*HEADER    NEUROPEPTIDE                            06-AUG-19   6KNO              
*TITLE     STRUCTURE OF SINGLE DISULFIDE PEPTIDE CZON1107-P7A (MINOR CONFORMER)  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CZON1107-P7A(MINOR CONFORMER);                             
*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    27                                                                    
*AUTHOR    S.P.SARMA,M.MADHAN KUMAR                                              
*REVDAT   1   08-APR-20 6KNO    0                                                
# Restraints file 1: czon1107_P7A_cc.upl
 12 PHE  H      11 GLY  HA2     2.40
 12 PHE  H      12 PHE  HA      3.50
 12 PHE  H      12 PHE  HB2     5.00
 12 PHE  H      20 CYSS H       5.00
 12 PHE  HA     12 PHE  QD      5.00
 12 PHE  HA     13 ARG  H       2.40
 12 PHE  HB2    12 PHE  QD      5.00
 12 PHE  HB3    12 PHE  QD      0.00
 13 ARG  H      13 ARG  HB2     5.00
 13 ARG  H      13 ARG  HB3     0.00
 13 ARG  H      13 ARG  HD2     5.00
 13 ARG  H      13 ARG  HG2     5.00
 13 ARG  HE     13 ARG  HB2     5.00
 13 ARG  HE     13 ARG  HB3     0.00
 13 ARG  HE     13 ARG  HG2     3.50
 16 CYSS H      15 PRO  HA      3.50 
 16 CYSS H      16 CYSS HB2     5.00
 16 CYSS HA     16 CYSS H       3.50
 17 ALA  H      16 CYSS H       4.20
 17 ALA  H      16 CYSS HA      3.50
 17 ALA  H      17 ALA  HA      3.50
 17 ALA  H      17 ALA  QB      5.00
 17 ALA  H      18 PRO  HA      4.80
 19 PHE  H      19 PHE  HA      3.50
 19 PHE  H      19 PHE  HB2     5.00
 19 PHE  HA     19 PHE  HB2     5.00
 19 PHE  HA     19 PHE  HB3     0.00
 20 CYSS HB2    20 CYSS HA      3.50
 21 CTN  H1     21 CTN  H2      3.50
 
  # restraint file for disulphide bonds
16	CYSS	SG	20	CYSS	SG	2.05	2.0
16	CYSS	SG	20	CYSS	CB	3.05	2.0
16	CYSS	CB	20	CYSS	SG	3.15	2.0	#3.05
16	CYSS	CB	20	CYSS	CB	4.20	2.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY  11           HT1      GLY  11  -0.898   1.759  -1.778
    2    H2   GLY  11           HT2      GLY  11  -1.052   0.282  -2.590
    3    H3   GLY  11           HT3      GLY  11  -1.787   1.669  -3.221
    4    HA2  GLY  11           HA1      GLY  11   0.181   1.150  -4.463
    5    HA3  GLY  11           HA2      GLY  11   0.378   2.666  -3.593
    6    H    PHE  12           HN       PHE  12   2.393   0.718  -4.569
    7    HA   PHE  12           HA       PHE  12   3.488  -0.360  -2.082
    8    HB2  PHE  12           HB2      PHE  12   4.515  -0.587  -4.935
    9    HB3  PHE  12           HB1      PHE  12   5.274  -1.310  -3.532
   10    HD1  PHE  12           HD1      PHE  12   2.171  -1.377  -5.573
   11    HD2  PHE  12           HD2      PHE  12   4.570  -3.361  -2.669
   12    HE1  PHE  12           HE1      PHE  12   0.795  -3.391  -5.815
   13    HE2  PHE  12           HE2      PHE  12   3.188  -5.376  -2.909
   14    HZ   PHE  12           HZ       PHE  12   1.298  -5.394  -4.484
   15    H    ARG  13           HN       ARG  13   6.054  -0.115  -2.061
   16    HA   ARG  13           HA       ARG  13   6.525   2.688  -1.678
   17    HB2  ARG  13           HB2      ARG  13   8.705   2.022  -0.830
   18    HB3  ARG  13           HB1      ARG  13   7.448   1.030  -0.117
   19    HG2  ARG  13           HG2      ARG  13   7.987  -0.757  -1.770
   20    HG3  ARG  13           HG1      ARG  13   9.341   0.224  -2.323
   21    HD2  ARG  13           HD2      ARG  13   9.009  -0.640   0.545
   22    HD3  ARG  13           HD1      ARG  13   9.875  -1.606  -0.645
   23    HE   ARG  13           HE       ARG  13  10.929   1.017  -0.626
   24   HH11  ARG  13          HH11      ARG  13  10.843  -1.870   1.358
   25   HH12  ARG  13          HH12      ARG  13  12.364  -1.545   2.110
   26   HH21  ARG  13          HH21      ARG  13  12.927   1.461   0.392
   27   HH22  ARG  13          HH22      ARG  13  13.559   0.355   1.561
   28    H    SER  14           HN       SER  14   8.006   3.992  -2.750
   29    HA   SER  14           HA       SER  14   8.268   3.440  -5.552
   30    HB2  SER  14           HB2      SER  14   9.375   5.757  -3.954
   31    HB3  SER  14           HB1      SER  14   9.149   5.694  -5.700
   32    HG   SER  14           HG       SER  14   6.835   5.106  -4.465
   33    HA   PRO  15           HA       PRO  15   9.329   3.827  -7.214
   34    HB2  PRO  15           HB2      PRO  15  10.969   2.296  -8.960
   35    HB3  PRO  15           HB1      PRO  15  10.975   4.048  -8.759
   36    HG2  PRO  15           HG2      PRO  15  13.059   2.334  -8.048
   37    HG3  PRO  15           HG1      PRO  15  12.850   3.996  -7.476
   38    HD2  PRO  15           HD2      PRO  15  12.161   1.421  -6.124
   39    HD3  PRO  15           HD1      PRO  15  12.794   2.929  -5.428
   40    H    CYS  16           HN       CYS  16   7.690   2.668  -8.204
   41    HA   CYS  16           HA       CYS  16   7.804  -0.236  -7.927
   42    HB2  CYS  16           HB2      CYS  16   5.187   0.110  -7.617
   43    HB3  CYS  16           HB1      CYS  16   6.305   0.185  -6.259
   44    H    ALA  17           HN       ALA  17   7.689  -1.121 -10.073
   45    HA   ALA  17           HA       ALA  17   5.815   0.137 -11.911
   46    HB1  ALA  17           HB1      ALA  17   8.616  -0.735 -12.620
   47    HB2  ALA  17           HB2      ALA  17   8.054   0.930 -12.486
   48    HB3  ALA  17           HB3      ALA  17   7.408  -0.119 -13.747
   49    HA   PRO  18           HA       PRO  18   4.971  -0.141 -13.579
   50    HB2  PRO  18           HB2      PRO  18   2.901  -1.178 -14.989
   51    HB3  PRO  18           HB1      PRO  18   4.567  -1.206 -15.566
   52    HG2  PRO  18           HG2      PRO  18   2.902  -3.400 -14.602
   53    HG3  PRO  18           HG1      PRO  18   4.365  -3.480 -15.561
   54    HD2  PRO  18           HD2      PRO  18   4.057  -3.911 -12.722
   55    HD3  PRO  18           HD1      PRO  18   5.531  -4.049 -13.700
   56    H    PHE  19           HN       PHE  19   3.031  -2.608 -11.952
   57    HA   PHE  19           HA       PHE  19   0.929  -0.701 -11.333
   58    HB2  PHE  19           HB2      PHE  19   1.127  -3.487 -10.200
   59    HB3  PHE  19           HB1      PHE  19  -0.309  -2.502 -10.425
   60    HD1  PHE  19           HD1      PHE  19   1.221  -5.330 -11.525
   61    HD2  PHE  19           HD2      PHE  19  -0.515  -1.768 -13.087
   62    HE1  PHE  19           HE1      PHE  19   0.797  -6.479 -13.658
   63    HE2  PHE  19           HE2      PHE  19  -0.939  -2.911 -15.226
   64    HZ   PHE  19           HZ       PHE  19  -0.283  -5.269 -15.511
   65    H    CYS  20           HN       CYS  20   0.738   0.349  -9.452
   66    HA   CYS  20           HA       CYS  20   2.483  -0.462  -7.269
   67    HB2  CYS  20           HB2      CYS  20   3.439   1.475  -8.550
   68    HB3  CYS  20           HB1      CYS  20   2.016   2.404  -8.091
   69    HN1  NH2  21           H1       CYS  20   0.422  -1.451  -6.631
   70    HN2  NH2  21           H2       CYS  20  -0.756  -0.480  -5.819
  Start of MODEL    2
    1    H1   GLY  11           HT1      GLY  11   0.044   3.009  -1.543
    2    H2   GLY  11           HT2      GLY  11  -0.717   1.554  -1.137
    3    H3   GLY  11           HT3      GLY  11  -1.423   2.591  -2.274
    4    HA2  GLY  11           HA1      GLY  11  -0.379   0.721  -3.365
    5    HA3  GLY  11           HA2      GLY  11   0.407   2.236  -3.789
    6    H    PHE  12           HN       PHE  12   1.968   0.304  -4.311
    7    HA   PHE  12           HA       PHE  12   3.454  -0.711  -2.069
    8    HB2  PHE  12           HB2      PHE  12   3.945  -0.869  -5.058
    9    HB3  PHE  12           HB1      PHE  12   5.126  -1.427  -3.893
   10    HD1  PHE  12           HD1      PHE  12   1.436  -1.791  -4.398
   11    HD2  PHE  12           HD2      PHE  12   5.146  -3.667  -3.510
   12    HE1  PHE  12           HE1      PHE  12   0.300  -3.965  -4.237
   13    HE2  PHE  12           HE2      PHE  12   4.017  -5.839  -3.348
   14    HZ   PHE  12           HZ       PHE  12   1.590  -5.991  -3.714
   15    H    ARG  13           HN       ARG  13   5.979  -0.494  -2.284
   16    HA   ARG  13           HA       ARG  13   6.533   2.265  -1.704
   17    HB2  ARG  13           HB2      ARG  13   8.455  -0.071  -1.866
   18    HB3  ARG  13           HB1      ARG  13   8.795   1.506  -1.177
   19    HG2  ARG  13           HG2      ARG  13   7.154   1.135   0.568
   20    HG3  ARG  13           HG1      ARG  13   6.740  -0.429  -0.135
   21    HD2  ARG  13           HD2      ARG  13   9.039  -1.196   0.241
   22    HD3  ARG  13           HD1      ARG  13   9.435   0.367   0.953
   23    HE   ARG  13           HE       ARG  13   7.237  -1.065   2.184
   24   HH11  ARG  13          HH11      ARG  13  10.683  -0.368   2.227
   25   HH12  ARG  13          HH12      ARG  13  10.882  -0.786   3.895
   26   HH21  ARG  13          HH21      ARG  13   7.508  -1.635   4.411
   27   HH22  ARG  13          HH22      ARG  13   9.070  -1.509   5.137
   28    H    SER  14           HN       SER  14   7.336   3.757  -3.019
   29    HA   SER  14           HA       SER  14   7.838   3.091  -5.768
   30    HB2  SER  14           HB2      SER  14   6.614   5.159  -5.074
   31    HB3  SER  14           HB1      SER  14   8.106   5.759  -4.354
   32    HG   SER  14           HG       SER  14   8.753   6.343  -6.248
   33    HA   PRO  15           HA       PRO  15   9.021   4.037  -7.534
   34    HB2  PRO  15           HB2      PRO  15  11.053   2.297  -8.742
   35    HB3  PRO  15           HB1      PRO  15  10.622   3.959  -9.153
   36    HG2  PRO  15           HG2      PRO  15  12.961   3.341  -7.963
   37    HG3  PRO  15           HG1      PRO  15  12.105   4.860  -7.637
   38    HD2  PRO  15           HD2      PRO  15  12.189   2.346  -6.009
   39    HD3  PRO  15           HD1      PRO  15  12.313   4.037  -5.476
   40    H    CYS  16           HN       CYS  16   7.457   2.726  -8.395
   41    HA   CYS  16           HA       CYS  16   7.670  -0.146  -7.901
   42    HB2  CYS  16           HB2      CYS  16   5.025   0.153  -7.653
   43    HB3  CYS  16           HB1      CYS  16   6.122   0.306  -6.284
   44    H    ALA  17           HN       ALA  17   7.582  -1.186  -9.995
   45    HA   ALA  17           HA       ALA  17   5.790   0.005 -11.964
   46    HB1  ALA  17           HB1      ALA  17   8.590  -0.970 -12.501
   47    HB2  ALA  17           HB2      ALA  17   8.070   0.715 -12.471
   48    HB3  ALA  17           HB3      ALA  17   7.449  -0.378 -13.708
   49    HA   PRO  18           HA       PRO  18   5.139  -0.328 -13.756
   50    HB2  PRO  18           HB2      PRO  18   2.988  -1.530 -15.109
   51    HB3  PRO  18           HB1      PRO  18   4.622  -1.316 -15.736
   52    HG2  PRO  18           HG2      PRO  18   3.369  -3.766 -15.127
   53    HG3  PRO  18           HG1      PRO  18   5.055  -3.531 -15.518
   54    HD2  PRO  18           HD2      PRO  18   3.772  -3.857 -12.858
   55    HD3  PRO  18           HD1      PRO  18   5.407  -4.310 -13.385
   56    H    PHE  19           HN       PHE  19   3.386  -2.310 -11.629
   57    HA   PHE  19           HA       PHE  19   1.222  -0.326 -11.394
   58    HB2  PHE  19           HB2      PHE  19   1.109  -3.079 -10.190
   59    HB3  PHE  19           HB1      PHE  19  -0.219  -2.015 -10.635
   60    HD1  PHE  19           HD1      PHE  19   1.310  -4.954 -11.444
   61    HD2  PHE  19           HD2      PHE  19  -0.099  -1.400 -13.304
   62    HE1  PHE  19           HE1      PHE  19   1.125  -6.153 -13.577
   63    HE2  PHE  19           HE2      PHE  19  -0.287  -2.591 -15.445
   64    HZ   PHE  19           HZ       PHE  19   0.325  -4.973 -15.582
   65    H    CYS  20           HN       CYS  20   0.627   0.306  -9.259
   66    HA   CYS  20           HA       CYS  20   2.627  -0.338  -7.232
   67    HB2  CYS  20           HB2      CYS  20   2.911   1.937  -8.418
   68    HB3  CYS  20           HB1      CYS  20   1.485   2.424  -7.508
   69    HN1  NH2  21           H1       CYS  20   0.801  -1.827  -6.749
   70    HN2  NH2  21           H2       CYS  20  -0.465  -1.245  -5.725
  Start of MODEL    3
    1    H1   GLY  11           HT1      GLY  11  -0.540   1.771  -1.419
    2    H2   GLY  11           HT2      GLY  11  -0.871   0.259  -2.095
    3    H3   GLY  11           HT3      GLY  11  -1.549   1.650  -2.770
    4    HA2  GLY  11           HA1      GLY  11   0.298   0.839  -4.098
    5    HA3  GLY  11           HA2      GLY  11   0.598   2.442  -3.441
    6    H    PHE  12           HN       PHE  12   2.659   0.849  -4.304
    7    HA   PHE  12           HA       PHE  12   3.872  -0.118  -1.792
    8    HB2  PHE  12           HB2      PHE  12   4.534  -0.776  -4.673
    9    HB3  PHE  12           HB1      PHE  12   5.613  -1.153  -3.342
   10    HD1  PHE  12           HD1      PHE  12   2.128  -1.728  -4.523
   11    HD2  PHE  12           HD2      PHE  12   5.375  -3.098  -2.138
   12    HE1  PHE  12           HE1      PHE  12   0.925  -3.819  -4.087
   13    HE2  PHE  12           HE2      PHE  12   4.172  -5.192  -1.703
   14    HZ   PHE  12           HZ       PHE  12   1.947  -5.554  -2.676
   15    H    ARG  13           HN       ARG  13   6.416   0.076  -2.019
   16    HA   ARG  13           HA       ARG  13   6.995   2.841  -1.735
   17    HB2  ARG  13           HB2      ARG  13   8.246   1.177  -0.457
   18    HB3  ARG  13           HB1      ARG  13   8.885   0.478  -1.941
   19    HG2  ARG  13           HG2      ARG  13  10.003   2.641  -2.399
   20    HG3  ARG  13           HG1      ARG  13   9.470   3.192  -0.808
   21    HD2  ARG  13           HD2      ARG  13  10.686   1.401   0.255
   22    HD3  ARG  13           HD1      ARG  13  11.150   0.748  -1.316
   23    HE   ARG  13           HE       ARG  13  11.986   3.438  -1.082
   24   HH11  ARG  13          HH11      ARG  13  12.771   0.213   0.053
   25   HH12  ARG  13          HH12      ARG  13  14.439   0.567   0.327
   26   HH21  ARG  13          HH21      ARG  13  14.207   3.917  -0.735
   27   HH22  ARG  13          HH22      ARG  13  15.262   2.695  -0.116
   28    H    SER  14           HN       SER  14   7.743   4.291  -3.137
   29    HA   SER  14           HA       SER  14   7.978   3.587  -5.912
   30    HB2  SER  14           HB2      SER  14   8.475   6.253  -4.559
   31    HB3  SER  14           HB1      SER  14   8.183   5.981  -6.277
   32    HG   SER  14           HG       SER  14   6.086   5.282  -5.761
   33    HA   PRO  15           HA       PRO  15   8.932   4.252  -7.704
   34    HB2  PRO  15           HB2      PRO  15  10.477   3.085  -9.550
   35    HB3  PRO  15           HB1      PRO  15  10.782   4.737  -8.999
   36    HG2  PRO  15           HG2      PRO  15  12.158   2.200  -8.224
   37    HG3  PRO  15           HG1      PRO  15  12.855   3.796  -8.551
   38    HD2  PRO  15           HD2      PRO  15  12.346   2.795  -6.028
   39    HD3  PRO  15           HD1      PRO  15  12.475   4.520  -6.415
   40    H    CYS  16           HN       CYS  16   7.401   2.801  -8.341
   41    HA   CYS  16           HA       CYS  16   7.979  -0.037  -7.979
   42    HB2  CYS  16           HB2      CYS  16   5.367  -0.021  -7.416
   43    HB3  CYS  16           HB1      CYS  16   6.599   0.235  -6.182
   44    H    ALA  17           HN       ALA  17   7.723  -1.062 -10.062
   45    HA   ALA  17           HA       ALA  17   5.635  -0.014 -11.803
   46    HB1  ALA  17           HB1      ALA  17   7.141  -0.274 -13.712
   47    HB2  ALA  17           HB2      ALA  17   8.439  -0.770 -12.628
   48    HB3  ALA  17           HB3      ALA  17   7.797   0.869 -12.539
   49    HA   PRO  18           HA       PRO  18   5.135  -0.537 -13.875
   50    HB2  PRO  18           HB2      PRO  18   2.897  -1.606 -14.982
   51    HB3  PRO  18           HB1      PRO  18   4.522  -1.939 -15.591
   52    HG2  PRO  18           HG2      PRO  18   2.756  -3.625 -13.893
   53    HG3  PRO  18           HG1      PRO  18   3.875  -4.111 -15.162
   54    HD2  PRO  18           HD2      PRO  18   4.384  -4.273 -12.444
   55    HD3  PRO  18           HD1      PRO  18   5.630  -4.231 -13.704
   56    H    PHE  19           HN       PHE  19   2.696  -2.461 -12.094
   57    HA   PHE  19           HA       PHE  19   1.271   0.011 -11.472
   58    HB2  PHE  19           HB2      PHE  19   0.425  -2.743 -10.573
   59    HB3  PHE  19           HB1      PHE  19  -0.573  -1.311 -10.790
   60    HD1  PHE  19           HD1      PHE  19  -0.407  -4.360 -11.980
   61    HD2  PHE  19           HD2      PHE  19   0.133  -0.414 -13.468
   62    HE1  PHE  19           HE1      PHE  19  -0.965  -5.144 -14.243
   63    HE2  PHE  19           HE2      PHE  19  -0.422  -1.188 -15.730
   64    HZ   PHE  19           HZ       PHE  19  -0.972  -3.556 -16.123
   65    H    CYS  20           HN       CYS  20   0.691   0.470  -9.214
   66    HA   CYS  20           HA       CYS  20   2.668  -0.609  -7.362
   67    HB2  CYS  20           HB2      CYS  20   3.255   1.654  -8.321
   68    HB3  CYS  20           HB1      CYS  20   1.825   2.280  -7.511
   69    HN1  NH2  21           H1       CYS  20   0.974  -1.940  -6.571
   70    HN2  NH2  21           H2       CYS  20  -0.287  -1.295  -5.580
  Start of MODEL    4
    1    H1   GLY  11           HT1      GLY  11  -0.814  -0.897  -0.856
    2    H2   GLY  11           HT2      GLY  11  -0.727  -2.026  -2.110
    3    H3   GLY  11           HT3      GLY  11  -1.951  -0.863  -2.105
    4    HA2  GLY  11           HA1      GLY  11  -0.218  -0.317  -3.692
    5    HA3  GLY  11           HA2      GLY  11  -0.362   0.888  -2.419
    6    H    PHE  12           HN       PHE  12   1.944   0.148  -4.138
    7    HA   PHE  12           HA       PHE  12   3.786  -0.838  -2.073
    8    HB2  PHE  12           HB2      PHE  12   4.120  -0.734  -5.085
    9    HB3  PHE  12           HB1      PHE  12   5.418  -1.119  -3.975
   10    HD1  PHE  12           HD1      PHE  12   2.202  -2.332  -5.338
   11    HD2  PHE  12           HD2      PHE  12   5.575  -3.220  -2.888
   12    HE1  PHE  12           HE1      PHE  12   1.567  -4.697  -5.317
   13    HE2  PHE  12           HE2      PHE  12   4.934  -5.588  -2.869
   14    HZ   PHE  12           HZ       PHE  12   2.933  -6.329  -4.083
   15    H    ARG  13           HN       ARG  13   6.131   0.114  -2.620
   16    HA   ARG  13           HA       ARG  13   5.787   3.025  -2.400
   17    HB2  ARG  13           HB2      ARG  13   8.006   1.208  -1.422
   18    HB3  ARG  13           HB1      ARG  13   8.216   2.939  -1.559
   19    HG2  ARG  13           HG2      ARG  13   7.686   2.427   0.701
   20    HG3  ARG  13           HG1      ARG  13   6.306   3.254  -0.010
   21    HD2  ARG  13           HD2      ARG  13   5.143   1.148  -0.270
   22    HD3  ARG  13           HD1      ARG  13   6.553   0.267   0.325
   23    HE   ARG  13           HE       ARG  13   6.105   1.823   2.391
   24   HH11  ARG  13          HH11      ARG  13   3.780   0.023   0.462
   25   HH12  ARG  13          HH12      ARG  13   2.634  -0.110   1.744
   26   HH21  ARG  13          HH21      ARG  13   4.603   1.624   4.089
   27   HH22  ARG  13          HH22      ARG  13   3.112   0.793   3.827
   28    H    SER  14           HN       SER  14   7.113   4.438  -3.584
   29    HA   SER  14           HA       SER  14   7.722   3.455  -6.215
   30    HB2  SER  14           HB2      SER  14   8.199   6.214  -5.074
   31    HB3  SER  14           HB1      SER  14   8.097   5.773  -6.777
   32    HG   SER  14           HG       SER  14   5.928   5.162  -5.104
   33    HA   PRO  15           HA       PRO  15   8.964   4.197  -7.920
   34    HB2  PRO  15           HB2      PRO  15  10.724   2.944  -9.529
   35    HB3  PRO  15           HB1      PRO  15  10.986   4.597  -8.965
   36    HG2  PRO  15           HG2      PRO  15  12.183   2.045  -7.983
   37    HG3  PRO  15           HG1      PRO  15  12.946   3.629  -8.204
   38    HD2  PRO  15           HD2      PRO  15  12.073   2.645  -5.783
   39    HD3  PRO  15           HD1      PRO  15  12.268   4.367  -6.151
   40    H    CYS  16           HN       CYS  16   7.258   2.850  -8.198
   41    HA   CYS  16           HA       CYS  16   7.714  -0.018  -7.939
   42    HB2  CYS  16           HB2      CYS  16   5.101   0.072  -7.570
   43    HB3  CYS  16           HB1      CYS  16   6.219   0.431  -6.258
   44    H    ALA  17           HN       ALA  17   7.545  -1.149  -9.972
   45    HA   ALA  17           HA       ALA  17   5.673  -0.093 -11.938
   46    HB1  ALA  17           HB1      ALA  17   8.482  -1.058 -12.484
   47    HB2  ALA  17           HB2      ALA  17   7.926   0.612 -12.581
   48    HB3  ALA  17           HB3      ALA  17   7.301  -0.592 -13.706
   49    HA   PRO  18           HA       PRO  18   5.246  -0.732 -13.986
   50    HB2  PRO  18           HB2      PRO  18   2.969  -1.731 -15.085
   51    HB3  PRO  18           HB1      PRO  18   4.584  -2.201 -15.622
   52    HG2  PRO  18           HG2      PRO  18   2.680  -3.657 -13.861
   53    HG3  PRO  18           HG1      PRO  18   3.787  -4.295 -15.072
   54    HD2  PRO  18           HD2      PRO  18   4.242  -4.327 -12.353
   55    HD3  PRO  18           HD1      PRO  18   5.516  -4.404 -13.583
   56    H    PHE  19           HN       PHE  19   2.956  -2.304 -11.806
   57    HA   PHE  19           HA       PHE  19   1.558   0.269 -11.521
   58    HB2  PHE  19           HB2      PHE  19   0.515  -2.364 -10.467
   59    HB3  PHE  19           HB1      PHE  19  -0.380  -0.880 -10.768
   60    HD1  PHE  19           HD1      PHE  19  -0.500  -3.976 -11.768
   61    HD2  PHE  19           HD2      PHE  19   0.452  -0.213 -13.506
   62    HE1  PHE  19           HE1      PHE  19  -1.123  -4.843 -13.978
   63    HE2  PHE  19           HE2      PHE  19  -0.172  -1.074 -15.721
   64    HZ   PHE  19           HZ       PHE  19  -0.961  -3.392 -15.958
   65    H    CYS  20           HN       CYS  20   0.559   0.282  -9.096
   66    HA   CYS  20           HA       CYS  20   2.788  -0.369  -7.318
   67    HB2  CYS  20           HB2      CYS  20   2.508   2.110  -8.150
   68    HB3  CYS  20           HB1      CYS  20   1.228   2.149  -6.941
   69    HN1  NH2  21           H1       CYS  20   1.085  -2.177  -7.167
   70    HN2  NH2  21           H2       CYS  20  -0.102  -1.985  -5.925
  Start of MODEL    5
    1    H1   GLY  11           HT1      GLY  11  -1.361   2.697  -1.375
    2    H2   GLY  11           HT2      GLY  11  -1.660   1.043  -1.555
    3    H3   GLY  11           HT3      GLY  11  -2.455   2.156  -2.547
    4    HA2  GLY  11           HA1      GLY  11  -0.681   1.063  -3.751
    5    HA3  GLY  11           HA2      GLY  11  -0.374   2.784  -3.570
    6    H    PHE  12           HN       PHE  12   1.704   1.124  -4.141
    7    HA   PHE  12           HA       PHE  12   3.054   0.597  -1.586
    8    HB2  PHE  12           HB2      PHE  12   3.943  -0.026  -4.425
    9    HB3  PHE  12           HB1      PHE  12   4.872  -0.381  -2.985
   10    HD1  PHE  12           HD1      PHE  12   1.798  -1.271  -4.839
   11    HD2  PHE  12           HD2      PHE  12   4.378  -2.221  -1.585
   12    HE1  PHE  12           HE1      PHE  12   0.678  -3.433  -4.583
   13    HE2  PHE  12           HE2      PHE  12   3.254  -4.388  -1.329
   14    HZ   PHE  12           HZ       PHE  12   1.403  -4.997  -2.830
   15    H    ARG  13           HN       ARG  13   5.581   1.118  -1.834
   16    HA   ARG  13           HA       ARG  13   5.686   4.012  -2.155
   17    HB2  ARG  13           HB2      ARG  13   6.635   3.037  -0.092
   18    HB3  ARG  13           HB1      ARG  13   7.768   2.091  -1.050
   19    HG2  ARG  13           HG2      ARG  13   8.789   4.162  -1.858
   20    HG3  ARG  13           HG1      ARG  13   7.673   5.088  -0.853
   21    HD2  ARG  13           HD2      ARG  13   8.570   4.073   1.141
   22    HD3  ARG  13           HD1      ARG  13   9.612   3.031   0.175
   23    HE   ARG  13           HE       ARG  13  10.315   5.539  -0.602
   24   HH11  ARG  13          HH11      ARG  13  10.129   3.954   2.533
   25   HH12  ARG  13          HH12      ARG  13  11.385   4.906   3.235
   26   HH21  ARG  13          HH21      ARG  13  12.003   6.790   0.329
   27   HH22  ARG  13          HH22      ARG  13  12.448   6.526   1.979
   28    H    SER  14           HN       SER  14   6.999   5.065  -3.611
   29    HA   SER  14           HA       SER  14   7.643   3.626  -5.995
   30    HB2  SER  14           HB2      SER  14   8.255   6.491  -5.226
   31    HB3  SER  14           HB1      SER  14   8.329   5.817  -6.853
   32    HG   SER  14           HG       SER  14   6.095   6.386  -5.249
   33    HA   PRO  15           HA       PRO  15   9.014   4.086  -7.731
   34    HB2  PRO  15           HB2      PRO  15  10.993   2.348  -8.848
   35    HB3  PRO  15           HB1      PRO  15  10.838   4.092  -9.071
   36    HG2  PRO  15           HG2      PRO  15  12.906   2.835  -7.714
   37    HG3  PRO  15           HG1      PRO  15  12.461   4.537  -7.534
   38    HD2  PRO  15           HD2      PRO  15  11.795   2.206  -5.798
   39    HD3  PRO  15           HD1      PRO  15  12.179   3.880  -5.343
   40    H    CYS  16           HN       CYS  16   7.427   2.751  -8.426
   41    HA   CYS  16           HA       CYS  16   7.696  -0.108  -7.904
   42    HB2  CYS  16           HB2      CYS  16   5.071   0.111  -7.618
   43    HB3  CYS  16           HB1      CYS  16   6.164   0.409  -6.269
   44    H    ALA  17           HN       ALA  17   7.595  -1.182  -9.987
   45    HA   ALA  17           HA       ALA  17   5.792  -0.017 -11.963
   46    HB1  ALA  17           HB1      ALA  17   8.590  -1.018 -12.488
   47    HB2  ALA  17           HB2      ALA  17   8.060   0.664 -12.533
   48    HB3  ALA  17           HB3      ALA  17   7.443  -0.488 -13.717
   49    HA   PRO  18           HA       PRO  18   5.177  -0.406 -13.787
   50    HB2  PRO  18           HB2      PRO  18   3.040  -1.563 -15.150
   51    HB3  PRO  18           HB1      PRO  18   4.707  -1.508 -15.722
   52    HG2  PRO  18           HG2      PRO  18   3.221  -3.806 -14.936
   53    HG3  PRO  18           HG1      PRO  18   4.894  -3.746 -15.429
   54    HD2  PRO  18           HD2      PRO  18   3.751  -3.879 -12.709
   55    HD3  PRO  18           HD1      PRO  18   5.359  -4.365 -13.280
   56    H    PHE  19           HN       PHE  19   3.359  -2.264 -11.610
   57    HA   PHE  19           HA       PHE  19   1.290  -0.183 -11.443
   58    HB2  PHE  19           HB2      PHE  19   0.993  -2.944 -10.275
   59    HB3  PHE  19           HB1      PHE  19  -0.265  -1.786 -10.680
   60    HD1  PHE  19           HD1      PHE  19   0.889  -4.836 -11.534
   61    HD2  PHE  19           HD2      PHE  19   0.023  -1.103 -13.386
   62    HE1  PHE  19           HE1      PHE  19   0.582  -5.982 -13.684
   63    HE2  PHE  19           HE2      PHE  19  -0.283  -2.244 -15.545
   64    HZ   PHE  19           HZ       PHE  19  -0.004  -4.687 -15.695
   65    H    CYS  20           HN       CYS  20   0.580   0.304  -9.200
   66    HA   CYS  20           HA       CYS  20   2.652  -0.336  -7.243
   67    HB2  CYS  20           HB2      CYS  20   2.721   2.023  -8.366
   68    HB3  CYS  20           HB1      CYS  20   1.356   2.362  -7.309
   69    HN1  NH2  21           H1       CYS  20   0.619  -1.892  -7.125
   70    HN2  NH2  21           H2       CYS  20  -0.535  -1.436  -5.921
  Start of MODEL    6
    1    H1   GLY  11           HT1      GLY  11  -0.564   4.099  -2.313
    2    H2   GLY  11           HT2      GLY  11  -1.391   2.625  -2.325
    3    H3   GLY  11           HT3      GLY  11  -1.663   3.755  -3.555
    4    HA2  GLY  11           HA1      GLY  11  -0.261   1.944  -4.318
    5    HA3  GLY  11           HA2      GLY  11   0.584   3.486  -4.345
    6    H    PHE  12           HN       PHE  12   2.168   1.394  -4.378
    7    HA   PHE  12           HA       PHE  12   2.953   0.863  -1.594
    8    HB2  PHE  12           HB2      PHE  12   3.804  -0.476  -4.179
    9    HB3  PHE  12           HB1      PHE  12   4.612  -0.751  -2.650
   10    HD1  PHE  12           HD1      PHE  12   1.282  -1.026  -4.298
   11    HD2  PHE  12           HD2      PHE  12   3.822  -2.314  -1.133
   12    HE1  PHE  12           HE1      PHE  12  -0.336  -2.779  -3.714
   13    HE2  PHE  12           HE2      PHE  12   2.204  -4.070  -0.546
   14    HZ   PHE  12           HZ       PHE  12   0.122  -4.305  -1.836
   15    H    ARG  13           HN       ARG  13   5.562   0.597  -1.535
   16    HA   ARG  13           HA       ARG  13   6.500   3.252  -1.649
   17    HB2  ARG  13           HB2      ARG  13   8.698   2.324  -0.999
   18    HB3  ARG  13           HB1      ARG  13   7.391   1.738   0.015
   19    HG2  ARG  13           HG2      ARG  13   7.396  -0.384  -1.165
   20    HG3  ARG  13           HG1      ARG  13   8.651   0.210  -2.255
   21    HD2  ARG  13           HD2      ARG  13  10.186   0.446  -0.382
   22    HD3  ARG  13           HD1      ARG  13   8.928  -0.082   0.734
   23    HE   ARG  13           HE       ARG  13   9.127  -2.124  -1.061
   24   HH11  ARG  13          HH11      ARG  13  11.438  -0.461   0.981
   25   HH12  ARG  13          HH12      ARG  13  12.419  -1.864   1.230
   26   HH21  ARG  13          HH21      ARG  13  10.441  -3.981  -0.737
   27   HH22  ARG  13          HH22      ARG  13  11.859  -3.860   0.250
   28    H    SER  14           HN       SER  14   7.172   4.368  -3.297
   29    HA   SER  14           HA       SER  14   7.798   3.137  -5.816
   30    HB2  SER  14           HB2      SER  14   7.981   6.041  -4.968
   31    HB3  SER  14           HB1      SER  14   7.984   5.434  -6.624
   32    HG   SER  14           HG       SER  14   5.856   4.425  -5.839
   33    HA   PRO  15           HA       PRO  15   9.098   4.091  -7.725
   34    HB2  PRO  15           HB2      PRO  15  11.207   2.277  -8.665
   35    HB3  PRO  15           HB1      PRO  15  10.780   3.888  -9.244
   36    HG2  PRO  15           HG2      PRO  15  13.053   3.435  -7.881
   37    HG3  PRO  15           HG1      PRO  15  12.145   4.948  -7.711
   38    HD2  PRO  15           HD2      PRO  15  12.179   2.551  -5.909
   39    HD3  PRO  15           HD1      PRO  15  12.259   4.276  -5.488
   40    H    CYS  16           HN       CYS  16   7.461   2.773  -8.331
   41    HA   CYS  16           HA       CYS  16   7.727  -0.099  -7.852
   42    HB2  CYS  16           HB2      CYS  16   5.114   0.162  -7.482
   43    HB3  CYS  16           HB1      CYS  16   6.255   0.435  -6.169
   44    H    ALA  17           HN       ALA  17   7.582  -1.122  -9.964
   45    HA   ALA  17           HA       ALA  17   5.665   0.007 -11.846
   46    HB1  ALA  17           HB1      ALA  17   8.482  -0.846 -12.515
   47    HB2  ALA  17           HB2      ALA  17   7.889   0.813 -12.470
   48    HB3  ALA  17           HB3      ALA  17   7.262  -0.315 -13.670
   49    HA   PRO  18           HA       PRO  18   5.130  -0.442 -13.794
   50    HB2  PRO  18           HB2      PRO  18   2.997  -1.492 -15.104
   51    HB3  PRO  18           HB1      PRO  18   4.666  -1.746 -15.624
   52    HG2  PRO  18           HG2      PRO  18   2.811  -3.602 -14.283
   53    HG3  PRO  18           HG1      PRO  18   4.159  -3.961 -15.345
   54    HD2  PRO  18           HD2      PRO  18   4.117  -4.129 -12.522
   55    HD3  PRO  18           HD1      PRO  18   5.541  -4.262 -13.568
   56    H    PHE  19           HN       PHE  19   2.925  -2.485 -11.938
   57    HA   PHE  19           HA       PHE  19   1.188  -0.176 -11.456
   58    HB2  PHE  19           HB2      PHE  19   0.693  -2.958 -10.398
   59    HB3  PHE  19           HB1      PHE  19  -0.469  -1.669 -10.662
   60    HD1  PHE  19           HD1      PHE  19   0.100  -4.752 -11.682
   61    HD2  PHE  19           HD2      PHE  19  -0.034  -0.857 -13.395
   62    HE1  PHE  19           HE1      PHE  19  -0.448  -5.733 -13.865
   63    HE2  PHE  19           HE2      PHE  19  -0.581  -1.837 -15.582
   64    HZ   PHE  19           HZ       PHE  19  -0.790  -4.277 -15.819
   65    H    CYS  20           HN       CYS  20   0.828   0.578  -9.353
   66    HA   CYS  20           HA       CYS  20   2.891  -0.276  -7.468
   67    HB2  CYS  20           HB2      CYS  20   2.919   2.098  -8.424
   68    HB3  CYS  20           HB1      CYS  20   1.470   2.378  -7.465
   69    HN1  NH2  21           H1       CYS  20   1.301  -1.975  -6.959
   70    HN2  NH2  21           H2       CYS  20   0.049  -1.619  -5.821
  Start of MODEL    7
    1    H1   GLY  11           HT1      GLY  11   1.066   2.314  -1.428
    2    H2   GLY  11           HT2      GLY  11   0.170   0.892  -1.308
    3    H3   GLY  11           HT3      GLY  11  -0.391   2.166  -2.271
    4    HA2  GLY  11           HA1      GLY  11   0.547   0.415  -3.634
    5    HA3  GLY  11           HA2      GLY  11   1.468   1.904  -3.767
    6    H    PHE  12           HN       PHE  12   2.867  -0.053  -4.579
    7    HA   PHE  12           HA       PHE  12   4.257  -1.450  -2.450
    8    HB2  PHE  12           HB2      PHE  12   4.701  -1.420  -5.454
    9    HB3  PHE  12           HB1      PHE  12   5.745  -2.271  -4.333
   10    HD1  PHE  12           HD1      PHE  12   2.137  -2.019  -5.253
   11    HD2  PHE  12           HD2      PHE  12   5.317  -4.450  -3.819
   12    HE1  PHE  12           HE1      PHE  12   0.661  -3.984  -5.312
   13    HE2  PHE  12           HE2      PHE  12   3.850  -6.415  -3.877
   14    HZ   PHE  12           HZ       PHE  12   1.516  -6.185  -4.625
   15    H    ARG  13           HN       ARG  13   6.815  -1.478  -2.847
   16    HA   ARG  13           HA       ARG  13   7.696   1.050  -1.977
   17    HB2  ARG  13           HB2      ARG  13   9.989   0.078  -2.140
   18    HB3  ARG  13           HB1      ARG  13   8.865  -0.890  -1.204
   19    HG2  ARG  13           HG2      ARG  13   8.588  -2.404  -3.105
   20    HG3  ARG  13           HG1      ARG  13   9.712  -1.419  -4.044
   21    HD2  ARG  13           HD2      ARG  13  11.479  -1.884  -2.416
   22    HD3  ARG  13           HD1      ARG  13  10.353  -2.857  -1.472
   23    HE   ARG  13           HE       ARG  13  10.391  -3.872  -4.061
   24   HH11  ARG  13          HH11      ARG  13  12.590  -3.573  -1.334
   25   HH12  ARG  13          HH12      ARG  13  13.504  -4.976  -1.766
   26   HH21  ARG  13          HH21      ARG  13  11.602  -5.734  -4.607
   27   HH22  ARG  13          HH22      ARG  13  12.944  -6.205  -3.622
   28    H    SER  14           HN       SER  14   8.193   2.773  -3.069
   29    HA   SER  14           HA       SER  14   8.243   2.731  -5.937
   30    HB2  SER  14           HB2      SER  14   8.701   5.043  -4.037
   31    HB3  SER  14           HB1      SER  14   8.307   5.151  -5.754
   32    HG   SER  14           HG       SER  14   6.358   3.831  -5.048
   33    HA   PRO  15           HA       PRO  15   9.082   3.988  -7.659
   34    HB2  PRO  15           HB2      PRO  15  10.441   2.903  -9.753
   35    HB3  PRO  15           HB1      PRO  15  10.783   4.513  -9.112
   36    HG2  PRO  15           HG2      PRO  15  12.203   1.931  -8.600
   37    HG3  PRO  15           HG1      PRO  15  12.879   3.544  -8.889
   38    HD2  PRO  15           HD2      PRO  15  12.669   2.470  -6.412
   39    HD3  PRO  15           HD1      PRO  15  12.541   4.214  -6.713
   40    H    CYS  16           HN       CYS  16   7.319   2.735  -7.994
   41    HA   CYS  16           HA       CYS  16   7.682  -0.152  -7.921
   42    HB2  CYS  16           HB2      CYS  16   5.031   0.141  -7.585
   43    HB3  CYS  16           HB1      CYS  16   6.185   0.202  -6.255
   44    H    ALA  17           HN       ALA  17   7.550  -1.147 -10.017
   45    HA   ALA  17           HA       ALA  17   5.675   0.005 -11.924
   46    HB1  ALA  17           HB1      ALA  17   7.311  -0.331 -13.713
   47    HB2  ALA  17           HB2      ALA  17   8.501  -0.863 -12.527
   48    HB3  ALA  17           HB3      ALA  17   7.911   0.797 -12.499
   49    HA   PRO  18           HA       PRO  18   5.144  -0.400 -13.833
   50    HB2  PRO  18           HB2      PRO  18   2.983  -1.688 -15.127
   51    HB3  PRO  18           HB1      PRO  18   4.600  -1.434 -15.783
   52    HG2  PRO  18           HG2      PRO  18   3.452  -3.907 -15.127
   53    HG3  PRO  18           HG1      PRO  18   5.138  -3.615 -15.485
   54    HD2  PRO  18           HD2      PRO  18   3.801  -3.919 -12.846
   55    HD3  PRO  18           HD1      PRO  18   5.457  -4.348 -13.328
   56    H    PHE  19           HN       PHE  19   3.457  -2.249 -11.588
   57    HA   PHE  19           HA       PHE  19   1.316  -0.238 -11.396
   58    HB2  PHE  19           HB2      PHE  19   1.061  -3.023 -10.291
   59    HB3  PHE  19           HB1      PHE  19  -0.210  -1.887 -10.719
   60    HD1  PHE  19           HD1      PHE  19   1.107  -4.881 -11.585
   61    HD2  PHE  19           HD2      PHE  19   0.086  -1.162 -13.384
   62    HE1  PHE  19           HE1      PHE  19   0.918  -5.992 -13.765
   63    HE2  PHE  19           HE2      PHE  19  -0.104  -2.269 -15.571
   64    HZ   PHE  19           HZ       PHE  19   0.314  -4.688 -15.762
   65    H    CYS  20           HN       CYS  20   0.718   0.374  -9.260
   66    HA   CYS  20           HA       CYS  20   2.655  -0.392  -7.206
   67    HB2  CYS  20           HB2      CYS  20   3.051   1.896  -8.326
   68    HB3  CYS  20           HB1      CYS  20   1.600   2.412  -7.475
   69    HN1  NH2  21           H1       CYS  20   0.758  -1.832  -6.804
   70    HN2  NH2  21           H2       CYS  20  -0.501  -1.226  -5.787
  Start of MODEL    8
    1    H1   GLY  11           HT1      GLY  11  -0.623   0.869  -0.732
    2    H2   GLY  11           HT2      GLY  11  -0.887  -0.471  -1.722
    3    H3   GLY  11           HT3      GLY  11  -1.813   0.927  -1.930
    4    HA2  GLY  11           HA1      GLY  11  -0.126   0.740  -3.643
    5    HA3  GLY  11           HA2      GLY  11   0.123   2.156  -2.626
    6    H    PHE  12           HN       PHE  12   1.884   0.088  -4.213
    7    HA   PHE  12           HA       PHE  12   3.555  -0.964  -2.115
    8    HB2  PHE  12           HB2      PHE  12   3.876  -1.006  -5.129
    9    HB3  PHE  12           HB1      PHE  12   5.103  -1.606  -4.034
   10    HD1  PHE  12           HD1      PHE  12   1.543  -2.089  -4.998
   11    HD2  PHE  12           HD2      PHE  12   4.982  -3.734  -3.102
   12    HE1  PHE  12           HE1      PHE  12   0.414  -4.263  -4.838
   13    HE2  PHE  12           HE2      PHE  12   3.856  -5.912  -2.943
   14    HZ   PHE  12           HZ       PHE  12   1.569  -6.179  -3.810
   15    H    ARG  13           HN       ARG  13   6.079  -0.647  -2.666
   16    HA   ARG  13           HA       ARG  13   6.501   2.124  -1.917
   17    HB2  ARG  13           HB2      ARG  13   8.466  -0.177  -2.047
   18    HB3  ARG  13           HB1      ARG  13   8.799   1.421  -1.405
   19    HG2  ARG  13           HG2      ARG  13   7.242   1.123   0.370
   20    HG3  ARG  13           HG1      ARG  13   6.673  -0.398  -0.318
   21    HD2  ARG  13           HD2      ARG  13   8.774  -1.448   0.109
   22    HD3  ARG  13           HD1      ARG  13   9.503   0.086   0.583
   23    HE   ARG  13           HE       ARG  13   7.738   0.018   2.432
   24   HH11  ARG  13          HH11      ARG  13   9.255  -2.849   1.091
   25   HH12  ARG  13          HH12      ARG  13   9.123  -3.754   2.553
   26   HH21  ARG  13          HH21      ARG  13   7.571  -1.184   4.371
   27   HH22  ARG  13          HH22      ARG  13   8.158  -2.811   4.432
   28    H    SER  14           HN       SER  14   6.992   3.644  -3.303
   29    HA   SER  14           HA       SER  14   7.705   3.101  -6.003
   30    HB2  SER  14           HB2      SER  14   7.790   5.721  -4.483
   31    HB3  SER  14           HB1      SER  14   7.779   5.528  -6.236
   32    HG   SER  14           HG       SER  14   5.701   4.275  -5.683
   33    HA   PRO  15           HA       PRO  15   8.909   4.113  -7.728
   34    HB2  PRO  15           HB2      PRO  15  11.059   2.452  -8.851
   35    HB3  PRO  15           HB1      PRO  15  10.558   4.084  -9.303
   36    HG2  PRO  15           HG2      PRO  15  12.883   3.615  -8.027
   37    HG3  PRO  15           HG1      PRO  15  11.929   5.081  -7.738
   38    HD2  PRO  15           HD2      PRO  15  12.102   2.582  -6.096
   39    HD3  PRO  15           HD1      PRO  15  12.114   4.279  -5.567
   40    H    CYS  16           HN       CYS  16   7.308   2.770  -8.353
   41    HA   CYS  16           HA       CYS  16   7.670  -0.095  -7.931
   42    HB2  CYS  16           HB2      CYS  16   5.004   0.140  -7.704
   43    HB3  CYS  16           HB1      CYS  16   6.094   0.294  -6.331
   44    H    ALA  17           HN       ALA  17   7.574  -1.185  -9.988
   45    HA   ALA  17           HA       ALA  17   5.801  -0.043 -11.997
   46    HB1  ALA  17           HB1      ALA  17   7.473  -0.489 -13.718
   47    HB2  ALA  17           HB2      ALA  17   8.595  -1.070 -12.492
   48    HB3  ALA  17           HB3      ALA  17   8.105   0.625 -12.507
   49    HA   PRO  18           HA       PRO  18   5.214  -0.479 -13.861
   50    HB2  PRO  18           HB2      PRO  18   2.878  -1.771 -14.913
   51    HB3  PRO  18           HB1      PRO  18   4.398  -1.449 -15.746
   52    HG2  PRO  18           HG2      PRO  18   3.477  -3.973 -15.101
   53    HG3  PRO  18           HG1      PRO  18   5.154  -3.577 -15.417
   54    HD2  PRO  18           HD2      PRO  18   3.763  -3.919 -12.797
   55    HD3  PRO  18           HD1      PRO  18   5.406  -4.402 -13.268
   56    H    PHE  19           HN       PHE  19   3.230  -2.325 -11.702
   57    HA   PHE  19           HA       PHE  19   1.323  -0.096 -11.440
   58    HB2  PHE  19           HB2      PHE  19   0.837  -2.794 -10.228
   59    HB3  PHE  19           HB1      PHE  19  -0.325  -1.626 -10.844
   60    HD1  PHE  19           HD1      PHE  19   1.026  -4.730 -11.413
   61    HD2  PHE  19           HD2      PHE  19   0.057  -1.148 -13.497
   62    HE1  PHE  19           HE1      PHE  19   0.944  -5.985 -13.520
   63    HE2  PHE  19           HE2      PHE  19  -0.027  -2.398 -15.613
   64    HZ   PHE  19           HZ       PHE  19   0.418  -4.821 -15.626
   65    H    CYS  20           HN       CYS  20   0.581   0.316  -9.181
   66    HA   CYS  20           HA       CYS  20   2.663  -0.353  -7.234
   67    HB2  CYS  20           HB2      CYS  20   2.731   2.031  -8.295
   68    HB3  CYS  20           HB1      CYS  20   1.359   2.346  -7.239
   69    HN1  NH2  21           H1       CYS  20   0.668  -1.924  -7.122
   70    HN2  NH2  21           H2       CYS  20  -0.494  -1.511  -5.909
  Start of MODEL    9
    1    H1   GLY  11           HT1      GLY  11   0.440   3.341  -1.904
    2    H2   GLY  11           HT2      GLY  11  -0.501   1.958  -1.643
    3    H3   GLY  11           HT3      GLY  11  -0.940   3.064  -2.843
    4    HA2  GLY  11           HA1      GLY  11   0.070   1.102  -3.800
    5    HA3  GLY  11           HA2      GLY  11   1.025   2.547  -4.104
    6    H    PHE  12           HN       PHE  12   2.467   0.474  -4.433
    7    HA   PHE  12           HA       PHE  12   3.624  -0.501  -1.949
    8    HB2  PHE  12           HB2      PHE  12   4.330  -1.064  -4.851
    9    HB3  PHE  12           HB1      PHE  12   5.269  -1.672  -3.501
   10    HD1  PHE  12           HD1      PHE  12   1.692  -1.544  -4.567
   11    HD2  PHE  12           HD2      PHE  12   4.836  -3.792  -2.794
   12    HE1  PHE  12           HE1      PHE  12   0.194  -3.481  -4.374
   13    HE2  PHE  12           HE2      PHE  12   3.343  -5.735  -2.598
   14    HZ   PHE  12           HZ       PHE  12   1.017  -5.581  -3.389
   15    H    ARG  13           HN       ARG  13   6.181  -0.578  -2.018
   16    HA   ARG  13           HA       ARG  13   7.032   2.081  -1.621
   17    HB2  ARG  13           HB2      ARG  13   9.304   1.084  -1.313
   18    HB3  ARG  13           HB1      ARG  13   8.057   0.339  -0.326
   19    HG2  ARG  13           HG2      ARG  13   7.942  -1.541  -1.874
   20    HG3  ARG  13           HG1      ARG  13   9.163  -0.781  -2.893
   21    HD2  ARG  13           HD2      ARG  13  10.784  -0.920  -1.083
   22    HD3  ARG  13           HD1      ARG  13   9.563  -1.618  -0.022
   23    HE   ARG  13           HE       ARG  13   9.603  -3.297  -2.153
   24   HH11  ARG  13          HH11      ARG  13  12.094  -2.110   0.027
   25   HH12  ARG  13          HH12      ARG  13  13.058  -3.539  -0.105
   26   HH21  ARG  13          HH21      ARG  13  10.875  -5.185  -2.308
   27   HH22  ARG  13          HH22      ARG  13  12.363  -5.299  -1.429
   28    H    SER  14           HN       SER  14   7.693   3.533  -3.009
   29    HA   SER  14           HA       SER  14   8.119   2.834  -5.770
   30    HB2  SER  14           HB2      SER  14   8.255   5.521  -4.380
   31    HB3  SER  14           HB1      SER  14   8.199   5.252  -6.122
   32    HG   SER  14           HG       SER  14   6.147   4.092  -5.622
   33    HA   PRO  15           HA       PRO  15   9.205   4.057  -7.567
   34    HB2  PRO  15           HB2      PRO  15  11.260   2.504  -8.964
   35    HB3  PRO  15           HB1      PRO  15  10.758   4.174  -9.227
   36    HG2  PRO  15           HG2      PRO  15  13.154   3.547  -8.156
   37    HG3  PRO  15           HG1      PRO  15  12.263   5.009  -7.699
   38    HD2  PRO  15           HD2      PRO  15  12.481   2.393  -6.255
   39    HD3  PRO  15           HD1      PRO  15  12.557   4.047  -5.607
   40    H    CYS  16           HN       CYS  16   7.544   2.753  -8.168
   41    HA   CYS  16           HA       CYS  16   7.951  -0.137  -7.971
   42    HB2  CYS  16           HB2      CYS  16   5.348  -0.011  -7.495
   43    HB3  CYS  16           HB1      CYS  16   6.531   0.218  -6.209
   44    H    ALA  17           HN       ALA  17   7.779  -1.041 -10.111
   45    HA   ALA  17           HA       ALA  17   5.703   0.054 -11.845
   46    HB1  ALA  17           HB1      ALA  17   7.863   0.928 -12.590
   47    HB2  ALA  17           HB2      ALA  17   7.209  -0.214 -13.765
   48    HB3  ALA  17           HB3      ALA  17   8.503  -0.712 -12.675
   49    HA   PRO  18           HA       PRO  18   5.070  -0.382 -13.759
   50    HB2  PRO  18           HB2      PRO  18   2.914  -1.466 -14.989
   51    HB3  PRO  18           HB1      PRO  18   4.563  -1.681 -15.581
   52    HG2  PRO  18           HG2      PRO  18   2.810  -3.585 -14.162
   53    HG3  PRO  18           HG1      PRO  18   4.095  -3.910 -15.309
   54    HD2  PRO  18           HD2      PRO  18   4.238  -4.118 -12.494
   55    HD3  PRO  18           HD1      PRO  18   5.599  -4.191 -13.625
   56    H    PHE  19           HN       PHE  19   2.793  -2.548 -12.050
   57    HA   PHE  19           HA       PHE  19   1.089  -0.269 -11.430
   58    HB2  PHE  19           HB2      PHE  19   0.650  -3.077 -10.423
   59    HB3  PHE  19           HB1      PHE  19  -0.537  -1.803 -10.645
   60    HD1  PHE  19           HD1      PHE  19   0.065  -4.850 -11.747
   61    HD2  PHE  19           HD2      PHE  19  -0.130  -0.920 -13.362
   62    HE1  PHE  19           HE1      PHE  19  -0.479  -5.790 -13.953
   63    HE2  PHE  19           HE2      PHE  19  -0.673  -1.853 -15.572
   64    HZ   PHE  19           HZ       PHE  19  -0.847  -4.290 -15.869
   65    H    CYS  20           HN       CYS  20   0.672   0.420  -9.310
   66    HA   CYS  20           HA       CYS  20   2.549  -0.567  -7.310
   67    HB2  CYS  20           HB2      CYS  20   3.291   1.588  -8.428
   68    HB3  CYS  20           HB1      CYS  20   1.880   2.348  -7.704
   69    HN1  NH2  21           H1       CYS  20   0.633  -1.754  -6.653
   70    HN2  NH2  21           H2       CYS  20  -0.577  -0.965  -5.703
  Start of MODEL   10
    1    H1   GLY  11           HT1      GLY  11   0.593   2.825  -1.420
    2    H2   GLY  11           HT2      GLY  11  -0.392   1.462  -1.582
    3    H3   GLY  11           HT3      GLY  11  -0.746   2.869  -2.449
    4    HA2  GLY  11           HA1      GLY  11   0.257   1.228  -3.889
    5    HA3  GLY  11           HA2      GLY  11   1.288   2.643  -3.713
    6    H    PHE  12           HN       PHE  12   2.600   0.549  -4.564
    7    HA   PHE  12           HA       PHE  12   3.627  -0.939  -2.269
    8    HB2  PHE  12           HB2      PHE  12   4.228  -1.228  -5.231
    9    HB3  PHE  12           HB1      PHE  12   5.033  -2.143  -3.973
   10    HD1  PHE  12           HD1      PHE  12   1.752  -1.578  -5.594
   11    HD2  PHE  12           HD2      PHE  12   4.021  -3.981  -2.906
   12    HE1  PHE  12           HE1      PHE  12  -0.032  -3.261  -5.598
   13    HE2  PHE  12           HE2      PHE  12   2.234  -5.667  -2.908
   14    HZ   PHE  12           HZ       PHE  12   0.204  -5.307  -4.255
   15    H    ARG  13           HN       ARG  13   6.168  -1.352  -2.583
   16    HA   ARG  13           HA       ARG  13   7.411   0.954  -1.616
   17    HB2  ARG  13           HB2      ARG  13   8.778  -1.432  -2.885
   18    HB3  ARG  13           HB1      ARG  13   9.500  -0.285  -1.770
   19    HG2  ARG  13           HG2      ARG  13   8.044  -1.054   0.010
   20    HG3  ARG  13           HG1      ARG  13   7.240  -2.159  -1.105
   21    HD2  ARG  13           HD2      ARG  13   9.427  -3.283  -1.473
   22    HD3  ARG  13           HD1      ARG  13  10.121  -2.249  -0.224
   23    HE   ARG  13           HE       ARG  13   7.889  -3.487   0.879
   24   HH11  ARG  13          HH11      ARG  13  11.040  -4.425  -0.357
   25   HH12  ARG  13          HH12      ARG  13  11.144  -5.844   0.623
   26   HH21  ARG  13          HH21      ARG  13   8.030  -5.375   2.179
   27   HH22  ARG  13          HH22      ARG  13   9.424  -6.390   2.076
   28    H    SER  14           HN       SER  14   8.087   2.711  -2.635
   29    HA   SER  14           HA       SER  14   8.198   2.744  -5.530
   30    HB2  SER  14           HB2      SER  14   8.541   4.990  -3.533
   31    HB3  SER  14           HB1      SER  14   8.355   5.174  -5.278
   32    HG   SER  14           HG       SER  14   6.415   3.702  -3.915
   33    HA   PRO  15           HA       PRO  15   9.121   3.902  -7.223
   34    HB2  PRO  15           HB2      PRO  15  10.577   2.803  -9.227
   35    HB3  PRO  15           HB1      PRO  15  10.933   4.402  -8.563
   36    HG2  PRO  15           HG2      PRO  15  12.236   1.775  -7.959
   37    HG3  PRO  15           HG1      PRO  15  12.987   3.355  -8.252
   38    HD2  PRO  15           HD2      PRO  15  12.630   2.360  -5.763
   39    HD3  PRO  15           HD1      PRO  15  12.558   4.098  -6.110
   40    H    CYS  16           HN       CYS  16   7.552   2.642  -8.182
   41    HA   CYS  16           HA       CYS  16   7.871  -0.255  -7.955
   42    HB2  CYS  16           HB2      CYS  16   5.223  -0.002  -7.544
   43    HB3  CYS  16           HB1      CYS  16   6.404  -0.004  -6.238
   44    H    ALA  17           HN       ALA  17   7.686  -1.136 -10.110
   45    HA   ALA  17           HA       ALA  17   5.741   0.141 -11.858
   46    HB1  ALA  17           HB1      ALA  17   7.957   0.993 -12.448
   47    HB2  ALA  17           HB2      ALA  17   7.287  -0.007 -13.737
   48    HB3  ALA  17           HB3      ALA  17   8.533  -0.658 -12.672
   49    HA   PRO  18           HA       PRO  18   4.926  -0.045 -13.532
   50    HB2  PRO  18           HB2      PRO  18   2.944  -1.231 -15.102
   51    HB3  PRO  18           HB1      PRO  18   4.577  -0.834 -15.638
   52    HG2  PRO  18           HG2      PRO  18   3.479  -3.423 -15.366
   53    HG3  PRO  18           HG1      PRO  18   5.157  -3.033 -15.675
   54    HD2  PRO  18           HD2      PRO  18   3.836  -3.720 -13.096
   55    HD3  PRO  18           HD1      PRO  18   5.500  -4.044 -13.636
   56    H    PHE  19           HN       PHE  19   3.511  -2.374 -11.574
   57    HA   PHE  19           HA       PHE  19   1.017  -0.843 -11.281
   58    HB2  PHE  19           HB2      PHE  19   1.449  -3.626 -10.212
   59    HB3  PHE  19           HB1      PHE  19  -0.070  -2.805 -10.549
   60    HD1  PHE  19           HD1      PHE  19   2.002  -5.326 -11.623
   61    HD2  PHE  19           HD2      PHE  19  -0.228  -2.042 -13.154
   62    HE1  PHE  19           HE1      PHE  19   1.940  -6.403 -13.829
   63    HE2  PHE  19           HE2      PHE  19  -0.293  -3.112 -15.366
   64    HZ   PHE  19           HZ       PHE  19   0.793  -5.297 -15.706
   65    H    CYS  20           HN       CYS  20   0.937   0.406  -9.530
   66    HA   CYS  20           HA       CYS  20   2.348  -0.487  -7.147
   67    HB2  CYS  20           HB2      CYS  20   3.571   1.317  -8.425
   68    HB3  CYS  20           HB1      CYS  20   2.216   2.379  -8.055
   69    HN1  NH2  21           H1       CYS  20   0.253  -1.246  -6.519
   70    HN2  NH2  21           H2       CYS  20  -0.934  -0.145  -5.916
  Start of MODEL   11
    1    H1   GLY  11           HT1      GLY  11  -0.792   2.540  -1.223
    2    H2   GLY  11           HT2      GLY  11  -1.453   1.075  -1.738
    3    H3   GLY  11           HT3      GLY  11  -2.023   2.534  -2.383
    4    HA2  GLY  11           HA1      GLY  11  -0.583   1.412  -3.951
    5    HA3  GLY  11           HA2      GLY  11   0.095   2.948  -3.426
    6    H    PHE  12           HN       PHE  12   1.722   1.067  -4.522
    7    HA   PHE  12           HA       PHE  12   2.986  -0.379  -2.324
    8    HB2  PHE  12           HB2      PHE  12   3.497  -0.414  -5.313
    9    HB3  PHE  12           HB1      PHE  12   4.611  -1.136  -4.169
   10    HD1  PHE  12           HD1      PHE  12   0.918  -1.158  -4.750
   11    HD2  PHE  12           HD2      PHE  12   4.438  -3.384  -3.908
   12    HE1  PHE  12           HE1      PHE  12  -0.401  -3.233  -4.746
   13    HE2  PHE  12           HE2      PHE  12   3.129  -5.464  -3.900
   14    HZ   PHE  12           HZ       PHE  12   0.706  -5.390  -4.320
   15    H    ARG  13           HN       ARG  13   5.527  -0.353  -2.571
   16    HA   ARG  13           HA       ARG  13   6.268   2.353  -1.887
   17    HB2  ARG  13           HB2      ARG  13   8.433   1.344  -1.236
   18    HB3  ARG  13           HB1      ARG  13   7.060   0.592  -0.446
   19    HG2  ARG  13           HG2      ARG  13   7.176  -1.292  -1.995
   20    HG3  ARG  13           HG1      ARG  13   8.525  -0.529  -2.831
   21    HD2  ARG  13           HD2      ARG  13   8.552  -1.284   0.084
   22    HD3  ARG  13           HD1      ARG  13   9.162  -2.319  -1.205
   23    HE   ARG  13           HE       ARG  13  10.545  -0.073  -1.627
   24   HH11  ARG  13          HH11      ARG  13   9.934  -1.888   1.302
   25   HH12  ARG  13          HH12      ARG  13  11.430  -1.450   2.048
   26   HH21  ARG  13          HH21      ARG  13  12.537   0.522  -0.651
   27   HH22  ARG  13          HH22      ARG  13  12.924  -0.064   0.930
   28    H    SER  14           HN       SER  14   7.377   3.734  -3.109
   29    HA   SER  14           HA       SER  14   7.994   3.013  -5.817
   30    HB2  SER  14           HB2      SER  14   8.372   5.599  -4.290
   31    HB3  SER  14           HB1      SER  14   8.679   5.405  -6.015
   32    HG   SER  14           HG       SER  14   6.189   4.601  -5.026
   33    HA   PRO  15           HA       PRO  15   9.312   3.769  -7.445
   34    HB2  PRO  15           HB2      PRO  15  11.233   2.025  -8.748
   35    HB3  PRO  15           HB1      PRO  15  11.032   3.768  -8.925
   36    HG2  PRO  15           HG2      PRO  15  13.198   2.614  -7.723
   37    HG3  PRO  15           HG1      PRO  15  12.614   4.240  -7.337
   38    HD2  PRO  15           HD2      PRO  15  12.190   1.671  -5.864
   39    HD3  PRO  15           HD1      PRO  15  12.517   3.297  -5.225
   40    H    CYS  16           HN       CYS  16   7.553   2.624  -8.091
   41    HA   CYS  16           HA       CYS  16   7.687  -0.298  -7.900
   42    HB2  CYS  16           HB2      CYS  16   5.049   0.147  -7.669
   43    HB3  CYS  16           HB1      CYS  16   6.134   0.129  -6.282
   44    H    ALA  17           HN       ALA  17   7.622  -1.159 -10.078
   45    HA   ALA  17           HA       ALA  17   5.793   0.142 -11.932
   46    HB1  ALA  17           HB1      ALA  17   8.049   0.932 -12.447
   47    HB2  ALA  17           HB2      ALA  17   7.418  -0.085 -13.741
   48    HB3  ALA  17           HB3      ALA  17   8.600  -0.736 -12.605
   49    HA   PRO  18           HA       PRO  18   4.938  -0.076 -13.564
   50    HB2  PRO  18           HB2      PRO  18   3.003  -1.205 -15.167
   51    HB3  PRO  18           HB1      PRO  18   4.681  -0.964 -15.652
   52    HG2  PRO  18           HG2      PRO  18   3.319  -3.441 -15.219
   53    HG3  PRO  18           HG1      PRO  18   4.988  -3.212 -15.690
   54    HD2  PRO  18           HD2      PRO  18   3.865  -3.760 -13.008
   55    HD3  PRO  18           HD1      PRO  18   5.498  -4.075 -13.632
   56    H    PHE  19           HN       PHE  19   3.550  -2.354 -11.564
   57    HA   PHE  19           HA       PHE  19   1.033  -0.854 -11.271
   58    HB2  PHE  19           HB2      PHE  19   1.570  -3.561 -10.060
   59    HB3  PHE  19           HB1      PHE  19   0.022  -2.794 -10.379
   60    HD1  PHE  19           HD1      PHE  19   2.159  -5.300 -11.402
   61    HD2  PHE  19           HD2      PHE  19  -0.320  -2.231 -12.990
   62    HE1  PHE  19           HE1      PHE  19   2.023  -6.520 -13.527
   63    HE2  PHE  19           HE2      PHE  19  -0.460  -3.444 -15.124
   64    HZ   PHE  19           HZ       PHE  19   0.712  -5.593 -15.394
   65    H    CYS  20           HN       CYS  20   0.779   0.330  -9.475
   66    HA   CYS  20           HA       CYS  20   2.460  -0.342  -7.182
   67    HB2  CYS  20           HB2      CYS  20   3.349   1.606  -8.543
   68    HB3  CYS  20           HB1      CYS  20   1.909   2.490  -8.053
   69    HN1  NH2  21           H1       CYS  20   0.068  -1.324  -7.141
   70    HN2  NH2  21           H2       CYS  20  -1.009  -0.427  -6.131
  Start of MODEL   12
    1    H1   GLY  11           HT1      GLY  11   0.149   0.345  -1.033
    2    H2   GLY  11           HT2      GLY  11  -0.317  -1.101  -1.769
    3    H3   GLY  11           HT3      GLY  11  -1.122   0.339  -2.146
    4    HA2  GLY  11           HA1      GLY  11   0.396  -0.292  -3.908
    5    HA3  GLY  11           HA2      GLY  11   0.857   1.229  -3.156
    6    H    PHE  12           HN       PHE  12   2.668  -0.270  -4.594
    7    HA   PHE  12           HA       PHE  12   4.272  -1.758  -2.661
    8    HB2  PHE  12           HB2      PHE  12   4.736  -1.247  -5.623
    9    HB3  PHE  12           HB1      PHE  12   5.804  -2.171  -4.590
   10    HD1  PHE  12           HD1      PHE  12   2.338  -2.116  -5.943
   11    HD2  PHE  12           HD2      PHE  12   5.446  -4.436  -4.177
   12    HE1  PHE  12           HE1      PHE  12   1.070  -4.165  -6.403
   13    HE2  PHE  12           HE2      PHE  12   4.174  -6.487  -4.636
   14    HZ   PHE  12           HZ       PHE  12   1.984  -6.355  -5.752
   15    H    ARG  13           HN       ARG  13   6.763  -1.284  -2.959
   16    HA   ARG  13           HA       ARG  13   7.094   1.415  -2.015
   17    HB2  ARG  13           HB2      ARG  13   9.135  -0.783  -2.420
   18    HB3  ARG  13           HB1      ARG  13   9.510   0.798  -1.774
   19    HG2  ARG  13           HG2      ARG  13   7.683  -1.251  -0.546
   20    HG3  ARG  13           HG1      ARG  13   9.282  -0.771   0.023
   21    HD2  ARG  13           HD2      ARG  13   6.774   0.908  -0.034
   22    HD3  ARG  13           HD1      ARG  13   7.630   0.317   1.388
   23    HE   ARG  13           HE       ARG  13   8.388   2.558  -0.322
   24   HH11  ARG  13          HH11      ARG  13   9.256   0.450   2.350
   25   HH12  ARG  13          HH12      ARG  13  10.430   1.543   2.992
   26   HH21  ARG  13          HH21      ARG  13   9.944   3.996   0.525
   27   HH22  ARG  13          HH22      ARG  13  10.829   3.566   1.950
   28    H    SER  14           HN       SER  14   7.664   3.117  -3.108
   29    HA   SER  14           HA       SER  14   8.059   2.986  -5.921
   30    HB2  SER  14           HB2      SER  14   8.436   5.497  -5.589
   31    HB3  SER  14           HB1      SER  14   6.865   4.857  -5.111
   32    HG   SER  14           HG       SER  14   7.412   5.972  -3.367
   33    HA   PRO  15           HA       PRO  15   9.018   4.113  -7.599
   34    HB2  PRO  15           HB2      PRO  15  10.583   3.061  -9.551
   35    HB3  PRO  15           HB1      PRO  15  10.840   4.679  -8.891
   36    HG2  PRO  15           HG2      PRO  15  12.258   2.124  -8.251
   37    HG3  PRO  15           HG1      PRO  15  12.931   3.746  -8.491
   38    HD2  PRO  15           HD2      PRO  15  12.519   2.668  -6.035
   39    HD3  PRO  15           HD1      PRO  15  12.419   4.411  -6.351
   40    H    CYS  16           HN       CYS  16   7.341   2.781  -8.098
   41    HA   CYS  16           HA       CYS  16   7.823  -0.090  -7.958
   42    HB2  CYS  16           HB2      CYS  16   5.169   0.069  -7.579
   43    HB3  CYS  16           HB1      CYS  16   6.339   0.175  -6.267
   44    H    ALA  17           HN       ALA  17   7.638  -1.120 -10.032
   45    HA   ALA  17           HA       ALA  17   5.709  -0.006 -11.914
   46    HB1  ALA  17           HB1      ALA  17   7.893   0.788 -12.601
   47    HB2  ALA  17           HB2      ALA  17   7.323  -0.436 -13.736
   48    HB3  ALA  17           HB3      ALA  17   8.540  -0.850 -12.531
   49    HA   PRO  18           HA       PRO  18   5.163  -0.489 -13.855
   50    HB2  PRO  18           HB2      PRO  18   2.995  -1.540 -15.104
   51    HB3  PRO  18           HB1      PRO  18   4.650  -1.823 -15.648
   52    HG2  PRO  18           HG2      PRO  18   2.799  -3.632 -14.230
   53    HG3  PRO  18           HG1      PRO  18   4.122  -4.026 -15.312
   54    HD2  PRO  18           HD2      PRO  18   4.138  -4.140 -12.487
   55    HD3  PRO  18           HD1      PRO  18   5.540  -4.303 -13.559
   56    H    PHE  19           HN       PHE  19   3.009  -2.426 -11.849
   57    HA   PHE  19           HA       PHE  19   1.319  -0.063 -11.435
   58    HB2  PHE  19           HB2      PHE  19   0.647  -2.836 -10.455
   59    HB3  PHE  19           HB1      PHE  19  -0.437  -1.475 -10.696
   60    HD1  PHE  19           HD1      PHE  19  -0.110  -4.541 -11.795
   61    HD2  PHE  19           HD2      PHE  19   0.183  -0.614 -13.412
   62    HE1  PHE  19           HE1      PHE  19  -0.670  -5.418 -14.025
   63    HE2  PHE  19           HE2      PHE  19  -0.374  -1.487 -15.641
   64    HZ   PHE  19           HZ       PHE  19  -0.800  -3.889 -15.949
   65    H    CYS  20           HN       CYS  20   0.665   0.407  -9.224
   66    HA   CYS  20           HA       CYS  20   2.642  -0.504  -7.272
   67    HB2  CYS  20           HB2      CYS  20   3.100   1.794  -8.294
   68    HB3  CYS  20           HB1      CYS  20   1.668   2.339  -7.429
   69    HN1  NH2  21           H1       CYS  20   0.664  -1.889  -6.912
   70    HN2  NH2  21           H2       CYS  20  -0.514  -1.291  -5.799
  Start of MODEL   13
    1    H1   GLY  11           HT1      GLY  11   0.555   3.025  -1.943
    2    H2   GLY  11           HT2      GLY  11  -0.195   1.585  -1.492
    3    H3   GLY  11           HT3      GLY  11  -0.881   2.545  -2.705
    4    HA2  GLY  11           HA1      GLY  11   0.206   0.675  -3.703
    5    HA3  GLY  11           HA2      GLY  11   1.066   2.154  -4.102
    6    H    PHE  12           HN       PHE  12   2.597   0.154  -4.483
    7    HA   PHE  12           HA       PHE  12   3.921  -0.794  -2.092
    8    HB2  PHE  12           HB2      PHE  12   4.742  -1.098  -5.001
    9    HB3  PHE  12           HB1      PHE  12   5.498  -1.893  -3.636
   10    HD1  PHE  12           HD1      PHE  12   2.388  -1.741  -5.640
   11    HD2  PHE  12           HD2      PHE  12   4.570  -3.809  -2.621
   12    HE1  PHE  12           HE1      PHE  12   0.822  -3.619  -5.794
   13    HE2  PHE  12           HE2      PHE  12   2.995  -5.690  -2.782
   14    HZ   PHE  12           HZ       PHE  12   1.121  -5.596  -4.367
   15    H    ARG  13           HN       ARG  13   6.500  -0.676  -2.289
   16    HA   ARG  13           HA       ARG  13   7.133   2.034  -1.760
   17    HB2  ARG  13           HB2      ARG  13   9.457   1.251  -1.494
   18    HB3  ARG  13           HB1      ARG  13   8.312   0.261  -0.600
   19    HG2  ARG  13           HG2      ARG  13   8.479  -1.505  -2.189
   20    HG3  ARG  13           HG1      ARG  13   9.373  -0.487  -3.312
   21    HD2  ARG  13           HD2      ARG  13  10.876  -2.034  -2.206
   22    HD3  ARG  13           HD1      ARG  13  11.237  -0.384  -1.715
   23    HE   ARG  13           HE       ARG  13  10.501  -0.869   0.434
   24   HH11  ARG  13          HH11      ARG  13   9.953  -3.608  -1.696
   25   HH12  ARG  13          HH12      ARG  13   9.730  -4.735  -0.404
   26   HH21  ARG  13          HH21      ARG  13  10.210  -2.362   2.153
   27   HH22  ARG  13          HH22      ARG  13   9.877  -4.019   1.798
   28    H    SER  14           HN       SER  14   7.853   3.601  -3.041
   29    HA   SER  14           HA       SER  14   8.155   3.116  -5.850
   30    HB2  SER  14           HB2      SER  14   8.504   5.626  -4.192
   31    HB3  SER  14           HB1      SER  14   8.598   5.578  -5.953
   32    HG   SER  14           HG       SER  14   6.342   4.441  -4.768
   33    HA   PRO  15           HA       PRO  15   9.155   3.982  -7.598
   34    HB2  PRO  15           HB2      PRO  15  10.649   2.787  -9.486
   35    HB3  PRO  15           HB1      PRO  15  11.025   4.401  -8.874
   36    HG2  PRO  15           HG2      PRO  15  12.258   1.771  -8.167
   37    HG3  PRO  15           HG1      PRO  15  13.043   3.335  -8.445
   38    HD2  PRO  15           HD2      PRO  15  12.501   2.321  -5.961
   39    HD3  PRO  15           HD1      PRO  15  12.636   4.055  -6.308
   40    H    CYS  16           HN       CYS  16   7.454   2.703  -8.107
   41    HA   CYS  16           HA       CYS  16   7.834  -0.190  -7.940
   42    HB2  CYS  16           HB2      CYS  16   5.183   0.069  -7.558
   43    HB3  CYS  16           HB1      CYS  16   6.353   0.120  -6.241
   44    H    ALA  17           HN       ALA  17   7.711  -1.098 -10.086
   45    HA   ALA  17           HA       ALA  17   5.753   0.080 -11.894
   46    HB1  ALA  17           HB1      ALA  17   7.341  -0.132 -13.746
   47    HB2  ALA  17           HB2      ALA  17   8.578  -0.698 -12.624
   48    HB3  ALA  17           HB3      ALA  17   7.961   0.948 -12.496
   49    HA   PRO  18           HA       PRO  18   5.039  -0.248 -13.677
   50    HB2  PRO  18           HB2      PRO  18   2.892  -1.301 -14.974
   51    HB3  PRO  18           HB1      PRO  18   4.541  -1.376 -15.598
   52    HG2  PRO  18           HG2      PRO  18   2.883  -3.502 -14.460
   53    HG3  PRO  18           HG1      PRO  18   4.282  -3.642 -15.506
   54    HD2  PRO  18           HD2      PRO  18   4.153  -4.010 -12.665
   55    HD3  PRO  18           HD1      PRO  18   5.584  -4.112 -13.707
   56    H    PHE  19           HN       PHE  19   2.933  -2.580 -12.011
   57    HA   PHE  19           HA       PHE  19   1.019  -0.492 -11.364
   58    HB2  PHE  19           HB2      PHE  19   0.931  -3.304 -10.286
   59    HB3  PHE  19           HB1      PHE  19  -0.399  -2.180 -10.510
   60    HD1  PHE  19           HD1      PHE  19   0.733  -5.146 -11.599
   61    HD2  PHE  19           HD2      PHE  19  -0.361  -1.360 -13.203
   62    HE1  PHE  19           HE1      PHE  19   0.236  -6.212 -13.758
   63    HE2  PHE  19           HE2      PHE  19  -0.856  -2.418 -15.369
   64    HZ   PHE  19           HZ       PHE  19  -0.558  -4.846 -15.646
   65    H    CYS  20           HN       CYS  20   0.756   0.412  -9.378
   66    HA   CYS  20           HA       CYS  20   2.544  -0.494  -7.264
   67    HB2  CYS  20           HB2      CYS  20   3.426   1.535  -8.453
   68    HB3  CYS  20           HB1      CYS  20   1.987   2.398  -7.921
   69    HN1  NH2  21           H1       CYS  20   0.569  -1.569  -6.594
   70    HN2  NH2  21           H2       CYS  20  -0.634  -0.683  -5.728
  Start of MODEL   14
    1    H1   GLY  11           HT1      GLY  11  -0.958   0.121  -1.259
    2    H2   GLY  11           HT2      GLY  11  -1.012  -1.089  -2.440
    3    H3   GLY  11           HT3      GLY  11  -1.974   0.291  -2.600
    4    HA2  GLY  11           HA1      GLY  11  -0.048   0.378  -4.065
    5    HA3  GLY  11           HA2      GLY  11  -0.042   1.675  -2.878
    6    H    PHE  12           HN       PHE  12   2.257   0.708  -4.256
    7    HA   PHE  12           HA       PHE  12   3.702  -0.564  -2.019
    8    HB2  PHE  12           HB2      PHE  12   4.197  -0.779  -4.995
    9    HB3  PHE  12           HB1      PHE  12   5.412  -1.212  -3.806
   10    HD1  PHE  12           HD1      PHE  12   1.915  -1.987  -4.830
   11    HD2  PHE  12           HD2      PHE  12   5.436  -3.315  -2.840
   12    HE1  PHE  12           HE1      PHE  12   0.939  -4.227  -4.605
   13    HE2  PHE  12           HE2      PHE  12   4.461  -5.560  -2.612
   14    HZ   PHE  12           HZ       PHE  12   2.208  -6.016  -3.495
   15    H    ARG  13           HN       ARG  13   6.218  -0.090  -2.400
   16    HA   ARG  13           HA       ARG  13   6.437   2.774  -1.987
   17    HB2  ARG  13           HB2      ARG  13   8.537   0.602  -1.744
   18    HB3  ARG  13           HB1      ARG  13   8.763   2.288  -1.328
   19    HG2  ARG  13           HG2      ARG  13   7.184   2.148   0.457
   20    HG3  ARG  13           HG1      ARG  13   6.693   0.528  -0.040
   21    HD2  ARG  13           HD2      ARG  13   8.139   0.319   1.855
   22    HD3  ARG  13           HD1      ARG  13   9.007  -0.250   0.434
   23    HE   ARG  13           HE       ARG  13   9.516   2.512   1.066
   24   HH11  ARG  13          HH11      ARG  13  10.456  -0.805   1.730
   25   HH12  ARG  13          HH12      ARG  13  12.044  -0.384   2.272
   26   HH21  ARG  13          HH21      ARG  13  11.632   3.073   1.771
   27   HH22  ARG  13          HH22      ARG  13  12.715   1.829   2.288
   28    H    SER  14           HN       SER  14   7.656   4.174  -3.166
   29    HA   SER  14           HA       SER  14   7.960   3.544  -5.947
   30    HB2  SER  14           HB2      SER  14   7.166   5.762  -5.107
   31    HB3  SER  14           HB1      SER  14   8.763   6.038  -4.422
   32    HG   SER  14           HG       SER  14   8.833   7.008  -6.340
   33    HA   PRO  15           HA       PRO  15   9.047   4.047  -7.655
   34    HB2  PRO  15           HB2      PRO  15  10.853   2.511  -9.264
   35    HB3  PRO  15           HB1      PRO  15  10.653   4.262  -9.236
   36    HG2  PRO  15           HG2      PRO  15  12.913   2.920  -8.367
   37    HG3  PRO  15           HG1      PRO  15  12.459   4.562  -7.877
   38    HD2  PRO  15           HD2      PRO  15  12.074   1.972  -6.430
   39    HD3  PRO  15           HD1      PRO  15  12.521   3.568  -5.788
   40    H    CYS  16           HN       CYS  16   7.337   2.775  -8.180
   41    HA   CYS  16           HA       CYS  16   7.656  -0.119  -7.897
   42    HB2  CYS  16           HB2      CYS  16   5.006   0.167  -7.634
   43    HB3  CYS  16           HB1      CYS  16   6.115   0.311  -6.273
   44    H    ALA  17           HN       ALA  17   7.536  -1.180  -9.975
   45    HA   ALA  17           HA       ALA  17   5.743  -0.013 -11.949
   46    HB1  ALA  17           HB1      ALA  17   8.544  -0.995 -12.489
   47    HB2  ALA  17           HB2      ALA  17   8.026   0.692 -12.479
   48    HB3  ALA  17           HB3      ALA  17   7.397  -0.417 -13.698
   49    HA   PRO  18           HA       PRO  18   5.172  -0.415 -13.820
   50    HB2  PRO  18           HB2      PRO  18   2.957  -1.663 -15.071
   51    HB3  PRO  18           HB1      PRO  18   4.564  -1.438 -15.759
   52    HG2  PRO  18           HG2      PRO  18   3.392  -3.890 -15.084
   53    HG3  PRO  18           HG1      PRO  18   5.080  -3.623 -15.450
   54    HD2  PRO  18           HD2      PRO  18   3.748  -3.892 -12.806
   55    HD3  PRO  18           HD1      PRO  18   5.389  -4.364 -13.294
   56    H    PHE  19           HN       PHE  19   3.331  -2.305 -11.654
   57    HA   PHE  19           HA       PHE  19   1.296  -0.192 -11.413
   58    HB2  PHE  19           HB2      PHE  19   0.948  -2.952 -10.275
   59    HB3  PHE  19           HB1      PHE  19  -0.284  -1.792 -10.756
   60    HD1  PHE  19           HD1      PHE  19   0.989  -4.840 -11.542
   61    HD2  PHE  19           HD2      PHE  19   0.060  -1.139 -13.427
   62    HE1  PHE  19           HE1      PHE  19   0.810  -5.990 -13.704
   63    HE2  PHE  19           HE2      PHE  19  -0.121  -2.287 -15.595
   64    HZ   PHE  19           HZ       PHE  19   0.256  -4.714 -15.734
   65    H    CYS  20           HN       CYS  20   0.696   0.392  -9.241
   66    HA   CYS  20           HA       CYS  20   2.722  -0.324  -7.265
   67    HB2  CYS  20           HB2      CYS  20   2.862   2.020  -8.360
   68    HB3  CYS  20           HB1      CYS  20   1.436   2.387  -7.396
   69    HN1  NH2  21           H1       CYS  20   1.108  -1.907  -6.661
   70    HN2  NH2  21           H2       CYS  20  -0.242  -1.435  -5.692
  Start of MODEL   15
    1    H1   GLY  11           HT1      GLY  11  -1.528   3.815  -1.994
    2    H2   GLY  11           HT2      GLY  11  -1.947   2.190  -2.180
    3    H3   GLY  11           HT3      GLY  11  -2.551   3.346  -3.256
    4    HA2  GLY  11           HA1      GLY  11  -0.771   2.099  -4.283
    5    HA3  GLY  11           HA2      GLY  11  -0.339   3.791  -4.080
    6    H    PHE  12           HN       PHE  12   1.574   1.825  -4.426
    7    HA   PHE  12           HA       PHE  12   2.666   1.427  -1.741
    8    HB2  PHE  12           HB2      PHE  12   3.346   0.101  -4.369
    9    HB3  PHE  12           HB1      PHE  12   4.456   0.058  -3.016
   10    HD1  PHE  12           HD1      PHE  12   1.098  -1.014  -4.144
   11    HD2  PHE  12           HD2      PHE  12   4.064  -1.269  -1.094
   12    HE1  PHE  12           HE1      PHE  12  -0.103  -2.894  -3.124
   13    HE2  PHE  12           HE2      PHE  12   2.859  -3.153  -0.080
   14    HZ   PHE  12           HZ       PHE  12   0.773  -3.968  -1.094
   15    H    ARG  13           HN       ARG  13   5.339   1.399  -2.086
   16    HA   ARG  13           HA       ARG  13   5.748   4.286  -2.304
   17    HB2  ARG  13           HB2      ARG  13   7.377   2.146  -0.905
   18    HB3  ARG  13           HB1      ARG  13   7.981   3.767  -1.165
   19    HG2  ARG  13           HG2      ARG  13   7.089   3.524   1.083
   20    HG3  ARG  13           HG1      ARG  13   6.152   4.696   0.160
   21    HD2  ARG  13           HD2      ARG  13   4.385   3.097  -0.174
   22    HD3  ARG  13           HD1      ARG  13   5.355   1.810   0.544
   23    HE   ARG  13           HE       ARG  13   5.231   3.441   2.584
   24   HH11  ARG  13          HH11      ARG  13   2.646   2.684   0.328
   25   HH12  ARG  13          HH12      ARG  13   1.400   2.791   1.516
   26   HH21  ARG  13          HH21      ARG  13   3.574   3.575   4.168
   27   HH22  ARG  13          HH22      ARG  13   1.929   3.302   3.707
   28    H    SER  14           HN       SER  14   7.005   5.247  -3.725
   29    HA   SER  14           HA       SER  14   7.795   3.936  -6.085
   30    HB2  SER  14           HB2      SER  14   8.710   6.633  -5.061
   31    HB3  SER  14           HB1      SER  14   8.711   6.087  -6.738
   32    HG   SER  14           HG       SER  14   6.595   6.922  -5.126
   33    HA   PRO  15           HA       PRO  15   9.119   4.074  -7.652
   34    HB2  PRO  15           HB2      PRO  15  11.027   2.398  -8.874
   35    HB3  PRO  15           HB1      PRO  15  11.017   4.161  -8.888
   36    HG2  PRO  15           HG2      PRO  15  12.913   2.512  -7.612
   37    HG3  PRO  15           HG1      PRO  15  12.724   4.259  -7.397
   38    HD2  PRO  15           HD2      PRO  15  11.759   2.018  -5.690
   39    HD3  PRO  15           HD1      PRO  15  12.279   3.653  -5.226
   40    H    CYS  16           HN       CYS  16   7.482   2.753  -8.294
   41    HA   CYS  16           HA       CYS  16   7.796  -0.121  -7.888
   42    HB2  CYS  16           HB2      CYS  16   5.144   0.141  -7.529
   43    HB3  CYS  16           HB1      CYS  16   6.305   0.233  -6.206
   44    H    ALA  17           HN       ALA  17   7.633  -1.129  -9.993
   45    HA   ALA  17           HA       ALA  17   5.734   0.049 -11.873
   46    HB1  ALA  17           HB1      ALA  17   7.978   0.821 -12.463
   47    HB2  ALA  17           HB2      ALA  17   7.336  -0.272 -13.690
   48    HB3  ALA  17           HB3      ALA  17   8.538  -0.849 -12.536
   49    HA   PRO  18           HA       PRO  18   5.097  -0.319 -13.716
   50    HB2  PRO  18           HB2      PRO  18   3.055  -1.349 -15.162
   51    HB3  PRO  18           HB1      PRO  18   4.748  -1.551 -15.622
   52    HG2  PRO  18           HG2      PRO  18   2.872  -3.502 -14.481
   53    HG3  PRO  18           HG1      PRO  18   4.296  -3.787 -15.462
   54    HD2  PRO  18           HD2      PRO  18   4.050  -4.027 -12.630
   55    HD3  PRO  18           HD1      PRO  18   5.523  -4.202 -13.597
   56    H    PHE  19           HN       PHE  19   3.028  -2.501 -11.893
   57    HA   PHE  19           HA       PHE  19   1.132  -0.316 -11.410
   58    HB2  PHE  19           HB2      PHE  19   0.771  -3.151 -10.432
   59    HB3  PHE  19           HB1      PHE  19  -0.455  -1.912 -10.654
   60    HD1  PHE  19           HD1      PHE  19   0.359  -4.928 -11.810
   61    HD2  PHE  19           HD2      PHE  19  -0.143  -0.986 -13.330
   62    HE1  PHE  19           HE1      PHE  19  -0.139  -5.851 -14.036
   63    HE2  PHE  19           HE2      PHE  19  -0.638  -1.899 -15.555
   64    HZ   PHE  19           HZ       PHE  19  -0.636  -4.338 -15.912
   65    H    CYS  20           HN       CYS  20   0.823   0.502  -9.374
   66    HA   CYS  20           HA       CYS  20   2.728  -0.440  -7.363
   67    HB2  CYS  20           HB2      CYS  20   3.323   1.727  -8.458
   68    HB3  CYS  20           HB1      CYS  20   1.829   2.403  -7.821
   69    HN1  NH2  21           H1       CYS  20   0.918  -1.765  -6.655
   70    HN2  NH2  21           H2       CYS  20  -0.312  -1.068  -5.662
  Start of MODEL   16
    1    H1   GLY  11           HT1      GLY  11  -2.035   1.955  -1.764
    2    H2   GLY  11           HT2      GLY  11  -2.090   0.719  -2.911
    3    H3   GLY  11           HT3      GLY  11  -2.803   2.214  -3.247
    4    HA2  GLY  11           HA1      GLY  11  -0.702   1.966  -4.404
    5    HA3  GLY  11           HA2      GLY  11  -0.666   3.288  -3.243
    6    H    PHE  12           HN       PHE  12   1.606   1.871  -4.284
    7    HA   PHE  12           HA       PHE  12   2.558   0.634  -1.783
    8    HB2  PHE  12           HB2      PHE  12   2.299  -0.908  -3.842
    9    HB3  PHE  12           HB1      PHE  12   3.627  -0.010  -4.550
   10    HD1  PHE  12           HD1      PHE  12   2.732  -2.194  -1.641
   11    HD2  PHE  12           HD2      PHE  12   5.845  -0.589  -4.088
   12    HE1  PHE  12           HE1      PHE  12   4.342  -3.700  -0.588
   13    HE2  PHE  12           HE2      PHE  12   7.452  -2.110  -3.024
   14    HZ   PHE  12           HZ       PHE  12   6.703  -3.664  -1.275
   15    H    ARG  13           HN       ARG  13   5.117   0.694  -1.813
   16    HA   ARG  13           HA       ARG  13   5.813   3.475  -1.913
   17    HB2  ARG  13           HB2      ARG  13   8.026   2.696  -1.006
   18    HB3  ARG  13           HB1      ARG  13   6.635   2.291  -0.017
   19    HG2  ARG  13           HG2      ARG  13   6.680  -0.001  -0.865
   20    HG3  ARG  13           HG1      ARG  13   8.055   0.401  -1.891
   21    HD2  ARG  13           HD2      ARG  13   8.139   0.776   1.086
   22    HD3  ARG  13           HD1      ARG  13   8.498  -0.781   0.347
   23    HE   ARG  13           HE       ARG  13  10.065   1.122  -0.943
   24   HH11  ARG  13          HH11      ARG  13   9.744  -0.181   2.300
   25   HH12  ARG  13          HH12      ARG  13  11.420   0.001   2.681
   26   HH21  ARG  13          HH21      ARG  13  12.281   1.381  -0.435
   27   HH22  ARG  13          HH22      ARG  13  12.872   0.907   1.121
   28    H    SER  14           HN       SER  14   7.040   4.509  -3.336
   29    HA   SER  14           HA       SER  14   7.641   3.204  -5.827
   30    HB2  SER  14           HB2      SER  14   8.434   5.612  -6.385
   31    HB3  SER  14           HB1      SER  14   6.713   5.345  -6.104
   32    HG   SER  14           HG       SER  14   6.816   6.430  -4.279
   33    HA   PRO  15           HA       PRO  15   9.030   4.016  -7.599
   34    HB2  PRO  15           HB2      PRO  15  11.029   2.224  -8.705
   35    HB3  PRO  15           HB1      PRO  15  10.789   3.941  -9.030
   36    HG2  PRO  15           HG2      PRO  15  12.949   2.950  -7.682
   37    HG3  PRO  15           HG1      PRO  15  12.308   4.585  -7.443
   38    HD2  PRO  15           HD2      PRO  15  11.917   2.129  -5.778
   39    HD3  PRO  15           HD1      PRO  15  12.175   3.810  -5.264
   40    H    CYS  16           HN       CYS  16   7.388   2.763  -8.343
   41    HA   CYS  16           HA       CYS  16   7.579  -0.114  -7.894
   42    HB2  CYS  16           HB2      CYS  16   4.945   0.206  -7.681
   43    HB3  CYS  16           HB1      CYS  16   6.024   0.381  -6.300
   44    H    ALA  17           HN       ALA  17   7.550  -1.129  -9.978
   45    HA   ALA  17           HA       ALA  17   5.735  -0.037 -11.978
   46    HB1  ALA  17           HB1      ALA  17   7.424  -0.488 -13.695
   47    HB2  ALA  17           HB2      ALA  17   8.564  -0.982 -12.445
   48    HB3  ALA  17           HB3      ALA  17   8.004   0.689 -12.518
   49    HA   PRO  18           HA       PRO  18   5.204  -0.572 -13.917
   50    HB2  PRO  18           HB2      PRO  18   2.990  -1.605 -15.101
   51    HB3  PRO  18           HB1      PRO  18   4.628  -1.966 -15.650
   52    HG2  PRO  18           HG2      PRO  18   2.769  -3.630 -14.044
   53    HG3  PRO  18           HG1      PRO  18   3.956  -4.127 -15.243
   54    HD2  PRO  18           HD2      PRO  18   4.290  -4.266 -12.488
   55    HD3  PRO  18           HD1      PRO  18   5.600  -4.299 -13.678
   56    H    PHE  19           HN       PHE  19   2.962  -2.413 -11.867
   57    HA   PHE  19           HA       PHE  19   1.387   0.029 -11.479
   58    HB2  PHE  19           HB2      PHE  19   0.636  -2.684 -10.387
   59    HB3  PHE  19           HB1      PHE  19  -0.404  -1.295 -10.658
   60    HD1  PHE  19           HD1      PHE  19  -0.214  -4.400 -11.661
   61    HD2  PHE  19           HD2      PHE  19   0.222  -0.547 -13.411
   62    HE1  PHE  19           HE1      PHE  19  -0.833  -5.328 -13.852
   63    HE2  PHE  19           HE2      PHE  19  -0.395  -1.469 -15.605
   64    HZ   PHE  19           HZ       PHE  19  -0.922  -3.862 -15.826
   65    H    CYS  20           HN       CYS  20   0.577   0.288  -9.135
   66    HA   CYS  20           HA       CYS  20   2.803  -0.293  -7.333
   67    HB2  CYS  20           HB2      CYS  20   2.730   2.052  -8.371
   68    HB3  CYS  20           HB1      CYS  20   1.325   2.318  -7.348
   69    HN1  NH2  21           H1       CYS  20   1.398  -1.988  -6.574
   70    HN2  NH2  21           H2       CYS  20   0.095  -1.620  -5.498
  Start of MODEL   17
    1    H1   GLY  11           HT1      GLY  11   0.302   0.384  -0.855
    2    H2   GLY  11           HT2      GLY  11  -0.213  -0.939  -1.770
    3    H3   GLY  11           HT3      GLY  11  -0.909   0.578  -2.019
    4    HA2  GLY  11           HA1      GLY  11   0.665   0.036  -3.772
    5    HA3  GLY  11           HA2      GLY  11   1.159   1.451  -2.851
    6    H    PHE  12           HN       PHE  12   3.003   0.048  -4.334
    7    HA   PHE  12           HA       PHE  12   4.463  -1.517  -2.308
    8    HB2  PHE  12           HB2      PHE  12   4.779  -1.503  -5.325
    9    HB3  PHE  12           HB1      PHE  12   5.835  -2.362  -4.222
   10    HD1  PHE  12           HD1      PHE  12   2.395  -2.251  -5.580
   11    HD2  PHE  12           HD2      PHE  12   5.185  -4.388  -3.159
   12    HE1  PHE  12           HE1      PHE  12   0.896  -4.189  -5.560
   13    HE2  PHE  12           HE2      PHE  12   3.677  -6.325  -3.142
   14    HZ   PHE  12           HZ       PHE  12   1.532  -6.228  -4.339
   15    H    ARG  13           HN       ARG  13   6.992  -1.387  -2.920
   16    HA   ARG  13           HA       ARG  13   7.800   1.171  -2.005
   17    HB2  ARG  13           HB2      ARG  13   9.500  -1.038  -3.193
   18    HB3  ARG  13           HB1      ARG  13  10.090   0.340  -2.280
   19    HG2  ARG  13           HG2      ARG  13   9.096  -0.417  -0.282
   20    HG3  ARG  13           HG1      ARG  13   8.141  -1.632  -1.133
   21    HD2  ARG  13           HD2      ARG  13  10.193  -2.817  -1.730
   22    HD3  ARG  13           HD1      ARG  13  11.144  -1.595  -0.887
   23    HE   ARG  13           HE       ARG  13  10.398  -2.432   1.160
   24   HH11  ARG  13          HH11      ARG  13   8.971  -4.199  -1.516
   25   HH12  ARG  13          HH12      ARG  13   8.525  -5.561  -0.555
   26   HH21  ARG  13          HH21      ARG  13   9.798  -4.225   2.441
   27   HH22  ARG  13          HH22      ARG  13   8.994  -5.577   1.711
   28    H    SER  14           HN       SER  14   8.040   2.972  -3.105
   29    HA   SER  14           HA       SER  14   8.050   2.925  -5.998
   30    HB2  SER  14           HB2      SER  14   8.043   5.269  -4.083
   31    HB3  SER  14           HB1      SER  14   7.719   5.336  -5.817
   32    HG   SER  14           HG       SER  14   6.015   3.672  -5.206
   33    HA   PRO  15           HA       PRO  15   8.698   4.329  -7.777
   34    HB2  PRO  15           HB2      PRO  15  10.801   3.132  -9.461
   35    HB3  PRO  15           HB1      PRO  15   9.964   4.675  -9.647
   36    HG2  PRO  15           HG2      PRO  15  12.532   4.566  -8.889
   37    HG3  PRO  15           HG1      PRO  15  11.424   5.785  -8.233
   38    HD2  PRO  15           HD2      PRO  15  12.361   3.221  -6.996
   39    HD3  PRO  15           HD1      PRO  15  12.205   4.831  -6.263
   40    H    CYS  16           HN       CYS  16   7.153   2.816  -8.093
   41    HA   CYS  16           HA       CYS  16   7.958   0.010  -8.052
   42    HB2  CYS  16           HB2      CYS  16   5.344  -0.119  -7.424
   43    HB3  CYS  16           HB1      CYS  16   6.622   0.078  -6.228
   44    H    ALA  17           HN       ALA  17   7.673  -1.045 -10.106
   45    HA   ALA  17           HA       ALA  17   5.538  -0.074 -11.835
   46    HB1  ALA  17           HB1      ALA  17   8.363  -0.791 -12.630
   47    HB2  ALA  17           HB2      ALA  17   7.665   0.827 -12.625
   48    HB3  ALA  17           HB3      ALA  17   7.060  -0.389 -13.747
   49    HA   PRO  18           HA       PRO  18   5.162  -0.768 -14.089
   50    HB2  PRO  18           HB2      PRO  18   2.801  -1.844 -14.938
   51    HB3  PRO  18           HB1      PRO  18   4.369  -2.314 -15.606
   52    HG2  PRO  18           HG2      PRO  18   2.728  -3.679 -13.508
   53    HG3  PRO  18           HG1      PRO  18   3.574  -4.385 -14.889
   54    HD2  PRO  18           HD2      PRO  18   4.581  -4.443 -12.383
   55    HD3  PRO  18           HD1      PRO  18   5.626  -4.291 -13.809
   56    H    PHE  19           HN       PHE  19   2.830  -2.341 -11.895
   57    HA   PHE  19           HA       PHE  19   1.658   0.312 -11.417
   58    HB2  PHE  19           HB2      PHE  19   0.292  -2.285 -10.716
   59    HB3  PHE  19           HB1      PHE  19  -0.425  -0.689 -10.900
   60    HD1  PHE  19           HD1      PHE  19  -0.524  -3.725 -12.284
   61    HD2  PHE  19           HD2      PHE  19   0.389   0.262 -13.449
   62    HE1  PHE  19           HE1      PHE  19  -1.071  -4.286 -14.611
   63    HE2  PHE  19           HE2      PHE  19  -0.160  -0.292 -15.783
   64    HZ   PHE  19           HZ       PHE  19  -0.887  -2.571 -16.365
   65    H    CYS  20           HN       CYS  20   0.854   0.636  -9.160
   66    HA   CYS  20           HA       CYS  20   2.684  -0.641  -7.277
   67    HB2  CYS  20           HB2      CYS  20   3.100   1.798  -8.035
   68    HB3  CYS  20           HB1      CYS  20   1.710   2.180  -7.028
   69    HN1  NH2  21           H1       CYS  20   0.775  -2.084  -7.035
   70    HN2  NH2  21           H2       CYS  20  -0.477  -1.603  -5.944
  Start of MODEL   18
    1    H1   GLY  11           HT1      GLY  11  -1.237   4.275  -1.803
    2    H2   GLY  11           HT2      GLY  11  -2.022   2.787  -1.681
    3    H3   GLY  11           HT3      GLY  11  -2.477   3.884  -2.885
    4    HA2  GLY  11           HA1      GLY  11  -1.157   2.122  -3.832
    5    HA3  GLY  11           HA2      GLY  11  -0.313   3.663  -3.930
    6    H    PHE  12           HN       PHE  12   1.259   1.578  -4.180
    7    HA   PHE  12           HA       PHE  12   2.260   0.930  -1.511
    8    HB2  PHE  12           HB2      PHE  12   2.857  -0.306  -4.207
    9    HB3  PHE  12           HB1      PHE  12   3.836  -0.631  -2.788
   10    HD1  PHE  12           HD1      PHE  12   0.268  -0.693  -3.888
   11    HD2  PHE  12           HD2      PHE  12   3.282  -2.369  -1.396
   12    HE1  PHE  12           HE1      PHE  12  -1.302  -2.439  -3.169
   13    HE2  PHE  12           HE2      PHE  12   1.716  -4.117  -0.675
   14    HZ   PHE  12           HZ       PHE  12  -0.580  -4.154  -1.563
   15    H    ARG  13           HN       ARG  13   4.804   0.619  -1.604
   16    HA   ARG  13           HA       ARG  13   5.810   3.265  -1.607
   17    HB2  ARG  13           HB2      ARG  13   7.961   2.223  -0.986
   18    HB3  ARG  13           HB1      ARG  13   6.621   1.683   0.010
   19    HG2  ARG  13           HG2      ARG  13   6.495  -0.395  -1.264
   20    HG3  ARG  13           HG1      ARG  13   7.834   0.147  -2.277
   21    HD2  ARG  13           HD2      ARG  13   7.964  -0.257   0.704
   22    HD3  ARG  13           HD1      ARG  13   8.540  -1.412  -0.496
   23    HE   ARG  13           HE       ARG  13   9.981   0.618  -1.222
   24   HH11  ARG  13          HH11      ARG  13   9.156  -0.263   2.067
   25   HH12  ARG  13          HH12      ARG  13  10.608   0.378   2.743
   26   HH21  ARG  13          HH21      ARG  13  11.893   1.510  -0.322
   27   HH22  ARG  13          HH22      ARG  13  12.175   1.390   1.377
   28    H    SER  14           HN       SER  14   7.177   4.304  -2.933
   29    HA   SER  14           HA       SER  14   7.480   3.210  -5.619
   30    HB2  SER  14           HB2      SER  14   8.095   5.992  -4.604
   31    HB3  SER  14           HB1      SER  14   7.925   5.491  -6.286
   32    HG   SER  14           HG       SER  14   5.732   4.797  -4.879
   33    HA   PRO  15           HA       PRO  15   8.810   4.034  -7.389
   34    HB2  PRO  15           HB2      PRO  15  10.818   2.320  -8.621
   35    HB3  PRO  15           HB1      PRO  15  10.518   4.039  -8.891
   36    HG2  PRO  15           HG2      PRO  15  12.749   3.115  -7.654
   37    HG3  PRO  15           HG1      PRO  15  12.023   4.688  -7.281
   38    HD2  PRO  15           HD2      PRO  15  11.770   2.091  -5.802
   39    HD3  PRO  15           HD1      PRO  15  12.039   3.726  -5.162
   40    H    CYS  16           HN       CYS  16   7.317   2.751  -8.395
   41    HA   CYS  16           HA       CYS  16   7.413  -0.110  -7.822
   42    HB2  CYS  16           HB2      CYS  16   4.782   0.272  -7.763
   43    HB3  CYS  16           HB1      CYS  16   5.785   0.470  -6.327
   44    H    ALA  17           HN       ALA  17   7.449  -1.195  -9.895
   45    HA   ALA  17           HA       ALA  17   5.760  -0.056 -11.985
   46    HB1  ALA  17           HB1      ALA  17   8.098   0.574 -12.413
   47    HB2  ALA  17           HB2      ALA  17   7.471  -0.519 -13.647
   48    HB3  ALA  17           HB3      ALA  17   8.548  -1.132 -12.394
   49    HA   PRO  18           HA       PRO  18   5.235  -0.507 -13.835
   50    HB2  PRO  18           HB2      PRO  18   3.238  -1.550 -15.345
   51    HB3  PRO  18           HB1      PRO  18   4.947  -1.828 -15.691
   52    HG2  PRO  18           HG2      PRO  18   2.943  -3.667 -14.606
   53    HG3  PRO  18           HG1      PRO  18   4.451  -4.039 -15.411
   54    HD2  PRO  18           HD2      PRO  18   3.901  -4.060 -12.598
   55    HD3  PRO  18           HD1      PRO  18   5.443  -4.404 -13.404
   56    H    PHE  19           HN       PHE  19   3.362  -2.223 -11.622
   57    HA   PHE  19           HA       PHE  19   1.349  -0.076 -11.511
   58    HB2  PHE  19           HB2      PHE  19   1.025  -2.762 -10.167
   59    HB3  PHE  19           HB1      PHE  19  -0.216  -1.582 -10.551
   60    HD1  PHE  19           HD1      PHE  19   0.813  -4.708 -11.320
   61    HD2  PHE  19           HD2      PHE  19  -0.127  -1.055 -13.287
   62    HE1  PHE  19           HE1      PHE  19   0.296  -5.952 -13.376
   63    HE2  PHE  19           HE2      PHE  19  -0.640  -2.293 -15.350
   64    HZ   PHE  19           HZ       PHE  19  -0.430  -4.746 -15.394
   65    H    CYS  20           HN       CYS  20   0.561   0.160  -9.094
   66    HA   CYS  20           HA       CYS  20   2.899  -0.095  -7.360
   67    HB2  CYS  20           HB2      CYS  20   2.419   2.249  -8.376
   68    HB3  CYS  20           HB1      CYS  20   1.099   2.294  -7.210
   69    HN1  NH2  21           H1       CYS  20   1.534  -2.022  -6.874
   70    HN2  NH2  21           H2       CYS  20   0.338  -1.857  -5.638
  Start of MODEL   19
    1    H1   GLY  11           HT1      GLY  11  -1.374   1.772  -1.425
    2    H2   GLY  11           HT2      GLY  11  -1.520   0.286  -2.217
    3    H3   GLY  11           HT3      GLY  11  -2.337   1.643  -2.805
    4    HA2  GLY  11           HA1      GLY  11  -0.377   1.129  -4.133
    5    HA3  GLY  11           HA2      GLY  11  -0.288   2.712  -3.370
    6    H    PHE  12           HN       PHE  12   1.975   1.332  -4.268
    7    HA   PHE  12           HA       PHE  12   3.216   0.565  -1.703
    8    HB2  PHE  12           HB2      PHE  12   4.002  -0.228  -4.520
    9    HB3  PHE  12           HB1      PHE  12   5.011  -0.508  -3.115
   10    HD1  PHE  12           HD1      PHE  12   1.821  -1.457  -4.738
   11    HD2  PHE  12           HD2      PHE  12   4.551  -2.234  -1.556
   12    HE1  PHE  12           HE1      PHE  12   0.672  -3.569  -4.264
   13    HE2  PHE  12           HE2      PHE  12   3.398  -4.349  -1.084
   14    HZ   PHE  12           HZ       PHE  12   1.457  -5.020  -2.437
   15    H    ARG  13           HN       ARG  13   5.742   0.980  -1.880
   16    HA   ARG  13           HA       ARG  13   5.961   3.854  -2.189
   17    HB2  ARG  13           HB2      ARG  13   8.087   1.893  -1.289
   18    HB3  ARG  13           HB1      ARG  13   8.130   3.640  -1.121
   19    HG2  ARG  13           HG2      ARG  13   6.195   1.785   0.252
   20    HG3  ARG  13           HG1      ARG  13   7.591   2.569   0.990
   21    HD2  ARG  13           HD2      ARG  13   6.593   4.759   0.551
   22    HD3  ARG  13           HD1      ARG  13   5.207   3.979  -0.209
   23    HE   ARG  13           HE       ARG  13   5.585   2.999   2.415
   24   HH11  ARG  13          HH11      ARG  13   4.395   5.801   0.686
   25   HH12  ARG  13          HH12      ARG  13   3.311   6.284   1.943
   26   HH21  ARG  13          HH21      ARG  13   4.137   3.628   4.090
   27   HH22  ARG  13          HH22      ARG  13   3.165   5.044   3.888
   28    H    SER  14           HN       SER  14   6.886   4.886  -3.825
   29    HA   SER  14           HA       SER  14   7.748   3.411  -6.126
   30    HB2  SER  14           HB2      SER  14   7.813   6.392  -5.589
   31    HB3  SER  14           HB1      SER  14   7.972   5.619  -7.165
   32    HG   SER  14           HG       SER  14   5.771   4.651  -6.142
   33    HA   PRO  15           HA       PRO  15   9.089   4.244  -8.006
   34    HB2  PRO  15           HB2      PRO  15  11.003   2.831  -9.288
   35    HB3  PRO  15           HB1      PRO  15  11.148   4.564  -8.979
   36    HG2  PRO  15           HG2      PRO  15  12.369   2.269  -7.506
   37    HG3  PRO  15           HG1      PRO  15  13.092   3.823  -7.953
   38    HD2  PRO  15           HD2      PRO  15  12.136   3.258  -5.458
   39    HD3  PRO  15           HD1      PRO  15  12.198   4.896  -6.135
   40    H    CYS  16           HN       CYS  16   7.498   2.814  -8.388
   41    HA   CYS  16           HA       CYS  16   8.043  -0.024  -7.985
   42    HB2  CYS  16           HB2      CYS  16   5.467  -0.041  -7.393
   43    HB3  CYS  16           HB1      CYS  16   6.675   0.346  -6.171
   44    H    ALA  17           HN       ALA  17   7.750  -1.093 -10.050
   45    HA   ALA  17           HA       ALA  17   5.696   0.002 -11.811
   46    HB1  ALA  17           HB1      ALA  17   8.481  -0.824 -12.620
   47    HB2  ALA  17           HB2      ALA  17   7.857   0.825 -12.578
   48    HB3  ALA  17           HB3      ALA  17   7.194  -0.340 -13.723
   49    HA   PRO  18           HA       PRO  18   5.125  -0.477 -13.797
   50    HB2  PRO  18           HB2      PRO  18   2.882  -1.515 -14.921
   51    HB3  PRO  18           HB1      PRO  18   4.503  -1.827 -15.547
   52    HG2  PRO  18           HG2      PRO  18   2.738  -3.576 -13.931
   53    HG3  PRO  18           HG1      PRO  18   3.895  -4.014 -15.178
   54    HD2  PRO  18           HD2      PRO  18   4.299  -4.207 -12.425
   55    HD3  PRO  18           HD1      PRO  18   5.578  -4.219 -13.651
   56    H    PHE  19           HN       PHE  19   2.595  -2.459 -12.208
   57    HA   PHE  19           HA       PHE  19   1.193  -0.039 -11.464
   58    HB2  PHE  19           HB2      PHE  19   0.401  -2.833 -10.639
   59    HB3  PHE  19           HB1      PHE  19  -0.626  -1.413 -10.791
   60    HD1  PHE  19           HD1      PHE  19  -0.335  -4.416 -12.131
   61    HD2  PHE  19           HD2      PHE  19  -0.022  -0.371 -13.402
   62    HE1  PHE  19           HE1      PHE  19  -0.871  -5.094 -14.431
   63    HE2  PHE  19           HE2      PHE  19  -0.560  -1.044 -15.703
   64    HZ   PHE  19           HZ       PHE  19  -0.982  -3.410 -16.219
   65    H    CYS  20           HN       CYS  20   0.642   0.426  -9.242
   66    HA   CYS  20           HA       CYS  20   2.605  -0.646  -7.369
   67    HB2  CYS  20           HB2      CYS  20   3.244   1.579  -8.391
   68    HB3  CYS  20           HB1      CYS  20   1.838   2.258  -7.581
   69    HN1  NH2  21           H1       CYS  20   0.673  -1.906  -6.788
   70    HN2  NH2  21           H2       CYS  20  -0.490  -1.198  -5.724
  Start of MODEL   20
    1    H1   GLY  11           HT1      GLY  11  -0.544  -0.108  -1.089
    2    H2   GLY  11           HT2      GLY  11  -0.710  -1.481  -2.059
    3    H3   GLY  11           HT3      GLY  11  -1.661  -0.115  -2.360
    4    HA2  GLY  11           HA1      GLY  11   0.129  -0.282  -3.966
    5    HA3  GLY  11           HA2      GLY  11   0.285   1.155  -2.965
    6    H    PHE  12           HN       PHE  12   2.460   0.190  -4.306
    7    HA   PHE  12           HA       PHE  12   4.004  -1.210  -2.226
    8    HB2  PHE  12           HB2      PHE  12   4.585  -0.924  -5.190
    9    HB3  PHE  12           HB1      PHE  12   5.682  -1.643  -4.029
   10    HD1  PHE  12           HD1      PHE  12   2.466  -2.106  -5.783
   11    HD2  PHE  12           HD2      PHE  12   5.321  -3.820  -3.115
   12    HE1  PHE  12           HE1      PHE  12   1.401  -4.293  -6.041
   13    HE2  PHE  12           HE2      PHE  12   4.242  -6.010  -3.378
   14    HZ   PHE  12           HZ       PHE  12   2.281  -6.250  -4.842
   15    H    ARG  13           HN       ARG  13   6.509  -0.566  -2.587
   16    HA   ARG  13           HA       ARG  13   6.591   2.246  -1.848
   17    HB2  ARG  13           HB2      ARG  13   8.887   0.277  -1.969
   18    HB3  ARG  13           HB1      ARG  13   8.873   1.820  -1.144
   19    HG2  ARG  13           HG2      ARG  13   7.304  -0.645  -0.408
   20    HG3  ARG  13           HG1      ARG  13   8.670   0.043   0.465
   21    HD2  ARG  13           HD2      ARG  13   6.030   1.444   0.039
   22    HD3  ARG  13           HD1      ARG  13   6.442   0.530   1.483
   23    HE   ARG  13           HE       ARG  13   7.657   3.075   0.636
   24   HH11  ARG  13          HH11      ARG  13   7.197   0.601   3.088
   25   HH12  ARG  13          HH12      ARG  13   7.831   1.582   4.364
   26   HH21  ARG  13          HH21      ARG  13   8.502   4.355   2.327
   27   HH22  ARG  13          HH22      ARG  13   8.564   3.716   3.938
   28    H    SER  14           HN       SER  14   7.398   3.833  -3.094
   29    HA   SER  14           HA       SER  14   7.865   3.286  -5.860
   30    HB2  SER  14           HB2      SER  14   8.230   5.893  -4.373
   31    HB3  SER  14           HB1      SER  14   7.971   5.679  -6.106
   32    HG   SER  14           HG       SER  14   5.928   4.577  -5.343
   33    HA   PRO  15           HA       PRO  15   8.907   4.159  -7.611
   34    HB2  PRO  15           HB2      PRO  15  10.524   2.944  -9.388
   35    HB3  PRO  15           HB1      PRO  15  10.809   4.600  -8.837
   36    HG2  PRO  15           HG2      PRO  15  12.106   2.059  -7.939
   37    HG3  PRO  15           HG1      PRO  15  12.850   3.629  -8.297
   38    HD2  PRO  15           HD2      PRO  15  12.293   2.786  -5.770
   39    HD3  PRO  15           HD1      PRO  15  12.303   4.496  -6.242
   40    H    CYS  16           HN       CYS  16   7.357   2.773  -8.335
   41    HA   CYS  16           HA       CYS  16   7.827  -0.078  -7.956
   42    HB2  CYS  16           HB2      CYS  16   5.185   0.053  -7.475
   43    HB3  CYS  16           HB1      CYS  16   6.404   0.187  -6.210
   44    H    ALA  17           HN       ALA  17   7.609  -1.102 -10.024
   45    HA   ALA  17           HA       ALA  17   5.613  -0.018 -11.848
   46    HB1  ALA  17           HB1      ALA  17   8.445  -0.799 -12.541
   47    HB2  ALA  17           HB2      ALA  17   7.786   0.836 -12.538
   48    HB3  ALA  17           HB3      ALA  17   7.198  -0.350 -13.702
   49    HA   PRO  18           HA       PRO  18   5.181  -0.508 -13.879
   50    HB2  PRO  18           HB2      PRO  18   3.048  -1.567 -15.174
   51    HB3  PRO  18           HB1      PRO  18   4.716  -1.867 -15.670
   52    HG2  PRO  18           HG2      PRO  18   2.832  -3.632 -14.227
   53    HG3  PRO  18           HG1      PRO  18   4.121  -4.059 -15.340
   54    HD2  PRO  18           HD2      PRO  18   4.228  -4.214 -12.545
   55    HD3  PRO  18           HD1      PRO  18   5.619  -4.273 -13.641
   56    H    PHE  19           HN       PHE  19   3.060  -2.408 -11.836
   57    HA   PHE  19           HA       PHE  19   1.356  -0.038 -11.453
   58    HB2  PHE  19           HB2      PHE  19   0.668  -2.803 -10.459
   59    HB3  PHE  19           HB1      PHE  19  -0.411  -1.441 -10.717
   60    HD1  PHE  19           HD1      PHE  19  -0.052  -4.527 -11.776
   61    HD2  PHE  19           HD2      PHE  19   0.182  -0.615 -13.438
   62    HE1  PHE  19           HE1      PHE  19  -0.611  -5.438 -13.991
   63    HE2  PHE  19           HE2      PHE  19  -0.375  -1.519 -15.655
   64    HZ   PHE  19           HZ       PHE  19  -0.772  -3.933 -15.933
   65    H    CYS  20           HN       CYS  20   0.724   0.447  -9.218
   66    HA   CYS  20           HA       CYS  20   2.714  -0.497  -7.294
   67    HB2  CYS  20           HB2      CYS  20   3.158   1.815  -8.267
   68    HB3  CYS  20           HB1      CYS  20   1.706   2.339  -7.420
   69    HN1  NH2  21           H1       CYS  20   0.703  -1.898  -7.001
   70    HN2  NH2  21           H2       CYS  20  -0.456  -1.335  -5.850
  Start of MODEL   21
    1    H1   GLY  11           HT1      GLY  11  -0.541   2.609  -1.247
    2    H2   GLY  11           HT2      GLY  11  -1.230   1.224  -1.933
    3    H3   GLY  11           HT3      GLY  11  -1.624   2.753  -2.536
    4    HA2  GLY  11           HA1      GLY  11  -0.068   1.570  -3.972
    5    HA3  GLY  11           HA2      GLY  11   0.567   3.088  -3.352
    6    H    PHE  12           HN       PHE  12   2.148   0.968  -4.316
    7    HA   PHE  12           HA       PHE  12   3.317  -0.243  -1.925
    8    HB2  PHE  12           HB2      PHE  12   3.952  -0.588  -4.877
    9    HB3  PHE  12           HB1      PHE  12   4.976  -1.230  -3.611
   10    HD1  PHE  12           HD1      PHE  12   1.443  -1.323  -4.797
   11    HD2  PHE  12           HD2      PHE  12   4.578  -3.310  -2.723
   12    HE1  PHE  12           HE1      PHE  12   0.059  -3.346  -4.647
   13    HE2  PHE  12           HE2      PHE  12   3.197  -5.339  -2.569
   14    HZ   PHE  12           HZ       PHE  12   0.933  -5.358  -3.531
   15    H    ARG  13           HN       ARG  13   5.951  -0.231  -2.204
   16    HA   ARG  13           HA       ARG  13   6.568   2.553  -1.707
   17    HB2  ARG  13           HB2      ARG  13   8.260   0.051  -1.443
   18    HB3  ARG  13           HB1      ARG  13   8.958   1.647  -1.369
   19    HG2  ARG  13           HG2      ARG  13   8.632   0.982   0.857
   20    HG3  ARG  13           HG1      ARG  13   7.385   2.174   0.513
   21    HD2  ARG  13           HD2      ARG  13   6.503   0.309   1.808
   22    HD3  ARG  13           HD1      ARG  13   5.746   0.378   0.223
   23    HE   ARG  13           HE       ARG  13   6.738  -1.638  -0.318
   24   HH11  ARG  13          HH11      ARG  13   8.120  -0.455   2.690
   25   HH12  ARG  13          HH12      ARG  13   8.852  -1.964   3.097
   26   HH21  ARG  13          HH21      ARG  13   7.726  -3.633   0.212
   27   HH22  ARG  13          HH22      ARG  13   8.633  -3.780   1.680
   28    H    SER  14           HN       SER  14   7.135   3.923  -3.200
   29    HA   SER  14           HA       SER  14   7.833   3.076  -5.835
   30    HB2  SER  14           HB2      SER  14   7.926   5.831  -4.579
   31    HB3  SER  14           HB1      SER  14   8.017   5.482  -6.306
   32    HG   SER  14           HG       SER  14   5.882   4.238  -5.458
   33    HA   PRO  15           HA       PRO  15   9.028   4.080  -7.611
   34    HB2  PRO  15           HB2      PRO  15  10.782   2.777  -9.198
   35    HB3  PRO  15           HB1      PRO  15  11.021   4.454  -8.692
   36    HG2  PRO  15           HG2      PRO  15  12.236   1.952  -7.585
   37    HG3  PRO  15           HG1      PRO  15  13.003   3.514  -7.925
   38    HD2  PRO  15           HD2      PRO  15  12.226   2.747  -5.435
   39    HD3  PRO  15           HD1      PRO  15  12.271   4.440  -5.959
   40    H    CYS  16           HN       CYS  16   7.425   2.739  -8.249
   41    HA   CYS  16           HA       CYS  16   7.801  -0.140  -7.912
   42    HB2  CYS  16           HB2      CYS  16   5.154   0.094  -7.539
   43    HB3  CYS  16           HB1      CYS  16   6.317   0.206  -6.219
   44    H    ALA  17           HN       ALA  17   7.643  -1.120 -10.038
   45    HA   ALA  17           HA       ALA  17   5.692   0.034 -11.873
   46    HB1  ALA  17           HB1      ALA  17   8.503  -0.809 -12.581
   47    HB2  ALA  17           HB2      ALA  17   7.897   0.847 -12.527
   48    HB3  ALA  17           HB3      ALA  17   7.269  -0.283 -13.726
   49    HA   PRO  18           HA       PRO  18   5.118  -0.341 -13.754
   50    HB2  PRO  18           HB2      PRO  18   3.103  -1.398 -15.230
   51    HB3  PRO  18           HB1      PRO  18   4.804  -1.562 -15.669
   52    HG2  PRO  18           HG2      PRO  18   2.952  -3.566 -14.605
   53    HG3  PRO  18           HG1      PRO  18   4.433  -3.808 -15.508
   54    HD2  PRO  18           HD2      PRO  18   4.037  -4.035 -12.677
   55    HD3  PRO  18           HD1      PRO  18   5.552  -4.231 -13.576
   56    H    PHE  19           HN       PHE  19   3.213  -2.420 -11.758
   57    HA   PHE  19           HA       PHE  19   1.193  -0.308 -11.410
   58    HB2  PHE  19           HB2      PHE  19   0.926  -3.114 -10.333
   59    HB3  PHE  19           HB1      PHE  19  -0.339  -1.927 -10.603
   60    HD1  PHE  19           HD1      PHE  19   0.682  -4.949 -11.658
   61    HD2  PHE  19           HD2      PHE  19  -0.169  -1.113 -13.295
   62    HE1  PHE  19           HE1      PHE  19   0.201  -5.990 -13.831
   63    HE2  PHE  19           HE2      PHE  19  -0.646  -2.148 -15.475
   64    HZ   PHE  19           HZ       PHE  19  -0.461  -4.589 -15.742
   65    H    CYS  20           HN       CYS  20   0.707   0.394  -9.282
   66    HA   CYS  20           HA       CYS  20   2.639  -0.454  -7.262
   67    HB2  CYS  20           HB2      CYS  20   3.224   1.741  -8.401
   68    HB3  CYS  20           HB1      CYS  20   1.766   2.403  -7.674
   69    HN1  NH2  21           H1       CYS  20   0.394  -1.675  -7.118
   70    HN2  NH2  21           H2       CYS  20  -0.695  -1.003  -5.959
  Start of MODEL   22
    1    H1   GLY  11           HT1      GLY  11  -0.332  -3.114  -1.528
    2    H2   GLY  11           HT2      GLY  11  -0.549  -3.729  -3.090
    3    H3   GLY  11           HT3      GLY  11  -1.656  -2.621  -2.451
    4    HA2  GLY  11           HA1      GLY  11  -0.167  -1.573  -4.047
    5    HA3  GLY  11           HA2      GLY  11  -0.027  -0.891  -2.433
    6    H    PHE  12           HN       PHE  12   1.956  -0.771  -4.500
    7    HA   PHE  12           HA       PHE  12   4.058  -2.441  -3.285
    8    HB2  PHE  12           HB2      PHE  12   3.973  -1.156  -6.034
    9    HB3  PHE  12           HB1      PHE  12   5.386  -1.935  -5.353
   10    HD1  PHE  12           HD1      PHE  12   1.944  -2.554  -6.581
   11    HD2  PHE  12           HD2      PHE  12   5.624  -4.287  -5.304
   12    HE1  PHE  12           HE1      PHE  12   1.215  -4.732  -7.440
   13    HE2  PHE  12           HE2      PHE  12   4.890  -6.469  -6.163
   14    HZ   PHE  12           HZ       PHE  12   2.686  -6.694  -7.234
   15    H    ARG  13           HN       ARG  13   6.323  -1.199  -3.699
   16    HA   ARG  13           HA       ARG  13   5.930   1.449  -2.461
   17    HB2  ARG  13           HB2      ARG  13   8.176  -0.538  -2.011
   18    HB3  ARG  13           HB1      ARG  13   8.221   1.121  -1.450
   19    HG2  ARG  13           HG2      ARG  13   7.602  -0.199   0.408
   20    HG3  ARG  13           HG1      ARG  13   6.131   0.613  -0.124
   21    HD2  ARG  13           HD2      ARG  13   5.390  -1.393  -1.248
   22    HD3  ARG  13           HD1      ARG  13   6.908  -2.203  -0.863
   23    HE   ARG  13           HE       ARG  13   5.471  -1.282   1.448
   24   HH11  ARG  13          HH11      ARG  13   5.824  -3.877  -0.876
   25   HH12  ARG  13          HH12      ARG  13   5.158  -5.087   0.166
   26   HH21  ARG  13          HH21      ARG  13   4.562  -2.881   2.836
   27   HH22  ARG  13          HH22      ARG  13   4.419  -4.513   2.286
   28    H    SER  14           HN       SER  14   6.898   3.177  -3.355
   29    HA   SER  14           HA       SER  14   7.891   2.976  -5.998
   30    HB2  SER  14           HB2      SER  14   8.012   5.317  -4.083
   31    HB3  SER  14           HB1      SER  14   8.226   5.394  -5.830
   32    HG   SER  14           HG       SER  14   5.959   4.162  -5.492
   33    HA   PRO  15           HA       PRO  15   9.268   3.831  -7.517
   34    HB2  PRO  15           HB2      PRO  15  11.347   2.066  -8.601
   35    HB3  PRO  15           HB1      PRO  15  11.027   3.765  -8.962
   36    HG2  PRO  15           HG2      PRO  15  13.200   2.982  -7.573
   37    HG3  PRO  15           HG1      PRO  15  12.379   4.520  -7.255
   38    HD2  PRO  15           HD2      PRO  15  12.185   1.927  -5.765
   39    HD3  PRO  15           HD1      PRO  15  12.322   3.582  -5.130
   40    H    CYS  16           HN       CYS  16   7.523   2.662  -8.123
   41    HA   CYS  16           HA       CYS  16   7.685  -0.250  -7.915
   42    HB2  CYS  16           HB2      CYS  16   5.053   0.153  -7.738
   43    HB3  CYS  16           HB1      CYS  16   6.114   0.199  -6.332
   44    H    ALA  17           HN       ALA  17   7.645  -1.176 -10.061
   45    HA   ALA  17           HA       ALA  17   5.860   0.102 -11.974
   46    HB1  ALA  17           HB1      ALA  17   7.494  -0.187 -13.756
   47    HB2  ALA  17           HB2      ALA  17   8.652  -0.849 -12.603
   48    HB3  ALA  17           HB3      ALA  17   8.142   0.834 -12.473
   49    HA   PRO  18           HA       PRO  18   5.016  -0.136 -13.591
   50    HB2  PRO  18           HB2      PRO  18   3.014  -1.156 -15.123
   51    HB3  PRO  18           HB1      PRO  18   4.706  -1.125 -15.625
   52    HG2  PRO  18           HG2      PRO  18   3.059  -3.400 -14.930
   53    HG3  PRO  18           HG1      PRO  18   4.653  -3.398 -15.651
   54    HD2  PRO  18           HD2      PRO  18   3.897  -3.821 -12.858
   55    HD3  PRO  18           HD1      PRO  18   5.459  -4.120 -13.645
   56    H    PHE  19           HN       PHE  19   3.373  -2.447 -11.658
   57    HA   PHE  19           HA       PHE  19   1.067  -0.673 -11.304
   58    HB2  PHE  19           HB2      PHE  19   1.317  -3.430 -10.110
   59    HB3  PHE  19           HB1      PHE  19  -0.141  -2.494 -10.391
   60    HD1  PHE  19           HD1      PHE  19   1.653  -5.229 -11.462
   61    HD2  PHE  19           HD2      PHE  19  -0.442  -1.864 -13.008
   62    HE1  PHE  19           HE1      PHE  19   1.325  -6.418 -13.588
   63    HE2  PHE  19           HE2      PHE  19  -0.772  -3.045 -15.141
   64    HZ   PHE  19           HZ       PHE  19   0.113  -5.326 -15.432
   65    H    CYS  20           HN       CYS  20   0.682   0.299  -9.390
   66    HA   CYS  20           HA       CYS  20   2.463  -0.350  -7.178
   67    HB2  CYS  20           HB2      CYS  20   3.159   1.723  -8.530
   68    HB3  CYS  20           HB1      CYS  20   1.733   2.490  -7.841
   69    HN1  NH2  21           H1       CYS  20   0.624  -1.506  -6.409
   70    HN2  NH2  21           H2       CYS  20  -0.708  -0.675  -5.689
  Start of MODEL   23
    1    H1   GLY  11           HT1      GLY  11   0.043  -1.848  -1.365
    2    H2   GLY  11           HT2      GLY  11  -0.352  -2.693  -2.773
    3    H3   GLY  11           HT3      GLY  11  -1.188  -1.276  -2.370
    4    HA2  GLY  11           HA1      GLY  11   0.422  -0.882  -4.129
    5    HA3  GLY  11           HA2      GLY  11   0.778   0.039  -2.676
    6    H    PHE  12           HN       PHE  12   2.662  -0.640  -4.714
    7    HA   PHE  12           HA       PHE  12   4.326  -2.653  -3.365
    8    HB2  PHE  12           HB2      PHE  12   4.590  -1.504  -6.165
    9    HB3  PHE  12           HB1      PHE  12   5.662  -2.692  -5.451
   10    HD1  PHE  12           HD1      PHE  12   2.155  -2.158  -6.549
   11    HD2  PHE  12           HD2      PHE  12   5.161  -4.966  -5.483
   12    HE1  PHE  12           HE1      PHE  12   0.729  -3.980  -7.362
   13    HE2  PHE  12           HE2      PHE  12   3.738  -6.798  -6.294
   14    HZ   PHE  12           HZ       PHE  12   1.517  -6.306  -7.235
   15    H    ARG  13           HN       ARG  13   6.717  -2.170  -3.338
   16    HA   ARG  13           HA       ARG  13   7.146   0.364  -2.103
   17    HB2  ARG  13           HB2      ARG  13   9.212  -1.655  -3.019
   18    HB3  ARG  13           HB1      ARG  13   9.497  -0.315  -1.931
   19    HG2  ARG  13           HG2      ARG  13   7.770  -2.733  -1.405
   20    HG3  ARG  13           HG1      ARG  13   9.326  -2.360  -0.667
   21    HD2  ARG  13           HD2      ARG  13   6.838  -0.674  -0.370
   22    HD3  ARG  13           HD1      ARG  13   7.362  -1.886   0.793
   23    HE   ARG  13           HE       ARG  13   9.521  -0.241   0.551
   24   HH11  ARG  13          HH11      ARG  13   6.147   0.244   1.367
   25   HH12  ARG  13          HH12      ARG  13   6.456   1.640   2.345
   26   HH21  ARG  13          HH21      ARG  13   9.925   1.605   1.839
   27   HH22  ARG  13          HH22      ARG  13   8.607   2.406   2.626
   28    H    SER  14           HN       SER  14   8.137   2.163  -2.850
   29    HA   SER  14           HA       SER  14   8.213   2.452  -5.729
   30    HB2  SER  14           HB2      SER  14   8.583   4.503  -3.540
   31    HB3  SER  14           HB1      SER  14   8.367   4.843  -5.256
   32    HG   SER  14           HG       SER  14   6.346   3.398  -4.791
   33    HA   PRO  15           HA       PRO  15   9.142   3.795  -7.320
   34    HB2  PRO  15           HB2      PRO  15  10.571   2.827  -9.418
   35    HB3  PRO  15           HB1      PRO  15  10.925   4.376  -8.647
   36    HG2  PRO  15           HG2      PRO  15  12.245   1.720  -8.247
   37    HG3  PRO  15           HG1      PRO  15  12.986   3.321  -8.412
   38    HD2  PRO  15           HD2      PRO  15  12.647   2.125  -6.016
   39    HD3  PRO  15           HD1      PRO  15  12.554   3.885  -6.220
   40    H    CYS  16           HN       CYS  16   7.391   2.640  -7.937
   41    HA   CYS  16           HA       CYS  16   7.596  -0.273  -7.896
   42    HB2  CYS  16           HB2      CYS  16   4.950   0.194  -7.752
   43    HB3  CYS  16           HB1      CYS  16   6.006   0.166  -6.338
   44    H    ALA  17           HN       ALA  17   7.566  -1.204 -10.040
   45    HA   ALA  17           HA       ALA  17   5.857   0.105 -11.999
   46    HB1  ALA  17           HB1      ALA  17   8.148   0.825 -12.425
   47    HB2  ALA  17           HB2      ALA  17   7.563  -0.220 -13.719
   48    HB3  ALA  17           HB3      ALA  17   8.667  -0.859 -12.504
   49    HA   PRO  18           HA       PRO  18   4.995  -0.120 -13.619
   50    HB2  PRO  18           HB2      PRO  18   2.941  -1.258 -15.104
   51    HB3  PRO  18           HB1      PRO  18   4.589  -1.007 -15.681
   52    HG2  PRO  18           HG2      PRO  18   3.290  -3.493 -15.202
   53    HG3  PRO  18           HG1      PRO  18   4.957  -3.251 -15.677
   54    HD2  PRO  18           HD2      PRO  18   3.832  -3.772 -12.985
   55    HD3  PRO  18           HD1      PRO  18   5.454  -4.128 -13.618
   56    H    PHE  19           HN       PHE  19   3.512  -2.381 -11.608
   57    HA   PHE  19           HA       PHE  19   1.075  -0.773 -11.282
   58    HB2  PHE  19           HB2      PHE  19   1.552  -3.454  -9.996
   59    HB3  PHE  19           HB1      PHE  19   0.022  -2.664 -10.346
   60    HD1  PHE  19           HD1      PHE  19   2.132  -5.235 -11.289
   61    HD2  PHE  19           HD2      PHE  19  -0.321  -2.189 -12.968
   62    HE1  PHE  19           HE1      PHE  19   1.982  -6.518 -13.379
   63    HE2  PHE  19           HE2      PHE  19  -0.474  -3.467 -15.065
   64    HZ   PHE  19           HZ       PHE  19   0.678  -5.635 -15.271
   65    H    CYS  20           HN       CYS  20   0.720   0.288  -9.401
   66    HA   CYS  20           HA       CYS  20   2.533  -0.271  -7.184
   67    HB2  CYS  20           HB2      CYS  20   3.158   1.809  -8.548
   68    HB3  CYS  20           HB1      CYS  20   1.698   2.533  -7.879
   69    HN1  NH2  21           H1       CYS  20   0.612  -1.515  -6.580
   70    HN2  NH2  21           H2       CYS  20  -0.673  -0.703  -5.765
  Start of MODEL   24
    1    H1   GLY  11           HT1      GLY  11   0.322   0.135  -0.854
    2    H2   GLY  11           HT2      GLY  11  -0.221  -1.465  -0.916
    3    H3   GLY  11           HT3      GLY  11  -1.201  -0.214  -1.495
    4    HA2  GLY  11           HA1      GLY  11  -0.184  -1.429  -3.309
    5    HA3  GLY  11           HA2      GLY  11   0.343   0.248  -3.258
    6    H    PHE  12           HN       PHE  12   1.960  -1.141  -4.651
    7    HA   PHE  12           HA       PHE  12   3.951  -2.585  -3.198
    8    HB2  PHE  12           HB2      PHE  12   4.103  -1.399  -5.993
    9    HB3  PHE  12           HB1      PHE  12   5.283  -2.478  -5.284
   10    HD1  PHE  12           HD1      PHE  12   1.848  -2.283  -6.635
   11    HD2  PHE  12           HD2      PHE  12   4.901  -4.824  -5.072
   12    HE1  PHE  12           HE1      PHE  12   0.630  -4.248  -7.445
   13    HE2  PHE  12           HE2      PHE  12   3.673  -6.790  -5.883
   14    HZ   PHE  12           HZ       PHE  12   1.538  -6.503  -7.071
   15    H    ARG  13           HN       ARG  13   6.295  -1.919  -3.328
   16    HA   ARG  13           HA       ARG  13   6.540   0.658  -2.053
   17    HB2  ARG  13           HB2      ARG  13   8.688  -1.374  -2.703
   18    HB3  ARG  13           HB1      ARG  13   8.858   0.017  -1.652
   19    HG2  ARG  13           HG2      ARG  13   7.278  -0.905  -0.091
   20    HG3  ARG  13           HG1      ARG  13   6.983  -2.278  -1.157
   21    HD2  ARG  13           HD2      ARG  13   9.327  -2.941  -0.936
   22    HD3  ARG  13           HD1      ARG  13   9.608  -1.569   0.134
   23    HE   ARG  13           HE       ARG  13   7.498  -3.302   1.008
   24   HH11  ARG  13          HH11      ARG  13  10.963  -2.740   1.082
   25   HH12  ARG  13          HH12      ARG  13  11.208  -3.634   2.540
   26   HH21  ARG  13          HH21      ARG  13   7.821  -4.498   2.932
   27   HH22  ARG  13          HH22      ARG  13   9.407  -4.634   3.603
   28    H    SER  14           HN       SER  14   7.418   2.463  -2.886
   29    HA   SER  14           HA       SER  14   7.900   2.542  -5.730
   30    HB2  SER  14           HB2      SER  14   8.042   4.746  -3.660
   31    HB3  SER  14           HB1      SER  14   8.040   4.964  -5.411
   32    HG   SER  14           HG       SER  14   5.950   3.623  -5.154
   33    HA   PRO  15           HA       PRO  15   9.062   3.822  -7.295
   34    HB2  PRO  15           HB2      PRO  15  11.105   2.282  -8.752
   35    HB3  PRO  15           HB1      PRO  15  10.635   3.973  -8.942
   36    HG2  PRO  15           HG2      PRO  15  12.989   3.290  -7.856
   37    HG3  PRO  15           HG1      PRO  15  12.076   4.699  -7.286
   38    HD2  PRO  15           HD2      PRO  15  12.275   1.959  -6.087
   39    HD3  PRO  15           HD1      PRO  15  12.344   3.545  -5.286
   40    H    CYS  16           HN       CYS  16   7.368   2.672  -8.065
   41    HA   CYS  16           HA       CYS  16   7.516  -0.245  -7.885
   42    HB2  CYS  16           HB2      CYS  16   4.876   0.228  -7.822
   43    HB3  CYS  16           HB1      CYS  16   5.884   0.235  -6.375
   44    H    ALA  17           HN       ALA  17   7.574  -1.182 -10.036
   45    HA   ALA  17           HA       ALA  17   5.840   0.054 -12.025
   46    HB1  ALA  17           HB1      ALA  17   7.536  -0.324 -13.743
   47    HB2  ALA  17           HB2      ALA  17   8.643  -0.951 -12.522
   48    HB3  ALA  17           HB3      ALA  17   8.150   0.741 -12.478
   49    HA   PRO  18           HA       PRO  18   5.065  -0.250 -13.710
   50    HB2  PRO  18           HB2      PRO  18   3.055  -1.424 -15.211
   51    HB3  PRO  18           HB1      PRO  18   4.733  -1.261 -15.727
   52    HG2  PRO  18           HG2      PRO  18   3.324  -3.668 -15.131
   53    HG3  PRO  18           HG1      PRO  18   5.004  -3.509 -15.584
   54    HD2  PRO  18           HD2      PRO  18   3.823  -3.841 -12.891
   55    HD3  PRO  18           HD1      PRO  18   5.452  -4.253 -13.466
   56    H    PHE  19           HN       PHE  19   3.569  -2.235 -11.511
   57    HA   PHE  19           HA       PHE  19   1.181  -0.518 -11.338
   58    HB2  PHE  19           HB2      PHE  19   1.399  -3.230 -10.039
   59    HB3  PHE  19           HB1      PHE  19  -0.050  -2.312 -10.423
   60    HD1  PHE  19           HD1      PHE  19   1.782  -5.088 -11.286
   61    HD2  PHE  19           HD2      PHE  19  -0.228  -1.796 -13.080
   62    HE1  PHE  19           HE1      PHE  19   1.567  -6.365 -13.371
   63    HE2  PHE  19           HE2      PHE  19  -0.448  -3.067 -15.176
   64    HZ   PHE  19           HZ       PHE  19   0.451  -5.358 -15.322
   65    H    CYS  20           HN       CYS  20   0.631   0.263  -9.290
   66    HA   CYS  20           HA       CYS  20   2.608  -0.228  -7.200
   67    HB2  CYS  20           HB2      CYS  20   2.879   2.001  -8.486
   68    HB3  CYS  20           HB1      CYS  20   1.445   2.505  -7.600
   69    HN1  NH2  21           H1       CYS  20  -0.327   1.749  -7.510
   70    HN2  NH2  21           H2       CYS  20  -1.172   0.986  -6.212
  Start of MODEL   25
    1    H1   GLY  11           HT1      GLY  11   0.040   1.257  -1.262
    2    H2   GLY  11           HT2      GLY  11  -0.346  -0.087  -2.207
    3    H3   GLY  11           HT3      GLY  11  -1.022   1.421  -2.567
    4    HA2  GLY  11           HA1      GLY  11   0.739   0.867  -4.107
    5    HA3  GLY  11           HA2      GLY  11   1.115   2.301  -3.158
    6    H    PHE  12           HN       PHE  12   2.808   0.157  -4.507
    7    HA   PHE  12           HA       PHE  12   4.145  -1.017  -2.205
    8    HB2  PHE  12           HB2      PHE  12   4.752  -1.302  -5.169
    9    HB3  PHE  12           HB1      PHE  12   5.645  -2.087  -3.884
   10    HD1  PHE  12           HD1      PHE  12   2.396  -2.017  -5.645
   11    HD2  PHE  12           HD2      PHE  12   4.792  -3.976  -2.710
   12    HE1  PHE  12           HE1      PHE  12   0.843  -3.912  -5.636
   13    HE2  PHE  12           HE2      PHE  12   3.229  -5.871  -2.705
   14    HZ   PHE  12           HZ       PHE  12   1.254  -5.842  -4.169
   15    H    ARG  13           HN       ARG  13   6.652  -0.964  -2.345
   16    HA   ARG  13           HA       ARG  13   7.475   1.658  -1.801
   17    HB2  ARG  13           HB2      ARG  13   8.648  -0.223  -0.841
   18    HB3  ARG  13           HB1      ARG  13   9.114  -0.798  -2.434
   19    HG2  ARG  13           HG2      ARG  13  10.525   1.161  -2.732
   20    HG3  ARG  13           HG1      ARG  13  10.021   1.766  -1.152
   21    HD2  ARG  13           HD2      ARG  13  12.072   0.734  -0.730
   22    HD3  ARG  13           HD1      ARG  13  10.854  -0.448  -0.242
   23    HE   ARG  13           HE       ARG  13  11.488  -1.045  -2.871
   24   HH11  ARG  13          HH11      ARG  13  13.198  -0.900   0.189
   25   HH12  ARG  13          HH12      ARG  13  14.331  -2.133  -0.242
   26   HH21  ARG  13          HH21      ARG  13  12.974  -2.693  -3.437
   27   HH22  ARG  13          HH22      ARG  13  14.198  -3.162  -2.308
   28    H    SER  14           HN       SER  14   7.865   3.282  -3.103
   29    HA   SER  14           HA       SER  14   8.063   2.909  -5.940
   30    HB2  SER  14           HB2      SER  14   8.330   5.466  -4.344
   31    HB3  SER  14           HB1      SER  14   7.921   5.313  -6.054
   32    HG   SER  14           HG       SER  14   5.988   4.246  -5.417
   33    HA   PRO  15           HA       PRO  15   8.885   4.140  -7.719
   34    HB2  PRO  15           HB2      PRO  15  10.400   3.070  -9.709
   35    HB3  PRO  15           HB1      PRO  15  10.587   4.731  -9.139
   36    HG2  PRO  15           HG2      PRO  15  12.205   2.309  -8.479
   37    HG3  PRO  15           HG1      PRO  15  12.743   3.968  -8.788
   38    HD2  PRO  15           HD2      PRO  15  12.512   2.921  -6.288
   39    HD3  PRO  15           HD1      PRO  15  12.302   4.646  -6.640
   40    H    CYS  16           HN       CYS  16   7.262   2.759  -8.151
   41    HA   CYS  16           HA       CYS  16   7.784  -0.104  -7.937
   42    HB2  CYS  16           HB2      CYS  16   5.123   0.070  -7.562
   43    HB3  CYS  16           HB1      CYS  16   6.292   0.217  -6.250
   44    H    ALA  17           HN       ALA  17   7.631  -1.156 -10.025
   45    HA   ALA  17           HA       ALA  17   5.733  -0.009 -11.922
   46    HB1  ALA  17           HB1      ALA  17   7.347  -0.354 -13.723
   47    HB2  ALA  17           HB2      ALA  17   8.538  -0.925 -12.554
   48    HB3  ALA  17           HB3      ALA  17   7.986   0.748 -12.503
   49    HA   PRO  18           HA       PRO  18   5.157  -0.378 -13.807
   50    HB2  PRO  18           HB2      PRO  18   2.921  -1.672 -15.010
   51    HB3  PRO  18           HB1      PRO  18   4.491  -1.352 -15.746
   52    HG2  PRO  18           HG2      PRO  18   3.484  -3.874 -15.152
   53    HG3  PRO  18           HG1      PRO  18   5.165  -3.503 -15.465
   54    HD2  PRO  18           HD2      PRO  18   3.777  -3.881 -12.849
   55    HD3  PRO  18           HD1      PRO  18   5.429  -4.334 -13.326
   56    H    PHE  19           HN       PHE  19   3.309  -2.324 -11.683
   57    HA   PHE  19           HA       PHE  19   1.266  -0.227 -11.401
   58    HB2  PHE  19           HB2      PHE  19   0.939  -3.000 -10.299
   59    HB3  PHE  19           HB1      PHE  19  -0.299  -1.853 -10.800
   60    HD1  PHE  19           HD1      PHE  19   1.089  -4.866 -11.590
   61    HD2  PHE  19           HD2      PHE  19   0.047  -1.182 -13.445
   62    HE1  PHE  19           HE1      PHE  19   0.979  -5.999 -13.766
   63    HE2  PHE  19           HE2      PHE  19  -0.064  -2.308 -15.627
   64    HZ   PHE  19           HZ       PHE  19   0.402  -4.722 -15.790
   65    H    CYS  20           HN       CYS  20   0.683   0.367  -9.251
   66    HA   CYS  20           HA       CYS  20   2.618  -0.441  -7.224
   67    HB2  CYS  20           HB2      CYS  20   3.071   1.822  -8.347
   68    HB3  CYS  20           HB1      CYS  20   1.635   2.385  -7.499
   69    HN1  NH2  21           H1       CYS  20   0.737  -1.829  -6.714
   70    HN2  NH2  21           H2       CYS  20  -0.518  -1.175  -5.721
  Start of MODEL   26
    1    H1   GLY  11           HT1      GLY  11  -0.480  -2.519  -1.497
    2    H2   GLY  11           HT2      GLY  11  -0.479  -3.137  -3.067
    3    H3   GLY  11           HT3      GLY  11  -1.711  -2.090  -2.573
    4    HA2  GLY  11           HA1      GLY  11  -0.136  -0.936  -3.968
    5    HA3  GLY  11           HA2      GLY  11  -0.137  -0.292  -2.332
    6    H    PHE  12           HN       PHE  12   1.975  -0.336  -4.468
    7    HA   PHE  12           HA       PHE  12   3.978  -1.941  -3.036
    8    HB2  PHE  12           HB2      PHE  12   4.005  -0.905  -5.882
    9    HB3  PHE  12           HB1      PHE  12   5.386  -1.647  -5.098
   10    HD1  PHE  12           HD1      PHE  12   1.847  -2.326  -6.057
   11    HD2  PHE  12           HD2      PHE  12   5.670  -3.941  -5.098
   12    HE1  PHE  12           HE1      PHE  12   1.072  -4.558  -6.724
   13    HE2  PHE  12           HE2      PHE  12   4.895  -6.173  -5.764
   14    HZ   PHE  12           HZ       PHE  12   2.594  -6.485  -6.580
   15    H    ARG  13           HN       ARG  13   6.226  -1.002  -3.110
   16    HA   ARG  13           HA       ARG  13   6.088   1.775  -2.183
   17    HB2  ARG  13           HB2      ARG  13   7.094   0.273  -0.581
   18    HB3  ARG  13           HB1      ARG  13   8.186  -0.385  -1.789
   19    HG2  ARG  13           HG2      ARG  13   9.283   1.819  -1.942
   20    HG3  ARG  13           HG1      ARG  13   8.239   2.389  -0.637
   21    HD2  ARG  13           HD2      ARG  13   9.154   0.800   0.884
   22    HD3  ARG  13           HD1      ARG  13  10.025  -0.017  -0.412
   23    HE   ARG  13           HE       ARG  13  11.137   2.371  -0.569
   24   HH11  ARG  13          HH11      ARG  13  10.341   0.560   2.336
   25   HH12  ARG  13          HH12      ARG  13  11.666   1.191   3.246
   26   HH21  ARG  13          HH21      ARG  13  12.887   3.202   0.627
   27   HH22  ARG  13          HH22      ARG  13  13.132   2.709   2.270
   28    H    SER  14           HN       SER  14   7.154   3.406  -3.178
   29    HA   SER  14           HA       SER  14   8.060   3.005  -5.843
   30    HB2  SER  14           HB2      SER  14   8.267   5.437  -4.054
   31    HB3  SER  14           HB1      SER  14   8.554   5.420  -5.794
   32    HG   SER  14           HG       SER  14   6.121   4.411  -4.834
   33    HA   PRO  15           HA       PRO  15   9.407   3.797  -7.360
   34    HB2  PRO  15           HB2      PRO  15  11.119   2.416  -8.923
   35    HB3  PRO  15           HB1      PRO  15  11.490   4.034  -8.316
   36    HG2  PRO  15           HG2      PRO  15  12.391   1.374  -7.288
   37    HG3  PRO  15           HG1      PRO  15  13.324   2.865  -7.502
   38    HD2  PRO  15           HD2      PRO  15  12.340   2.060  -5.098
   39    HD3  PRO  15           HD1      PRO  15  12.573   3.767  -5.527
   40    H    CYS  16           HN       CYS  16   7.749   2.626  -8.201
   41    HA   CYS  16           HA       CYS  16   7.874  -0.285  -7.952
   42    HB2  CYS  16           HB2      CYS  16   5.279   0.028  -7.601
   43    HB3  CYS  16           HB1      CYS  16   6.403   0.170  -6.253
   44    H    ALA  17           HN       ALA  17   7.737  -1.128 -10.124
   45    HA   ALA  17           HA       ALA  17   5.852   0.187 -11.900
   46    HB1  ALA  17           HB1      ALA  17   8.125   0.962 -12.445
   47    HB2  ALA  17           HB2      ALA  17   7.407   0.024 -13.753
   48    HB3  ALA  17           HB3      ALA  17   8.617  -0.711 -12.703
   49    HA   PRO  18           HA       PRO  18   4.907  -0.022 -13.465
   50    HB2  PRO  18           HB2      PRO  18   2.892  -1.050 -14.976
   51    HB3  PRO  18           HB1      PRO  18   4.564  -0.938 -15.530
   52    HG2  PRO  18           HG2      PRO  18   3.017  -3.293 -14.862
   53    HG3  PRO  18           HG1      PRO  18   4.574  -3.210 -15.659
   54    HD2  PRO  18           HD2      PRO  18   3.976  -3.796 -12.859
   55    HD3  PRO  18           HD1      PRO  18   5.513  -3.970 -13.728
   56    H    PHE  19           HN       PHE  19   3.186  -2.599 -11.832
   57    HA   PHE  19           HA       PHE  19   0.869  -0.917 -11.288
   58    HB2  PHE  19           HB2      PHE  19   1.324  -3.664 -10.135
   59    HB3  PHE  19           HB1      PHE  19  -0.198  -2.835 -10.418
   60    HD1  PHE  19           HD1      PHE  19   1.864  -5.386 -11.524
   61    HD2  PHE  19           HD2      PHE  19  -0.604  -2.250 -13.005
   62    HE1  PHE  19           HE1      PHE  19   1.628  -6.588 -13.654
   63    HE2  PHE  19           HE2      PHE  19  -0.841  -3.444 -15.144
   64    HZ   PHE  19           HZ       PHE  19   0.275  -5.617 -15.469
   65    H    CYS  20           HN       CYS  20   0.800   0.340  -9.547
   66    HA   CYS  20           HA       CYS  20   2.318  -0.465  -7.196
   67    HB2  CYS  20           HB2      CYS  20   3.475   1.331  -8.562
   68    HB3  CYS  20           HB1      CYS  20   2.125   2.383  -8.159
   69    HN1  NH2  21           H1       CYS  20   0.233  -1.246  -6.520
   70    HN2  NH2  21           H2       CYS  20  -0.948  -0.143  -5.906
  Start of MODEL   27
    1    H1   GLY  11           HT1      GLY  11  -0.645   3.832  -1.771
    2    H2   GLY  11           HT2      GLY  11  -1.483   2.434  -2.210
    3    H3   GLY  11           HT3      GLY  11  -1.682   3.858  -3.106
    4    HA2  GLY  11           HA1      GLY  11  -0.264   2.292  -4.262
    5    HA3  GLY  11           HA2      GLY  11   0.584   3.776  -3.842
    6    H    PHE  12           HN       PHE  12   2.106   1.673  -4.393
    7    HA   PHE  12           HA       PHE  12   2.860   0.603  -1.758
    8    HB2  PHE  12           HB2      PHE  12   3.325  -0.513  -4.526
    9    HB3  PHE  12           HB1      PHE  12   4.259  -1.039  -3.138
   10    HD1  PHE  12           HD1      PHE  12   0.728  -0.680  -4.278
   11    HD2  PHE  12           HD2      PHE  12   3.496  -2.747  -1.795
   12    HE1  PHE  12           HE1      PHE  12  -1.022  -2.287  -3.667
   13    HE2  PHE  12           HE2      PHE  12   1.748  -4.357  -1.181
   14    HZ   PHE  12           HZ       PHE  12  -0.516  -4.131  -2.118
   15    H    ARG  13           HN       ARG  13   5.362  -0.042  -1.902
   16    HA   ARG  13           HA       ARG  13   6.723   2.387  -1.538
   17    HB2  ARG  13           HB2      ARG  13   7.385   0.254  -0.424
   18    HB3  ARG  13           HB1      ARG  13   7.972  -0.342  -1.972
   19    HG2  ARG  13           HG2      ARG  13   9.801   0.423  -0.632
   20    HG3  ARG  13           HG1      ARG  13   9.600   1.493  -2.022
   21    HD2  ARG  13           HD2      ARG  13   8.514   3.144  -0.674
   22    HD3  ARG  13           HD1      ARG  13   8.462   2.052   0.706
   23    HE   ARG  13           HE       ARG  13  11.133   2.463  -0.130
   24   HH11  ARG  13          HH11      ARG  13   8.491   4.053   1.544
   25   HH12  ARG  13          HH12      ARG  13   9.528   5.060   2.490
   26   HH21  ARG  13          HH21      ARG  13  12.509   3.795   1.151
   27   HH22  ARG  13          HH22      ARG  13  11.813   4.916   2.272
   28    H    SER  14           HN       SER  14   7.387   3.758  -2.991
   29    HA   SER  14           HA       SER  14   7.831   2.945  -5.730
   30    HB2  SER  14           HB2      SER  14   8.086   5.676  -4.447
   31    HB3  SER  14           HB1      SER  14   8.006   5.334  -6.176
   32    HG   SER  14           HG       SER  14   5.910   4.179  -5.052
   33    HA   PRO  15           HA       PRO  15   9.025   3.993  -7.496
   34    HB2  PRO  15           HB2      PRO  15  10.719   2.661  -9.145
   35    HB3  PRO  15           HB1      PRO  15  10.993   4.331  -8.640
   36    HG2  PRO  15           HG2      PRO  15  12.188   1.808  -7.568
   37    HG3  PRO  15           HG1      PRO  15  12.978   3.356  -7.925
   38    HD2  PRO  15           HD2      PRO  15  12.268   2.621  -5.417
   39    HD3  PRO  15           HD1      PRO  15  12.272   4.312  -5.955
   40    H    CYS  16           HN       CYS  16   7.465   2.695  -8.324
   41    HA   CYS  16           HA       CYS  16   7.689  -0.191  -7.902
   42    HB2  CYS  16           HB2      CYS  16   5.057   0.120  -7.634
   43    HB3  CYS  16           HB1      CYS  16   6.156   0.299  -6.268
   44    H    ALA  17           HN       ALA  17   7.595  -1.179 -10.029
   45    HA   ALA  17           HA       ALA  17   5.758   0.035 -11.939
   46    HB1  ALA  17           HB1      ALA  17   8.569  -0.861 -12.556
   47    HB2  ALA  17           HB2      ALA  17   8.004   0.809 -12.487
   48    HB3  ALA  17           HB3      ALA  17   7.387  -0.280 -13.728
   49    HA   PRO  18           HA       PRO  18   5.092  -0.270 -13.728
   50    HB2  PRO  18           HB2      PRO  18   3.013  -1.481 -15.159
   51    HB3  PRO  18           HB1      PRO  18   4.663  -1.245 -15.738
   52    HG2  PRO  18           HG2      PRO  18   3.398  -3.715 -15.171
   53    HG3  PRO  18           HG1      PRO  18   5.081  -3.470 -15.572
   54    HD2  PRO  18           HD2      PRO  18   3.819  -3.854 -12.916
   55    HD3  PRO  18           HD1      PRO  18   5.464  -4.257 -13.452
   56    H    PHE  19           HN       PHE  19   3.477  -2.292 -11.570
   57    HA   PHE  19           HA       PHE  19   1.211  -0.423 -11.358
   58    HB2  PHE  19           HB2      PHE  19   1.207  -3.212 -10.221
   59    HB3  PHE  19           HB1      PHE  19  -0.166  -2.177 -10.591
   60    HD1  PHE  19           HD1      PHE  19   1.322  -5.068 -11.538
   61    HD2  PHE  19           HD2      PHE  19  -0.018  -1.416 -13.265
   62    HE1  PHE  19           HE1      PHE  19   1.111  -6.183 -13.717
   63    HE2  PHE  19           HE2      PHE  19  -0.229  -2.525 -15.452
   64    HZ   PHE  19           HZ       PHE  19   0.337  -4.911 -15.679
   65    H    CYS  20           HN       CYS  20   0.688   0.351  -9.293
   66    HA   CYS  20           HA       CYS  20   2.572  -0.338  -7.178
   67    HB2  CYS  20           HB2      CYS  20   2.969   1.892  -8.450
   68    HB3  CYS  20           HB1      CYS  20   1.548   2.456  -7.580
   69    HN1  NH2  21           H1       CYS  20   0.475  -1.708  -6.974
   70    HN2  NH2  21           H2       CYS  20  -0.744  -1.041  -5.945