS  20           HN       CYS  20  -7.784  -2.695 -10.703
   68    HA   CYS  20           HA       CYS  20  -6.391  -5.271 -10.554
   69    HB2  CYS  20           HB2      CYS  20  -6.624  -3.786  -8.368
   70    HB3  CYS  20           HB1      CYS  20  -8.233  -4.501  -8.343
   71    HN1  NH2  21           H1       CYS  20  -7.529  -6.166 -12.217
   72    HN2  NH2  21           H2       CYS  20  -9.236  -6.429 -12.189
  Start of MODEL   13
    1    H1   GLY  11           HT1      GLY  11   0.287   2.893  -1.479
    2    H2   GLY  11           HT2      GLY  11   1.364   2.576  -0.214
    3    H3   GLY  11           HT3      GLY  11   0.420   1.331  -0.850
    4    HA2  GLY  11           HA1      GLY  11   2.550   2.793  -2.303
    5    HA3  GLY  11           HA2      GLY  11   2.698   1.178  -1.625
    6    H    PHE  12           HN       PHE  12   2.990   2.011  -4.397
    7    HA   PHE  12           HA       PHE  12   0.645   0.796  -5.642
    8    HB2  PHE  12           HB2      PHE  12   2.788   2.628  -6.633
    9    HB3  PHE  12           HB1      PHE  12   1.967   1.578  -7.786
   10    HD1  PHE  12           HD1      PHE  12   1.127   3.885  -4.977
   11    HD2  PHE  12           HD2      PHE  12   0.103   2.400  -8.828
   12    HE1  PHE  12           HE1      PHE  12  -0.781   5.434  -5.063
   13    HE2  PHE  12           HE2      PHE  12  -1.806   3.947  -8.922
   14    HZ   PHE  12           HZ       PHE  12  -2.250   5.463  -7.035
   15    H    ARG  13           HN       ARG  13   0.726  -0.998  -6.902
   16    HA   ARG  13           HA       ARG  13   3.221  -2.378  -7.260
   17    HB2  ARG  13           HB2      ARG  13   1.007  -3.632  -5.555
   18    HB3  ARG  13           HB1      ARG  13   2.312  -4.540  -6.248
   19    HG2  ARG  13           HG2      ARG  13   2.948  -4.311  -4.035
   20    HG3  ARG  13           HG1      ARG  13   3.896  -3.049  -4.790
   21    HD2  ARG  13           HD2      ARG  13   2.310  -1.363  -3.997
   22    HD3  ARG  13           HD1      ARG  13   1.248  -2.616  -3.353
   23    HE   ARG  13           HE       ARG  13   3.958  -2.534  -2.301
   24   HH11  ARG  13          HH11      ARG  13   0.583  -1.625  -1.883
   25   HH12  ARG  13          HH12      ARG  13   0.749  -1.329  -0.188
   26   HH21  ARG  13          HH21      ARG  13   4.168  -2.138  -0.061
   27   HH22  ARG  13          HH22      ARG  13   2.793  -1.623   0.853
   28    H    SER  14           HN       SER  14   2.616  -4.677  -8.408
   29    HA   SER  14           HA       SER  14   0.529  -3.966 -10.326
   30    HB2  SER  14           HB2      SER  14   2.874  -5.845 -10.685
   31    HB3  SER  14           HB1      SER  14   1.728  -5.353 -11.934
   32    HG   SER  14           HG       SER  14   3.247  -3.460 -10.492
   33    HA   PRO  15           HA       PRO  15  -0.890  -4.450 -11.350
   34    HB2  PRO  15           HB2      PRO  15  -3.426  -5.312 -11.764
   35    HB3  PRO  15           HB1      PRO  15  -2.029  -5.987 -12.606
   36    HG2  PRO  15           HG2      PRO  15  -3.722  -7.224 -10.576
   37    HG3  PRO  15           HG1      PRO  15  -2.513  -7.975 -11.624
   38    HD2  PRO  15           HD2      PRO  15  -2.271  -7.138  -8.834
   39    HD3  PRO  15           HD1      PRO  15  -1.174  -8.145  -9.796
   40    H    CYS  16           HN       CYS  16  -1.786  -5.100  -8.233
   41    HA   CYS  16           HA       CYS  16  -3.720  -2.857  -8.183
   42    HB2  CYS  16           HB2      CYS  16  -3.883  -4.867  -5.945
   43    HB3  CYS  16           HB1      CYS  16  -5.127  -3.924  -6.730
   44    HA   PRO  17           HA       PRO  17  -4.416  -1.343  -7.293
   45    HB2  PRO  17           HB2      PRO  17  -4.259   1.138  -6.429
   46    HB3  PRO  17           HB1      PRO  17  -4.529  -0.155  -5.248
   47    HG2  PRO  17           HG2      PRO  17  -1.984   1.209  -6.002
   48    HG3  PRO  17           HG1      PRO  17  -2.622   0.950  -4.382
   49    HD2  PRO  17           HD2      PRO  17  -0.766  -0.693  -5.582
   50    HD3  PRO  17           HD1      PRO  17  -1.903  -1.252  -4.340
   51    HA   PRO  18           HA       PRO  18  -5.461   0.537  -7.795
   52    HB2  PRO  18           HB2      PRO  18  -6.362   2.551  -9.244
   53    HB3  PRO  18           HB1      PRO  18  -5.092   2.831  -8.045
   54    HG2  PRO  18           HG2      PRO  18  -4.914   2.752 -10.989
   55    HG3  PRO  18           HG1      PRO  18  -3.899   3.631  -9.852
   56    HD2  PRO  18           HD2      PRO  18  -3.378   1.057 -11.079
   57    HD3  PRO  18           HD1      PRO  18  -2.343   1.954  -9.947
   58    H    PHE  19           HN       PHE  19  -4.403  -0.674 -10.703
   59    HA   PHE  19           HA       PHE  19  -7.115  -1.026 -11.771
   60    HB2  PHE  19           HB2      PHE  19  -4.465  -1.503 -13.153
   61    HB3  PHE  19           HB1      PHE  19  -6.052  -1.666 -13.890
   62    HD1  PHE  19           HD1      PHE  19  -3.312   0.357 -13.778
   63    HD2  PHE  19           HD2      PHE  19  -7.544   0.599 -13.417
   64    HE1  PHE  19           HE1      PHE  19  -3.228   2.724 -14.427
   65    HE2  PHE  19           HE2      PHE  19  -7.466   2.971 -14.065
   66    HZ   PHE  19           HZ       PHE  19  -5.304   4.036 -14.572
   67    H    CYS  20           HN       CYS  20  -7.470  -2.550 -10.051
   68    HA   CYS  20           HA       CYS  20  -5.981  -5.022 -10.123
   69    HB2  CYS  20           HB2      CYS  20  -7.013  -3.742  -8.065
   70    HB3  CYS  20           HB1      CYS  20  -8.466  -4.631  -8.507
   71    HN1  NH2  21           H1       CYS  20  -6.469  -5.937 -12.087
   72    HN2  NH2  21           H2       CYS  20  -8.045  -6.488 -12.524
  Start of MODEL   14
    1    H1   GLY  11           HT1      GLY  11   0.461   3.275  -1.823
    2    H2   GLY  11           HT2      GLY  11   1.792   3.378  -0.789
    3    H3   GLY  11           HT3      GLY  11   1.147   1.869  -1.187
    4    HA2  GLY  11           HA1      GLY  11   2.516   3.731  -3.032
    5    HA3  GLY  11           HA2      GLY  11   3.158   2.212  -2.420
    6    H    PHE  12           HN       PHE  12   2.658   3.077  -5.168
    7    HA   PHE  12           HA       PHE  12   0.466   1.325  -5.968
    8    HB2  PHE  12           HB2      PHE  12   1.895   3.579  -7.356
    9    HB3  PHE  12           HB1      PHE  12   0.906   2.433  -8.255
   10    HD1  PHE  12           HD1      PHE  12   0.701   4.589  -5.215
   11    HD2  PHE  12           HD2      PHE  12  -1.294   2.930  -8.574
   12    HE1  PHE  12           HE1      PHE  12  -1.337   5.822  -4.607
   13    HE2  PHE  12           HE2      PHE  12  -3.337   4.155  -7.971
   14    HZ   PHE  12           HZ       PHE  12  -3.360   5.600  -5.985
   15    H    ARG  13           HN       ARG  13   0.739  -0.170  -7.674
   16    HA   ARG  13           HA       ARG  13   3.200  -0.895  -8.670
   17    HB2  ARG  13           HB2      ARG  13   3.832  -2.893  -7.436
   18    HB3  ARG  13           HB1      ARG  13   3.808  -1.522  -6.354
   19    HG2  ARG  13           HG2      ARG  13   1.373  -3.274  -6.456
   20    HG3  ARG  13           HG1      ARG  13   2.831  -3.915  -5.718
   21    HD2  ARG  13           HD2      ARG  13   2.877  -1.939  -4.161
   22    HD3  ARG  13           HD1      ARG  13   1.357  -1.395  -4.840
   23    HE   ARG  13           HE       ARG  13   1.178  -4.077  -3.881
   24   HH11  ARG  13          HH11      ARG  13   1.092  -0.710  -2.883
   25   HH12  ARG  13          HH12      ARG  13   0.221  -1.033  -1.426
   26   HH21  ARG  13          HH21      ARG  13   0.015  -4.503  -1.969
   27   HH22  ARG  13          HH22      ARG  13  -0.394  -3.205  -0.900
   28    H    SER  14           HN       SER  14   3.044  -3.423  -9.474
   29    HA   SER  14           HA       SER  14   0.376  -3.525 -10.629
   30    HB2  SER  14           HB2      SER  14   2.878  -5.010 -11.450
   31    HB3  SER  14           HB1      SER  14   1.370  -4.893 -12.358
   32    HG   SER  14           HG       SER  14   2.044  -2.433 -11.897
   33    HA   PRO  15           HA       PRO  15  -0.871  -4.677 -11.503
   34    HB2  PRO  15           HB2      PRO  15  -3.128  -6.093 -11.363
   35    HB3  PRO  15           HB1      PRO  15  -1.672  -6.748 -12.122
   36    HG2  PRO  15           HG2      PRO  15  -2.901  -7.407  -9.506
   37    HG3  PRO  15           HG1      PRO  15  -1.909  -8.415 -10.569
   38    HD2  PRO  15           HD2      PRO  15  -1.066  -6.996  -8.244
   39    HD3  PRO  15           HD1      PRO  15  -0.050  -7.897  -9.385
   40    H    CYS  16           HN       CYS  16  -1.464  -4.935  -8.169
   41    HA   CYS  16           HA       CYS  16  -3.499  -2.803  -8.327
   42    HB2  CYS  16           HB2      CYS  16  -3.848  -4.782  -6.086
   43    HB3  CYS  16           HB1      CYS  16  -5.026  -3.833  -6.959
   44    HA   PRO  17           HA       PRO  17  -4.409  -1.398  -7.304
   45    HB2  PRO  17           HB2      PRO  17  -4.422   1.055  -6.305
   46    HB3  PRO  17           HB1      PRO  17  -4.725  -0.320  -5.230
   47    HG2  PRO  17           HG2      PRO  17  -2.198   1.219  -5.654
   48    HG3  PRO  17           HG1      PRO  17  -2.939   0.756  -4.130
   49    HD2  PRO  17           HD2      PRO  17  -0.893  -0.626  -5.368
   50    HD3  PRO  17           HD1      PRO  17  -2.041  -1.369  -4.236
   51    HA   PRO  18           HA       PRO  18  -5.574   0.430  -7.795
   52    HB2  PRO  18           HB2      PRO  18  -6.543   2.400  -9.248
   53    HB3  PRO  18           HB1      PRO  18  -5.334   2.749  -8.004
   54    HG2  PRO  18           HG2      PRO  18  -5.046   2.710 -10.952
   55    HG3  PRO  18           HG1      PRO  18  -4.134   3.644  -9.763
   56    HD2  PRO  18           HD2      PRO  18  -3.413   1.115 -10.982
   57    HD3  PRO  18           HD1      PRO  18  -2.470   2.075  -9.826
   58    H    PHE  19           HN       PHE  19  -4.314  -0.731 -10.639
   59    HA   PHE  19           HA       PHE  19  -6.899  -1.054 -11.976
   60    HB2  PHE  19           HB2      PHE  19  -4.137  -1.747 -12.992
   61    HB3  PHE  19           HB1      PHE  19  -5.629  -1.810 -13.922
   62    HD1  PHE  19           HD1      PHE  19  -2.799   0.086 -13.223
   63    HD2  PHE  19           HD2      PHE  19  -6.972   0.479 -13.934
   64    HE1  PHE  19           HE1      PHE  19  -2.462   2.430 -13.881
   65    HE2  PHE  19           HE2      PHE  19  -6.641   2.822 -14.595
   66    HZ   PHE  19           HZ       PHE  19  -4.387   3.800 -14.569
   67    H    CYS  20           HN       CYS  20  -7.525  -2.508 -10.227
   68    HA   CYS  20           HA       CYS  20  -6.223  -5.122 -10.369
   69    HB2  CYS  20           HB2      CYS  20  -6.727  -3.729  -8.188
   70    HB3  CYS  20           HB1      CYS  20  -8.311  -4.483  -8.345
   71    HN1  NH2  21           H1       CYS  20  -7.119  -6.154 -12.051
   72    HN2  NH2  21           H2       CYS  20  -8.812  -6.437 -12.258
  Start of MODEL   15
    1    H1   GLY  11           HT1      GLY  11   0.583   0.578  -0.247
    2    H2   GLY  11           HT2      GLY  11   1.981   1.097   0.550
    3    H3   GLY  11           HT3      GLY  11   2.059  -0.189  -0.548
    4    HA2  GLY  11           HA1      GLY  11   1.427   2.625  -1.197
    5    HA3  GLY  11           HA2      GLY  11   2.945   1.803  -1.540
    6    H    PHE  12           HN       PHE  12   2.321   2.579  -3.758
    7    HA   PHE  12           HA       PHE  12   0.286   0.891  -4.982
    8    HB2  PHE  12           HB2      PHE  12   1.494   3.507  -5.731
    9    HB3  PHE  12           HB1      PHE  12   0.885   2.469  -7.015
   10    HD1  PHE  12           HD1      PHE  12  -0.159   3.855  -3.716
   11    HD2  PHE  12           HD2      PHE  12  -1.316   2.653  -7.627
   12    HE1  PHE  12           HE1      PHE  12  -2.449   4.634  -3.276
   13    HE2  PHE  12           HE2      PHE  12  -3.608   3.427  -7.194
   14    HZ   PHE  12           HZ       PHE  12  -4.178   4.416  -5.014
   15    H    ARG  13           HN       ARG  13   0.679  -0.200  -6.928
   16    HA   ARG  13           HA       ARG  13   3.167  -0.564  -8.015
   17    HB2  ARG  13           HB2      ARG  13   3.889  -2.762  -7.217
   18    HB3  ARG  13           HB1      ARG  13   3.827  -1.633  -5.889
   19    HG2  ARG  13           HG2      ARG  13   1.470  -3.444  -6.325
   20    HG3  ARG  13           HG1      ARG  13   2.959  -4.127  -5.703
   21    HD2  ARG  13           HD2      ARG  13   2.903  -2.473  -3.818
   22    HD3  ARG  13           HD1      ARG  13   1.355  -1.891  -4.396
   23    HE   ARG  13           HE       ARG  13   1.684  -4.717  -3.647
   24   HH11  ARG  13          HH11      ARG  13   0.111  -1.604  -3.152
   25   HH12  ARG  13          HH12      ARG  13  -1.095  -2.262  -2.104
   26   HH21  ARG  13          HH21      ARG  13   0.104  -5.549  -2.235
   27   HH22  ARG  13          HH22      ARG  13  -1.097  -4.496  -1.573
   28    H    SER  14           HN       SER  14   3.105  -2.836  -9.391
   29    HA   SER  14           HA       SER  14   0.422  -2.740 -10.505
   30    HB2  SER  14           HB2      SER  14   1.572  -3.871 -12.482
   31    HB3  SER  14           HB1      SER  14   2.041  -2.207 -12.142
   32    HG   SER  14           HG       SER  14   3.930  -2.903 -11.275
   33    HA   PRO  15           HA       PRO  15  -0.794  -3.617 -11.667
   34    HB2  PRO  15           HB2      PRO  15  -3.047  -5.018 -11.906
   35    HB3  PRO  15           HB1      PRO  15  -1.583  -5.471 -12.785
   36    HG2  PRO  15           HG2      PRO  15  -2.824  -6.742 -10.406
   37    HG3  PRO  15           HG1      PRO  15  -1.868  -7.473 -11.702
   38    HD2  PRO  15           HD2      PRO  15  -0.962  -6.708  -9.116
   39    HD3  PRO  15           HD1      PRO  15   0.029  -7.278 -10.472
   40    H    CYS  16           HN       CYS  16  -1.504  -4.827  -8.532
   41    HA   CYS  16           HA       CYS  16  -3.662  -2.825  -8.221
   42    HB2  CYS  16           HB2      CYS  16  -3.533  -5.063  -6.205
   43    HB3  CYS  16           HB1      CYS  16  -4.895  -4.190  -6.857
   44    HA   PRO  17           HA       PRO  17  -4.406  -1.395  -7.345
   45    HB2  PRO  17           HB2      PRO  17  -4.078   1.156  -6.191
   46    HB3  PRO  17           HB1      PRO  17  -5.101  -0.139  -5.575
   47    HG2  PRO  17           HG2      PRO  17  -2.812   0.889  -4.311
   48    HG3  PRO  17           HG1      PRO  17  -3.647  -0.591  -3.900
   49    HD2  PRO  17           HD2      PRO  17  -1.203  -0.198  -5.564
   50    HD3  PRO  17           HD1      PRO  17  -1.598  -1.516  -4.439
   51    HA   PRO  18           HA       PRO  18  -5.595   0.452  -7.784
   52    HB2  PRO  18           HB2      PRO  18  -6.597   2.330  -9.326
   53    HB3  PRO  18           HB1      PRO  18  -5.440   2.767  -8.063
   54    HG2  PRO  18           HG2      PRO  18  -5.043   2.592 -11.007
   55    HG3  PRO  18           HG1      PRO  18  -4.263   3.670  -9.844
   56    HD2  PRO  18           HD2      PRO  18  -3.257   1.192 -10.888
   57    HD3  PRO  18           HD1      PRO  18  -2.508   2.228  -9.655
   58    H    PHE  19           HN       PHE  19  -4.221  -0.709 -10.589
   59    HA   PHE  19           HA       PHE  19  -6.743  -1.138 -12.001
   60    HB2  PHE  19           HB2      PHE  19  -3.934  -1.874 -12.854
   61    HB3  PHE  19           HB1      PHE  19  -5.380  -1.958 -13.851
   62    HD1  PHE  19           HD1      PHE  19  -2.559  -0.064 -13.113
   63    HD2  PHE  19           HD2      PHE  19  -6.697   0.361 -14.003
   64    HE1  PHE  19           HE1      PHE  19  -2.157   2.244 -13.860
   65    HE2  PHE  19           HE2      PHE  19  -6.305   2.671 -14.752
   66    HZ   PHE  19           HZ       PHE  19  -4.030   3.614 -14.680
   67    H    CYS  20           HN       CYS  20  -7.660  -2.621 -10.522
   68    HA   CYS  20           HA       CYS  20  -6.432  -5.279 -10.677
   69    HB2  CYS  20           HB2      CYS  20  -6.310  -3.915  -8.418
   70    HB3  CYS  20           HB1      CYS  20  -7.957  -4.508  -8.237
   71    HN1  NH2  21           H1       CYS  20  -7.823  -5.905 -12.295
   72    HN2  NH2  21           H2       CYS  20  -9.518  -6.124 -12.053
  Start of MODEL   16
    1    H1   GLY  11           HT1      GLY  11  -0.337   2.625  -0.618
    2    H2   GLY  11           HT2      GLY  11   0.937   2.536   0.490
    3    H3   GLY  11           HT3      GLY  11   0.392   1.139  -0.292
    4    HA2  GLY  11           HA1      GLY  11   1.684   3.456  -1.604
    5    HA3  GLY  11           HA2      GLY  11   2.459   1.917  -1.261
    6    H    PHE  12           HN       PHE  12   2.723   2.322  -3.719
    7    HA   PHE  12           HA       PHE  12   0.447   1.087  -5.096
    8    HB2  PHE  12           HB2      PHE  12   2.223   3.342  -5.924
    9    HB3  PHE  12           HB1      PHE  12   1.584   2.270  -7.165
   10    HD1  PHE  12           HD1      PHE  12   0.331   4.064  -4.135
   11    HD2  PHE  12           HD2      PHE  12  -0.347   2.944  -8.187
   12    HE1  PHE  12           HE1      PHE  12  -1.806   5.270  -4.106
   13    HE2  PHE  12           HE2      PHE  12  -2.489   4.151  -8.161
   14    HZ   PHE  12           HZ       PHE  12  -3.220   5.314  -6.117
   15    H    ARG  13           HN       ARG  13   0.965  -0.189  -6.957
   16    HA   ARG  13           HA       ARG  13   3.488  -1.055  -7.575
   17    HB2  ARG  13           HB2      ARG  13   3.621  -3.337  -6.645
   18    HB3  ARG  13           HB1      ARG  13   3.632  -2.139  -5.373
   19    HG2  ARG  13           HG2      ARG  13   1.018  -3.432  -6.075
   20    HG3  ARG  13           HG1      ARG  13   2.233  -4.392  -5.249
   21    HD2  ARG  13           HD2      ARG  13   2.303  -2.780  -3.392
   22    HD3  ARG  13           HD1      ARG  13   1.144  -1.748  -4.199
   23    HE   ARG  13           HE       ARG  13   0.191  -4.432  -3.745
   24   HH11  ARG  13          HH11      ARG  13   0.521  -1.227  -2.353
   25   HH12  ARG  13          HH12      ARG  13  -0.828  -1.413  -1.293
   26   HH21  ARG  13          HH21      ARG  13  -1.589  -4.676  -2.343
   27   HH22  ARG  13          HH22      ARG  13  -2.027  -3.386  -1.278
   28    H    SER  14           HN       SER  14   3.255  -3.353  -8.896
   29    HA   SER  14           HA       SER  14   0.808  -2.919 -10.411
   30    HB2  SER  14           HB2      SER  14   2.030  -4.138 -12.247
   31    HB3  SER  14           HB1      SER  14   2.772  -2.615 -11.759
   32    HG   SER  14           HG       SER  14   4.318  -3.751 -10.611
   33    HA   PRO  15           HA       PRO  15  -0.482  -3.599 -11.548
   34    HB2  PRO  15           HB2      PRO  15  -2.828  -4.770 -12.039
   35    HB3  PRO  15           HB1      PRO  15  -1.343  -5.322 -12.821
   36    HG2  PRO  15           HG2      PRO  15  -2.899  -6.576 -10.630
   37    HG3  PRO  15           HG1      PRO  15  -1.881  -7.335 -11.863
   38    HD2  PRO  15           HD2      PRO  15  -1.180  -6.736  -9.163
   39    HD3  PRO  15           HD1      PRO  15  -0.120  -7.372 -10.434
   40    H    CYS  16           HN       CYS  16  -1.555  -4.888  -8.553
   41    HA   CYS  16           HA       CYS  16  -3.597  -2.760  -8.289
   42    HB2  CYS  16           HB2      CYS  16  -3.594  -4.961  -6.235
   43    HB3  CYS  16           HB1      CYS  16  -4.907  -4.071  -6.957
   44    HA   PRO  17           HA       PRO  17  -4.415  -1.404  -7.327
   45    HB2  PRO  17           HB2      PRO  17  -4.525   0.994  -6.212
   46    HB3  PRO  17           HB1      PRO  17  -4.811  -0.441  -5.217
   47    HG2  PRO  17           HG2      PRO  17  -2.360   1.231  -5.466
   48    HG3  PRO  17           HG1      PRO  17  -3.093   0.583  -4.006
   49    HD2  PRO  17           HD2      PRO  17  -0.953  -0.562  -5.375
   50    HD3  PRO  17           HD1      PRO  17  -2.011  -1.432  -4.248
   51    HA   PRO  18           HA       PRO  18  -5.631   0.422  -7.776
   52    HB2  PRO  18           HB2      PRO  18  -6.674   2.244  -9.367
   53    HB3  PRO  18           HB1      PRO  18  -5.551   2.735  -8.090
   54    HG2  PRO  18           HG2      PRO  18  -5.098   2.529 -11.024
   55    HG3  PRO  18           HG1      PRO  18  -4.383   3.654  -9.864
   56    HD2  PRO  18           HD2      PRO  18  -3.251   1.216 -10.852
   57    HD3  PRO  18           HD1      PRO  18  -2.582   2.284  -9.601
   58    H    PHE  19           HN       PHE  19  -4.182  -0.643 -10.600
   59    HA   PHE  19           HA       PHE  19  -6.643  -1.190 -12.041
   60    HB2  PHE  19           HB2      PHE  19  -3.811  -1.985 -12.747
   61    HB3  PHE  19           HB1      PHE  19  -5.214  -2.055 -13.807
   62    HD1  PHE  19           HD1      PHE  19  -2.393  -0.199 -12.964
   63    HD2  PHE  19           HD2      PHE  19  -6.479   0.278 -14.055
   64    HE1  PHE  19           HE1      PHE  19  -1.923   2.095 -13.710
   65    HE2  PHE  19           HE2      PHE  19  -6.014   2.574 -14.806
   66    HZ   PHE  19           HZ       PHE  19  -3.733   3.484 -14.633
   67    H    CYS  20           HN       CYS  20  -7.732  -2.661 -10.796
   68    HA   CYS  20           HA       CYS  20  -6.549  -5.320 -10.723
   69    HB2  CYS  20           HB2      CYS  20  -6.282  -3.848  -8.531
   70    HB3  CYS  20           HB1      CYS  20  -7.934  -4.391  -8.258
   71    HN1  NH2  21           H1       CYS  20  -8.081  -5.839 -12.302
   72    HN2  NH2  21           H2       CYS  20  -9.763  -5.995 -11.942
  Start of MODEL   17
    1    H1   GLY  11           HT1      GLY  11   2.108   4.424  -2.365
    2    H2   GLY  11           HT2      GLY  11   3.181   4.022  -1.119
    3    H3   GLY  11           HT3      GLY  11   1.820   3.067  -1.407
    4    HA2  GLY  11           HA1      GLY  11   4.070   3.425  -3.285
    5    HA3  GLY  11           HA2      GLY  11   3.833   2.030  -2.242
    6    H    PHE  12           HN       PHE  12   3.979   2.053  -5.110
    7    HA   PHE  12           HA       PHE  12   1.289   1.053  -5.705
    8    HB2  PHE  12           HB2      PHE  12   3.011   2.894  -7.311
    9    HB3  PHE  12           HB1      PHE  12   1.984   1.741  -8.155
   10    HD1  PHE  12           HD1      PHE  12   1.734   4.185  -5.344
   11    HD2  PHE  12           HD2      PHE  12  -0.098   2.453  -8.765
   12    HE1  PHE  12           HE1      PHE  12  -0.198   5.671  -5.055
   13    HE2  PHE  12           HE2      PHE  12  -2.036   3.936  -8.482
   14    HZ   PHE  12           HZ       PHE  12  -2.087   5.547  -6.622
   15    H    ARG  13           HN       ARG  13   1.234  -0.541  -7.453
   16    HA   ARG  13           HA       ARG  13   3.498  -1.842  -8.312
   17    HB2  ARG  13           HB2      ARG  13   3.470  -3.978  -7.018
   18    HB3  ARG  13           HB1      ARG  13   3.950  -2.607  -6.046
   19    HG2  ARG  13           HG2      ARG  13   1.072  -3.477  -5.945
   20    HG3  ARG  13           HG1      ARG  13   2.286  -4.490  -5.188
   21    HD2  ARG  13           HD2      ARG  13   2.981  -2.722  -3.704
   22    HD3  ARG  13           HD1      ARG  13   1.996  -1.532  -4.530
   23    HE   ARG  13           HE       ARG  13   0.662  -3.817  -3.265
   24   HH11  ARG  13          HH11      ARG  13   1.422  -0.387  -3.212
   25   HH12  ARG  13          HH12      ARG  13   0.171   0.000  -2.086
   26   HH21  ARG  13          HH21      ARG  13  -0.995  -3.298  -1.774
   27   HH22  ARG  13          HH22      ARG  13  -1.198  -1.661  -1.255
   28    H    SER  14           HN       SER  14   2.843  -4.235  -9.179
   29    HA   SER  14           HA       SER  14   0.205  -3.815 -10.354
   30    HB2  SER  14           HB2      SER  14   2.471  -5.604 -11.267
   31    HB3  SER  14           HB1      SER  14   0.968  -5.307 -12.137
   32    HG   SER  14           HG       SER  14   2.778  -3.247 -11.415
   33    HA   PRO  15           HA       PRO  15  -1.123  -4.797 -11.413
   34    HB2  PRO  15           HB2      PRO  15  -3.508  -5.991 -11.565
   35    HB3  PRO  15           HB1      PRO  15  -2.050  -6.770 -12.192
   36    HG2  PRO  15           HG2      PRO  15  -3.608  -7.380  -9.745
   37    HG3  PRO  15           HG1      PRO  15  -2.605  -8.450 -10.737
   38    HD2  PRO  15           HD2      PRO  15  -1.892  -7.155  -8.285
   39    HD3  PRO  15           HD1      PRO  15  -0.856  -8.158  -9.318
   40    H    CYS  16           HN       CYS  16  -1.840  -4.984  -8.167
   41    HA   CYS  16           HA       CYS  16  -3.782  -2.755  -8.315
   42    HB2  CYS  16           HB2      CYS  16  -4.202  -4.717  -6.063
   43    HB3  CYS  16           HB1      CYS  16  -5.352  -3.743  -6.949
   44    HA   PRO  17           HA       PRO  17  -4.432  -1.077  -7.350
   45    HB2  PRO  17           HB2      PRO  17  -3.896   1.408  -6.539
   46    HB3  PRO  17           HB1      PRO  17  -4.473   0.208  -5.373
   47    HG2  PRO  17           HG2      PRO  17  -1.671   1.115  -5.923
   48    HG3  PRO  17           HG1      PRO  17  -2.483   0.967  -4.366
   49    HD2  PRO  17           HD2      PRO  17  -0.813  -0.930  -5.408
   50    HD3  PRO  17           HD1      PRO  17  -2.141  -1.312  -4.294
   51    HA   PRO  18           HA       PRO  18  -5.128   1.234  -7.873
   52    HB2  PRO  18           HB2      PRO  18  -5.895   2.883  -9.785
   53    HB3  PRO  18           HB1      PRO  18  -4.539   3.324  -8.739
   54    HG2  PRO  18           HG2      PRO  18  -4.518   2.282 -11.531
   55    HG3  PRO  18           HG1      PRO  18  -3.490   3.523 -10.810
   56    HD2  PRO  18           HD2      PRO  18  -2.800   0.825 -11.154
   57    HD3  PRO  18           HD1      PRO  18  -1.974   1.971 -10.081
   58    H    PHE  19           HN       PHE  19  -4.386  -0.448 -10.756
   59    HA   PHE  19           HA       PHE  19  -7.154  -0.973 -11.464
   60    HB2  PHE  19           HB2      PHE  19  -4.645  -2.289 -12.545
   61    HB3  PHE  19           HB1      PHE  19  -6.247  -2.313 -13.269
   62    HD1  PHE  19           HD1      PHE  19  -3.103  -0.921 -13.512
   63    HD2  PHE  19           HD2      PHE  19  -7.210   0.179 -13.675
   64    HE1  PHE  19           HE1      PHE  19  -2.512   1.069 -14.826
   65    HE2  PHE  19           HE2      PHE  19  -6.627   2.175 -14.991
   66    HZ   PHE  19           HZ       PHE  19  -4.275   2.620 -15.568
   67    H    CYS  20           HN       CYS  20  -7.480  -3.543 -11.877
   68    HA   CYS  20           HA       CYS  20  -6.075  -5.336 -10.257
   69    HB2  CYS  20           HB2      CYS  20  -7.475  -3.796  -8.589
   70    HB3  CYS  20           HB1      CYS  20  -8.754  -4.934  -9.009
   71    HN1  NH2  21           H1       CYS  20  -6.270  -6.527 -12.135
   72    HN2  NH2  21           H2       CYS  20  -7.744  -7.290 -12.612
  Start of MODEL   18
    1    H1   GLY  11           HT1      GLY  11   1.832   3.720  -2.352
    2    H2   GLY  11           HT2      GLY  11   1.985   3.191  -0.752
    3    H3   GLY  11           HT3      GLY  11   0.507   3.035  -1.556
    4    HA2  GLY  11           HA1      GLY  11   3.010   1.634  -2.265
    5    HA3  GLY  11           HA2      GLY  11   1.645   0.917  -1.424
    6    H    PHE  12           HN       PHE  12   2.932   1.929  -4.437
    7    HA   PHE  12           HA       PHE  12   0.537   0.912  -5.795
    8    HB2  PHE  12           HB2      PHE  12   2.335   3.200  -6.426
    9    HB3  PHE  12           HB1      PHE  12   1.657   2.291  -7.771
   10    HD1  PHE  12           HD1      PHE  12   0.599   3.908  -4.587
   11    HD2  PHE  12           HD2      PHE  12  -0.387   2.908  -8.601
   12    HE1  PHE  12           HE1      PHE  12  -1.517   5.141  -4.370
   13    HE2  PHE  12           HE2      PHE  12  -2.504   4.139  -8.391
   14    HZ   PHE  12           HZ       PHE  12  -3.071   5.256  -6.273
   15    H    ARG  13           HN       ARG  13   0.769  -0.516  -7.451
   16    HA   ARG  13           HA       ARG  13   3.170  -1.319  -8.542
   17    HB2  ARG  13           HB2      ARG  13   3.652  -3.476  -7.520
   18    HB3  ARG  13           HB1      ARG  13   3.709  -2.236  -6.288
   19    HG2  ARG  13           HG2      ARG  13   1.142  -3.724  -6.603
   20    HG3  ARG  13           HG1      ARG  13   2.517  -4.616  -5.980
   21    HD2  ARG  13           HD2      ARG  13   2.766  -3.127  -4.106
   22    HD3  ARG  13           HD1      ARG  13   1.577  -2.002  -4.734
   23    HE   ARG  13           HE       ARG  13   0.162  -4.295  -4.475
   24   HH11  ARG  13          HH11      ARG  13   2.245  -2.522  -2.275
   25   HH12  ARG  13          HH12      ARG  13   1.374  -3.017  -0.867
   26   HH21  ARG  13          HH21      ARG  13  -0.978  -4.942  -2.624
   27   HH22  ARG  13          HH22      ARG  13  -0.469  -4.402  -1.059
   28    H    SER  14           HN       SER  14   2.804  -3.720  -9.623
   29    HA   SER  14           HA       SER  14   0.124  -3.492 -10.725
   30    HB2  SER  14           HB2      SER  14   2.513  -4.987 -11.819
   31    HB3  SER  14           HB1      SER  14   0.997  -4.659 -12.661
   32    HG   SER  14           HG       SER  14   1.498  -2.398 -12.404
   33    HA   PRO  15           HA       PRO  15  -1.274  -4.340 -11.605
   34    HB2  PRO  15           HB2      PRO  15  -3.557  -5.669 -11.761
   35    HB3  PRO  15           HB1      PRO  15  -2.107  -6.288 -12.563
   36    HG2  PRO  15           HG2      PRO  15  -3.435  -7.228 -10.072
   37    HG3  PRO  15           HG1      PRO  15  -2.530  -8.151 -11.281
   38    HD2  PRO  15           HD2      PRO  15  -1.563  -7.151  -8.788
   39    HD3  PRO  15           HD1      PRO  15  -0.621  -7.947 -10.064
   40    H    CYS  16           HN       CYS  16  -1.478  -4.847  -8.366
   41    HA   CYS  16           HA       CYS  16  -3.754  -2.997  -8.104
   42    HB2  CYS  16           HB2      CYS  16  -3.493  -5.099  -5.950
   43    HB3  CYS  16           HB1      CYS  16  -4.887  -4.203  -6.497
   44    HA   PRO  17           HA       PRO  17  -4.424  -1.498  -7.356
   45    HB2  PRO  17           HB2      PRO  17  -4.543   0.914  -6.310
   46    HB3  PRO  17           HB1      PRO  17  -4.742  -0.487  -5.244
   47    HG2  PRO  17           HG2      PRO  17  -2.354   1.249  -5.669
   48    HG3  PRO  17           HG1      PRO  17  -2.992   0.617  -4.153
   49    HD2  PRO  17           HD2      PRO  17  -0.899  -0.506  -5.652
   50    HD3  PRO  17           HD1      PRO  17  -1.813  -1.338  -4.380
   51    HA   PRO  18           HA       PRO  18  -5.656   0.340  -7.820
   52    HB2  PRO  18           HB2      PRO  18  -6.654   2.310  -9.275
   53    HB3  PRO  18           HB1      PRO  18  -5.507   2.663  -7.975
   54    HG2  PRO  18           HG2      PRO  18  -5.102   2.746 -10.908
   55    HG3  PRO  18           HG1      PRO  18  -4.251   3.634  -9.641
   56    HD2  PRO  18           HD2      PRO  18  -3.456   1.175 -10.956
   57    HD3  PRO  18           HD1      PRO  18  -2.559   2.109  -9.741
   58    H    PHE  19           HN       PHE  19  -4.347  -0.630 -10.742
   59    HA   PHE  19           HA       PHE  19  -6.871  -0.951 -12.169
   60    HB2  PHE  19           HB2      PHE  19  -4.088  -1.802 -13.007
   61    HB3  PHE  19           HB1      PHE  19  -5.510  -1.696 -14.037
   62    HD1  PHE  19           HD1      PHE  19  -2.588  -0.068 -13.015
   63    HD2  PHE  19           HD2      PHE  19  -6.623   0.698 -14.122
   64    HE1  PHE  19           HE1      PHE  19  -1.989   2.251 -13.565
   65    HE2  PHE  19           HE2      PHE  19  -6.029   3.024 -14.676
   66    HZ   PHE  19           HZ       PHE  19  -3.711   3.801 -14.397
   67    H    CYS  20           HN       CYS  20  -7.050  -2.358  -9.928
   68    HA   CYS  20           HA       CYS  20  -6.026  -5.039 -10.269
   69    HB2  CYS  20           HB2      CYS  20  -6.297  -3.735  -8.049
   70    HB3  CYS  20           HB1      CYS  20  -7.989  -4.209  -8.155
   71    HN1  NH2  21           H1       CYS  20  -7.094  -5.665 -12.165
   72    HN2  NH2  21           H2       CYS  20  -8.768  -6.093 -12.167
  Start of MODEL   19
    1    H1   GLY  11           HT1      GLY  11   0.662   4.284  -2.664
    2    H2   GLY  11           HT2      GLY  11   1.215   3.870  -1.123
    3    H3   GLY  11           HT3      GLY  11  -0.147   3.101  -1.769
    4    HA2  GLY  11           HA1      GLY  11   2.608   2.885  -2.827
    5    HA3  GLY  11           HA2      GLY  11   1.784   1.663  -1.870
    6    H    PHE  12           HN       PHE  12   2.085   3.154  -4.963
    7    HA   PHE  12           HA       PHE  12  -0.029   1.465  -6.081
    8    HB2  PHE  12           HB2      PHE  12   1.406   3.911  -7.102
    9    HB3  PHE  12           HB1      PHE  12   0.486   2.874  -8.189
   10    HD1  PHE  12           HD1      PHE  12   0.024   4.483  -4.844
   11    HD2  PHE  12           HD2      PHE  12  -1.661   3.536  -8.631
   12    HE1  PHE  12           HE1      PHE  12  -2.054   5.619  -4.197
   13    HE2  PHE  12           HE2      PHE  12  -3.745   4.671  -7.988
   14    HZ   PHE  12           HZ       PHE  12  -3.941   5.711  -5.767
   15    H    ARG  13           HN       ARG  13   0.363  -0.098  -7.587
   16    HA   ARG  13           HA       ARG  13   2.831  -0.557  -8.769
   17    HB2  ARG  13           HB2      ARG  13   3.839  -2.341  -7.520
   18    HB3  ARG  13           HB1      ARG  13   3.567  -1.022  -6.405
   19    HG2  ARG  13           HG2      ARG  13   1.460  -3.135  -6.523
   20    HG3  ARG  13           HG1      ARG  13   3.022  -3.605  -5.877
   21    HD2  ARG  13           HD2      ARG  13   2.884  -1.824  -4.175
   22    HD3  ARG  13           HD1      ARG  13   1.336  -1.300  -4.810
   23    HE   ARG  13           HE       ARG  13   1.391  -4.068  -4.012
   24   HH11  ARG  13          HH11      ARG  13   0.813  -0.768  -2.965
   25   HH12  ARG  13          HH12      ARG  13  -0.129  -1.242  -1.596
   26   HH21  ARG  13          HH21      ARG  13   0.135  -4.688  -2.202
   27   HH22  ARG  13          HH22      ARG  13  -0.517  -3.468  -1.163
   28    H    SER  14           HN       SER  14   2.939  -3.118  -9.485
   29    HA   SER  14           HA       SER  14   0.230  -3.623 -10.412
   30    HB2  SER  14           HB2      SER  14   1.493  -5.184 -12.023
   31    HB3  SER  14           HB1      SER  14   1.703  -3.448 -12.247
   32    HG   SER  14           HG       SER  14   3.719  -3.568 -11.488
   33    HA   PRO  15           HA       PRO  15  -0.813  -5.183 -11.336
   34    HB2  PRO  15           HB2      PRO  15  -2.955  -6.690 -10.812
   35    HB3  PRO  15           HB1      PRO  15  -1.493  -7.386 -11.524
   36    HG2  PRO  15           HG2      PRO  15  -2.482  -7.515  -8.713
   37    HG3  PRO  15           HG1      PRO  15  -1.655  -8.755  -9.669
   38    HD2  PRO  15           HD2      PRO  15  -0.452  -7.101  -7.772
   39    HD3  PRO  15           HD1      PRO  15   0.402  -8.006  -9.034
   40    H    CYS  16           HN       CYS  16  -1.274  -4.907  -7.949
   41    HA   CYS  16           HA       CYS  16  -3.308  -2.832  -8.364
   42    HB2  CYS  16           HB2      CYS  16  -3.871  -4.680  -6.054
   43    HB3  CYS  16           HB1      CYS  16  -4.961  -3.728  -7.034
   44    HA   PRO  17           HA       PRO  17  -4.394  -1.461  -7.315
   45    HB2  PRO  17           HB2      PRO  17  -4.520   0.996  -6.334
   46    HB3  PRO  17           HB1      PRO  17  -4.775  -0.379  -5.246
   47    HG2  PRO  17           HG2      PRO  17  -2.301   1.235  -5.699
   48    HG3  PRO  17           HG1      PRO  17  -3.051   0.811  -4.160
   49    HD2  PRO  17           HD2      PRO  17  -0.953  -0.564  -5.287
   50    HD3  PRO  17           HD1      PRO  17  -2.131  -1.314  -4.190
   51    HA   PRO  18           HA       PRO  18  -5.585   0.445  -7.793
   52    HB2  PRO  18           HB2      PRO  18  -6.583   2.274  -9.440
   53    HB3  PRO  18           HB1      PRO  18  -5.487   2.734  -8.131
   54    HG2  PRO  18           HG2      PRO  18  -4.995   2.632 -11.040
   55    HG3  PRO  18           HG1      PRO  18  -4.177   3.597  -9.809
   56    HD2  PRO  18           HD2      PRO  18  -3.335   1.079 -10.964
   57    HD3  PRO  18           HD1      PRO  18  -2.480   2.077  -9.773
   58    H    PHE  19           HN       PHE  19  -4.386  -0.374 -10.938
   59    HA   PHE  19           HA       PHE  19  -6.966  -1.034 -12.059
   60    HB2  PHE  19           HB2      PHE  19  -4.268  -1.851 -13.140
   61    HB3  PHE  19           HB1      PHE  19  -5.781  -1.709 -14.024
   62    HD1  PHE  19           HD1      PHE  19  -2.737  -0.151 -13.209
   63    HD2  PHE  19           HD2      PHE  19  -6.807   0.697 -14.113
   64    HE1  PHE  19           HE1      PHE  19  -2.111   2.139 -13.840
   65    HE2  PHE  19           HE2      PHE  19  -6.184   2.996 -14.747
   66    HZ   PHE  19           HZ       PHE  19  -3.834   3.716 -14.611
   67    H    CYS  20           HN       CYS  20  -7.707  -2.515 -10.478
   68    HA   CYS  20           HA       CYS  20  -6.271  -5.080 -10.467
   69    HB2  CYS  20           HB2      CYS  20  -6.538  -3.648  -8.307
   70    HB3  CYS  20           HB1      CYS  20  -8.182  -4.274  -8.308
   71    HN1  NH2  21           H1       CYS  20  -7.357  -5.904 -12.236
   72    HN2  NH2  21           H2       CYS  20  -9.030  -6.328 -12.198
  Start of MODEL   20
    1    H1   GLY  11           HT1      GLY  11   1.171   3.364  -1.740
    2    H2   GLY  11           HT2      GLY  11   2.264   3.111  -0.477
    3    H3   GLY  11           HT3      GLY  11   1.057   1.972  -0.794
    4    HA2  GLY  11           HA1      GLY  11   3.326   2.635  -2.569
    5    HA3  GLY  11           HA2      GLY  11   3.161   1.176  -1.607
    6    H    PHE  12           HN       PHE  12   3.035   2.164  -4.630
    7    HA   PHE  12           HA       PHE  12   0.633   0.673  -5.389
    8    HB2  PHE  12           HB2      PHE  12   2.339   2.712  -6.768
    9    HB3  PHE  12           HB1      PHE  12   1.359   1.610  -7.728
   10    HD1  PHE  12           HD1      PHE  12   0.793   3.525  -4.559
   11    HD2  PHE  12           HD2      PHE  12  -0.531   2.627  -8.508
   12    HE1  PHE  12           HE1      PHE  12  -1.182   4.937  -4.215
   13    HE2  PHE  12           HE2      PHE  12  -2.510   4.043  -8.162
   14    HZ   PHE  12           HZ       PHE  12  -2.836   5.194  -6.012
   15    H    ARG  13           HN       ARG  13   0.644  -1.046  -6.753
   16    HA   ARG  13           HA       ARG  13   3.208  -2.130  -7.572
   17    HB2  ARG  13           HB2      ARG  13   1.258  -3.669  -5.766
   18    HB3  ARG  13           HB1      ARG  13   2.319  -4.511  -6.855
   19    HG2  ARG  13           HG2      ARG  13   3.242  -4.593  -4.662
   20    HG3  ARG  13           HG1      ARG  13   4.302  -3.577  -5.616
   21    HD2  ARG  13           HD2      ARG  13   3.222  -1.579  -4.577
   22    HD3  ARG  13           HD1      ARG  13   2.210  -2.659  -3.614
   23    HE   ARG  13           HE       ARG  13   5.062  -3.054  -3.320
   24   HH11  ARG  13          HH11      ARG  13   2.190  -1.444  -2.110
   25   HH12  ARG  13          HH12      ARG  13   2.900  -1.053  -0.584
   26   HH21  ARG  13          HH21      ARG  13   6.002  -2.554  -1.301
   27   HH22  ARG  13          HH22      ARG  13   5.081  -1.685  -0.122
   28    H    SER  14           HN       SER  14   2.680  -4.249  -9.050
   29    HA   SER  14           HA       SER  14   0.431  -3.391 -10.681
   30    HB2  SER  14           HB2      SER  14   1.622  -4.718 -12.479
   31    HB3  SER  14           HB1      SER  14   2.477  -3.286 -11.901
   32    HG   SER  14           HG       SER  14   4.046  -4.566 -11.393
   33    HA   PRO  15           HA       PRO  15  -1.062  -3.732 -11.597
   34    HB2  PRO  15           HB2      PRO  15  -3.502  -4.622 -12.156
   35    HB3  PRO  15           HB1      PRO  15  -2.092  -5.224 -13.036
   36    HG2  PRO  15           HG2      PRO  15  -3.750  -6.581 -10.994
   37    HG3  PRO  15           HG1      PRO  15  -2.763  -7.279 -12.286
   38    HD2  PRO  15           HD2      PRO  15  -2.078  -6.946  -9.508
   39    HD3  PRO  15           HD1      PRO  15  -1.095  -7.663 -10.800
   40    H    CYS  16           HN       CYS  16  -1.623  -4.912  -8.597
   41    HA   CYS  16           HA       CYS  16  -3.856  -3.047  -8.069
   42    HB2  CYS  16           HB2      CYS  16  -3.325  -5.198  -6.028
   43    HB3  CYS  16           HB1      CYS  16  -4.810  -4.429  -6.517
   44    HA   PRO  17           HA       PRO  17  -4.448  -1.521  -7.406
   45    HB2  PRO  17           HB2      PRO  17  -4.628   0.856  -6.274
   46    HB3  PRO  17           HB1      PRO  17  -4.851  -0.589  -5.278
   47    HG2  PRO  17           HG2      PRO  17  -2.501   1.218  -5.495
   48    HG3  PRO  17           HG1      PRO  17  -3.145   0.432  -4.066
   49    HD2  PRO  17           HD2      PRO  17  -0.987  -0.471  -5.657
   50    HD3  PRO  17           HD1      PRO  17  -1.825  -1.407  -4.404
   51    HA   PRO  18           HA       PRO  18  -5.711   0.311  -7.849
   52    HB2  PRO  18           HB2      PRO  18  -6.689   2.344  -9.199
   53    HB3  PRO  18           HB1      PRO  18  -5.527   2.648  -7.899
   54    HG2  PRO  18           HG2      PRO  18  -5.135   2.785 -10.843
   55    HG3  PRO  18           HG1      PRO  18  -4.314   3.693  -9.569
   56    HD2  PRO  18           HD2      PRO  18  -3.429   1.279 -10.887
   57    HD3  PRO  18           HD1      PRO  18  -2.592   2.199  -9.619
   58    H    PHE  19           HN       PHE  19  -4.333  -0.882 -10.492
   59    HA   PHE  19           HA       PHE  19  -6.713  -0.964 -12.210
   60    HB2  PHE  19           HB2      PHE  19  -3.890  -1.888 -12.794
   61    HB3  PHE  19           HB1      PHE  19  -5.217  -1.808 -13.946
   62    HD1  PHE  19           HD1      PHE  19  -2.369  -0.176 -12.794
   63    HD2  PHE  19           HD2      PHE  19  -6.340   0.602 -14.105
   64    HE1  PHE  19           HE1      PHE  19  -1.730   2.134 -13.346
   65    HE2  PHE  19           HE2      PHE  19  -5.708   2.914 -14.662
   66    HZ   PHE  19           HZ       PHE  19  -3.402   3.681 -14.282
   67    H    CYS  20           HN       CYS  20  -6.744  -2.430  -9.796
   68    HA   CYS  20           HA       CYS  20  -6.116  -5.176 -10.429
   69    HB2  CYS  20           HB2      CYS  20  -6.015  -3.952  -8.120
   70    HB3  CYS  20           HB1      CYS  20  -7.728  -4.351  -8.050
   71    HN1  NH2  21           H1       CYS  20  -7.457  -5.665 -12.153
   72    HN2  NH2  21           H2       CYS  20  -9.170  -5.824 -11.997
  Start of MODEL   21
    1    H1   GLY  11           HT1      GLY  11   0.291   1.180  -1.261
    2    H2   GLY  11           HT2      GLY  11   1.463   0.751  -0.129
    3    H3   GLY  11           HT3      GLY  11   0.734  -0.435  -1.094
    4    HA2  GLY  11           HA1      GLY  11   2.515   1.733  -2.031
    5    HA3  GLY  11           HA2      GLY  11   2.927   0.027  -1.915
    6    H    PHE  12           HN       PHE  12   3.158   1.425  -4.288
    7    HA   PHE  12           HA       PHE  12   0.808   0.635  -5.847
    8    HB2  PHE  12           HB2      PHE  12   2.874   2.734  -6.209
    9    HB3  PHE  12           HB1      PHE  12   2.228   1.984  -7.666
   10    HD1  PHE  12           HD1      PHE  12   1.137   3.604  -4.500
   11    HD2  PHE  12           HD2      PHE  12   0.253   2.751  -8.572
   12    HE1  PHE  12           HE1      PHE  12  -0.870   5.017  -4.357
   13    HE2  PHE  12           HE2      PHE  12  -1.755   4.164  -8.436
   14    HZ   PHE  12           HZ       PHE  12  -2.319   5.298  -6.324
   15    H    ARG  13           HN       ARG  13   0.854  -1.135  -6.927
   16    HA   ARG  13           HA       ARG  13   3.326  -2.120  -8.059
   17    HB2  ARG  13           HB2      ARG  13   1.735  -3.800  -6.061
   18    HB3  ARG  13           HB1      ARG  13   3.089  -4.358  -7.010
   19    HG2  ARG  13           HG2      ARG  13   4.661  -3.368  -5.647
   20    HG3  ARG  13           HG1      ARG  13   3.602  -2.045  -5.160
   21    HD2  ARG  13           HD2      ARG  13   4.085  -3.589  -3.336
   22    HD3  ARG  13           HD1      ARG  13   2.372  -3.527  -3.702
   23    HE   ARG  13           HE       ARG  13   4.166  -5.760  -4.481
   24   HH11  ARG  13          HH11      ARG  13   0.956  -4.534  -3.711
   25   HH12  ARG  13          HH12      ARG  13   0.198  -6.078  -3.876
   26   HH21  ARG  13          HH21      ARG  13   3.131  -7.809  -4.707
   27   HH22  ARG  13          HH22      ARG  13   1.424  -7.929  -4.443
   28    H    SER  14           HN       SER  14   2.710  -4.368  -9.265
   29    HA   SER  14           HA       SER  14   0.195  -3.786 -10.604
   30    HB2  SER  14           HB2      SER  14   2.462  -5.602 -11.457
   31    HB3  SER  14           HB1      SER  14   1.075  -5.128 -12.436
   32    HG   SER  14           HG       SER  14   2.552  -3.056 -11.337
   33    HA   PRO  15           HA       PRO  15  -1.242  -4.471 -11.607
   34    HB2  PRO  15           HB2      PRO  15  -3.719  -5.410 -11.808
   35    HB3  PRO  15           HB1      PRO  15  -2.363  -6.265 -12.552
   36    HG2  PRO  15           HG2      PRO  15  -3.891  -6.928 -10.086
   37    HG3  PRO  15           HG1      PRO  15  -3.123  -8.010 -11.255
   38    HD2  PRO  15           HD2      PRO  15  -2.070  -7.172  -8.754
   39    HD3  PRO  15           HD1      PRO  15  -1.222  -8.086 -10.016
   40    H    CYS  16           HN       CYS  16  -2.075  -5.114  -8.369
   41    HA   CYS  16           HA       CYS  16  -3.915  -2.783  -8.288
   42    HB2  CYS  16           HB2      CYS  16  -4.140  -4.784  -6.044
   43    HB3  CYS  16           HB1      CYS  16  -5.358  -3.819  -6.838
   44    HA   PRO  17           HA       PRO  17  -4.424  -1.150  -7.474
   45    HB2  PRO  17           HB2      PRO  17  -4.090   1.300  -6.481
   46    HB3  PRO  17           HB1      PRO  17  -4.627  -0.012  -5.422
   47    HG2  PRO  17           HG2      PRO  17  -1.938   1.219  -5.724
   48    HG3  PRO  17           HG1      PRO  17  -2.760   0.708  -4.250
   49    HD2  PRO  17           HD2      PRO  17  -0.833  -0.763  -5.659
   50    HD3  PRO  17           HD1      PRO  17  -1.940  -1.413  -4.436
   51    HA   PRO  18           HA       PRO  18  -5.207   1.178  -7.872
   52    HB2  PRO  18           HB2      PRO  18  -5.911   2.993  -9.646
   53    HB3  PRO  18           HB1      PRO  18  -4.607   3.346  -8.504
   54    HG2  PRO  18           HG2      PRO  18  -4.460   2.634 -11.388
   55    HG3  PRO  18           HG1      PRO  18  -3.440   3.741 -10.466
   56    HD2  PRO  18           HD2      PRO  18  -2.846   1.048 -11.111
   57    HD3  PRO  18           HD1      PRO  18  -1.963   2.079  -9.968
   58    H    PHE  19           HN       PHE  19  -4.323  -0.688 -10.361
   59    HA   PHE  19           HA       PHE  19  -7.033  -1.012 -11.441
   60    HB2  PHE  19           HB2      PHE  19  -4.466  -2.341 -12.354
   61    HB3  PHE  19           HB1      PHE  19  -6.002  -2.307 -13.211
   62    HD1  PHE  19           HD1      PHE  19  -2.829  -0.870 -12.966
   63    HD2  PHE  19           HD2      PHE  19  -6.888   0.106 -13.769
   64    HE1  PHE  19           HE1      PHE  19  -2.105   1.163 -14.140
   65    HE2  PHE  19           HE2      PHE  19  -6.169   2.141 -14.946
   66    HZ   PHE  19           HZ       PHE  19  -3.772   2.670 -15.132
   67    H    CYS  20           HN       CYS  20  -7.342  -3.588 -11.887
   68    HA   CYS  20           HA       CYS  20  -6.082  -5.403 -10.194
   69    HB2  CYS  20           HB2      CYS  20  -7.498  -3.792  -8.584
   70    HB3  CYS  20           HB1      CYS  20  -8.776  -4.927  -9.015
   71    HN1  NH2  21           H1       CYS  20  -6.251  -6.774 -11.883
   72    HN2  NH2  21           H2       CYS  20  -7.739  -7.417 -12.480
  Start of MODEL   22
    1    H1   GLY  11           HT1      GLY  11   1.110   1.950  -0.693
    2    H2   GLY  11           HT2      GLY  11   2.681   2.231  -0.142
    3    H3   GLY  11           HT3      GLY  11   2.277   0.739  -0.830
    4    HA2  GLY  11           HA1      GLY  11   2.317   3.343  -2.233
    5    HA3  GLY  11           HA2      GLY  11   3.526   2.077  -2.389
    6    H    PHE  12           HN       PHE  12   2.453   2.862  -4.645
    7    HA   PHE  12           HA       PHE  12   0.264   1.033  -5.260
    8    HB2  PHE  12           HB2      PHE  12   1.236   3.581  -6.487
    9    HB3  PHE  12           HB1      PHE  12   0.388   2.417  -7.501
   10    HD1  PHE  12           HD1      PHE  12  -0.045   3.847  -4.062
   11    HD2  PHE  12           HD2      PHE  12  -1.825   2.866  -7.805
   12    HE1  PHE  12           HE1      PHE  12  -2.212   4.672  -3.246
   13    HE2  PHE  12           HE2      PHE  12  -3.995   3.688  -6.992
   14    HZ   PHE  12           HZ       PHE  12  -4.189   4.590  -4.710
   15    H    ARG  13           HN       ARG  13   0.382  -0.065  -7.387
   16    HA   ARG  13           HA       ARG  13   2.787  -0.473  -8.650
   17    HB2  ARG  13           HB2      ARG  13   3.485  -2.726  -7.915
   18    HB3  ARG  13           HB1      ARG  13   3.655  -1.541  -6.643
   19    HG2  ARG  13           HG2      ARG  13   1.176  -3.238  -6.705
   20    HG3  ARG  13           HG1      ARG  13   2.693  -3.975  -6.227
   21    HD2  ARG  13           HD2      ARG  13   2.956  -2.263  -4.438
   22    HD3  ARG  13           HD1      ARG  13   1.411  -1.572  -4.866
   23    HE   ARG  13           HE       ARG  13   0.842  -4.197  -4.355
   24   HH11  ARG  13          HH11      ARG  13   2.398  -1.612  -2.590
   25   HH12  ARG  13          HH12      ARG  13   1.902  -2.193  -1.039
   26   HH21  ARG  13          HH21      ARG  13   0.181  -4.981  -2.308
   27   HH22  ARG  13          HH22      ARG  13   0.638  -4.122  -0.877
   28    H    SER  14           HN       SER  14   2.675  -2.736  -9.995
   29    HA   SER  14           HA       SER  14  -0.070  -2.770 -10.937
   30    HB2  SER  14           HB2      SER  14   1.060  -3.908 -12.956
   31    HB3  SER  14           HB1      SER  14   1.369  -2.191 -12.698
   32    HG   SER  14           HG       SER  14   3.315  -3.212 -13.084
   33    HA   PRO  15           HA       PRO  15  -1.399  -3.711 -11.867
   34    HB2  PRO  15           HB2      PRO  15  -3.580  -5.217 -11.853
   35    HB3  PRO  15           HB1      PRO  15  -2.194  -5.644 -12.866
   36    HG2  PRO  15           HG2      PRO  15  -3.101  -6.846 -10.293
   37    HG3  PRO  15           HG1      PRO  15  -2.350  -7.625 -11.694
   38    HD2  PRO  15           HD2      PRO  15  -1.047  -6.815  -9.324
   39    HD3  PRO  15           HD1      PRO  15  -0.269  -7.324 -10.835
   40    H    CYS  16           HN       CYS  16  -1.512  -4.808  -8.640
   41    HA   CYS  16           HA       CYS  16  -3.797  -3.008  -8.090
   42    HB2  CYS  16           HB2      CYS  16  -3.266  -5.215  -6.102
   43    HB3  CYS  16           HB1      CYS  16  -4.747  -4.403  -6.535
   44    HA   PRO  17           HA       PRO  17  -4.428  -1.517  -7.377
   45    HB2  PRO  17           HB2      PRO  17  -4.373   0.964  -6.156
   46    HB3  PRO  17           HB1      PRO  17  -5.099  -0.479  -5.448
   47    HG2  PRO  17           HG2      PRO  17  -2.796   0.934  -4.512
   48    HG3  PRO  17           HG1      PRO  17  -3.483  -0.527  -3.861
   49    HD2  PRO  17           HD2      PRO  17  -1.194  -0.188  -5.720
   50    HD3  PRO  17           HD1      PRO  17  -1.504  -1.482  -4.543
   51    HA   PRO  18           HA       PRO  18  -5.760   0.188  -7.831
   52    HB2  PRO  18           HB2      PRO  18  -6.862   2.132  -9.209
   53    HB3  PRO  18           HB1      PRO  18  -5.737   2.529  -7.902
   54    HG2  PRO  18           HG2      PRO  18  -5.324   2.655 -10.846
   55    HG3  PRO  18           HG1      PRO  18  -4.593   3.645  -9.576
   56    HD2  PRO  18           HD2      PRO  18  -3.499   1.297 -10.844
   57    HD3  PRO  18           HD1      PRO  18  -2.765   2.289  -9.568
   58    H    PHE  19           HN       PHE  19  -4.257  -0.804 -10.547
   59    HA   PHE  19           HA       PHE  19  -6.539  -0.996 -12.346
   60    HB2  PHE  19           HB2      PHE  19  -3.759  -2.131 -12.716
   61    HB3  PHE  19           HB1      PHE  19  -4.970  -1.855 -13.961
   62    HD1  PHE  19           HD1      PHE  19  -2.101  -0.571 -12.398
   63    HD2  PHE  19           HD2      PHE  19  -5.755   0.636 -14.214
   64    HE1  PHE  19           HE1      PHE  19  -1.165   1.672 -12.786
   65    HE2  PHE  19           HE2      PHE  19  -4.820   2.878 -14.607
   66    HZ   PHE  19           HZ       PHE  19  -2.527   3.397 -13.891
   67    H    CYS  20           HN       CYS  20  -6.798  -2.378  -9.888
   68    HA   CYS  20           HA       CYS  20  -6.278  -5.176 -10.470
   69    HB2  CYS  20           HB2      CYS  20  -6.023  -3.887  -8.175
   70    HB3  CYS  20           HB1      CYS  20  -7.730  -4.286  -8.023
   71    HN1  NH2  21           H1       CYS  20  -7.709  -5.868 -11.955
   72    HN2  NH2  21           H2       CYS  20  -9.428  -5.796 -11.783
  Start of MODEL   23
    1    H1   GLY  11           HT1      GLY  11   0.838   2.178  -0.706
    2    H2   GLY  11           HT2      GLY  11   1.286   1.421   0.738
    3    H3   GLY  11           HT3      GLY  11  -0.061   0.874  -0.119
    4    HA2  GLY  11           HA1      GLY  11   2.736   0.779  -1.087
    5    HA3  GLY  11           HA2      GLY  11   1.851  -0.587  -0.424
    6    H    PHE  12           HN       PHE  12   2.606   1.153  -3.206
    7    HA   PHE  12           HA       PHE  12   0.364  -0.010  -4.665
    8    HB2  PHE  12           HB2      PHE  12   2.175   2.291  -5.186
    9    HB3  PHE  12           HB1      PHE  12   1.526   1.425  -6.575
   10    HD1  PHE  12           HD1      PHE  12   0.431   3.012  -3.390
   11    HD2  PHE  12           HD2      PHE  12  -0.534   2.011  -7.409
   12    HE1  PHE  12           HE1      PHE  12  -1.681   4.251  -3.186
   13    HE2  PHE  12           HE2      PHE  12  -2.652   3.242  -7.214
   14    HZ   PHE  12           HZ       PHE  12  -3.228   4.364  -5.099
   15    H    ARG  13           HN       ARG  13   0.564  -1.521  -6.168
   16    HA   ARG  13           HA       ARG  13   3.204  -2.379  -6.981
   17    HB2  ARG  13           HB2      ARG  13   1.232  -4.275  -5.577
   18    HB3  ARG  13           HB1      ARG  13   2.487  -4.857  -6.630
   19    HG2  ARG  13           HG2      ARG  13   3.229  -5.189  -4.412
   20    HG3  ARG  13           HG1      ARG  13   4.205  -3.873  -5.026
   21    HD2  ARG  13           HD2      ARG  13   2.724  -2.280  -3.813
   22    HD3  ARG  13           HD1      ARG  13   1.797  -3.650  -3.193
   23    HE   ARG  13           HE       ARG  13   4.672  -3.410  -2.617
   24   HH11  ARG  13          HH11      ARG  13   1.334  -3.588  -1.501
   25   HH12  ARG  13          HH12      ARG  13   1.781  -3.636   0.170
   26   HH21  ARG  13          HH21      ARG  13   5.241  -3.462  -0.417
   27   HH22  ARG  13          HH22      ARG  13   4.006  -3.553   0.789
   28    H    SER  14           HN       SER  14   2.773  -4.341  -8.712
   29    HA   SER  14           HA       SER  14   0.630  -3.235 -10.350
   30    HB2  SER  14           HB2      SER  14   2.958  -3.115 -11.263
   31    HB3  SER  14           HB1      SER  14   3.011  -4.876 -11.255
   32    HG   SER  14           HG       SER  14   2.092  -4.786 -13.106
   33    HA   PRO  15           HA       PRO  15  -0.752  -3.451 -11.497
   34    HB2  PRO  15           HB2      PRO  15  -3.173  -4.175 -12.304
   35    HB3  PRO  15           HB1      PRO  15  -1.730  -4.784 -13.122
   36    HG2  PRO  15           HG2      PRO  15  -3.582  -6.186 -11.274
   37    HG3  PRO  15           HG1      PRO  15  -2.598  -6.841 -12.593
   38    HD2  PRO  15           HD2      PRO  15  -1.992  -6.829  -9.790
   39    HD3  PRO  15           HD1      PRO  15  -0.971  -7.420 -11.116
   40    H    CYS  16           HN       CYS  16  -1.536  -4.825  -8.648
   41    HA   CYS  16           HA       CYS  16  -3.779  -2.971  -8.106
   42    HB2  CYS  16           HB2      CYS  16  -3.299  -5.201  -6.143
   43    HB3  CYS  16           HB1      CYS  16  -4.774  -4.428  -6.651
   44    HA   PRO  17           HA       PRO  17  -4.458  -1.497  -7.345
   45    HB2  PRO  17           HB2      PRO  17  -4.165   1.075  -6.201
   46    HB3  PRO  17           HB1      PRO  17  -5.177  -0.230  -5.582
   47    HG2  PRO  17           HG2      PRO  17  -2.939   0.818  -4.288
   48    HG3  PRO  17           HG1      PRO  17  -3.695  -0.710  -3.925
   49    HD2  PRO  17           HD2      PRO  17  -1.300  -0.154  -5.620
   50    HD3  PRO  17           HD1      PRO  17  -1.583  -1.492  -4.479
   51    HA   PRO  18           HA       PRO  18  -5.697   0.298  -7.821
   52    HB2  PRO  18           HB2      PRO  18  -6.703   2.232  -9.289
   53    HB3  PRO  18           HB1      PRO  18  -5.551   2.628  -8.005
   54    HG2  PRO  18           HG2      PRO  18  -5.141   2.574 -10.957
   55    HG3  PRO  18           HG1      PRO  18  -4.372   3.607  -9.744
   56    HD2  PRO  18           HD2      PRO  18  -3.358   1.169 -10.881
   57    HD3  PRO  18           HD1      PRO  18  -2.609   2.170  -9.619
   58    H    PHE  19           HN       PHE  19  -4.268  -0.761 -10.609
   59    HA   PHE  19           HA       PHE  19  -6.669  -1.002 -12.244
   60    HB2  PHE  19           HB2      PHE  19  -3.834  -1.897 -12.809
   61    HB3  PHE  19           HB1      PHE  19  -5.162  -1.889 -13.961
   62    HD1  PHE  19           HD1      PHE  19  -2.376  -0.126 -12.804
   63    HD2  PHE  19           HD2      PHE  19  -6.330   0.463 -14.256
   64    HE1  PHE  19           HE1      PHE  19  -1.800   2.181 -13.435
   65    HE2  PHE  19           HE2      PHE  19  -5.760   2.767 -14.889
   66    HZ   PHE  19           HZ       PHE  19  -3.493   3.630 -14.477
   67    H    CYS  20           HN       CYS  20  -6.921  -2.419  -9.911
   68    HA   CYS  20           HA       CYS  20  -6.287  -5.192 -10.570
   69    HB2  CYS  20           HB2      CYS  20  -5.984  -3.973  -8.249
   70    HB3  CYS  20           HB1      CYS  20  -7.674  -4.423  -8.049
   71    HN1  NH2  21           H1       CYS  20  -7.800  -5.431 -12.233
   72    HN2  NH2  21           H2       CYS  20  -9.493  -5.580 -11.921