*HEADER    NEUROPEPTIDE                            01-AUG-19   6KMY              
*TITLE     STRUCTURE OF SINGLE DISULFIDE PEPTIDE CZON1107-P5A                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CZON1107-P5A;                                              
*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 ANATGONIST NMR, NEUROPEPTIDE                                    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    28                                                                    
*AUTHOR    S.P.SARMA,M.MADHAN KUMAR                                              
*REVDAT   1   08-APR-20 6KMY    0                                                
# Restraints file 1: Czon1107_P5A.upl
  2 PHE  H       1 GLY  HA2     3.50
  2 PHE  H       1 GLY  HA3     0.00
  2 PHE  H       2 PHE  HA      3.50
  2 PHE  H       2 PHE  HB2     5.00
  2 PHE  H       2 PHE  HB3     0.00
  2 PHE  H       2 PHE  QD      5.00
  2 PHE  HA      2 PHE  QD      5.00 
  2 PHE  HA      2 PHE  QE      6.00
  2 PHE  HB2     2 PHE  HA      3.50
  2 PHE  HB2     2 PHE  QD      5.00
  2 PHE  HB3     2 PHE  QD      0.00
  2 PHE  HB2     2 PHE  QE      5.50
  2 PHE  HB3     2 PHE  QE      0.00
  2 PHE  HB2     3 ARG  H       5.00
  2 PHE  HB3     3 ARF  H       0.00
  3 ARG  H       2 PHE  HA      2.50
  3 ARG  H       2 PHE  QD      6.00
  3 ARG  H       3 ARG  HA      3.50
  3 ARG  H       3 ARG  HB2     5.00
  3 ARG  H       3 ARG  HB3     0.00
  3 ARG  H       3 ARG  HG2     5.00
  3 ARG  H       3 ARG  HG3     0.00
  3 ARG  HA      3 ARG  HB2     3.50
  3 ARG  HA      3 ARG  HB3     0.00
  3 ARG  HA      3 ARG  HD2     5.00
  3 ARG  HA      3 ARG  HD3     0.00
  3 ARG  HA      3 ARG  HG2     5.00
  3 ARG  HA      3 ARG  HG3     0.00
  3 ARG  HB2     3 ARG  HD2     5.00
  3 ARG  HB3     3 ARG  HD2     0.00
  3 ARG  HE      3 ARG  HB2     5.00
  3 ARG  HE      3 ARG  HB3     0.00
  3 ARG  HE      3 ARG  HD2     3.50
  3 ARG  HE      3 ARG  HD3     0.00
  3 ARG  HE      3 ARG  HG2     5.00
  3 ARG  HE      3 ARG  HG3     0.00
  3 ARG  QG      3 ARG  QB      3.50
  3 ARG  QG      3 ARG  QD      3.50
  4 SER  H       3 ARG  HA      2.80
  4 SER  H       3 ARG  HB2     5.00
  4 SER  H       3 ARG  HB3     0.00
  4 SER  H       3 ARG  QG      5.00
  4 SER  H       4 SER  HA      3.50
  4 SER  H       4 SER  HB2     5.00
  4 SER  H       4 SER  HB3     0.00
  4 SER  HA      4 SER  HB2     3.50
  4 SER  HA      4 SER  HB3     0.00
  5 ALA  H       4 SER  H       4.20
  5 ALA  H       4 SER  HA      2.80
  5 ALA  H       4 SER  HB2     5.00
  5 ALA  H       4 SER  HB3     0.00
  5 ALA  H       5 ALA  HA      3.50
  5 ALA  H       5 ALA  QB      5.00
  5 ALA  H       6 CYS  H       4.20
  5 ALA  HA      6 CYS  H       3.50
  6 CYS  H       4 SER  HB2     5.00
  6 CYS  H       4 SER  HB3     0.00
  6 CYS  H       5 ALA  QB      5.00
  6 CYS  H       6 CYS  HA      3.50
  6 CYS  H       6 CYS  HB2     5.00
  6 CYS  H       6 CYS  HB3     0.00
  6 CYS  HB2     6 CYS  HA      3.50
  6 CYS  HB3     6 CYS  HA      0.00
  8 PRO  HA      7 PRO  HA      5.00
  8 PRO  HA      7 PRO  HB2     5.00
  8 PRO  HA      7 PRO  HB3     0.00
  7 PRO  HD2     5 ALA  QB      5.00
  7 PRO  HD3     5 ALA  QB      0.00
  8 PRO  HG2     9 PHE  QD      5.00
  8 PRO  HG3     9 PHE  QD      0.00
  8 PRO  HG2     9 PHE  QE      5.00
  8 PRO  HG3     9 PHE  QE      0.00
  9 PHE  H       8 PRO  HD2     5.50
  9 PHE  H       8 PRO  HD3     0.00
  9 PHE  H       9 PHE  HA      3.50
  9 PHE  H       9 PHE  HB2     5.00
  9 PHE  H       9 PHE  HB3     0.00
  9 PHE  H       9 PHE  QD      5.00
  9 PHE  HA      9 PHE  QD      5.00
  9 PHE  HB2     9 PHE  HA      3.50
  9 PHE  HB3     9 PHE  HA      0.00
  9 PHE  HB2     9 PHE  QD      5.00 
  9 PHE  HB3     9 PHE  QD      0.00
  9 PHE  HB2     9 PHE  QE      5.00
  9 PHE  HB3     9 PHE  QE      0.00
10 CYS    H      9 PHE  H       5.00
10 CYS    H      9 PHE  HA      4.50
10 CYS    H      11 NH2  HN1    5.00
10 CYS    H      11 NH2  HN2    5.00
10 CYS    H      10 CYS  HA     3.50
10 CYS    H      10 CYS  HB2    5.00
10 CYS    H      10 CYS  HB3    0.00
10 CYS    HA     11 NH2  HN1    5.00
10 CYS    HA     11 NH2  HN2    0.00
10 CYS    HB2    11 NH2  HN1    5.00
10 CYS    HB3    11 NH2  HN1    0.00
10 CYS    HB2    11 NH2  HN2    5.00
10 CYS    HB3    11 NH2  HN2    0.00

 # restraint file for disulphide bonds
6	CYSS	SG	10	CYSS	SG	2.05	2.0
6	CYSS	SG	10	CYSS	CB	3.05	2.0
6	CYSS	CB	10	CYSS	SG	3.15	2.0	
6	CYSS	CB	10	CYSS	CB	4.20	2.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1  11.095   3.401  -7.290
    2    H2   GLY   1           HT2      GLY   1  11.244   1.825  -7.885
    3    H3   GLY   1           HT3      GLY   1  11.375   2.118  -6.227
    4    HA2  GLY   1           HA1      GLY   1   9.088   2.786  -6.102
    5    HA3  GLY   1           HA2      GLY   1   8.939   2.552  -7.838
    6    H    PHE   2           HN       PHE   2   7.491   1.269  -5.625
    7    HA   PHE   2           HA       PHE   2   8.236  -1.505  -6.227
    8    HB2  PHE   2           HB2      PHE   2   6.959  -0.419  -3.752
    9    HB3  PHE   2           HB1      PHE   2   7.145  -2.130  -4.090
   10    HD1  PHE   2           HD1      PHE   2   8.799   0.870  -2.923
   11    HD2  PHE   2           HD2      PHE   2   9.400  -3.129  -4.243
   12    HE1  PHE   2           HE1      PHE   2  11.063   0.896  -1.966
   13    HE2  PHE   2           HE2      PHE   2  11.661  -3.112  -3.287
   14    HZ   PHE   2           HZ       PHE   2  12.498  -1.097  -2.146
   15    H    ARG   3           HN       ARG   3   6.964  -2.188  -7.663
   16    HA   ARG   3           HA       ARG   3   4.083  -2.042  -7.337
   17    HB2  ARG   3           HB2      ARG   3   5.532  -0.902  -9.715
   18    HB3  ARG   3           HB1      ARG   3   3.859  -1.432  -9.812
   19    HG2  ARG   3           HG2      ARG   3   3.252   0.163  -8.060
   20    HG3  ARG   3           HG1      ARG   3   4.931   0.696  -7.971
   21    HD2  ARG   3           HD2      ARG   3   3.212   0.832 -10.434
   22    HD3  ARG   3           HD1      ARG   3   3.475   2.177  -9.324
   23    HE   ARG   3           HE       ARG   3   5.984   1.401 -10.018
   24   HH11  ARG   3          HH11      ARG   3   3.144   2.364 -11.843
   25   HH12  ARG   3          HH12      ARG   3   4.050   3.009 -13.169
   26   HH21  ARG   3          HH21      ARG   3   7.185   2.253 -11.744
   27   HH22  ARG   3          HH22      ARG   3   6.378   2.945 -13.109
   28    H    SER   4           HN       SER   4   2.954  -3.623  -8.556
   29    HA   SER   4           HA       SER   4   4.561  -5.972  -9.002
   30    HB2  SER   4           HB2      SER   4   1.557  -5.646  -9.064
   31    HB3  SER   4           HB1      SER   4   2.444  -7.169  -9.072
   32    HG   SER   4           HG       SER   4   2.754  -5.259  -7.005
   33    H    ALA   5           HN       ALA   5   5.534  -5.100 -10.870
   34    HA   ALA   5           HA       ALA   5   3.848  -5.256 -13.260
   35    HB1  ALA   5           HB1      ALA   5   5.614  -4.049 -14.440
   36    HB2  ALA   5           HB2      ALA   5   6.567  -3.988 -12.958
   37    HB3  ALA   5           HB3      ALA   5   5.027  -3.133 -13.052
   38    H    CYS   6           HN       CYS   6   3.921  -7.548 -13.009
   39    HA   CYS   6           HA       CYS   6   6.427  -8.855 -13.510
   40    HB2  CYS   6           HB2      CYS   6   4.959 -10.918 -13.783
   41    HB3  CYS   6           HB1      CYS   6   4.948 -10.144 -12.207
   42    HA   PRO   7           HA       PRO   7   6.803 -10.953 -14.422
   43    HB2  PRO   7           HB2      PRO   7   8.780 -11.666 -16.099
   44    HB3  PRO   7           HB1      PRO   7   7.133 -12.286 -16.278
   45    HG2  PRO   7           HG2      PRO   7   8.511 -10.108 -17.786
   46    HG3  PRO   7           HG1      PRO   7   7.412 -11.362 -18.383
   47    HD2  PRO   7           HD2      PRO   7   6.674  -8.754 -17.842
   48    HD3  PRO   7           HD1      PRO   7   5.555 -10.130 -17.864
   49    HA   PRO   8           HA       PRO   8   8.040 -11.891 -13.419
   50    HB2  PRO   8           HB2      PRO   8  10.132 -12.645 -12.051
   51    HB3  PRO   8           HB1      PRO   8  10.293 -12.423 -13.801
   52    HG2  PRO   8           HG2      PRO   8  11.324 -10.717 -11.588
   53    HG3  PRO   8           HG1      PRO   8  11.948 -10.914 -13.237
   54    HD2  PRO   8           HD2      PRO   8  10.129  -8.877 -12.209
   55    HD3  PRO   8           HD1      PRO   8  10.889  -8.974 -13.814
   56    H    PHE   9           HN       PHE   9   7.069  -9.477 -11.957
   57    HA   PHE   9           HA       PHE   9   7.130 -10.584  -9.245
   58    HB2  PHE   9           HB2      PHE   9   7.801  -7.707  -9.876
   59    HB3  PHE   9           HB1      PHE   9   7.424  -8.296  -8.264
   60    HD1  PHE   9           HD1      PHE   9   8.889 -10.400  -7.535
   61    HD2  PHE   9           HD2      PHE   9   9.999  -7.518 -10.458
   62    HE1  PHE   9           HE1      PHE   9  11.256 -10.970  -7.191
   63    HE2  PHE   9           HE2      PHE   9  12.366  -8.084 -10.124
   64    HZ   PHE   9           HZ       PHE   9  13.001  -9.812  -8.489
   65    H    CYS  10           HN       CYS  10   4.983 -11.184  -9.319
   66    HA   CYS  10           HA       CYS  10   3.237  -9.144  -8.419
   67    HB2  CYS  10           HB2      CYS  10   1.408  -9.402 -10.047
   68    HB3  CYS  10           HB1      CYS  10   2.852  -8.751 -10.802
   69    HN1  NH2  11           H1       CYS  10   2.998 -10.268  -6.600
   70    HN2  NH2  11           H2       CYS  10   2.254 -11.824  -6.500
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1  10.398   1.730  -8.029
    2    H2   GLY   1           HT2      GLY   1  11.531   1.191  -6.905
    3    H3   GLY   1           HT3      GLY   1  10.943   2.773  -6.822
    4    HA2  GLY   1           HA1      GLY   1   9.933   1.351  -5.143
    5    HA3  GLY   1           HA2      GLY   1   8.761   2.007  -6.272
    6    H    PHE   2           HN       PHE   2   8.568  -0.381  -4.631
    7    HA   PHE   2           HA       PHE   2   8.799  -2.560  -6.525
    8    HB2  PHE   2           HB2      PHE   2   7.815  -2.514  -3.697
    9    HB3  PHE   2           HB1      PHE   2   8.003  -3.962  -4.666
   10    HD1  PHE   2           HD1      PHE   2   9.780  -1.307  -2.874
   11    HD2  PHE   2           HD2      PHE   2  10.151  -4.882  -5.139
   12    HE1  PHE   2           HE1      PHE   2  12.128  -1.495  -2.185
   13    HE2  PHE   2           HE2      PHE   2  12.495  -5.079  -4.457
   14    HZ   PHE   2           HZ       PHE   2  13.492  -3.386  -2.975
   15    H    ARG   3           HN       ARG   3   7.289  -2.954  -7.848
   16    HA   ARG   3           HA       ARG   3   4.475  -2.452  -7.160
   17    HB2  ARG   3           HB2      ARG   3   5.839  -1.861  -9.788
   18    HB3  ARG   3           HB1      ARG   3   4.104  -1.783  -9.517
   19    HG2  ARG   3           HG2      ARG   3   4.411   0.002  -7.914
   20    HG3  ARG   3           HG1      ARG   3   6.163  -0.096  -8.115
   21    HD2  ARG   3           HD2      ARG   3   4.173   0.574 -10.270
   22    HD3  ARG   3           HD1      ARG   3   5.188   1.739  -9.420
   23    HE   ARG   3           HE       ARG   3   6.910  -0.139 -10.488
   24   HH11  ARG   3          HH11      ARG   3   4.590   2.173 -11.741
   25   HH12  ARG   3          HH12      ARG   3   5.413   2.373 -13.244
   26   HH21  ARG   3          HH21      ARG   3   7.999   0.132 -12.467
   27   HH22  ARG   3          HH22      ARG   3   7.362   1.207 -13.664
   28    H    SER   4           HN       SER   4   3.006  -3.905  -8.153
   29    HA   SER   4           HA       SER   4   4.206  -6.431  -8.825
   30    HB2  SER   4           HB2      SER   4   1.299  -5.651  -8.637
   31    HB3  SER   4           HB1      SER   4   1.918  -7.286  -8.894
   32    HG   SER   4           HG       SER   4   2.041  -5.664  -6.587
   33    H    ALA   5           HN       ALA   5   5.191  -5.607 -10.644
   34    HA   ALA   5           HA       ALA   5   3.434  -5.590 -12.988
   35    HB1  ALA   5           HB1      ALA   5   5.077  -4.170 -14.124
   36    HB2  ALA   5           HB2      ALA   5   6.039  -4.103 -12.646
   37    HB3  ALA   5           HB3      ALA   5   4.428  -3.382 -12.684
   38    H    CYS   6           HN       CYS   6   3.697  -7.878 -12.894
   39    HA   CYS   6           HA       CYS   6   6.318  -8.937 -13.419
   40    HB2  CYS   6           HB2      CYS   6   5.041 -11.094 -13.878
   41    HB3  CYS   6           HB1      CYS   6   4.919 -10.436 -12.253
   42    HA   PRO   7           HA       PRO   7   6.887 -10.920 -14.432
   43    HB2  PRO   7           HB2      PRO   7   8.898 -11.473 -16.106
   44    HB3  PRO   7           HB1      PRO   7   7.276 -12.124 -16.372
   45    HG2  PRO   7           HG2      PRO   7   8.628  -9.812 -17.698
   46    HG3  PRO   7           HG1      PRO   7   7.588 -11.058 -18.406
   47    HD2  PRO   7           HD2      PRO   7   6.750  -8.510 -17.700
   48    HD3  PRO   7           HD1      PRO   7   5.680  -9.912 -17.888
   49    HA   PRO   8           HA       PRO   8   8.202 -11.869 -13.526
   50    HB2  PRO   8           HB2      PRO   8  10.321 -12.601 -12.180
   51    HB3  PRO   8           HB1      PRO   8  10.490 -12.260 -13.909
   52    HG2  PRO   8           HG2      PRO   8  11.374 -10.631 -11.573
   53    HG3  PRO   8           HG1      PRO   8  12.075 -10.726 -13.202
   54    HD2  PRO   8           HD2      PRO   8  10.167  -8.792 -12.170
   55    HD3  PRO   8           HD1      PRO   8  10.924  -8.838 -13.777
   56    H    PHE   9           HN       PHE   9   7.129  -9.577 -11.981
   57    HA   PHE   9           HA       PHE   9   7.058 -10.810  -9.336
   58    HB2  PHE   9           HB2      PHE   9   7.920  -7.940  -9.746
   59    HB3  PHE   9           HB1      PHE   9   7.443  -8.611  -8.196
   60    HD1  PHE   9           HD1      PHE   9   8.788 -10.791  -7.512
   61    HD2  PHE   9           HD2      PHE   9  10.145  -7.845 -10.258
   62    HE1  PHE   9           HE1      PHE   9  11.113 -11.485  -7.099
   63    HE2  PHE   9           HE2      PHE   9  12.471  -8.535  -9.857
   64    HZ   PHE   9           HZ       PHE   9  12.957 -10.356  -8.276
   65    H    CYS  10           HN       CYS  10   4.888 -11.178  -9.246
   66    HA   CYS  10           HA       CYS  10   3.275  -8.909  -8.654
   67    HB2  CYS  10           HB2      CYS  10   1.465  -9.294 -10.282
   68    HB3  CYS  10           HB1      CYS  10   2.964  -8.838 -11.072
   69    HN1  NH2  11           H1       CYS  10   3.203  -9.927  -6.686
   70    HN2  NH2  11           H2       CYS  10   2.209 -11.309  -6.394
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1   3.829   0.871  -0.310
    2    H2   GLY   1           HT2      GLY   1   3.887  -0.533   0.621
    3    H3   GLY   1           HT3      GLY   1   2.508   0.443   0.660
    4    HA2  GLY   1           HA1      GLY   1   2.090  -1.495  -0.683
    5    HA3  GLY   1           HA2      GLY   1   2.091  -0.044  -1.676
    6    H    PHE   2           HN       PHE   2   2.610  -2.817  -2.441
    7    HA   PHE   2           HA       PHE   2   5.434  -2.654  -3.203
    8    HB2  PHE   2           HB2      PHE   2   3.559  -5.024  -3.242
    9    HB3  PHE   2           HB1      PHE   2   5.258  -5.059  -3.703
   10    HD1  PHE   2           HD1      PHE   2   2.915  -5.301  -1.016
   11    HD2  PHE   2           HD2      PHE   2   6.983  -4.470  -1.945
   12    HE1  PHE   2           HE1      PHE   2   3.534  -5.726   1.324
   13    HE2  PHE   2           HE2      PHE   2   7.608  -4.895   0.391
   14    HZ   PHE   2           HZ       PHE   2   5.882  -5.525   2.032
   15    H    ARG   3           HN       ARG   3   6.041  -2.944  -5.365
   16    HA   ARG   3           HA       ARG   3   3.998  -2.085  -7.236
   17    HB2  ARG   3           HB2      ARG   3   6.988  -2.321  -7.524
   18    HB3  ARG   3           HB1      ARG   3   5.911  -1.783  -8.808
   19    HG2  ARG   3           HG2      ARG   3   5.150   0.051  -7.346
   20    HG3  ARG   3           HG1      ARG   3   6.344  -0.449  -6.148
   21    HD2  ARG   3           HD2      ARG   3   6.931   0.447  -8.966
   22    HD3  ARG   3           HD1      ARG   3   7.147   1.417  -7.511
   23    HE   ARG   3           HE       ARG   3   8.583  -1.081  -7.502
   24   HH11  ARG   3          HH11      ARG   3   8.703   2.331  -8.319
   25   HH12  ARG   3          HH12      ARG   3  10.431   2.388  -8.374
   26   HH21  ARG   3          HH21      ARG   3  10.875  -1.006  -7.573
   27   HH22  ARG   3          HH22      ARG   3  11.672   0.477  -7.955
   28    H    SER   4           HN       SER   4   3.041  -3.350  -8.623
   29    HA   SER   4           HA       SER   4   4.027  -6.077  -8.935
   30    HB2  SER   4           HB2      SER   4   1.215  -5.113  -9.433
   31    HB3  SER   4           HB1      SER   4   1.786  -6.776  -9.331
   32    HG   SER   4           HG       SER   4   0.770  -5.403  -7.411
   33    H    ALA   5           HN       ALA   5   5.316  -5.719 -10.612
   34    HA   ALA   5           HA       ALA   5   3.910  -5.298 -13.142
   35    HB1  ALA   5           HB1      ALA   5   5.840  -4.131 -14.077
   36    HB2  ALA   5           HB2      ALA   5   6.642  -4.195 -12.507
   37    HB3  ALA   5           HB3      ALA   5   5.162  -3.254 -12.703
   38    H    CYS   6           HN       CYS   6   3.837  -7.629 -13.051
   39    HA   CYS   6           HA       CYS   6   6.386  -8.933 -13.480
   40    HB2  CYS   6           HB2      CYS   6   4.983 -11.012 -13.771
   41    HB3  CYS   6           HB1      CYS   6   4.899 -10.248 -12.192
   42    HA   PRO   7           HA       PRO   7   6.869 -10.957 -14.444
   43    HB2  PRO   7           HB2      PRO   7   8.918 -11.100 -16.472
   44    HB3  PRO   7           HB1      PRO   7   7.742 -12.333 -16.018
   45    HG2  PRO   7           HG2      PRO   7   7.726 -11.010 -18.428
   46    HG3  PRO   7           HG1      PRO   7   6.292 -11.741 -17.686
   47    HD2  PRO   7           HD2      PRO   7   7.168  -8.872 -17.693
   48    HD3  PRO   7           HD1      PRO   7   5.539  -9.553 -17.884
   49    HA   PRO   8           HA       PRO   8   8.142 -11.870 -13.489
   50    HB2  PRO   8           HB2      PRO   8  10.267 -12.579 -12.125
   51    HB3  PRO   8           HB1      PRO   8  10.414 -12.312 -13.869
   52    HG2  PRO   8           HG2      PRO   8  11.403 -10.630 -11.626
   53    HG3  PRO   8           HG1      PRO   8  12.007 -10.748 -13.288
   54    HD2  PRO   8           HD2      PRO   8  10.122  -8.819 -12.165
   55    HD3  PRO   8           HD1      PRO   8  10.868  -8.827 -13.780
   56    H    PHE   9           HN       PHE   9   7.089  -9.530 -11.969
   57    HA   PHE   9           HA       PHE   9   7.080 -10.728  -9.301
   58    HB2  PHE   9           HB2      PHE   9   7.848  -7.843  -9.775
   59    HB3  PHE   9           HB1      PHE   9   7.440  -8.513  -8.205
   60    HD1  PHE   9           HD1      PHE   9   8.858 -10.736  -7.645
   61    HD2  PHE   9           HD2      PHE   9  10.059  -7.605 -10.262
   62    HE1  PHE   9           HE1      PHE   9  11.207 -11.360  -7.305
   63    HE2  PHE   9           HE2      PHE   9  12.412  -8.226  -9.931
   64    HZ   PHE   9           HZ       PHE   9  12.991 -10.106  -8.450
   65    H    CYS  10           HN       CYS  10   4.913 -11.195  -9.298
   66    HA   CYS  10           HA       CYS  10   3.260  -9.017  -8.514
   67    HB2  CYS  10           HB2      CYS  10   1.434  -9.299 -10.137
   68    HB3  CYS  10           HB1      CYS  10   2.912  -8.768 -10.921
   69    HN1  NH2  11           H1       CYS  10   3.230 -10.178  -6.626
   70    HN2  NH2  11           H2       CYS  10   2.283 -11.612  -6.435
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1   0.292   3.490  -1.400
    2    H2   GLY   1           HT2      GLY   1   1.580   3.559  -2.489
    3    H3   GLY   1           HT3      GLY   1   1.717   2.633  -1.086
    4    HA2  GLY   1           HA1      GLY   1  -0.012   1.153  -1.873
    5    HA3  GLY   1           HA2      GLY   1  -0.145   2.131  -3.328
    6    H    PHE   2           HN       PHE   2   0.829  -0.726  -2.535
    7    HA   PHE   2           HA       PHE   2   3.495  -0.660  -3.678
    8    HB2  PHE   2           HB2      PHE   2   1.830  -2.905  -2.551
    9    HB3  PHE   2           HB1      PHE   2   3.402  -3.152  -3.298
   10    HD1  PHE   2           HD1      PHE   2   1.665  -2.360  -0.294
   11    HD2  PHE   2           HD2      PHE   2   5.394  -1.922  -2.287
   12    HE1  PHE   2           HE1      PHE   2   2.756  -1.908   1.862
   13    HE2  PHE   2           HE2      PHE   2   6.496  -1.470  -0.137
   14    HZ   PHE   2           HZ       PHE   2   5.176  -1.464   1.943
   15    H    ARG   3           HN       ARG   3   4.083  -1.736  -5.540
   16    HA   ARG   3           HA       ARG   3   1.909  -2.503  -7.343
   17    HB2  ARG   3           HB2      ARG   3   4.188  -0.643  -7.993
   18    HB3  ARG   3           HB1      ARG   3   3.084  -1.323  -9.179
   19    HG2  ARG   3           HG2      ARG   3   1.225  -0.173  -8.177
   20    HG3  ARG   3           HG1      ARG   3   2.255   0.421  -6.874
   21    HD2  ARG   3           HD2      ARG   3   2.614   1.035  -9.792
   22    HD3  ARG   3           HD1      ARG   3   1.839   2.105  -8.621
   23    HE   ARG   3           HE       ARG   3   4.366   1.458  -7.636
   24   HH11  ARG   3          HH11      ARG   3   2.979   3.196 -10.344
   25   HH12  ARG   3          HH12      ARG   3   4.310   4.291 -10.490
   26   HH21  ARG   3          HH21      ARG   3   6.123   2.904  -7.820
   27   HH22  ARG   3          HH22      ARG   3   6.116   4.117  -9.053
   28    H    SER   4           HN       SER   4   2.523  -3.982  -8.974
   29    HA   SER   4           HA       SER   4   5.179  -5.082  -8.924
   30    HB2  SER   4           HB2      SER   4   2.736  -6.737  -8.249
   31    HB3  SER   4           HB1      SER   4   4.342  -7.382  -8.578
   32    HG   SER   4           HG       SER   4   3.548  -5.716  -6.416
   33    H    ALA   5           HN       ALA   5   5.573  -4.873 -10.974
   34    HA   ALA   5           HA       ALA   5   3.537  -5.547 -12.950
   35    HB1  ALA   5           HB1      ALA   5   4.379  -3.266 -13.120
   36    HB2  ALA   5           HB2      ALA   5   4.838  -4.220 -14.534
   37    HB3  ALA   5           HB3      ALA   5   6.026  -3.880 -13.277
   38    H    CYS   6           HN       CYS   6   3.890  -7.720 -12.828
   39    HA   CYS   6           HA       CYS   6   6.446  -8.840 -13.461
   40    HB2  CYS   6           HB2      CYS   6   5.180 -11.002 -13.674
   41    HB3  CYS   6           HB1      CYS   6   4.994 -10.193 -12.127
   42    HA   PRO   7           HA       PRO   7   6.885 -10.989 -14.453
   43    HB2  PRO   7           HB2      PRO   7   8.894 -11.044 -16.552
   44    HB3  PRO   7           HB1      PRO   7   7.813 -12.335 -16.027
   45    HG2  PRO   7           HG2      PRO   7   7.593 -11.098 -18.445
   46    HG3  PRO   7           HG1      PRO   7   6.216 -11.812 -17.588
   47    HD2  PRO   7           HD2      PRO   7   7.064  -8.942 -17.754
   48    HD3  PRO   7           HD1      PRO   7   5.434  -9.641 -17.839
   49    HA   PRO   8           HA       PRO   8   8.142 -11.892 -13.466
   50    HB2  PRO   8           HB2      PRO   8  10.253 -12.591 -12.087
   51    HB3  PRO   8           HB1      PRO   8  10.423 -12.332 -13.830
   52    HG2  PRO   8           HG2      PRO   8  11.354 -10.624 -11.575
   53    HG3  PRO   8           HG1      PRO   8  12.023 -10.785 -13.212
   54    HD2  PRO   8           HD2      PRO   8  10.144  -8.801 -12.211
   55    HD3  PRO   8           HD1      PRO   8  10.900  -8.890 -13.816
   56    H    PHE   9           HN       PHE   9   7.096  -9.533 -12.005
   57    HA   PHE   9           HA       PHE   9   7.095 -10.652  -9.303
   58    HB2  PHE   9           HB2      PHE   9   7.747  -7.758  -9.897
   59    HB3  PHE   9           HB1      PHE   9   7.357  -8.378  -8.301
   60    HD1  PHE   9           HD1      PHE   9   8.873 -10.383  -7.508
   61    HD2  PHE   9           HD2      PHE   9   9.939  -7.572 -10.514
   62    HE1  PHE   9           HE1      PHE   9  11.248 -10.891  -7.131
   63    HE2  PHE   9           HE2      PHE   9  12.317  -8.077 -10.148
   64    HZ   PHE   9           HZ       PHE   9  12.974  -9.739  -8.455
   65    H    CYS  10           HN       CYS  10   4.952 -11.171  -9.214
   66    HA   CYS  10           HA       CYS  10   3.212  -9.022  -8.595
   67    HB2  CYS  10           HB2      CYS  10   1.380  -9.543 -10.192
   68    HB3  CYS  10           HB1      CYS  10   2.805  -8.871 -10.966
   69    HN1  NH2  11           H1       CYS  10   3.309 -10.109  -6.653
   70    HN2  NH2  11           H2       CYS  10   2.368 -11.531  -6.364
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1   5.365  -1.395   0.749
    2    H2   GLY   1           HT2      GLY   1   4.169  -2.573   0.917
    3    H3   GLY   1           HT3      GLY   1   3.872  -0.988   1.423
    4    HA2  GLY   1           HA1      GLY   1   2.777  -1.467  -0.680
    5    HA3  GLY   1           HA2      GLY   1   3.968  -0.180  -0.813
    6    H    PHE   2           HN       PHE   2   2.945  -3.170  -1.995
    7    HA   PHE   2           HA       PHE   2   5.500  -3.664  -3.342
    8    HB2  PHE   2           HB2      PHE   2   3.054  -5.404  -3.026
    9    HB3  PHE   2           HB1      PHE   2   4.455  -5.842  -3.992
   10    HD1  PHE   2           HD1      PHE   2   3.063  -5.618  -0.666
   11    HD2  PHE   2           HD2      PHE   2   6.625  -6.251  -2.896
   12    HE1  PHE   2           HE1      PHE   2   4.130  -6.586   1.325
   13    HE2  PHE   2           HE2      PHE   2   7.701  -7.217  -0.916
   14    HZ   PHE   2           HZ       PHE   2   6.455  -7.389   1.204
   15    H    ARG   3           HN       ARG   3   5.603  -3.831  -5.575
   16    HA   ARG   3           HA       ARG   3   3.270  -2.785  -7.017
   17    HB2  ARG   3           HB2      ARG   3   6.196  -2.267  -7.426
   18    HB3  ARG   3           HB1      ARG   3   5.025  -2.007  -8.715
   19    HG2  ARG   3           HG2      ARG   3   3.833  -0.413  -7.371
   20    HG3  ARG   3           HG1      ARG   3   4.897  -0.726  -5.999
   21    HD2  ARG   3           HD2      ARG   3   5.812   0.335  -8.660
   22    HD3  ARG   3           HD1      ARG   3   5.443   1.347  -7.265
   23    HE   ARG   3           HE       ARG   3   7.289  -0.584  -6.463
   24   HH11  ARG   3          HH11      ARG   3   7.152   2.162  -8.631
   25   HH12  ARG   3          HH12      ARG   3   8.823   2.560  -8.448
   26   HH21  ARG   3          HH21      ARG   3   9.517  -0.061  -6.216
   27   HH22  ARG   3          HH22      ARG   3  10.173   1.286  -7.080
   28    H    SER   4           HN       SER   4   2.343  -4.310  -8.109
   29    HA   SER   4           HA       SER   4   3.829  -6.671  -8.811
   30    HB2  SER   4           HB2      SER   4   1.470  -7.481  -9.417
   31    HB3  SER   4           HB1      SER   4   1.866  -7.259  -7.709
   32    HG   SER   4           HG       SER   4   0.113  -5.866  -9.335
   33    H    ALA   5           HN       ALA   5   4.967  -5.724 -10.455
   34    HA   ALA   5           HA       ALA   5   3.443  -5.556 -12.961
   35    HB1  ALA   5           HB1      ALA   5   6.045  -4.169 -12.323
   36    HB2  ALA   5           HB2      ALA   5   4.463  -3.395 -12.442
   37    HB3  ALA   5           HB3      ALA   5   5.201  -4.129 -13.869
   38    H    CYS   6           HN       CYS   6   3.666  -7.887 -12.951
   39    HA   CYS   6           HA       CYS   6   6.334  -8.890 -13.398
   40    HB2  CYS   6           HB2      CYS   6   5.128 -11.087 -13.870
   41    HB3  CYS   6           HB1      CYS   6   4.966 -10.436 -12.247
   42    HA   PRO   7           HA       PRO   7   6.872 -10.923 -14.436
   43    HB2  PRO   7           HB2      PRO   7   8.887 -11.142 -16.463
   44    HB3  PRO   7           HB1      PRO   7   7.612 -12.297 -16.075
   45    HG2  PRO   7           HG2      PRO   7   7.748 -10.850 -18.430
   46    HG3  PRO   7           HG1      PRO   7   6.267 -11.560 -17.768
   47    HD2  PRO   7           HD2      PRO   7   7.254  -8.736 -17.599
   48    HD3  PRO   7           HD1      PRO   7   5.602  -9.338 -17.853
   49    HA   PRO   8           HA       PRO   8   8.108 -11.885 -13.485
   50    HB2  PRO   8           HB2      PRO   8  10.209 -12.665 -12.107
   51    HB3  PRO   8           HB1      PRO   8  10.353 -12.442 -13.856
   52    HG2  PRO   8           HG2      PRO   8  11.451 -10.777 -11.659
   53    HG3  PRO   8           HG1      PRO   8  12.010 -10.929 -13.334
   54    HD2  PRO   8           HD2      PRO   8  10.226  -8.922 -12.176
   55    HD3  PRO   8           HD1      PRO   8  10.951  -8.956 -13.799
   56    H    PHE   9           HN       PHE   9   7.146  -9.512 -11.995
   57    HA   PHE   9           HA       PHE   9   7.103 -10.680  -9.308
   58    HB2  PHE   9           HB2      PHE   9   7.794  -7.781  -9.834
   59    HB3  PHE   9           HB1      PHE   9   7.439  -8.453  -8.251
   60    HD1  PHE   9           HD1      PHE   9   8.944 -10.613  -7.695
   61    HD2  PHE   9           HD2      PHE   9   9.986  -7.482 -10.379
   62    HE1  PHE   9           HE1      PHE   9  11.321 -11.156  -7.400
   63    HE2  PHE   9           HE2      PHE   9  12.367  -8.022 -10.092
   64    HZ   PHE   9           HZ       PHE   9  13.039  -9.862  -8.601
   65    H    CYS  10           HN       CYS  10   4.956 -11.149  -9.217
   66    HA   CYS  10           HA       CYS  10   3.232  -8.960  -8.688
   67    HB2  CYS  10           HB2      CYS  10   1.446  -9.460 -10.313
   68    HB3  CYS  10           HB1      CYS  10   2.919  -8.921 -11.096
   69    HN1  NH2  11           H1       CYS  10   2.913  -9.775  -6.731
   70    HN2  NH2  11           H2       CYS  10   2.097 -11.265  -6.413
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1   2.482   2.130  -1.000
    2    H2   GLY   1           HT2      GLY   1   1.329   0.917  -0.761
    3    H3   GLY   1           HT3      GLY   1   0.835   2.504  -1.051
    4    HA2  GLY   1           HA1      GLY   1   0.563   1.141  -3.027
    5    HA3  GLY   1           HA2      GLY   1   1.728   2.434  -3.273
    6    H    PHE   2           HN       PHE   2   1.214  -0.639  -4.033
    7    HA   PHE   2           HA       PHE   2   4.046  -1.379  -3.781
    8    HB2  PHE   2           HB2      PHE   2   1.612  -3.125  -4.086
    9    HB3  PHE   2           HB1      PHE   2   3.262  -3.719  -4.207
   10    HD1  PHE   2           HD1      PHE   2   0.561  -3.050  -2.025
   11    HD2  PHE   2           HD2      PHE   2   4.801  -3.275  -2.206
   12    HE1  PHE   2           HE1      PHE   2   0.648  -3.335   0.414
   13    HE2  PHE   2           HE2      PHE   2   4.897  -3.560   0.227
   14    HZ   PHE   2           HZ       PHE   2   2.818  -3.589   1.544
   15    H    ARG   3           HN       ARG   3   5.161  -2.020  -5.516
   16    HA   ARG   3           HA       ARG   3   3.871  -1.603  -8.114
   17    HB2  ARG   3           HB2      ARG   3   6.730  -1.214  -7.264
   18    HB3  ARG   3           HB1      ARG   3   6.202  -1.201  -8.943
   19    HG2  ARG   3           HG2      ARG   3   4.747   0.674  -8.490
   20    HG3  ARG   3           HG1      ARG   3   5.241   0.665  -6.795
   21    HD2  ARG   3           HD2      ARG   3   7.051   1.105  -9.161
   22    HD3  ARG   3           HD1      ARG   3   6.447   2.366  -8.087
   23    HE   ARG   3           HE       ARG   3   7.668   0.726  -6.360
   24   HH11  ARG   3          HH11      ARG   3   8.743   2.064  -9.407
   25   HH12  ARG   3          HH12      ARG   3  10.413   2.077  -8.965
   26   HH21  ARG   3          HH21      ARG   3   9.891   0.740  -5.768
   27   HH22  ARG   3          HH22      ARG   3  11.071   1.330  -6.886
   28    H    SER   4           HN       SER   4   3.478  -3.377  -9.124
   29    HA   SER   4           HA       SER   4   5.410  -5.550  -9.053
   30    HB2  SER   4           HB2      SER   4   2.466  -5.928  -8.480
   31    HB3  SER   4           HB1      SER   4   3.656  -7.213  -8.681
   32    HG   SER   4           HG       SER   4   4.523  -5.429  -6.862
   33    H    ALA   5           HN       ALA   5   5.871  -4.896 -11.147
   34    HA   ALA   5           HA       ALA   5   3.770  -5.339 -13.122
   35    HB1  ALA   5           HB1      ALA   5   6.404  -3.892 -13.411
   36    HB2  ALA   5           HB2      ALA   5   4.817  -3.135 -13.257
   37    HB3  ALA   5           HB3      ALA   5   5.201  -4.105 -14.681
   38    H    CYS   6           HN       CYS   6   3.986  -7.569 -12.905
   39    HA   CYS   6           HA       CYS   6   6.475  -8.831 -13.539
   40    HB2  CYS   6           HB2      CYS   6   5.135 -10.933 -13.622
   41    HB3  CYS   6           HB1      CYS   6   4.989 -10.045 -12.113
   42    HA   PRO   7           HA       PRO   7   6.886 -11.016 -14.471
   43    HB2  PRO   7           HB2      PRO   7   8.933 -11.457 -16.178
   44    HB3  PRO   7           HB1      PRO   7   7.363 -12.246 -16.357
   45    HG2  PRO   7           HG2      PRO   7   8.448  -9.850 -17.785
   46    HG3  PRO   7           HG1      PRO   7   7.550 -11.230 -18.442
   47    HD2  PRO   7           HD2      PRO   7   6.393  -8.827 -17.889
   48    HD3  PRO   7           HD1      PRO   7   5.515 -10.366 -17.797
   49    HA   PRO   8           HA       PRO   8   8.164 -11.880 -13.460
   50    HB2  PRO   8           HB2      PRO   8  10.309 -12.532 -12.123
   51    HB3  PRO   8           HB1      PRO   8  10.455 -12.239 -13.864
   52    HG2  PRO   8           HG2      PRO   8  11.348 -10.534 -11.586
   53    HG3  PRO   8           HG1      PRO   8  12.015 -10.650 -13.228
   54    HD2  PRO   8           HD2      PRO   8  10.064  -8.748 -12.189
   55    HD3  PRO   8           HD1      PRO   8  10.826  -8.778 -13.796
   56    H    PHE   9           HN       PHE   9   7.069  -9.553 -11.960
   57    HA   PHE   9           HA       PHE   9   7.082 -10.717  -9.281
   58    HB2  PHE   9           HB2      PHE   9   7.799  -7.824  -9.794
   59    HB3  PHE   9           HB1      PHE   9   7.381  -8.469  -8.216
   60    HD1  PHE   9           HD1      PHE   9   8.835 -10.573  -7.502
   61    HD2  PHE   9           HD2      PHE   9  10.008  -7.633 -10.339
   62    HE1  PHE   9           HE1      PHE   9  11.192 -11.147  -7.116
   63    HE2  PHE   9           HE2      PHE   9  12.368  -8.205  -9.962
   64    HZ   PHE   9           HZ       PHE   9  12.965  -9.964  -8.348
   65    H    CYS  10           HN       CYS  10   4.926 -11.205  -9.208
   66    HA   CYS  10           HA       CYS  10   3.221  -9.052  -8.517
   67    HB2  CYS  10           HB2      CYS  10   1.382  -9.483 -10.133
   68    HB3  CYS  10           HB1      CYS  10   2.819  -8.803 -10.878
   69    HN1  NH2  11           H1       CYS  10   2.798  -9.908  -6.630
   70    HN2  NH2  11           H2       CYS  10   2.042 -11.442  -6.380
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1   4.820   2.431  -1.468
    2    H2   GLY   1           HT2      GLY   1   5.295   1.003  -0.701
    3    H3   GLY   1           HT3      GLY   1   3.947   1.853  -0.137
    4    HA2  GLY   1           HA1      GLY   1   3.272  -0.081  -1.388
    5    HA3  GLY   1           HA2      GLY   1   2.768   1.406  -2.175
    6    H    PHE   2           HN       PHE   2   3.710  -1.485  -2.946
    7    HA   PHE   2           HA       PHE   2   5.443  -0.575  -5.140
    8    HB2  PHE   2           HB2      PHE   2   5.399  -3.232  -3.713
    9    HB3  PHE   2           HB1      PHE   2   6.231  -2.976  -5.242
   10    HD1  PHE   2           HD1      PHE   2   6.354  -2.533  -1.662
   11    HD2  PHE   2           HD2      PHE   2   8.134  -1.390  -5.349
   12    HE1  PHE   2           HE1      PHE   2   8.339  -1.737  -0.450
   13    HE2  PHE   2           HE2      PHE   2  10.124  -0.591  -4.149
   14    HZ   PHE   2           HZ       PHE   2  10.231  -0.764  -1.693
   15    H    ARG   3           HN       ARG   3   5.045  -1.423  -7.187
   16    HA   ARG   3           HA       ARG   3   2.287  -2.341  -7.519
   17    HB2  ARG   3           HB2      ARG   3   4.159  -1.006  -9.470
   18    HB3  ARG   3           HB1      ARG   3   2.544  -1.575  -9.869
   19    HG2  ARG   3           HG2      ARG   3   1.615  -0.053  -8.172
   20    HG3  ARG   3           HG1      ARG   3   3.240   0.554  -7.860
   21    HD2  ARG   3           HD2      ARG   3   1.808   0.668 -10.505
   22    HD3  ARG   3           HD1      ARG   3   1.953   2.008  -9.370
   23    HE   ARG   3           HE       ARG   3   4.419   0.796 -10.333
   24   HH11  ARG   3          HH11      ARG   3   2.134   3.455 -10.550
   25   HH12  ARG   3          HH12      ARG   3   3.241   4.496 -11.371
   26   HH21  ARG   3          HH21      ARG   3   5.873   2.184 -11.427
   27   HH22  ARG   3          HH22      ARG   3   5.364   3.775 -11.876
   28    H    SER   4           HN       SER   4   1.804  -4.047  -8.909
   29    HA   SER   4           HA       SER   4   3.880  -6.048  -9.008
   30    HB2  SER   4           HB2      SER   4   0.902  -6.258  -9.484
   31    HB3  SER   4           HB1      SER   4   2.031  -7.608  -9.435
   32    HG   SER   4           HG       SER   4   2.364  -6.149  -7.228
   33    H    ALA   5           HN       ALA   5   5.001  -5.163 -10.722
   34    HA   ALA   5           HA       ALA   5   3.677  -5.323 -13.328
   35    HB1  ALA   5           HB1      ALA   5   6.283  -3.989 -12.621
   36    HB2  ALA   5           HB2      ALA   5   4.741  -3.175 -12.899
   37    HB3  ALA   5           HB3      ALA   5   5.545  -4.031 -14.221
   38    H    CYS   6           HN       CYS   6   3.794  -7.629 -13.151
   39    HA   CYS   6           HA       CYS   6   6.415  -8.787 -13.508
   40    HB2  CYS   6           HB2      CYS   6   5.030 -10.931 -13.895
   41    HB3  CYS   6           HB1      CYS   6   5.057 -10.241 -12.281
   42    HA   PRO   7           HA       PRO   7   6.824 -10.942 -14.465
   43    HB2  PRO   7           HB2      PRO   7   8.804 -11.653 -16.119
   44    HB3  PRO   7           HB1      PRO   7   7.145 -12.214 -16.367
   45    HG2  PRO   7           HG2      PRO   7   8.631 -10.024 -17.756
   46    HG3  PRO   7           HG1      PRO   7   7.513 -11.222 -18.429
   47    HD2  PRO   7           HD2      PRO   7   6.837  -8.608 -17.789
   48    HD3  PRO   7           HD1      PRO   7   5.679  -9.946 -17.934
   49    HA   PRO   8           HA       PRO   8   7.988 -11.898 -13.424
   50    HB2  PRO   8           HB2      PRO   8  10.042 -12.731 -12.040
   51    HB3  PRO   8           HB1      PRO   8  10.230 -12.497 -13.784
   52    HG2  PRO   8           HG2      PRO   8  11.299 -10.847 -11.549
   53    HG3  PRO   8           HG1      PRO   8  11.920 -11.038 -13.196
   54    HD2  PRO   8           HD2      PRO   8  10.144  -8.971 -12.145
   55    HD3  PRO   8           HD1      PRO   8  10.926  -9.055 -13.739
   56    H    PHE   9           HN       PHE   9   7.068  -9.479 -11.995
   57    HA   PHE   9           HA       PHE   9   7.165 -10.491  -9.238
   58    HB2  PHE   9           HB2      PHE   9   7.581  -7.591  -9.976
   59    HB3  PHE   9           HB1      PHE   9   7.420  -8.214  -8.342
   60    HD1  PHE   9           HD1      PHE   9   9.169 -10.241  -7.875
   61    HD2  PHE   9           HD2      PHE   9   9.679  -7.072 -10.665
   62    HE1  PHE   9           HE1      PHE   9  11.609 -10.537  -7.763
   63    HE2  PHE   9           HE2      PHE   9  12.117  -7.366 -10.561
   64    HZ   PHE   9           HZ       PHE   9  13.086  -9.101  -9.109
   65    H    CYS  10           HN       CYS  10   5.029 -11.178  -9.237
   66    HA   CYS  10           HA       CYS  10   3.216  -9.128  -8.482
   67    HB2  CYS  10           HB2      CYS  10   1.372  -9.703 -10.066
   68    HB3  CYS  10           HB1      CYS  10   2.732  -8.886 -10.814
   69    HN1  NH2  11           H1       CYS  10   3.033 -10.082  -6.572
   70    HN2  NH2  11           H2       CYS  10   2.319 -11.635  -6.315
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1  -2.101  -1.651  -0.281
    2    H2   GLY   1           HT2      GLY   1  -3.082  -2.447  -1.406
    3    H3   GLY   1           HT3      GLY   1  -3.443  -0.864  -0.943
    4    HA2  GLY   1           HA1      GLY   1  -2.438  -0.921  -3.126
    5    HA3  GLY   1           HA2      GLY   1  -1.449  -0.049  -1.964
    6    H    PHE   2           HN       PHE   2  -1.448  -2.384  -4.319
    7    HA   PHE   2           HA       PHE   2   1.168  -3.358  -3.410
    8    HB2  PHE   2           HB2      PHE   2  -0.949  -4.929  -4.884
    9    HB3  PHE   2           HB1      PHE   2   0.697  -5.480  -4.633
   10    HD1  PHE   2           HD1      PHE   2  -2.591  -5.503  -3.376
   11    HD2  PHE   2           HD2      PHE   2   1.481  -5.610  -2.162
   12    HE1  PHE   2           HE1      PHE   2  -3.258  -6.510  -1.237
   13    HE2  PHE   2           HE2      PHE   2   0.824  -6.614  -0.024
   14    HZ   PHE   2           HZ       PHE   2  -1.551  -7.066   0.443
   15    H    ARG   3           HN       ARG   3   2.727  -3.509  -4.972
   16    HA   ARG   3           HA       ARG   3   2.007  -2.404  -7.587
   17    HB2  ARG   3           HB2      ARG   3   4.542  -2.179  -5.990
   18    HB3  ARG   3           HB1      ARG   3   4.492  -1.838  -7.717
   19    HG2  ARG   3           HG2      ARG   3   2.805  -0.136  -7.346
   20    HG3  ARG   3           HG1      ARG   3   2.832  -0.473  -5.616
   21    HD2  ARG   3           HD2      ARG   3   5.178   0.483  -7.241
   22    HD3  ARG   3           HD1      ARG   3   4.163   1.506  -6.225
   23    HE   ARG   3           HE       ARG   3   5.077  -0.532  -4.605
   24   HH11  ARG   3          HH11      ARG   3   6.489   2.064  -6.483
   25   HH12  ARG   3          HH12      ARG   3   7.872   2.233  -5.456
   26   HH21  ARG   3          HH21      ARG   3   6.899  -0.312  -3.235
   27   HH22  ARG   3          HH22      ARG   3   8.101   0.875  -3.596
   28    H    SER   4           HN       SER   4   1.772  -3.967  -8.950
   29    HA   SER   4           HA       SER   4   3.676  -6.166  -8.956
   30    HB2  SER   4           HB2      SER   4   0.670  -6.410  -9.151
   31    HB3  SER   4           HB1      SER   4   1.819  -7.731  -9.357
   32    HG   SER   4           HG       SER   4   2.556  -6.934  -7.136
   33    H    ALA   5           HN       ALA   5   4.677  -5.560 -10.741
   34    HA   ALA   5           HA       ALA   5   3.100  -5.640 -13.209
   35    HB1  ALA   5           HB1      ALA   5   5.536  -3.935 -12.706
   36    HB2  ALA   5           HB2      ALA   5   3.876  -3.356 -12.886
   37    HB3  ALA   5           HB3      ALA   5   4.706  -4.113 -14.251
   38    H    CYS   6           HN       CYS   6   3.540  -7.897 -13.123
   39    HA   CYS   6           HA       CYS   6   6.267  -8.749 -13.422
   40    HB2  CYS   6           HB2      CYS   6   5.049 -10.988 -14.028
   41    HB3  CYS   6           HB1      CYS   6   5.055 -10.413 -12.368
   42    HA   PRO   7           HA       PRO   7   6.852 -10.865 -14.387
   43    HB2  PRO   7           HB2      PRO   7   8.813 -11.631 -16.015
   44    HB3  PRO   7           HB1      PRO   7   7.143 -12.146 -16.294
   45    HG2  PRO   7           HG2      PRO   7   8.718 -10.011 -17.662
   46    HG3  PRO   7           HG1      PRO   7   7.569 -11.173 -18.347
   47    HD2  PRO   7           HD2      PRO   7   6.982  -8.523 -17.684
   48    HD3  PRO   7           HD1      PRO   7   5.785  -9.812 -17.918
   49    HA   PRO   8           HA       PRO   8   8.112 -11.906 -13.485
   50    HB2  PRO   8           HB2      PRO   8  10.171 -12.743 -12.109
   51    HB3  PRO   8           HB1      PRO   8  10.380 -12.438 -13.841
   52    HG2  PRO   8           HG2      PRO   8  11.311 -10.817 -11.513
   53    HG3  PRO   8           HG1      PRO   8  12.055 -11.009 -13.116
   54    HD2  PRO   8           HD2      PRO   8  10.279  -8.911 -12.206
   55    HD3  PRO   8           HD1      PRO   8  11.035  -9.083 -13.804
   56    H    PHE   9           HN       PHE   9   7.120  -9.550 -12.006
   57    HA   PHE   9           HA       PHE   9   7.087 -10.689  -9.314
   58    HB2  PHE   9           HB2      PHE   9   7.847  -7.826  -9.891
   59    HB3  PHE   9           HB1      PHE   9   7.391  -8.417  -8.300
   60    HD1  PHE   9           HD1      PHE   9   8.774 -10.449  -7.431
   61    HD2  PHE   9           HD2      PHE   9  10.058  -7.805 -10.495
   62    HE1  PHE   9           HE1      PHE   9  11.104 -11.091  -7.001
   63    HE2  PHE   9           HE2      PHE   9  12.395  -8.446 -10.072
   64    HZ   PHE   9           HZ       PHE   9  12.919 -10.090  -8.323
   65    H    CYS  10           HN       CYS  10   4.980 -11.150  -9.139
   66    HA   CYS  10           HA       CYS  10   3.238  -8.980  -8.615
   67    HB2  CYS  10           HB2      CYS  10   1.399  -9.658 -10.183
   68    HB3  CYS  10           HB1      CYS  10   2.789  -8.919 -10.961
   69    HN1  NH2  11           H1       CYS  10   3.224  -9.897  -6.618
   70    HN2  NH2  11           H2       CYS  10   2.345 -11.341  -6.256
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1   7.171   1.414  -0.508
    2    H2   GLY   1           HT2      GLY   1   7.891   1.355  -2.035
    3    H3   GLY   1           HT3      GLY   1   8.071   0.060  -0.974
    4    HA2  GLY   1           HA1      GLY   1   5.719  -0.418  -1.108
    5    HA3  GLY   1           HA2      GLY   1   5.531   0.948  -2.199
    6    H    PHE   2           HN       PHE   2   4.977  -1.897  -2.647
    7    HA   PHE   2           HA       PHE   2   6.829  -2.322  -4.894
    8    HB2  PHE   2           HB2      PHE   2   5.465  -4.401  -3.184
    9    HB3  PHE   2           HB1      PHE   2   6.330  -4.760  -4.668
   10    HD1  PHE   2           HD1      PHE   2   6.591  -4.199  -1.142
   11    HD2  PHE   2           HD2      PHE   2   8.787  -4.230  -4.783
   12    HE1  PHE   2           HE1      PHE   2   8.689  -4.391   0.128
   13    HE2  PHE   2           HE2      PHE   2  10.884  -4.421  -3.526
   14    HZ   PHE   2           HZ       PHE   2  10.841  -4.503  -1.064
   15    H    ARG   3           HN       ARG   3   5.964  -2.944  -6.822
   16    HA   ARG   3           HA       ARG   3   3.032  -2.815  -7.018
   17    HB2  ARG   3           HB2      ARG   3   5.099  -1.832  -8.986
   18    HB3  ARG   3           HB1      ARG   3   3.371  -1.893  -9.299
   19    HG2  ARG   3           HG2      ARG   3   2.988  -0.342  -7.443
   20    HG3  ARG   3           HG1      ARG   3   4.729  -0.259  -7.171
   21    HD2  ARG   3           HD2      ARG   3   3.323   0.505  -9.717
   22    HD3  ARG   3           HD1      ARG   3   3.866   1.638  -8.481
   23    HE   ARG   3           HE       ARG   3   6.150   0.416  -9.049
   24   HH11  ARG   3          HH11      ARG   3   3.680   1.663 -11.210
   25   HH12  ARG   3          HH12      ARG   3   4.787   1.997 -12.495
   26   HH21  ARG   3          HH21      ARG   3   7.619   0.872 -10.757
   27   HH22  ARG   3          HH22      ARG   3   7.031   1.542 -12.240
   28    H    SER   4           HN       SER   4   2.057  -4.166  -8.565
   29    HA   SER   4           HA       SER   4   3.502  -6.618  -8.961
   30    HB2  SER   4           HB2      SER   4   0.635  -5.916  -9.614
   31    HB3  SER   4           HB1      SER   4   1.349  -7.527  -9.649
   32    HG   SER   4           HG       SER   4   0.256  -7.197  -7.695
   33    H    ALA   5           HN       ALA   5   4.946  -5.645 -10.434
   34    HA   ALA   5           HA       ALA   5   3.821  -5.375 -13.125
   35    HB1  ALA   5           HB1      ALA   5   4.972  -3.352 -12.417
   36    HB2  ALA   5           HB2      ALA   5   5.843  -4.145 -13.736
   37    HB3  ALA   5           HB3      ALA   5   6.431  -4.290 -12.081
   38    H    CYS   6           HN       CYS   6   3.778  -7.693 -13.129
   39    HA   CYS   6           HA       CYS   6   6.387  -8.901 -13.476
   40    HB2  CYS   6           HB2      CYS   6   5.005 -11.014 -13.931
   41    HB3  CYS   6           HB1      CYS   6   4.996 -10.370 -12.299
   42    HA   PRO   7           HA       PRO   7   6.832 -10.910 -14.453
   43    HB2  PRO   7           HB2      PRO   7   8.792 -11.609 -16.145
   44    HB3  PRO   7           HB1      PRO   7   7.134 -12.186 -16.347
   45    HG2  PRO   7           HG2      PRO   7   8.595 -10.069 -17.840
   46    HG3  PRO   7           HG1      PRO   7   7.361 -11.201 -18.412
   47    HD2  PRO   7           HD2      PRO   7   6.945  -8.509 -17.685
   48    HD3  PRO   7           HD1      PRO   7   5.686  -9.732 -17.938
   49    HA   PRO   8           HA       PRO   8   8.024 -11.887 -13.450
   50    HB2  PRO   8           HB2      PRO   8  10.090 -12.718 -12.067
   51    HB3  PRO   8           HB1      PRO   8  10.257 -12.503 -13.817
   52    HG2  PRO   8           HG2      PRO   8  11.352 -10.838 -11.608
   53    HG3  PRO   8           HG1      PRO   8  11.965 -11.055 -13.259
   54    HD2  PRO   8           HD2      PRO   8  10.234  -8.947 -12.221
   55    HD3  PRO   8           HD1      PRO   8  10.973  -9.077 -13.832
   56    H    PHE   9           HN       PHE   9   7.098  -9.478 -11.993
   57    HA   PHE   9           HA       PHE   9   7.133 -10.562  -9.262
   58    HB2  PHE   9           HB2      PHE   9   7.685  -7.661  -9.922
   59    HB3  PHE   9           HB1      PHE   9   7.402  -8.284  -8.304
   60    HD1  PHE   9           HD1      PHE   9   9.026 -10.203  -7.556
   61    HD2  PHE   9           HD2      PHE   9   9.831  -7.447 -10.688
   62    HE1  PHE   9           HE1      PHE   9  11.435 -10.629  -7.307
   63    HE2  PHE   9           HE2      PHE   9  12.241  -7.869 -10.449
   64    HZ   PHE   9           HZ       PHE   9  13.047  -9.464  -8.755
   65    H    CYS  10           HN       CYS  10   4.990 -11.159  -9.205
   66    HA   CYS  10           HA       CYS  10   3.207  -9.064  -8.539
   67    HB2  CYS  10           HB2      CYS  10   1.383  -9.592 -10.135
   68    HB3  CYS  10           HB1      CYS  10   2.787  -8.875 -10.904
   69    HN1  NH2  11           H1       CYS  10   2.820  -9.912  -6.639
   70    HN2  NH2  11           H2       CYS  10   2.124 -11.467  -6.361
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1   5.818   4.511  -3.318
    2    H2   GLY   1           HT2      GLY   1   6.361   4.113  -4.869
    3    H3   GLY   1           HT3      GLY   1   7.044   3.365  -3.519
    4    HA2  GLY   1           HA1      GLY   1   4.999   2.251  -3.016
    5    HA3  GLY   1           HA2      GLY   1   4.223   3.078  -4.361
    6    H    PHE   2           HN       PHE   2   4.827   0.169  -3.709
    7    HA   PHE   2           HA       PHE   2   6.385  -0.480  -6.105
    8    HB2  PHE   2           HB2      PHE   2   5.627  -2.186  -3.737
    9    HB3  PHE   2           HB1      PHE   2   6.467  -2.788  -5.159
   10    HD1  PHE   2           HD1      PHE   2   6.805  -1.168  -1.988
   11    HD2  PHE   2           HD2      PHE   2   8.718  -1.810  -5.732
   12    HE1  PHE   2           HE1      PHE   2   8.958  -0.520  -0.997
   13    HE2  PHE   2           HE2      PHE   2  10.873  -1.163  -4.748
   14    HZ   PHE   2           HZ       PHE   2  10.997  -0.517  -2.375
   15    H    ARG   3           HN       ARG   3   5.567  -1.746  -7.687
   16    HA   ARG   3           HA       ARG   3   2.697  -2.322  -7.531
   17    HB2  ARG   3           HB2      ARG   3   4.225  -1.129  -9.829
   18    HB3  ARG   3           HB1      ARG   3   2.596  -1.776  -9.973
   19    HG2  ARG   3           HG2      ARG   3   1.747  -0.149  -8.433
   20    HG3  ARG   3           HG1      ARG   3   3.376   0.432  -8.087
   21    HD2  ARG   3           HD2      ARG   3   2.040   0.526 -10.774
   22    HD3  ARG   3           HD1      ARG   3   2.122   1.878  -9.643
   23    HE   ARG   3           HE       ARG   3   4.715   0.877 -10.148
   24   HH11  ARG   3          HH11      ARG   3   2.168   2.728 -11.686
   25   HH12  ARG   3          HH12      ARG   3   3.256   3.616 -12.700
   26   HH21  ARG   3          HH21      ARG   3   6.157   2.061 -11.500
   27   HH22  ARG   3          HH22      ARG   3   5.516   3.229 -12.605
   28    H    SER   4           HN       SER   4   1.960  -4.076  -8.747
   29    HA   SER   4           HA       SER   4   3.832  -6.228  -8.903
   30    HB2  SER   4           HB2      SER   4   0.896  -6.178  -9.618
   31    HB3  SER   4           HB1      SER   4   1.888  -7.608  -9.340
   32    HG   SER   4           HG       SER   4   2.236  -6.290  -7.190
   33    H    ALA   5           HN       ALA   5   5.079  -5.289 -10.542
   34    HA   ALA   5           HA       ALA   5   3.912  -5.309 -13.208
   35    HB1  ALA   5           HB1      ALA   5   5.917  -4.141 -13.940
   36    HB2  ALA   5           HB2      ALA   5   6.564  -4.218 -12.300
   37    HB3  ALA   5           HB3      ALA   5   5.107  -3.278 -12.630
   38    H    CYS   6           HN       CYS   6   3.848  -7.622 -13.109
   39    HA   CYS   6           HA       CYS   6   6.440  -8.870 -13.492
   40    HB2  CYS   6           HB2      CYS   6   5.091 -10.994 -13.793
   41    HB3  CYS   6           HB1      CYS   6   5.010 -10.250 -12.206
   42    HA   PRO   7           HA       PRO   7   6.859 -10.973 -14.496
   43    HB2  PRO   7           HB2      PRO   7   8.879 -11.148 -16.545
   44    HB3  PRO   7           HB1      PRO   7   7.660 -12.347 -16.107
   45    HG2  PRO   7           HG2      PRO   7   7.674 -10.972 -18.487
   46    HG3  PRO   7           HG1      PRO   7   6.220 -11.664 -17.747
   47    HD2  PRO   7           HD2      PRO   7   7.206  -8.830 -17.697
   48    HD3  PRO   7           HD1      PRO   7   5.550  -9.445 -17.896
   49    HA   PRO   8           HA       PRO   8   8.005 -11.887 -13.437
   50    HB2  PRO   8           HB2      PRO   8  10.069 -12.696 -12.060
   51    HB3  PRO   8           HB1      PRO   8  10.259 -12.453 -13.804
   52    HG2  PRO   8           HG2      PRO   8  11.282 -10.790 -11.552
   53    HG3  PRO   8           HG1      PRO   8  11.938 -10.988 -13.188
   54    HD2  PRO   8           HD2      PRO   8  10.148  -8.912 -12.186
   55    HD3  PRO   8           HD1      PRO   8  10.925  -9.025 -13.782
   56    H    PHE   9           HN       PHE   9   7.086  -9.456 -11.979
   57    HA   PHE   9           HA       PHE   9   7.123 -10.566  -9.267
   58    HB2  PHE   9           HB2      PHE   9   7.794  -7.696  -9.922
   59    HB3  PHE   9           HB1      PHE   9   7.394  -8.260  -8.307
   60    HD1  PHE   9           HD1      PHE   9   8.841 -10.356  -7.530
   61    HD2  PHE   9           HD2      PHE   9  10.004  -7.526 -10.485
   62    HE1  PHE   9           HE1      PHE   9  11.197 -10.936  -7.152
   63    HE2  PHE   9           HE2      PHE   9  12.366  -8.104 -10.114
   64    HZ   PHE   9           HZ       PHE   9  12.964  -9.814  -8.445
   65    H    CYS  10           HN       CYS  10   4.998 -11.167  -9.250
   66    HA   CYS  10           HA       CYS  10   3.205  -9.094  -8.522
   67    HB2  CYS  10           HB2      CYS  10   1.398  -9.583 -10.139
   68    HB3  CYS  10           HB1      CYS  10   2.812  -8.875 -10.900
   69    HN1  NH2  11           H1       CYS  10   2.993 -10.084  -6.617
   70    HN2  NH2  11           H2       CYS  10   2.241 -11.624  -6.400
  Start of MODEL   11
    1    H1   GLY   1           HT1      GLY   1   4.034   3.584  -2.939
    2    H2   GLY   1           HT2      GLY   1   4.860   2.798  -1.696
    3    H3   GLY   1           HT3      GLY   1   3.340   3.480  -1.401
    4    HA2  GLY   1           HA1      GLY   1   3.172   1.096  -1.600
    5    HA3  GLY   1           HA2      GLY   1   2.297   1.922  -2.882
    6    H    PHE   2           HN       PHE   2   3.407  -0.784  -2.800
    7    HA   PHE   2           HA       PHE   2   5.509  -0.643  -4.830
    8    HB2  PHE   2           HB2      PHE   2   4.448  -2.940  -3.188
    9    HB3  PHE   2           HB1      PHE   2   5.639  -3.128  -4.470
   10    HD1  PHE   2           HD1      PHE   2   5.026  -1.875  -1.093
   11    HD2  PHE   2           HD2      PHE   2   7.896  -2.351  -4.194
   12    HE1  PHE   2           HE1      PHE   2   6.827  -1.367   0.499
   13    HE2  PHE   2           HE2      PHE   2   9.698  -1.846  -2.610
   14    HZ   PHE   2           HZ       PHE   2   9.169  -1.351  -0.256
   15    H    ARG   3           HN       ARG   3   5.288  -1.690  -6.818
   16    HA   ARG   3           HA       ARG   3   2.504  -2.222  -7.580
   17    HB2  ARG   3           HB2      ARG   3   4.738  -0.911  -9.078
   18    HB3  ARG   3           HB1      ARG   3   3.382  -1.637  -9.930
   19    HG2  ARG   3           HG2      ARG   3   1.833  -0.165  -8.866
   20    HG3  ARG   3           HG1      ARG   3   3.086   0.455  -7.790
   21    HD2  ARG   3           HD2      ARG   3   3.188   0.699 -10.782
   22    HD3  ARG   3           HD1      ARG   3   2.497   1.934  -9.728
   23    HE   ARG   3           HE       ARG   3   5.031   1.385  -8.761
   24   HH11  ARG   3          HH11      ARG   3   3.662   2.671 -11.722
   25   HH12  ARG   3          HH12      ARG   3   5.017   3.684 -12.056
   26   HH21  ARG   3          HH21      ARG   3   6.811   2.722  -9.190
   27   HH22  ARG   3          HH22      ARG   3   6.826   3.714 -10.608
   28    H    SER   4           HN       SER   4   2.071  -3.926  -8.950
   29    HA   SER   4           HA       SER   4   4.121  -5.994  -8.953
   30    HB2  SER   4           HB2      SER   4   1.111  -6.190  -9.096
   31    HB3  SER   4           HB1      SER   4   2.205  -7.564  -9.223
   32    HG   SER   4           HG       SER   4   1.654  -5.913  -7.012
   33    H    ALA   5           HN       ALA   5   5.054  -5.046 -10.796
   34    HA   ALA   5           HA       ALA   5   3.549  -5.376 -13.274
   35    HB1  ALA   5           HB1      ALA   5   4.581  -3.185 -12.988
   36    HB2  ALA   5           HB2      ALA   5   5.300  -4.059 -14.345
   37    HB3  ALA   5           HB3      ALA   5   6.162  -3.947 -12.812
   38    H    CYS   6           HN       CYS   6   3.746  -7.652 -13.053
   39    HA   CYS   6           HA       CYS   6   6.366  -8.788 -13.447
   40    HB2  CYS   6           HB2      CYS   6   5.066 -10.955 -13.740
   41    HB3  CYS   6           HB1      CYS   6   4.925 -10.171 -12.176
   42    HA   PRO   7           HA       PRO   7   6.826 -10.936 -14.382
   43    HB2  PRO   7           HB2      PRO   7   8.849 -11.245 -16.413
   44    HB3  PRO   7           HB1      PRO   7   7.602 -12.397 -15.934
   45    HG2  PRO   7           HG2      PRO   7   7.663 -11.124 -18.368
   46    HG3  PRO   7           HG1      PRO   7   6.191 -11.759 -17.616
   47    HD2  PRO   7           HD2      PRO   7   7.228  -8.944 -17.673
   48    HD3  PRO   7           HD1      PRO   7   5.564  -9.536 -17.866
   49    HA   PRO   8           HA       PRO   8   8.090 -11.900 -13.443
   50    HB2  PRO   8           HB2      PRO   8  10.187 -12.656 -12.062
   51    HB3  PRO   8           HB1      PRO   8  10.338 -12.441 -13.813
   52    HG2  PRO   8           HG2      PRO   8  11.395 -10.741 -11.616
   53    HG3  PRO   8           HG1      PRO   8  11.993 -10.934 -13.274
   54    HD2  PRO   8           HD2      PRO   8  10.200  -8.892 -12.210
   55    HD3  PRO   8           HD1      PRO   8  10.931  -8.987 -13.828
   56    H    PHE   9           HN       PHE   9   7.113  -9.508 -11.985
   57    HA   PHE   9           HA       PHE   9   7.127 -10.623  -9.278
   58    HB2  PHE   9           HB2      PHE   9   7.795  -7.733  -9.874
   59    HB3  PHE   9           HB1      PHE   9   7.444  -8.362  -8.272
   60    HD1  PHE   9           HD1      PHE   9   8.958 -10.437  -7.583
   61    HD2  PHE   9           HD2      PHE   9   9.981  -7.521 -10.502
   62    HE1  PHE   9           HE1      PHE   9  11.335 -10.977  -7.283
   63    HE2  PHE   9           HE2      PHE   9  12.361  -8.059 -10.211
   64    HZ   PHE   9           HZ       PHE   9  13.042  -9.790  -8.601
   65    H    CYS  10           HN       CYS  10   4.980 -11.183  -9.299
   66    HA   CYS  10           HA       CYS  10   3.249  -9.070  -8.542
   67    HB2  CYS  10           HB2      CYS  10   1.429  -9.427 -10.159
   68    HB3  CYS  10           HB1      CYS  10   2.882  -8.830 -10.939
   69    HN1  NH2  11           H1       CYS  10   2.803  -9.959  -6.682
   70    HN2  NH2  11           H2       CYS  10   2.093 -11.519  -6.458
  Start of MODEL   12
    1    H1   GLY   1           HT1      GLY   1  -0.230   2.004  -0.825
    2    H2   GLY   1           HT2      GLY   1   1.360   1.506  -1.114
    3    H3   GLY   1           HT3      GLY   1   0.321   0.520  -0.222
    4    HA2  GLY   1           HA1      GLY   1  -1.064   0.184  -2.154
    5    HA3  GLY   1           HA2      GLY   1   0.006   1.227  -3.079
    6    H    PHE   2           HN       PHE   2  -0.685  -1.567  -3.534
    7    HA   PHE   2           HA       PHE   2   1.761  -2.999  -2.892
    8    HB2  PHE   2           HB2      PHE   2  -0.762  -3.844  -4.308
    9    HB3  PHE   2           HB1      PHE   2   0.633  -4.893  -4.102
   10    HD1  PHE   2           HD1      PHE   2  -2.216  -3.326  -2.468
   11    HD2  PHE   2           HD2      PHE   2   1.248  -5.723  -1.908
   12    HE1  PHE   2           HE1      PHE   2  -3.051  -4.011  -0.260
   13    HE2  PHE   2           HE2      PHE   2   0.423  -6.411   0.296
   14    HZ   PHE   2           HZ       PHE   2  -1.732  -5.557   1.126
   15    H    ARG   3           HN       ARG   3   3.183  -3.795  -4.414
   16    HA   ARG   3           HA       ARG   3   3.033  -2.497  -7.042
   17    HB2  ARG   3           HB2      ARG   3   5.434  -3.274  -5.397
   18    HB3  ARG   3           HB1      ARG   3   5.526  -2.739  -7.069
   19    HG2  ARG   3           HG2      ARG   3   4.450  -0.625  -6.402
   20    HG3  ARG   3           HG1      ARG   3   4.524  -1.157  -4.720
   21    HD2  ARG   3           HD2      ARG   3   6.886  -0.806  -6.556
   22    HD3  ARG   3           HD1      ARG   3   6.385   0.340  -5.315
   23    HE   ARG   3           HE       ARG   3   6.723  -2.023  -3.986
   24   HH11  ARG   3          HH11      ARG   3   8.756  -0.022  -6.031
   25   HH12  ARG   3          HH12      ARG   3  10.228  -0.471  -5.242
   26   HH21  ARG   3          HH21      ARG   3   8.683  -2.618  -2.921
   27   HH22  ARG   3          HH22      ARG   3  10.183  -1.948  -3.464
   28    H    SER   4           HN       SER   4   2.866  -3.766  -8.731
   29    HA   SER   4           HA       SER   4   3.973  -6.408  -8.763
   30    HB2  SER   4           HB2      SER   4   0.976  -6.031  -8.824
   31    HB3  SER   4           HB1      SER   4   1.808  -7.515  -9.288
   32    HG   SER   4           HG       SER   4   2.746  -6.805  -6.916
   33    H    ALA   5           HN       ALA   5   5.068  -5.889 -10.542
   34    HA   ALA   5           HA       ALA   5   3.459  -5.593 -12.967
   35    HB1  ALA   5           HB1      ALA   5   6.052  -4.154 -12.410
   36    HB2  ALA   5           HB2      ALA   5   4.453  -3.413 -12.521
   37    HB3  ALA   5           HB3      ALA   5   5.187  -4.155 -13.946
   38    H    CYS   6           HN       CYS   6   3.693  -7.912 -12.997
   39    HA   CYS   6           HA       CYS   6   6.353  -8.926 -13.460
   40    HB2  CYS   6           HB2      CYS   6   5.094 -11.107 -13.951
   41    HB3  CYS   6           HB1      CYS   6   5.024 -10.484 -12.310
   42    HA   PRO   7           HA       PRO   7   6.911 -10.938 -14.522
   43    HB2  PRO   7           HB2      PRO   7   8.951 -11.410 -16.195
   44    HB3  PRO   7           HB1      PRO   7   7.342 -12.086 -16.478
   45    HG2  PRO   7           HG2      PRO   7   8.656  -9.726 -17.754
   46    HG3  PRO   7           HG1      PRO   7   7.628 -10.969 -18.488
   47    HD2  PRO   7           HD2      PRO   7   6.769  -8.443 -17.721
   48    HD3  PRO   7           HD1      PRO   7   5.710  -9.849 -17.944
   49    HA   PRO   8           HA       PRO   8   8.120 -11.851 -13.518
   50    HB2  PRO   8           HB2      PRO   8  10.236 -12.620 -12.192
   51    HB3  PRO   8           HB1      PRO   8  10.384 -12.299 -13.927
   52    HG2  PRO   8           HG2      PRO   8  11.390 -10.700 -11.629
   53    HG3  PRO   8           HG1      PRO   8  11.997 -10.776 -13.295
   54    HD2  PRO   8           HD2      PRO   8  10.126  -8.868 -12.114
   55    HD3  PRO   8           HD1      PRO   8  10.883  -8.828 -13.723
   56    H    PHE   9           HN       PHE   9   7.120  -9.537 -11.939
   57    HA   PHE   9           HA       PHE   9   7.057 -10.808  -9.310
   58    HB2  PHE   9           HB2      PHE   9   7.880  -7.919  -9.686
   59    HB3  PHE   9           HB1      PHE   9   7.463  -8.643  -8.142
   60    HD1  PHE   9           HD1      PHE   9   8.857 -10.833  -7.579
   61    HD2  PHE   9           HD2      PHE   9  10.085  -7.764 -10.251
   62    HE1  PHE   9           HE1      PHE   9  11.198 -11.509  -7.278
   63    HE2  PHE   9           HE2      PHE   9  12.426  -8.438  -9.958
   64    HZ   PHE   9           HZ       PHE   9  12.984 -10.315  -8.469
   65    H    CYS  10           HN       CYS  10   4.912 -11.172  -9.163
   66    HA   CYS  10           HA       CYS  10   3.252  -8.916  -8.650
   67    HB2  CYS  10           HB2      CYS  10   1.459  -9.439 -10.285
   68    HB3  CYS  10           HB1      CYS  10   2.942  -8.887 -11.047
   69    HN1  NH2  11           H1       CYS  10   2.954  -9.753  -6.670
   70    HN2  NH2  11           H2       CYS  10   2.078 -11.211  -6.356
  Start of MODEL   13
    1    H1   GLY   1           HT1      GLY   1   3.711   1.524  -1.157
    2    H2   GLY   1           HT2      GLY   1   2.954   0.244  -0.360
    3    H3   GLY   1           HT3      GLY   1   2.231   1.770  -0.381
    4    HA2  GLY   1           HA1      GLY   1   1.133   0.296  -1.931
    5    HA3  GLY   1           HA2      GLY   1   1.908   1.644  -2.750
    6    H    PHE   2           HN       PHE   2   1.356  -1.528  -3.017
    7    HA   PHE   2           HA       PHE   2   3.965  -2.103  -4.243
    8    HB2  PHE   2           HB2      PHE   2   1.794  -4.028  -3.413
    9    HB3  PHE   2           HB1      PHE   2   3.350  -4.467  -4.101
   10    HD1  PHE   2           HD1      PHE   2   1.543  -3.801  -1.122
   11    HD2  PHE   2           HD2      PHE   2   5.437  -3.794  -2.813
   12    HE1  PHE   2           HE1      PHE   2   2.515  -3.870   1.132
   13    HE2  PHE   2           HE2      PHE   2   6.419  -3.862  -0.568
   14    HZ   PHE   2           HZ       PHE   2   4.959  -3.900   1.414
   15    H    ARG   3           HN       ARG   3   4.087  -2.657  -6.346
   16    HA   ARG   3           HA       ARG   3   1.586  -2.522  -7.881
   17    HB2  ARG   3           HB2      ARG   3   4.371  -1.688  -8.668
   18    HB3  ARG   3           HB1      ARG   3   3.037  -1.821  -9.802
   19    HG2  ARG   3           HG2      ARG   3   1.798  -0.134  -8.527
   20    HG3  ARG   3           HG1      ARG   3   3.169   0.020  -7.426
   21    HD2  ARG   3           HD2      ARG   3   3.308   0.480 -10.392
   22    HD3  ARG   3           HD1      ARG   3   3.073   1.763  -9.208
   23    HE   ARG   3           HE       ARG   3   5.306   0.675  -8.291
   24   HH11  ARG   3          HH11      ARG   3   4.415   1.427 -11.606
   25   HH12  ARG   3          HH12      ARG   3   6.037   1.752 -12.106
   26   HH21  ARG   3          HH21      ARG   3   7.465   1.120  -8.952
   27   HH22  ARG   3          HH22      ARG   3   7.783   1.576 -10.589
   28    H    SER   4           HN       SER   4   1.231  -4.024  -9.463
   29    HA   SER   4           HA       SER   4   2.871  -6.411  -9.244
   30    HB2  SER   4           HB2      SER   4   0.086  -6.065 -10.368
   31    HB3  SER   4           HB1      SER   4   0.942  -7.593 -10.170
   32    HG   SER   4           HG       SER   4   1.082  -6.597  -7.831
   33    H    ALA   5           HN       ALA   5   4.465  -5.454 -10.576
   34    HA   ALA   5           HA       ALA   5   3.731  -5.351 -13.403
   35    HB1  ALA   5           HB1      ALA   5   5.792  -4.128 -13.794
   36    HB2  ALA   5           HB2      ALA   5   6.183  -4.219 -12.076
   37    HB3  ALA   5           HB3      ALA   5   4.771  -3.303 -12.613
   38    H    CYS   6           HN       CYS   6   3.684  -7.642 -13.354
   39    HA   CYS   6           HA       CYS   6   6.336  -8.829 -13.486
   40    HB2  CYS   6           HB2      CYS   6   4.936 -10.960 -13.952
   41    HB3  CYS   6           HB1      CYS   6   4.979 -10.308 -12.322
   42    HA   PRO   7           HA       PRO   7   6.828 -10.901 -14.433
   43    HB2  PRO   7           HB2      PRO   7   8.830 -11.604 -16.061
   44    HB3  PRO   7           HB1      PRO   7   7.181 -12.188 -16.316
   45    HG2  PRO   7           HG2      PRO   7   8.668 -10.033 -17.741
   46    HG3  PRO   7           HG1      PRO   7   7.513 -11.213 -18.383
   47    HD2  PRO   7           HD2      PRO   7   6.932  -8.553 -17.714
   48    HD3  PRO   7           HD1      PRO   7   5.738  -9.846 -17.945
   49    HA   PRO   8           HA       PRO   8   8.049 -11.884 -13.469
   50    HB2  PRO   8           HB2      PRO   8  10.119 -12.736 -12.147
   51    HB3  PRO   8           HB1      PRO   8  10.318 -12.391 -13.873
   52    HG2  PRO   8           HG2      PRO   8  11.250 -10.809 -11.514
   53    HG3  PRO   8           HG1      PRO   8  11.995 -10.973 -13.120
   54    HD2  PRO   8           HD2      PRO   8  10.195  -8.903 -12.178
   55    HD3  PRO   8           HD1      PRO   8  10.967  -9.041 -13.773
   56    H    PHE   9           HN       PHE   9   7.094  -9.511 -11.961
   57    HA   PHE   9           HA       PHE   9   7.104 -10.675  -9.274
   58    HB2  PHE   9           HB2      PHE   9   7.926  -7.831  -9.850
   59    HB3  PHE   9           HB1      PHE   9   7.440  -8.389  -8.256
   60    HD1  PHE   9           HD1      PHE   9   8.752 -10.509  -7.404
   61    HD2  PHE   9           HD2      PHE   9  10.148  -7.826 -10.388
   62    HE1  PHE   9           HE1      PHE   9  11.061 -11.211  -6.945
   63    HE2  PHE   9           HE2      PHE   9  12.461  -8.526  -9.938
   64    HZ   PHE   9           HZ       PHE   9  12.921 -10.220  -8.216
   65    H    CYS  10           HN       CYS  10   4.967 -11.176  -9.248
   66    HA   CYS  10           HA       CYS  10   3.244  -9.050  -8.482
   67    HB2  CYS  10           HB2      CYS  10   1.416  -9.489 -10.093
   68    HB3  CYS  10           HB1      CYS  10   2.842  -8.803 -10.856
   69    HN1  NH2  11           H1       CYS  10   3.044 -10.092  -6.586
   70    HN2  NH2  11           H2       CYS  10   2.245 -11.611  -6.397
  Start of MODEL   14
    1    H1   GLY   1           HT1      GLY   1  11.443   2.050  -4.801
    2    H2   GLY   1           HT2      GLY   1  12.076   0.725  -3.971
    3    H3   GLY   1           HT3      GLY   1  11.478   2.051  -3.110
    4    HA2  GLY   1           HA1      GLY   1   9.927   0.200  -3.062
    5    HA3  GLY   1           HA2      GLY   1   9.256   1.609  -3.874
    6    H    PHE   2           HN       PHE   2   8.792  -1.385  -4.123
    7    HA   PHE   2           HA       PHE   2   9.255  -1.533  -7.022
    8    HB2  PHE   2           HB2      PHE   2   9.150  -3.792  -5.035
    9    HB3  PHE   2           HB1      PHE   2   9.221  -4.003  -6.776
   10    HD1  PHE   2           HD1      PHE   2  11.104  -3.368  -3.776
   11    HD2  PHE   2           HD2      PHE   2  11.221  -3.204  -8.021
   12    HE1  PHE   2           HE1      PHE   2  13.559  -3.253  -3.699
   13    HE2  PHE   2           HE2      PHE   2  13.672  -3.091  -7.956
   14    HZ   PHE   2           HZ       PHE   2  14.848  -3.116  -5.792
   15    H    ARG   3           HN       ARG   3   7.623  -2.044  -8.307
   16    HA   ARG   3           HA       ARG   3   4.978  -2.343  -7.078
   17    HB2  ARG   3           HB2      ARG   3   5.798  -1.067  -9.683
   18    HB3  ARG   3           HB1      ARG   3   4.131  -1.482  -9.322
   19    HG2  ARG   3           HG2      ARG   3   4.335  -0.050  -7.262
   20    HG3  ARG   3           HG1      ARG   3   5.885   0.501  -7.900
   21    HD2  ARG   3           HD2      ARG   3   3.252   0.717  -9.349
   22    HD3  ARG   3           HD1      ARG   3   3.988   2.020  -8.420
   23    HE   ARG   3           HE       ARG   3   5.917   1.292 -10.202
   24   HH11  ARG   3          HH11      ARG   3   2.561   2.274 -10.515
   25   HH12  ARG   3          HH12      ARG   3   2.802   3.055 -12.042
   26   HH21  ARG   3          HH21      ARG   3   6.226   2.309 -12.237
   27   HH22  ARG   3          HH22      ARG   3   4.884   3.059 -13.027
   28    H    SER   4           HN       SER   4   3.458  -3.734  -8.156
   29    HA   SER   4           HA       SER   4   4.739  -6.164  -8.934
   30    HB2  SER   4           HB2      SER   4   1.797  -5.548  -8.734
   31    HB3  SER   4           HB1      SER   4   2.541  -7.144  -8.834
   32    HG   SER   4           HG       SER   4   3.674  -5.790  -6.822
   33    H    ALA   5           HN       ALA   5   5.619  -5.324 -10.823
   34    HA   ALA   5           HA       ALA   5   3.751  -5.398 -13.083
   35    HB1  ALA   5           HB1      ALA   5   5.406  -4.109 -14.361
   36    HB2  ALA   5           HB2      ALA   5   6.423  -4.006 -12.923
   37    HB3  ALA   5           HB3      ALA   5   4.840  -3.231 -12.941
   38    H    CYS   6           HN       CYS   6   3.916  -7.679 -12.912
   39    HA   CYS   6           HA       CYS   6   6.439  -8.905 -13.503
   40    HB2  CYS   6           HB2      CYS   6   5.028 -10.997 -13.816
   41    HB3  CYS   6           HB1      CYS   6   4.991 -10.259 -12.221
   42    HA   PRO   7           HA       PRO   7   6.868 -10.982 -14.509
   43    HB2  PRO   7           HB2      PRO   7   8.920 -11.087 -16.547
   44    HB3  PRO   7           HB1      PRO   7   7.754 -12.332 -16.097
   45    HG2  PRO   7           HG2      PRO   7   7.707 -10.992 -18.488
   46    HG3  PRO   7           HG1      PRO   7   6.279 -11.721 -17.734
   47    HD2  PRO   7           HD2      PRO   7   7.166  -8.860 -17.745
   48    HD3  PRO   7           HD1      PRO   7   5.532  -9.534 -17.914
   49    HA   PRO   8           HA       PRO   8   8.046 -11.873 -13.458
   50    HB2  PRO   8           HB2      PRO   8  10.154 -12.628 -12.083
   51    HB3  PRO   8           HB1      PRO   8  10.287 -12.426 -13.836
   52    HG2  PRO   8           HG2      PRO   8  11.414 -10.740 -11.674
   53    HG3  PRO   8           HG1      PRO   8  11.932 -10.888 -13.361
   54    HD2  PRO   8           HD2      PRO   8  10.127  -8.911 -12.156
   55    HD3  PRO   8           HD1      PRO   8  10.868  -8.905 -13.773
   56    H    PHE   9           HN       PHE   9   7.067  -9.490 -11.966
   57    HA   PHE   9           HA       PHE   9   7.101 -10.637  -9.270
   58    HB2  PHE   9           HB2      PHE   9   7.766  -7.737  -9.816
   59    HB3  PHE   9           HB1      PHE   9   7.457  -8.411  -8.224
   60    HD1  PHE   9           HD1      PHE   9   8.973 -10.532  -7.664
   61    HD2  PHE   9           HD2      PHE   9   9.936  -7.490 -10.476
   62    HE1  PHE   9           HE1      PHE   9  11.352 -11.096  -7.453
   63    HE2  PHE   9           HE2      PHE   9  12.319  -8.052 -10.272
   64    HZ   PHE   9           HZ       PHE   9  13.033  -9.859  -8.759
   65    H    CYS  10           HN       CYS  10   4.952 -11.175  -9.259
   66    HA   CYS  10           HA       CYS  10   3.220  -9.071  -8.479
   67    HB2  CYS  10           HB2      CYS  10   1.391  -9.470 -10.101
   68    HB3  CYS  10           HB1      CYS  10   2.825  -8.802 -10.862
   69    HN1  NH2  11           H1       CYS  10   2.687  -9.962  -6.634
   70    HN2  NH2  11           H2       CYS  10   2.055 -11.556  -6.426
  Start of MODEL   15
    1    H1   GLY   1           HT1      GLY   1   7.372   4.995  -6.480
    2    H2   GLY   1           HT2      GLY   1   7.882   4.661  -4.907
    3    H3   GLY   1           HT3      GLY   1   6.750   5.886  -5.187
    4    HA2  GLY   1           HA1      GLY   1   5.690   3.905  -4.302
    5    HA3  GLY   1           HA2      GLY   1   5.122   4.299  -5.919
    6    H    PHE   2           HN       PHE   2   5.119   1.732  -4.518
    7    HA   PHE   2           HA       PHE   2   6.980   0.206  -6.192
    8    HB2  PHE   2           HB2      PHE   2   5.418  -0.651  -3.756
    9    HB3  PHE   2           HB1      PHE   2   6.502  -1.683  -4.679
   10    HD1  PHE   2           HD1      PHE   2   6.249   0.825  -2.114
   11    HD2  PHE   2           HD2      PHE   2   8.924  -1.140  -4.768
   12    HE1  PHE   2           HE1      PHE   2   8.149   1.594  -0.760
   13    HE2  PHE   2           HE2      PHE   2  10.829  -0.378  -3.423
   14    HZ   PHE   2           HZ       PHE   2  10.443   0.993  -1.414
   15    H    ARG   3           HN       ARG   3   6.258  -1.299  -7.597
   16    HA   ARG   3           HA       ARG   3   3.367  -1.648  -7.877
   17    HB2  ARG   3           HB2      ARG   3   5.276  -0.769 -10.027
   18    HB3  ARG   3           HB1      ARG   3   3.694  -1.450 -10.373
   19    HG2  ARG   3           HG2      ARG   3   2.604   0.361  -9.241
   20    HG3  ARG   3           HG1      ARG   3   4.155   1.000  -8.690
   21    HD2  ARG   3           HD2      ARG   3   3.381   0.685 -11.573
   22    HD3  ARG   3           HD1      ARG   3   3.181   2.181 -10.658
   23    HE   ARG   3           HE       ARG   3   5.789   1.607 -10.290
   24   HH11  ARG   3          HH11      ARG   3   3.836   1.792 -13.204
   25   HH12  ARG   3          HH12      ARG   3   5.149   2.324 -14.195
   26   HH21  ARG   3          HH21      ARG   3   7.509   2.320 -11.589
   27   HH22  ARG   3          HH22      ARG   3   7.254   2.618 -13.276
   28    H    SER   4           HN       SER   4   2.748  -3.548  -8.935
   29    HA   SER   4           HA       SER   4   4.816  -5.603  -8.966
   30    HB2  SER   4           HB2      SER   4   1.816  -5.911  -8.833
   31    HB3  SER   4           HB1      SER   4   3.010  -7.198  -8.689
   32    HG   SER   4           HG       SER   4   3.522  -6.542  -6.708
   33    H    ALA   5           HN       ALA   5   5.495  -4.886 -10.994
   34    HA   ALA   5           HA       ALA   5   3.665  -5.359 -13.207
   35    HB1  ALA   5           HB1      ALA   5   6.302  -3.898 -13.188
   36    HB2  ALA   5           HB2      ALA   5   4.703  -3.153 -13.190
   37    HB3  ALA   5           HB3      ALA   5   5.242  -4.095 -14.582
   38    H    CYS   6           HN       CYS   6   3.887  -7.611 -12.927
   39    HA   CYS   6           HA       CYS   6   6.425  -8.822 -13.499
   40    HB2  CYS   6           HB2      CYS   6   5.100 -10.952 -13.679
   41    HB3  CYS   6           HB1      CYS   6   4.951 -10.116 -12.143
   42    HA   PRO   7           HA       PRO   7   6.854 -10.983 -14.448
   43    HB2  PRO   7           HB2      PRO   7   8.872 -11.549 -16.127
   44    HB3  PRO   7           HB1      PRO   7   7.258 -12.231 -16.351
   45    HG2  PRO   7           HG2      PRO   7   8.543  -9.915 -17.741
   46    HG3  PRO   7           HG1      PRO   7   7.549 -11.217 -18.418
   47    HD2  PRO   7           HD2      PRO   7   6.595  -8.712 -17.832
   48    HD3  PRO   7           HD1      PRO   7   5.586 -10.170 -17.859
   49    HA   PRO   8           HA       PRO   8   8.082 -11.889 -13.436
   50    HB2  PRO   8           HB2      PRO   8  10.192 -12.630 -12.078
   51    HB3  PRO   8           HB1      PRO   8  10.345 -12.391 -13.825
   52    HG2  PRO   8           HG2      PRO   8  11.360 -10.694 -11.600
   53    HG3  PRO   8           HG1      PRO   8  11.985 -10.867 -13.251
   54    HD2  PRO   8           HD2      PRO   8  10.153  -8.855 -12.200
   55    HD3  PRO   8           HD1      PRO   8  10.896  -8.937 -13.814
   56    H    PHE   9           HN       PHE   9   7.080  -9.518 -11.969
   57    HA   PHE   9           HA       PHE   9   7.118 -10.636  -9.264
   58    HB2  PHE   9           HB2      PHE   9   7.763  -7.744  -9.855
   59    HB3  PHE   9           HB1      PHE   9   7.413  -8.376  -8.256
   60    HD1  PHE   9           HD1      PHE   9   8.956 -10.386  -7.518
   61    HD2  PHE   9           HD2      PHE   9   9.939  -7.541 -10.521
   62    HE1  PHE   9           HE1      PHE   9  11.343 -10.880  -7.201
   63    HE2  PHE   9           HE2      PHE   9  12.328  -8.034 -10.214
   64    HZ   PHE   9           HZ       PHE   9  13.034  -9.707  -8.551
   65    H    CYS  10           HN       CYS  10   4.969 -11.192  -9.277
   66    HA   CYS  10           HA       CYS  10   3.239  -9.076  -8.523
   67    HB2  CYS  10           HB2      CYS  10   1.416  -9.451 -10.140
   68    HB3  CYS  10           HB1      CYS  10   2.863  -8.822 -10.908
   69    HN1  NH2  11           H1       CYS  10   2.744  -9.943  -6.671
   70    HN2  NH2  11           H2       CYS  10   2.055 -11.510  -6.444
  Start of MODEL   16
    1    H1   GLY   1           HT1      GLY   1   2.908   1.668  -0.981
    2    H2   GLY   1           HT2      GLY   1   3.591   0.539   0.068
    3    H3   GLY   1           HT3      GLY   1   2.021   1.090   0.334
    4    HA2  GLY   1           HA1      GLY   1   1.971  -1.110  -0.601
    5    HA3  GLY   1           HA2      GLY   1   1.287   0.069  -1.714
    6    H    PHE   2           HN       PHE   2   2.626  -2.587  -2.109
    7    HA   PHE   2           HA       PHE   2   4.963  -1.790  -3.668
    8    HB2  PHE   2           HB2      PHE   2   3.921  -4.520  -2.910
    9    HB3  PHE   2           HB1      PHE   2   5.352  -4.240  -3.895
   10    HD1  PHE   2           HD1      PHE   2   4.062  -4.553  -0.589
   11    HD2  PHE   2           HD2      PHE   2   7.250  -2.896  -2.866
   12    HE1  PHE   2           HE1      PHE   2   5.423  -4.377   1.450
   13    HE2  PHE   2           HE2      PHE   2   8.617  -2.719  -0.831
   14    HZ   PHE   2           HZ       PHE   2   7.705  -3.461   1.329
   15    H    ARG   3           HN       ARG   3   5.191  -2.355  -5.850
   16    HA   ARG   3           HA       ARG   3   2.648  -2.348  -7.272
   17    HB2  ARG   3           HB2      ARG   3   5.462  -1.816  -8.205
   18    HB3  ARG   3           HB1      ARG   3   4.048  -1.782  -9.249
   19    HG2  ARG   3           HG2      ARG   3   3.104   0.029  -7.884
   20    HG3  ARG   3           HG1      ARG   3   4.559   0.010  -6.886
   21    HD2  ARG   3           HD2      ARG   3   4.525   0.503  -9.851
   22    HD3  ARG   3           HD1      ARG   3   4.556   1.772  -8.632
   23    HE   ARG   3           HE       ARG   3   6.692   0.454  -7.899
   24   HH11  ARG   3          HH11      ARG   3   5.650   1.089 -11.191
   25   HH12  ARG   3          HH12      ARG   3   7.253   1.217 -11.815
   26   HH21  ARG   3          HH21      ARG   3   8.819   0.608  -8.721
   27   HH22  ARG   3          HH22      ARG   3   9.072   0.935 -10.400
   28    H    SER   4           HN       SER   4   2.138  -3.801  -8.886
   29    HA   SER   4           HA       SER   4   3.684  -6.282  -8.859
   30    HB2  SER   4           HB2      SER   4   0.734  -5.962  -9.436
   31    HB3  SER   4           HB1      SER   4   1.632  -7.472  -9.291
   32    HG   SER   4           HG       SER   4   0.954  -5.603  -7.282
   33    H    ALA   5           HN       ALA   5   4.962  -5.581 -10.535
   34    HA   ALA   5           HA       ALA   5   3.602  -5.500 -13.128
   35    HB1  ALA   5           HB1      ALA   5   4.599  -3.343 -12.689
   36    HB2  ALA   5           HB2      ALA   5   5.470  -4.165 -13.990
   37    HB3  ALA   5           HB3      ALA   5   6.158  -4.105 -12.369
   38    H    CYS   6           HN       CYS   6   3.747  -7.795 -13.043
   39    HA   CYS   6           HA       CYS   6   6.399  -8.885 -13.452
   40    HB2  CYS   6           HB2      CYS   6   5.145 -11.066 -13.796
   41    HB3  CYS   6           HB1      CYS   6   5.003 -10.343 -12.202
   42    HA   PRO   7           HA       PRO   7   6.914 -10.962 -14.506
   43    HB2  PRO   7           HB2      PRO   7   8.948 -11.012 -16.558
   44    HB3  PRO   7           HB1      PRO   7   7.797 -12.278 -16.128
   45    HG2  PRO   7           HG2      PRO   7   7.720 -10.892 -18.495
   46    HG3  PRO   7           HG1      PRO   7   6.305 -11.647 -17.746
   47    HD2  PRO   7           HD2      PRO   7   7.172  -8.775 -17.688
   48    HD3  PRO   7           HD1      PRO   7   5.542  -9.456 -17.882
   49    HA   PRO   8           HA       PRO   8   8.111 -11.866 -13.505
   50    HB2  PRO   8           HB2      PRO   8  10.207 -12.635 -12.148
   51    HB3  PRO   8           HB1      PRO   8  10.385 -12.330 -13.882
   52    HG2  PRO   8           HG2      PRO   8  11.346 -10.705 -11.580
   53    HG3  PRO   8           HG1      PRO   8  12.001 -10.816 -13.226
   54    HD2  PRO   8           HD2      PRO   8  10.127  -8.858 -12.140
   55    HD3  PRO   8           HD1      PRO   8  10.903  -8.874 -13.739
   56    H    PHE   9           HN       PHE   9   7.111  -9.506 -11.969
   57    HA   PHE   9           HA       PHE   9   7.052 -10.743  -9.321
   58    HB2  PHE   9           HB2      PHE   9   7.882  -7.868  -9.758
   59    HB3  PHE   9           HB1      PHE   9   7.430  -8.536  -8.197
   60    HD1  PHE   9           HD1      PHE   9   8.782 -10.718  -7.533
   61    HD2  PHE   9           HD2      PHE   9  10.099  -7.777 -10.301
   62    HE1  PHE   9           HE1      PHE   9  11.108 -11.424  -7.165
   63    HE2  PHE   9           HE2      PHE   9  12.428  -8.477  -9.944
   64    HZ   PHE   9           HZ       PHE   9  12.937 -10.303  -8.374
   65    H    CYS  10           HN       CYS  10   4.930 -11.163  -9.202
   66    HA   CYS  10           HA       CYS  10   3.221  -8.972  -8.609
   67    HB2  CYS  10           HB2      CYS  10   1.412  -9.490 -10.229
   68    HB3  CYS  10           HB1      CYS  10   2.863  -8.883 -11.007
   69    HN1  NH2  11           H1       CYS  10   2.824  -9.785  -6.673
   70    HN2  NH2  11           H2       CYS  10   2.092 -11.320  -6.366
  Start of MODEL   17
    1    H1   GLY   1           HT1      GLY   1   3.811   5.662  -5.415
    2    H2   GLY   1           HT2      GLY   1   4.730   5.448  -4.013
    3    H3   GLY   1           HT3      GLY   1   3.116   5.946  -3.900
    4    HA2  GLY   1           HA1      GLY   1   3.361   3.608  -3.335
    5    HA3  GLY   1           HA2      GLY   1   2.351   3.852  -4.754
    6    H    PHE   2           HN       PHE   2   3.883   1.490  -3.969
    7    HA   PHE   2           HA       PHE   2   6.055   1.426  -5.896
    8    HB2  PHE   2           HB2      PHE   2   5.072  -0.654  -3.944
    9    HB3  PHE   2           HB1      PHE   2   6.453  -0.864  -5.014
   10    HD1  PHE   2           HD1      PHE   2   5.255   0.589  -1.930
   11    HD2  PHE   2           HD2      PHE   2   8.459   0.554  -4.726
   12    HE1  PHE   2           HE1      PHE   2   6.715   1.658  -0.264
   13    HE2  PHE   2           HE2      PHE   2   9.925   1.619  -3.070
   14    HZ   PHE   2           HZ       PHE   2   9.056   2.174  -0.833
   15    H    ARG   3           HN       ARG   3   6.121   0.125  -7.674
   16    HA   ARG   3           HA       ARG   3   3.633  -1.201  -8.482
   17    HB2  ARG   3           HB2      ARG   3   5.186   0.855 -10.027
   18    HB3  ARG   3           HB1      ARG   3   4.073  -0.266 -10.802
   19    HG2  ARG   3           HG2      ARG   3   2.216   0.636  -9.673
   20    HG3  ARG   3           HG1      ARG   3   3.242   1.525  -8.544
   21    HD2  ARG   3           HD2      ARG   3   3.146   2.009 -11.504
   22    HD3  ARG   3           HD1      ARG   3   2.214   2.926 -10.317
   23    HE   ARG   3           HE       ARG   3   4.981   2.906  -9.665
   24   HH11  ARG   3          HH11      ARG   3   2.692   4.392 -11.854
   25   HH12  ARG   3          HH12      ARG   3   3.590   5.862 -12.002
   26   HH21  ARG   3          HH21      ARG   3   6.184   4.823  -9.874
   27   HH22  ARG   3          HH22      ARG   3   5.591   6.113 -10.865
   28    H    SER   4           HN       SER   4   3.925  -2.874 -10.040
   29    HA   SER   4           HA       SER   4   6.624  -3.611 -10.696
   30    HB2  SER   4           HB2      SER   4   6.156  -5.974  -9.805
   31    HB3  SER   4           HB1      SER   4   6.604  -4.729  -8.632
   32    HG   SER   4           HG       SER   4   4.077  -5.869  -9.163
   33    H    ALA   5           HN       ALA   5   6.144  -3.475 -12.788
   34    HA   ALA   5           HA       ALA   5   3.928  -4.819 -13.969
   35    HB1  ALA   5           HB1      ALA   5   6.337  -3.511 -15.237
   36    HB2  ALA   5           HB2      ALA   5   4.760  -2.759 -14.985
   37    HB3  ALA   5           HB3      ALA   5   4.926  -4.116 -16.102
   38    H    CYS   6           HN       CYS   6   4.208  -6.828 -13.339
   39    HA   CYS   6           HA       CYS   6   6.601  -8.327 -13.790
   40    HB2  CYS   6           HB2      CYS   6   5.395 -10.215 -12.951
   41    HB3  CYS   6           HB1      CYS   6   4.905  -8.821 -12.006
   42    HA   PRO   7           HA       PRO   7   6.596 -11.003 -14.136
   43    HB2  PRO   7           HB2      PRO   7   8.502 -11.536 -16.313
   44    HB3  PRO   7           HB1      PRO   7   7.519 -12.671 -15.386
   45    HG2  PRO   7           HG2      PRO   7   6.990 -12.118 -17.964
   46    HG3  PRO   7           HG1      PRO   7   5.701 -12.453 -16.796
   47    HD2  PRO   7           HD2      PRO   7   6.651  -9.822 -17.866
   48    HD3  PRO   7           HD1      PRO   7   4.994 -10.389 -17.583
   49    HA   PRO   8           HA       PRO   8   7.979 -11.952 -13.196
   50    HB2  PRO   8           HB2      PRO   8  10.158 -12.581 -11.876
   51    HB3  PRO   8           HB1      PRO   8  10.201 -12.527 -13.643
   52    HG2  PRO   8           HG2      PRO   8  11.385 -10.638 -11.678
   53    HG3  PRO   8           HG1      PRO   8  11.876 -10.969 -13.350
   54    HD2  PRO   8           HD2      PRO   8  10.132  -8.850 -12.345
   55    HD3  PRO   8           HD1      PRO   8  10.771  -9.072 -13.989
   56    H    PHE   9           HN       PHE   9   7.079  -9.451 -11.865
   57    HA   PHE   9           HA       PHE   9   7.294 -10.402  -9.098
   58    HB2  PHE   9           HB2      PHE   9   7.681  -7.516  -9.918
   59    HB3  PHE   9           HB1      PHE   9   7.492  -8.065  -8.260
   60    HD1  PHE   9           HD1      PHE   9   9.193 -10.009  -7.592
   61    HD2  PHE   9           HD2      PHE   9   9.807  -7.155 -10.684
   62    HE1  PHE   9           HE1      PHE   9  11.621 -10.361  -7.429
   63    HE2  PHE   9           HE2      PHE   9  12.232  -7.504 -10.531
   64    HZ   PHE   9           HZ       PHE   9  13.146  -9.109  -8.902
   65    H    CYS  10           HN       CYS  10   5.156 -11.252  -9.448
   66    HA   CYS  10           HA       CYS  10   3.226  -9.459  -8.384
   67    HB2  CYS  10           HB2      CYS  10   1.492  -9.672 -10.121
   68    HB3  CYS  10           HB1      CYS  10   2.904  -8.807 -10.702
   69    HN1  NH2  11           H1       CYS  10   2.616 -10.671  -6.777
   70    HN2  NH2  11           H2       CYS  10   2.118 -12.322  -6.880
  Start of MODEL   18
    1    H1   GLY   1           HT1      GLY   1   4.093   2.454  -0.983
    2    H2   GLY   1           HT2      GLY   1   3.825   0.946  -0.271
    3    H3   GLY   1           HT3      GLY   1   2.683   2.180  -0.096
    4    HA2  GLY   1           HA1      GLY   1   1.969   0.533  -1.716
    5    HA3  GLY   1           HA2      GLY   1   2.164   2.136  -2.412
    6    H    PHE   2           HN       PHE   2   3.211  -1.131  -2.447
    7    HA   PHE   2           HA       PHE   2   5.452  -0.520  -4.199
    8    HB2  PHE   2           HB2      PHE   2   4.502  -3.090  -2.953
    9    HB3  PHE   2           HB1      PHE   2   5.812  -3.016  -4.124
   10    HD1  PHE   2           HD1      PHE   2   4.776  -2.202  -0.721
   11    HD2  PHE   2           HD2      PHE   2   7.942  -2.062  -3.551
   12    HE1  PHE   2           HE1      PHE   2   6.358  -1.688   1.084
   13    HE2  PHE   2           HE2      PHE   2   9.534  -1.551  -1.754
   14    HZ   PHE   2           HZ       PHE   2   8.744  -1.364   0.570
   15    H    ARG   3           HN       ARG   3   5.622  -1.298  -6.272
   16    HA   ARG   3           HA       ARG   3   3.047  -1.773  -7.567
   17    HB2  ARG   3           HB2      ARG   3   5.662  -0.714  -8.596
   18    HB3  ARG   3           HB1      ARG   3   4.331  -1.160  -9.656
   19    HG2  ARG   3           HG2      ARG   3   2.917   0.504  -8.714
   20    HG3  ARG   3           HG1      ARG   3   4.075   0.840  -7.430
   21    HD2  ARG   3           HD2      ARG   3   4.615   1.241 -10.355
   22    HD3  ARG   3           HD1      ARG   3   4.057   2.513  -9.269
   23    HE   ARG   3           HE       ARG   3   6.402   1.233  -8.280
   24   HH11  ARG   3          HH11      ARG   3   5.298   3.645 -10.581
   25   HH12  ARG   3          HH12      ARG   3   6.806   4.493 -10.598
   26   HH21  ARG   3          HH21      ARG   3   8.397   2.379  -8.301
   27   HH22  ARG   3          HH22      ARG   3   8.563   3.779  -9.304
   28    H    SER   4           HN       SER   4   2.808  -3.429  -9.091
   29    HA   SER   4           HA       SER   4   4.878  -5.484  -9.033
   30    HB2  SER   4           HB2      SER   4   1.907  -5.972  -8.743
   31    HB3  SER   4           HB1      SER   4   3.163  -7.205  -8.817
   32    HG   SER   4           HG       SER   4   3.773  -6.752  -6.818
   33    H    ALA   5           HN       ALA   5   5.527  -4.974 -11.031
   34    HA   ALA   5           HA       ALA   5   3.603  -5.345 -13.208
   35    HB1  ALA   5           HB1      ALA   5   4.604  -3.118 -13.215
   36    HB2  ALA   5           HB2      ALA   5   5.120  -4.054 -14.621
   37    HB3  ALA   5           HB3      ALA   5   6.215  -3.837 -13.257
   38    H    CYS   6           HN       CYS   6   3.866  -7.591 -12.975
   39    HA   CYS   6           HA       CYS   6   6.429  -8.757 -13.507
   40    HB2  CYS   6           HB2      CYS   6   5.114 -10.901 -13.697
   41    HB3  CYS   6           HB1      CYS   6   4.992 -10.069 -12.154
   42    HA   PRO   7           HA       PRO   7   6.828 -10.961 -14.413
   43    HB2  PRO   7           HB2      PRO   7   8.810 -11.648 -16.071
   44    HB3  PRO   7           HB1      PRO   7   7.165 -12.256 -16.297
   45    HG2  PRO   7           HG2      PRO   7   8.554 -10.003 -17.699
   46    HG3  PRO   7           HG1      PRO   7   7.541 -11.288 -18.383
   47    HD2  PRO   7           HD2      PRO   7   6.630  -8.758 -17.845
   48    HD3  PRO   7           HD1      PRO   7   5.591 -10.196 -17.849
   49    HA   PRO   8           HA       PRO   8   8.059 -11.902 -13.423
   50    HB2  PRO   8           HB2      PRO   8  10.153 -12.671 -12.063
   51    HB3  PRO   8           HB1      PRO   8  10.322 -12.417 -13.808
   52    HG2  PRO   8           HG2      PRO   8  11.319 -10.739 -11.558
   53    HG3  PRO   8           HG1      PRO   8  11.977 -10.926 -13.193
   54    HD2  PRO   8           HD2      PRO   8  10.159  -8.880 -12.195
   55    HD3  PRO   8           HD1      PRO   8  10.918  -8.993 -13.800
   56    H    PHE   9           HN       PHE   9   7.094  -9.503 -11.980
   57    HA   PHE   9           HA       PHE   9   7.131 -10.574  -9.254
   58    HB2  PHE   9           HB2      PHE   9   7.752  -7.698  -9.936
   59    HB3  PHE   9           HB1      PHE   9   7.376  -8.265  -8.317
   60    HD1  PHE   9           HD1      PHE   9   8.892 -10.329  -7.550
   61    HD2  PHE   9           HD2      PHE   9   9.948  -7.452 -10.499
   62    HE1  PHE   9           HE1      PHE   9  11.271 -10.827  -7.178
   63    HE2  PHE   9           HE2      PHE   9  12.327  -7.946 -10.138
   64    HZ   PHE   9           HZ       PHE   9  12.994  -9.637  -8.475
   65    H    CYS  10           HN       CYS  10   5.006 -11.180  -9.238
   66    HA   CYS  10           HA       CYS  10   3.222  -9.112  -8.510
   67    HB2  CYS  10           HB2      CYS  10   1.392  -9.578 -10.114
   68    HB3  CYS  10           HB1      CYS  10   2.796  -8.845 -10.870
   69    HN1  NH2  11           H1       CYS  10   2.785  -9.985  -6.655
   70    HN2  NH2  11           H2       CYS  10   2.124 -11.562  -6.412
  Start of MODEL   19
    1    H1   GLY   1           HT1      GLY   1   6.718   0.156  -1.334
    2    H2   GLY   1           HT2      GLY   1   7.255  -1.155  -0.416
    3    H3   GLY   1           HT3      GLY   1   6.223  -0.007   0.280
    4    HA2  GLY   1           HA1      GLY   1   4.992  -1.978  -0.243
    5    HA3  GLY   1           HA2      GLY   1   4.474  -0.641  -1.260
    6    H    PHE   2           HN       PHE   2   4.287  -3.513  -1.715
    7    HA   PHE   2           HA       PHE   2   6.180  -4.008  -3.858
    8    HB2  PHE   2           HB2      PHE   2   3.961  -5.697  -2.714
    9    HB3  PHE   2           HB1      PHE   2   5.022  -6.205  -4.018
   10    HD1  PHE   2           HD1      PHE   2   4.657  -5.800  -0.456
   11    HD2  PHE   2           HD2      PHE   2   7.441  -6.493  -3.591
   12    HE1  PHE   2           HE1      PHE   2   6.297  -6.615   1.185
   13    HE2  PHE   2           HE2      PHE   2   9.086  -7.310  -1.961
   14    HZ   PHE   2           HZ       PHE   2   8.515  -7.373   0.430
   15    H    ARG   3           HN       ARG   3   5.646  -4.201  -5.974
   16    HA   ARG   3           HA       ARG   3   3.007  -3.146  -6.718
   17    HB2  ARG   3           HB2      ARG   3   5.667  -2.754  -8.082
   18    HB3  ARG   3           HB1      ARG   3   4.121  -2.220  -8.727
   19    HG2  ARG   3           HG2      ARG   3   3.806  -0.762  -6.808
   20    HG3  ARG   3           HG1      ARG   3   5.343  -1.308  -6.135
   21    HD2  ARG   3           HD2      ARG   3   5.005   0.070  -8.787
   22    HD3  ARG   3           HD1      ARG   3   5.489   0.869  -7.293
   23    HE   ARG   3           HE       ARG   3   7.166  -1.354  -7.956
   24   HH11  ARG   3          HH11      ARG   3   6.601   2.062  -8.547
   25   HH12  ARG   3          HH12      ARG   3   8.223   2.369  -9.058
   26   HH21  ARG   3          HH21      ARG   3   9.333  -0.929  -8.631
   27   HH22  ARG   3          HH22      ARG   3   9.772   0.673  -9.110
   28    H    SER   4           HN       SER   4   2.047  -4.009  -8.604
   29    HA   SER   4           HA       SER   4   2.929  -6.720  -9.144
   30    HB2  SER   4           HB2      SER   4   0.321  -5.386  -9.883
   31    HB3  SER   4           HB1      SER   4   0.730  -7.092 -10.084
   32    HG   SER   4           HG       SER   4   0.785  -5.788  -7.563
   33    H    ALA   5           HN       ALA   5   4.653  -5.957 -10.393
   34    HA   ALA   5           HA       ALA   5   3.785  -5.343 -13.124
   35    HB1  ALA   5           HB1      ALA   5   6.312  -4.388 -11.794
   36    HB2  ALA   5           HB2      ALA   5   4.926  -3.395 -12.259
   37    HB3  ALA   5           HB3      ALA   5   5.907  -4.186 -13.498
   38    H    CYS   6           HN       CYS   6   3.667  -7.660 -13.249
   39    HA   CYS   6           HA       CYS   6   6.278  -8.922 -13.435
   40    HB2  CYS   6           HB2      CYS   6   4.788 -10.954 -14.116
   41    HB3  CYS   6           HB1      CYS   6   4.880 -10.453 -12.435
   42    HA   PRO   7           HA       PRO   7   6.759 -10.862 -14.398
   43    HB2  PRO   7           HB2      PRO   7   8.662 -11.744 -16.053
   44    HB3  PRO   7           HB1      PRO   7   6.965 -12.174 -16.296
   45    HG2  PRO   7           HG2      PRO   7   8.646 -10.205 -17.764
   46    HG3  PRO   7           HG1      PRO   7   7.321 -11.219 -18.360
   47    HD2  PRO   7           HD2      PRO   7   7.161  -8.488 -17.596
   48    HD3  PRO   7           HD1      PRO   7   5.799  -9.570 -17.951
   49    HA   PRO   8           HA       PRO   8   7.920 -11.904 -13.403
   50    HB2  PRO   8           HB2      PRO   8   9.950 -12.817 -12.004
   51    HB3  PRO   8           HB1      PRO   8  10.108 -12.660 -13.759
   52    HG2  PRO   8           HG2      PRO   8  11.347 -11.024 -11.616
   53    HG3  PRO   8           HG1      PRO   8  11.889 -11.284 -13.283
   54    HD2  PRO   8           HD2      PRO   8  10.290  -9.087 -12.203
   55    HD3  PRO   8           HD1      PRO   8  11.006  -9.249 -13.822
   56    H    PHE   9           HN       PHE   9   7.131  -9.432 -11.978
   57    HA   PHE   9           HA       PHE   9   7.195 -10.477  -9.238
   58    HB2  PHE   9           HB2      PHE   9   7.788  -7.612  -9.979
   59    HB3  PHE   9           HB1      PHE   9   7.500  -8.176  -8.340
   60    HD1  PHE   9           HD1      PHE   9   9.041 -10.244  -7.650
   61    HD2  PHE   9           HD2      PHE   9   9.957  -7.385 -10.662
   62    HE1  PHE   9           HE1      PHE   9  11.433 -10.766  -7.413
   63    HE2  PHE   9           HE2      PHE   9  12.349  -7.902 -10.433
   64    HZ   PHE   9           HZ       PHE   9  13.091  -9.596  -8.806
   65    H    CYS  10           HN       CYS  10   5.044 -11.147  -9.365
   66    HA   CYS  10           HA       CYS  10   3.263  -9.135  -8.461
   67    HB2  CYS  10           HB2      CYS  10   1.469  -9.361 -10.097
   68    HB3  CYS  10           HB1      CYS  10   2.931  -8.790 -10.882
   69    HN1  NH2  11           H1       CYS  10   3.152 -10.334  -6.643
   70    HN2  NH2  11           H2       CYS  10   2.388 -11.882  -6.552
  Start of MODEL   20
    1    H1   GLY   1           HT1      GLY   1   7.121   4.238  -5.640
    2    H2   GLY   1           HT2      GLY   1   8.137   3.562  -4.474
    3    H3   GLY   1           HT3      GLY   1   7.018   4.744  -4.024
    4    HA2  GLY   1           HA1      GLY   1   6.257   2.580  -3.342
    5    HA3  GLY   1           HA2      GLY   1   5.203   3.252  -4.577
    6    H    PHE   2           HN       PHE   2   5.858   0.445  -3.759
    7    HA   PHE   2           HA       PHE   2   7.162  -0.592  -6.142
    8    HB2  PHE   2           HB2      PHE   2   6.104  -1.981  -3.684
    9    HB3  PHE   2           HB1      PHE   2   6.860  -2.807  -5.036
   10    HD1  PHE   2           HD1      PHE   2   7.403  -1.030  -1.976
   11    HD2  PHE   2           HD2      PHE   2   9.252  -2.259  -5.601
   12    HE1  PHE   2           HE1      PHE   2   9.614  -0.677  -0.963
   13    HE2  PHE   2           HE2      PHE   2  11.466  -1.910  -4.597
   14    HZ   PHE   2           HZ       PHE   2  11.652  -1.117  -2.273
   15    H    ARG   3           HN       ARG   3   6.179  -1.865  -7.654
   16    HA   ARG   3           HA       ARG   3   3.262  -2.109  -7.500
   17    HB2  ARG   3           HB2      ARG   3   4.865  -1.085  -9.835
   18    HB3  ARG   3           HB1      ARG   3   3.190  -1.596  -9.954
   19    HG2  ARG   3           HG2      ARG   3   2.590   0.137  -8.289
   20    HG3  ARG   3           HG1      ARG   3   4.268   0.687  -8.315
   21    HD2  ARG   3           HD2      ARG   3   2.396   0.584 -10.668
   22    HD3  ARG   3           HD1      ARG   3   2.862   2.037  -9.785
   23    HE   ARG   3           HE       ARG   3   5.238   1.200 -10.521
   24   HH11  ARG   3          HH11      ARG   3   2.285   1.207 -12.420
   25   HH12  ARG   3          HH12      ARG   3   3.102   1.433 -13.928
   26   HH21  ARG   3          HH21      ARG   3   6.323   1.500 -12.522
   27   HH22  ARG   3          HH22      ARG   3   5.400   1.595 -13.985
   28    H    SER   4           HN       SER   4   2.383  -3.837  -8.688
   29    HA   SER   4           HA       SER   4   4.223  -6.041  -8.980
   30    HB2  SER   4           HB2      SER   4   1.206  -5.977  -9.150
   31    HB3  SER   4           HB1      SER   4   2.211  -7.424  -9.133
   32    HG   SER   4           HG       SER   4   2.846  -5.841  -7.057
   33    H    ALA   5           HN       ALA   5   5.188  -5.128 -10.820
   34    HA   ALA   5           HA       ALA   5   3.600  -5.380 -13.263
   35    HB1  ALA   5           HB1      ALA   5   4.645  -3.192 -13.011
   36    HB2  ALA   5           HB2      ALA   5   5.338  -4.071 -14.378
   37    HB3  ALA   5           HB3      ALA   5   6.229  -3.959 -12.862
   38    H    CYS   6           HN       CYS   6   3.789  -7.665 -13.035
   39    HA   CYS   6           HA       CYS   6   6.402  -8.797 -13.489
   40    HB2  CYS   6           HB2      CYS   6   5.143 -10.973 -13.705
   41    HB3  CYS   6           HB1      CYS   6   4.966 -10.152 -12.162
   42    HA   PRO   7           HA       PRO   7   6.862 -10.974 -14.445
   43    HB2  PRO   7           HB2      PRO   7   8.910 -11.079 -16.493
   44    HB3  PRO   7           HB1      PRO   7   7.782 -12.344 -16.001
   45    HG2  PRO   7           HG2      PRO   7   7.672 -11.090 -18.427
   46    HG3  PRO   7           HG1      PRO   7   6.260 -11.799 -17.623
   47    HD2  PRO   7           HD2      PRO   7   7.133  -8.933 -17.738
   48    HD3  PRO   7           HD1      PRO   7   5.501  -9.620 -17.880
   49    HA   PRO   8           HA       PRO   8   8.127 -11.889 -13.461
   50    HB2  PRO   8           HB2      PRO   8  10.263 -12.600 -12.122
   51    HB3  PRO   8           HB1      PRO   8  10.404 -12.321 -13.864
   52    HG2  PRO   8           HG2      PRO   8  11.379 -10.641 -11.608
   53    HG3  PRO   8           HG1      PRO   8  12.006 -10.769 -13.263
   54    HD2  PRO   8           HD2      PRO   8  10.125  -8.822 -12.176
   55    HD3  PRO   8           HD1      PRO   8  10.868  -8.859 -13.790
   56    H    PHE   9           HN       PHE   9   7.100  -9.541 -11.961
   57    HA   PHE   9           HA       PHE   9   7.110 -10.695  -9.272
   58    HB2  PHE   9           HB2      PHE   9   7.821  -7.806  -9.817
   59    HB3  PHE   9           HB1      PHE   9   7.430  -8.445  -8.228
   60    HD1  PHE   9           HD1      PHE   9   8.901 -10.560  -7.547
   61    HD2  PHE   9           HD2      PHE   9  10.020  -7.597 -10.385
   62    HE1  PHE   9           HE1      PHE   9  11.268 -11.127  -7.199
   63    HE2  PHE   9           HE2      PHE   9  12.389  -8.163 -10.050
   64    HZ   PHE   9           HZ       PHE   9  13.017  -9.931  -8.454
   65    H    CYS  10           HN       CYS  10   4.957 -11.194  -9.227
   66    HA   CYS  10           HA       CYS  10   3.246  -9.027  -8.572
   67    HB2  CYS  10           HB2      CYS  10   1.443  -9.440 -10.207
   68    HB3  CYS  10           HB1      CYS  10   2.909  -8.846 -10.966
   69    HN1  NH2  11           H1       CYS  10   3.063 -10.012  -6.643
   70    HN2  NH2  11           H2       CYS  10   2.180 -11.478  -6.398
  Start of MODEL   21
    1    H1   GLY   1           HT1      GLY   1   5.044   5.460  -6.918
    2    H2   GLY   1           HT2      GLY   1   5.427   5.113  -5.313
    3    H3   GLY   1           HT3      GLY   1   4.182   6.201  -5.668
    4    HA2  GLY   1           HA1      GLY   1   3.267   4.088  -4.984
    5    HA3  GLY   1           HA2      GLY   1   2.871   4.451  -6.660
    6    H    PHE   2           HN       PHE   2   3.019   1.860  -5.302
    7    HA   PHE   2           HA       PHE   2   5.199   0.652  -6.859
    8    HB2  PHE   2           HB2      PHE   2   3.861  -0.416  -4.380
    9    HB3  PHE   2           HB1      PHE   2   5.139  -1.218  -5.278
   10    HD1  PHE   2           HD1      PHE   2   4.363   1.192  -2.737
   11    HD2  PHE   2           HD2      PHE   2   7.396  -0.131  -5.409
   12    HE1  PHE   2           HE1      PHE   2   6.054   2.364  -1.392
   13    HE2  PHE   2           HE2      PHE   2   9.090   1.035  -4.072
   14    HZ   PHE   2           HZ       PHE   2   8.423   2.286  -2.057
   15    H    ARG   3           HN       ARG   3   4.706  -0.833  -8.309
   16    HA   ARG   3           HA       ARG   3   1.958  -1.853  -8.428
   17    HB2  ARG   3           HB2      ARG   3   3.609  -0.790 -10.715
   18    HB3  ARG   3           HB1      ARG   3   2.173  -1.776 -10.937
   19    HG2  ARG   3           HG2      ARG   3   0.897  -0.039  -9.670
   20    HG3  ARG   3           HG1      ARG   3   2.346   0.970  -9.732
   21    HD2  ARG   3           HD2      ARG   3   0.861  -0.149 -12.104
   22    HD3  ARG   3           HD1      ARG   3   0.792   1.518 -11.537
   23    HE   ARG   3           HE       ARG   3   3.374   1.317 -11.955
   24   HH11  ARG   3          HH11      ARG   3   0.772   0.071 -13.965
   25   HH12  ARG   3          HH12      ARG   3   1.667   0.233 -15.433
   26   HH21  ARG   3          HH21      ARG   3   4.551   1.534 -13.918
   27   HH22  ARG   3          HH22      ARG   3   3.803   1.073 -15.412
   28    H    SER   4           HN       SER   4   1.731  -3.900  -9.359
   29    HA   SER   4           HA       SER   4   4.148  -5.489  -9.203
   30    HB2  SER   4           HB2      SER   4   1.247  -6.335  -9.361
   31    HB3  SER   4           HB1      SER   4   2.623  -7.409  -9.113
   32    HG   SER   4           HG       SER   4   2.180  -5.235  -7.375
   33    H    ALA   5           HN       ALA   5   4.881  -4.595 -11.166
   34    HA   ALA   5           HA       ALA   5   3.452  -5.312 -13.578
   35    HB1  ALA   5           HB1      ALA   5   5.117  -3.997 -14.764
   36    HB2  ALA   5           HB2      ALA   5   6.006  -3.745 -13.261
   37    HB3  ALA   5           HB3      ALA   5   4.390  -3.061 -13.455
   38    H    CYS   6           HN       CYS   6   3.742  -7.526 -13.153
   39    HA   CYS   6           HA       CYS   6   6.359  -8.655 -13.489
   40    HB2  CYS   6           HB2      CYS   6   5.016 -10.818 -13.736
   41    HB3  CYS   6           HB1      CYS   6   4.917  -9.982 -12.193
   42    HA   PRO   7           HA       PRO   7   6.741 -10.929 -14.325
   43    HB2  PRO   7           HB2      PRO   7   8.761 -11.389 -16.337
   44    HB3  PRO   7           HB1      PRO   7   7.492 -12.488 -15.793
   45    HG2  PRO   7           HG2      PRO   7   7.568 -11.358 -18.296
   46    HG3  PRO   7           HG1      PRO   7   6.084 -11.906 -17.500
   47    HD2  PRO   7           HD2      PRO   7   7.191  -9.131 -17.735
   48    HD3  PRO   7           HD1      PRO   7   5.511  -9.686 -17.869
   49    HA   PRO   8           HA       PRO   8   8.018 -11.925 -13.361
   50    HB2  PRO   8           HB2      PRO   8  10.141 -12.693 -12.035
   51    HB3  PRO   8           HB1      PRO   8  10.252 -12.497 -13.790
   52    HG2  PRO   8           HG2      PRO   8  11.382 -10.783 -11.639
   53    HG3  PRO   8           HG1      PRO   8  11.945 -11.007 -13.306
   54    HD2  PRO   8           HD2      PRO   8  10.193  -8.929 -12.238
   55    HD3  PRO   8           HD1      PRO   8  10.894  -9.056 -13.866
   56    H    PHE   9           HN       PHE   9   7.096  -9.512 -11.932
   57    HA   PHE   9           HA       PHE   9   7.207 -10.557  -9.200
   58    HB2  PHE   9           HB2      PHE   9   7.833  -7.681  -9.888
   59    HB3  PHE   9           HB1      PHE   9   7.522  -8.267  -8.260
   60    HD1  PHE   9           HD1      PHE   9   9.056 -10.327  -7.561
   61    HD2  PHE   9           HD2      PHE   9  10.006  -7.467 -10.562
   62    HE1  PHE   9           HE1      PHE   9  11.445 -10.849  -7.296
   63    HE2  PHE   9           HE2      PHE   9  12.395  -7.984 -10.308
   64    HZ   PHE   9           HZ       PHE   9  13.119  -9.678  -8.673
   65    H    CYS  10           HN       CYS  10   5.030 -11.200  -9.390
   66    HA   CYS  10           HA       CYS  10   3.262  -9.183  -8.453
   67    HB2  CYS  10           HB2      CYS  10   1.491  -9.339 -10.116
   68    HB3  CYS  10           HB1      CYS  10   2.970  -8.768 -10.866
   69    HN1  NH2  11           H1       CYS  10   2.467 -10.125  -6.771
   70    HN2  NH2  11           H2       CYS  10   1.916 -11.759  -6.676
  Start of MODEL   22
    1    H1   GLY   1           HT1      GLY   1   2.188   3.668  -2.465
    2    H2   GLY   1           HT2      GLY   1   0.663   3.006  -2.145
    3    H3   GLY   1           HT3      GLY   1   0.792   4.564  -2.788
    4    HA2  GLY   1           HA1      GLY   1   0.137   2.972  -4.469
    5    HA3  GLY   1           HA2      GLY   1   1.689   3.718  -4.822
    6    H    PHE   2           HN       PHE   2   0.118   0.892  -4.928
    7    HA   PHE   2           HA       PHE   2   2.478  -0.699  -4.228
    8    HB2  PHE   2           HB2      PHE   2  -0.359  -1.557  -4.774
    9    HB3  PHE   2           HB1      PHE   2   0.966  -2.655  -4.432
   10    HD1  PHE   2           HD1      PHE   2  -1.560  -0.541  -3.030
   11    HD2  PHE   2           HD2      PHE   2   2.126  -2.493  -2.210
   12    HE1  PHE   2           HE1      PHE   2  -1.984  -0.323  -0.619
   13    HE2  PHE   2           HE2      PHE   2   1.711  -2.281   0.197
   14    HZ   PHE   2           HZ       PHE   2  -0.348  -1.195   1.002
   15    H    ARG   3           HN       ARG   3   3.553  -1.825  -5.739
   16    HA   ARG   3           HA       ARG   3   2.521  -1.702  -8.483
   17    HB2  ARG   3           HB2      ARG   3   5.359  -1.129  -7.641
   18    HB3  ARG   3           HB1      ARG   3   4.829  -1.327  -9.304
   19    HG2  ARG   3           HG2      ARG   3   3.253   0.589  -8.907
   20    HG3  ARG   3           HG1      ARG   3   4.095   0.857  -7.379
   21    HD2  ARG   3           HD2      ARG   3   5.266   0.951 -10.156
   22    HD3  ARG   3           HD1      ARG   3   5.032   2.307  -9.055
   23    HE   ARG   3           HE       ARG   3   6.676   0.335  -7.867
   24   HH11  ARG   3          HH11      ARG   3   6.745   2.856 -10.296
   25   HH12  ARG   3          HH12      ARG   3   8.444   3.125 -10.145
   26   HH21  ARG   3          HH21      ARG   3   8.927   0.687  -7.674
   27   HH22  ARG   3          HH22      ARG   3   9.693   1.888  -8.656
   28    H    SER   4           HN       SER   4   2.751  -3.447  -9.665
   29    HA   SER   4           HA       SER   4   4.615  -5.537  -8.961
   30    HB2  SER   4           HB2      SER   4   1.627  -6.036  -9.001
   31    HB3  SER   4           HB1      SER   4   2.867  -7.285  -8.896
   32    HG   SER   4           HG       SER   4   3.237  -5.363  -7.025
   33    H    ALA   5           HN       ALA   5   5.446  -4.815 -10.978
   34    HA   ALA   5           HA       ALA   5   3.757  -5.301 -13.292
   35    HB1  ALA   5           HB1      ALA   5   5.408  -4.073 -14.571
   36    HB2  ALA   5           HB2      ALA   5   6.420  -3.908 -13.136
   37    HB3  ALA   5           HB3      ALA   5   4.842  -3.120 -13.199
   38    H    CYS   6           HN       CYS   6   3.932  -7.552 -12.928
   39    HA   CYS   6           HA       CYS   6   6.460  -8.799 -13.465
   40    HB2  CYS   6           HB2      CYS   6   5.143 -10.910 -13.546
   41    HB3  CYS   6           HB1      CYS   6   4.911  -9.997 -12.066
   42    HA   PRO   7           HA       PRO   7   6.814 -10.987 -14.398
   43    HB2  PRO   7           HB2      PRO   7   8.767 -11.236 -16.530
   44    HB3  PRO   7           HB1      PRO   7   7.620 -12.441 -15.942
   45    HG2  PRO   7           HG2      PRO   7   7.433 -11.268 -18.399
   46    HG3  PRO   7           HG1      PRO   7   6.034 -11.877 -17.497
   47    HD2  PRO   7           HD2      PRO   7   7.039  -9.063 -17.756
   48    HD3  PRO   7           HD1      PRO   7   5.372  -9.672 -17.806
   49    HA   PRO   8           HA       PRO   8   8.036 -11.902 -13.398
   50    HB2  PRO   8           HB2      PRO   8  10.147 -12.642 -12.023
   51    HB3  PRO   8           HB1      PRO   8  10.271 -12.487 -13.782
   52    HG2  PRO   8           HG2      PRO   8  11.407 -10.741 -11.665
   53    HG3  PRO   8           HG1      PRO   8  11.946 -10.966 -13.341
   54    HD2  PRO   8           HD2      PRO   8  10.177  -8.906 -12.243
   55    HD3  PRO   8           HD1      PRO   8  10.895  -9.002 -13.865
   56    H    PHE   9           HN       PHE   9   7.085  -9.468 -11.977
   57    HA   PHE   9           HA       PHE   9   7.161 -10.529  -9.247
   58    HB2  PHE   9           HB2      PHE   9   7.705  -7.629  -9.903
   59    HB3  PHE   9           HB1      PHE   9   7.452  -8.263  -8.285
   60    HD1  PHE   9           HD1      PHE   9   9.086 -10.225  -7.609
   61    HD2  PHE   9           HD2      PHE   9   9.841  -7.375 -10.676
   62    HE1  PHE   9           HE1      PHE   9  11.500 -10.658  -7.418
   63    HE2  PHE   9           HE2      PHE   9  12.249  -7.804 -10.490
   64    HZ   PHE   9           HZ       PHE   9  13.084  -9.449  -8.859
   65    H    CYS  10           HN       CYS  10   5.014 -11.173  -9.326
   66    HA   CYS  10           HA       CYS  10   3.215  -9.154  -8.502
   67    HB2  CYS  10           HB2      CYS  10   1.440  -9.401 -10.160
   68    HB3  CYS  10           HB1      CYS  10   2.908  -8.814 -10.916
   69    HN1  NH2  11           H1       CYS  10   2.562 -10.083  -6.746
   70    HN2  NH2  11           H2       CYS  10   1.973 -11.700  -6.600
  Start of MODEL   23
    1    H1   GLY   1           HT1      GLY   1   4.468  -1.467   1.546
    2    H2   GLY   1           HT2      GLY   1   5.604  -0.956   0.401
    3    H3   GLY   1           HT3      GLY   1   5.607  -2.556   0.932
    4    HA2  GLY   1           HA1      GLY   1   3.425  -2.908  -0.056
    5    HA3  GLY   1           HA2      GLY   1   3.471  -1.253  -0.646
    6    H    PHE   2           HN       PHE   2   3.768  -4.273  -1.673
    7    HA   PHE   2           HA       PHE   2   6.133  -3.923  -3.329
    8    HB2  PHE   2           HB2      PHE   2   4.165  -6.210  -3.151
    9    HB3  PHE   2           HB1      PHE   2   5.619  -6.209  -4.137
   10    HD1  PHE   2           HD1      PHE   2   4.240  -6.988  -0.966
   11    HD2  PHE   2           HD2      PHE   2   7.847  -5.866  -2.912
   12    HE1  PHE   2           HE1      PHE   2   5.534  -7.862   0.935
   13    HE2  PHE   2           HE2      PHE   2   9.147  -6.733  -1.018
   14    HZ   PHE   2           HZ       PHE   2   7.991  -7.736   0.912
   15    H    ARG   3           HN       ARG   3   6.104  -3.775  -5.558
   16    HA   ARG   3           HA       ARG   3   3.600  -2.784  -6.674
   17    HB2  ARG   3           HB2      ARG   3   6.425  -2.677  -7.728
   18    HB3  ARG   3           HB1      ARG   3   5.025  -2.046  -8.583
   19    HG2  ARG   3           HG2      ARG   3   4.604  -0.528  -6.669
   20    HG3  ARG   3           HG1      ARG   3   6.104  -1.100  -5.939
   21    HD2  ARG   3           HD2      ARG   3   5.846   0.257  -8.617
   22    HD3  ARG   3           HD1      ARG   3   6.416   1.016  -7.133
   23    HE   ARG   3           HE       ARG   3   7.927  -1.315  -7.849
   24   HH11  ARG   3          HH11      ARG   3   7.586   2.127  -8.454
   25   HH12  ARG   3          HH12      ARG   3   9.222   2.326  -8.962
   26   HH21  ARG   3          HH21      ARG   3  10.093  -1.039  -8.517
   27   HH22  ARG   3          HH22      ARG   3  10.659   0.521  -8.994
   28    H    SER   4           HN       SER   4   2.805  -3.542  -8.689
   29    HA   SER   4           HA       SER   4   3.415  -6.353  -9.096
   30    HB2  SER   4           HB2      SER   4   1.176  -6.229 -10.379
   31    HB3  SER   4           HB1      SER   4   1.149  -6.231  -8.612
   32    HG   SER   4           HG       SER   4   0.670  -4.125 -10.415
   33    H    ALA   5           HN       ALA   5   5.220  -5.877 -10.324
   34    HA   ALA   5           HA       ALA   5   4.541  -5.162 -13.084
   35    HB1  ALA   5           HB1      ALA   5   7.175  -4.686 -11.705
   36    HB2  ALA   5           HB2      ALA   5   6.005  -3.452 -12.184
   37    HB3  ALA   5           HB3      ALA   5   6.841  -4.409 -13.413
   38    H    CYS   6           HN       CYS   6   4.003  -7.400 -13.247
   39    HA   CYS   6           HA       CYS   6   6.396  -9.041 -13.499
   40    HB2  CYS   6           HB2      CYS   6   4.780 -10.949 -13.797
   41    HB3  CYS   6           HB1      CYS   6   4.810 -10.207 -12.206
   42    HA   PRO   7           HA       PRO   7   6.772 -10.938 -14.426
   43    HB2  PRO   7           HB2      PRO   7   8.720 -11.661 -16.129
   44    HB3  PRO   7           HB1      PRO   7   7.062 -12.247 -16.296
   45    HG2  PRO   7           HG2      PRO   7   8.488 -10.143 -17.839
   46    HG3  PRO   7           HG1      PRO   7   7.262 -11.298 -18.384
   47    HD2  PRO   7           HD2      PRO   7   6.824  -8.602 -17.701
   48    HD3  PRO   7           HD1      PRO   7   5.571  -9.845 -17.898
   49    HA   PRO   8           HA       PRO   8   7.954 -11.885 -13.399
   50    HB2  PRO   8           HB2      PRO   8  10.047 -12.699 -12.036
   51    HB3  PRO   8           HB1      PRO   8  10.172 -12.533 -13.794
   52    HG2  PRO   8           HG2      PRO   8  11.371 -10.845 -11.666
   53    HG3  PRO   8           HG1      PRO   8  11.889 -11.065 -13.347
   54    HD2  PRO   8           HD2      PRO   8  10.183  -8.971 -12.212
   55    HD3  PRO   8           HD1      PRO   8  10.899  -9.060 -13.835
   56    H    PHE   9           HN       PHE   9   7.081  -9.427 -11.956
   57    HA   PHE   9           HA       PHE   9   7.187 -10.495  -9.223
   58    HB2  PHE   9           HB2      PHE   9   7.772  -7.614  -9.918
   59    HB3  PHE   9           HB1      PHE   9   7.492  -8.206  -8.289
   60    HD1  PHE   9           HD1      PHE   9   9.050 -10.288  -7.652
   61    HD2  PHE   9           HD2      PHE   9   9.931  -7.344 -10.592
   62    HE1  PHE   9           HE1      PHE   9  11.446 -10.789  -7.431
   63    HE2  PHE   9           HE2      PHE   9  12.329  -7.842 -10.380
   64    HZ   PHE   9           HZ       PHE   9  13.090  -9.566  -8.798
   65    H    CYS  10           HN       CYS  10   5.003 -11.165  -9.466
   66    HA   CYS  10           HA       CYS  10   3.259  -9.197  -8.394
   67    HB2  CYS  10           HB2      CYS  10   1.472  -9.190 -10.011
   68    HB3  CYS  10           HB1      CYS  10   2.950  -8.691 -10.813
   69    HN1  NH2  11           H1       CYS  10   2.638 -10.281  -6.711
   70    HN2  NH2  11           H2       CYS  10   2.039 -11.902  -6.707
  Start of MODEL   24
    1    H1   GLY   1           HT1      GLY   1   6.802   0.822  -0.230
    2    H2   GLY   1           HT2      GLY   1   6.486  -0.810   0.074
    3    H3   GLY   1           HT3      GLY   1   5.514   0.382   0.769
    4    HA2  GLY   1           HA1      GLY   1   4.384  -0.651  -1.080
    5    HA3  GLY   1           HA2      GLY   1   4.719   1.045  -1.400
    6    H    PHE   2           HN       PHE   2   4.771  -1.931  -2.738
    7    HA   PHE   2           HA       PHE   2   6.789  -1.089  -4.699
    8    HB2  PHE   2           HB2      PHE   2   6.386  -3.874  -3.600
    9    HB3  PHE   2           HB1      PHE   2   7.329  -3.524  -5.042
   10    HD1  PHE   2           HD1      PHE   2   7.455  -3.978  -1.561
   11    HD2  PHE   2           HD2      PHE   2   9.227  -1.750  -4.722
   12    HE1  PHE   2           HE1      PHE   2   9.437  -3.575  -0.161
   13    HE2  PHE   2           HE2      PHE   2  11.211  -1.344  -3.328
   14    HZ   PHE   2           HZ       PHE   2  11.319  -2.257  -1.046
   15    H    ARG   3           HN       ARG   3   6.365  -1.641  -6.829
   16    HA   ARG   3           HA       ARG   3   3.543  -2.062  -7.376
   17    HB2  ARG   3           HB2      ARG   3   5.847  -1.183  -9.097
   18    HB3  ARG   3           HB1      ARG   3   4.219  -1.445  -9.709
   19    HG2  ARG   3           HG2      ARG   3   3.340   0.314  -8.397
   20    HG3  ARG   3           HG1      ARG   3   4.830   0.449  -7.462
   21    HD2  ARG   3           HD2      ARG   3   4.651   0.937 -10.416
   22    HD3  ARG   3           HD1      ARG   3   4.497   2.211  -9.206
   23    HE   ARG   3           HE       ARG   3   6.842   0.975  -8.576
   24   HH11  ARG   3          HH11      ARG   3   5.596   2.431 -11.511
   25   HH12  ARG   3          HH12      ARG   3   7.142   2.959 -12.066
   26   HH21  ARG   3          HH21      ARG   3   8.911   1.689  -9.312
   27   HH22  ARG   3          HH22      ARG   3   9.029   2.520 -10.824
   28    H    SER   4           HN       SER   4   2.752  -3.752  -8.602
   29    HA   SER   4           HA       SER   4   4.571  -5.998  -8.876
   30    HB2  SER   4           HB2      SER   4   2.324  -7.260  -9.121
   31    HB3  SER   4           HB1      SER   4   2.822  -6.713  -7.517
   32    HG   SER   4           HG       SER   4   0.748  -6.069  -7.723
   33    H    ALA   5           HN       ALA   5   5.417  -5.202 -10.769
   34    HA   ALA   5           HA       ALA   5   3.667  -5.414 -13.098
   35    HB1  ALA   5           HB1      ALA   5   6.325  -4.021 -12.869
   36    HB2  ALA   5           HB2      ALA   5   4.743  -3.239 -12.912
   37    HB3  ALA   5           HB3      ALA   5   5.335  -4.122 -14.323
   38    H    CYS   6           HN       CYS   6   3.820  -7.680 -12.939
   39    HA   CYS   6           HA       CYS   6   6.360  -8.914 -13.462
   40    HB2  CYS   6           HB2      CYS   6   4.960 -11.000 -13.818
   41    HB3  CYS   6           HB1      CYS   6   4.888 -10.272 -12.220
   42    HA   PRO   7           HA       PRO   7   6.844 -10.935 -14.405
   43    HB2  PRO   7           HB2      PRO   7   8.852 -11.569 -16.062
   44    HB3  PRO   7           HB1      PRO   7   7.223 -12.213 -16.299
   45    HG2  PRO   7           HG2      PRO   7   8.589  -9.952 -17.700
   46    HG3  PRO   7           HG1      PRO   7   7.556 -11.224 -18.374
   47    HD2  PRO   7           HD2      PRO   7   6.696  -8.668 -17.787
   48    HD3  PRO   7           HD1      PRO   7   5.634 -10.087 -17.870
   49    HA   PRO   8           HA       PRO   8   8.144 -11.879 -13.473
   50    HB2  PRO   8           HB2      PRO   8  10.264 -12.597 -12.113
   51    HB3  PRO   8           HB1      PRO   8  10.414 -12.335 -13.856
   52    HG2  PRO   8           HG2      PRO   8  11.392 -10.646 -11.612
   53    HG3  PRO   8           HG1      PRO   8  12.021 -10.789 -13.266
   54    HD2  PRO   8           HD2      PRO   8  10.158  -8.820 -12.193
   55    HD3  PRO   8           HD1      PRO   8  10.896  -8.876 -13.809
   56    H    PHE   9           HN       PHE   9   7.086  -9.563 -11.982
   57    HA   PHE   9           HA       PHE   9   7.102 -10.710  -9.296
   58    HB2  PHE   9           HB2      PHE   9   7.824  -7.822  -9.832
   59    HB3  PHE   9           HB1      PHE   9   7.433  -8.474  -8.250
   60    HD1  PHE   9           HD1      PHE   9   8.918 -10.552  -7.537
   61    HD2  PHE   9           HD2      PHE   9  10.019  -7.639 -10.436
   62    HE1  PHE   9           HE1      PHE   9  11.288 -11.104  -7.186
   63    HE2  PHE   9           HE2      PHE   9  12.391  -8.192 -10.095
   64    HZ   PHE   9           HZ       PHE   9  13.029  -9.925  -8.468
   65    H    CYS  10           HN       CYS  10   4.922 -11.198  -9.291
   66    HA   CYS  10           HA       CYS  10   3.273  -9.012  -8.537
   67    HB2  CYS  10           HB2      CYS  10   1.433  -9.303 -10.148
   68    HB3  CYS  10           HB1      CYS  10   2.907  -8.771 -10.938
   69    HN1  NH2  11           H1       CYS  10   3.395 -10.249  -6.661
   70    HN2  NH2  11           H2       CYS  10   2.378 -11.627  -6.435
  Start of MODEL   25
    1    H1   GLY   1           HT1      GLY   1   7.990   3.204  -3.508
    2    H2   GLY   1           HT2      GLY   1   8.614   2.175  -2.326
    3    H3   GLY   1           HT3      GLY   1   7.547   3.410  -1.891
    4    HA2  GLY   1           HA1      GLY   1   6.403   1.303  -1.888
    5    HA3  GLY   1           HA2      GLY   1   5.783   2.342  -3.166
    6    H    PHE   2           HN       PHE   2   5.741  -0.579  -2.974
    7    HA   PHE   2           HA       PHE   2   7.542  -1.271  -5.178
    8    HB2  PHE   2           HB2      PHE   2   6.107  -3.050  -3.212
    9    HB3  PHE   2           HB1      PHE   2   7.090  -3.629  -4.552
   10    HD1  PHE   2           HD1      PHE   2   7.105  -2.255  -1.212
   11    HD2  PHE   2           HD2      PHE   2   9.515  -3.187  -4.584
   12    HE1  PHE   2           HE1      PHE   2   9.115  -2.084   0.187
   13    HE2  PHE   2           HE2      PHE   2  11.530  -3.020  -3.193
   14    HZ   PHE   2           HZ       PHE   2  11.333  -2.470  -0.803
   15    H    ARG   3           HN       ARG   3   6.810  -2.188  -7.008
   16    HA   ARG   3           HA       ARG   3   3.914  -1.995  -7.478
   17    HB2  ARG   3           HB2      ARG   3   6.197  -1.624  -9.404
   18    HB3  ARG   3           HB1      ARG   3   4.493  -1.566  -9.824
   19    HG2  ARG   3           HG2      ARG   3   4.168   0.384  -8.481
   20    HG3  ARG   3           HG1      ARG   3   5.821   0.286  -7.869
   21    HD2  ARG   3           HD2      ARG   3   5.024   0.708 -10.735
   22    HD3  ARG   3           HD1      ARG   3   5.603   1.962  -9.637
   23    HE   ARG   3           HE       ARG   3   7.581   0.112  -9.568
   24   HH11  ARG   3          HH11      ARG   3   5.985   1.814 -12.183
   25   HH12  ARG   3          HH12      ARG   3   7.362   1.778 -13.225
   26   HH21  ARG   3          HH21      ARG   3   9.421   0.058 -10.956
   27   HH22  ARG   3          HH22      ARG   3   9.321   0.780 -12.524
   28    H    SER   4           HN       SER   4   2.963  -3.582  -8.773
   29    HA   SER   4           HA       SER   4   4.417  -6.094  -8.834
   30    HB2  SER   4           HB2      SER   4   1.473  -5.552  -9.289
   31    HB3  SER   4           HB1      SER   4   2.235  -7.138  -9.176
   32    HG   SER   4           HG       SER   4   2.094  -5.168  -7.125
   33    H    ALA   5           HN       ALA   5   5.688  -5.342 -10.553
   34    HA   ALA   5           HA       ALA   5   4.320  -5.187 -13.128
   35    HB1  ALA   5           HB1      ALA   5   7.120  -4.321 -12.421
   36    HB2  ALA   5           HB2      ALA   5   5.728  -3.258 -12.641
   37    HB3  ALA   5           HB3      ALA   5   6.361  -4.180 -14.006
   38    H    CYS   6           HN       CYS   6   4.060  -7.480 -12.991
   39    HA   CYS   6           HA       CYS   6   6.470  -9.002 -13.489
   40    HB2  CYS   6           HB2      CYS   6   4.900 -10.950 -13.710
   41    HB3  CYS   6           HB1      CYS   6   4.877 -10.152 -12.145
   42    HA   PRO   7           HA       PRO   7   6.796 -11.004 -14.479
   43    HB2  PRO   7           HB2      PRO   7   8.746 -11.633 -16.212
   44    HB3  PRO   7           HB1      PRO   7   7.096 -12.231 -16.412
   45    HG2  PRO   7           HG2      PRO   7   8.468  -9.960 -17.792
   46    HG3  PRO   7           HG1      PRO   7   7.385 -11.189 -18.468
   47    HD2  PRO   7           HD2      PRO   7   6.600  -8.637 -17.785
   48    HD3  PRO   7           HD1      PRO   7   5.504 -10.032 -17.857
   49    HA   PRO   8           HA       PRO   8   7.918 -11.885 -13.376
   50    HB2  PRO   8           HB2      PRO   8   9.992 -12.712 -12.004
   51    HB3  PRO   8           HB1      PRO   8  10.131 -12.562 -13.763
   52    HG2  PRO   8           HG2      PRO   8  11.322 -10.860 -11.640
   53    HG3  PRO   8           HG1      PRO   8  11.867 -11.118 -13.305
   54    HD2  PRO   8           HD2      PRO   8  10.183  -8.975 -12.244
   55    HD3  PRO   8           HD1      PRO   8  10.907  -9.122 -13.862
   56    H    PHE   9           HN       PHE   9   7.064  -9.416 -11.982
   57    HA   PHE   9           HA       PHE   9   7.213 -10.395  -9.214
   58    HB2  PHE   9           HB2      PHE   9   7.611  -7.509 -10.017
   59    HB3  PHE   9           HB1      PHE   9   7.427  -8.076  -8.366
   60    HD1  PHE   9           HD1      PHE   9   9.157  -9.964  -7.676
   61    HD2  PHE   9           HD2      PHE   9   9.710  -7.164 -10.831
   62    HE1  PHE   9           HE1      PHE   9  11.591 -10.276  -7.523
   63    HE2  PHE   9           HE2      PHE   9  12.143  -7.475 -10.687
   64    HZ   PHE   9           HZ       PHE   9  13.086  -9.031  -9.033
   65    H    CYS  10           HN       CYS  10   5.019 -11.171  -9.473
   66    HA   CYS  10           HA       CYS  10   3.245  -9.224  -8.400
   67    HB2  CYS  10           HB2      CYS  10   1.416  -9.329 -10.002
   68    HB3  CYS  10           HB1      CYS  10   2.861  -8.718 -10.786
   69    HN1  NH2  11           H1       CYS  10   2.857 -10.367  -6.667
   70    HN2  NH2  11           H2       CYS  10   2.198 -11.965  -6.643
  Start of MODEL   26
    1    H1   GLY   1           HT1      GLY   1   3.047   3.174  -1.844
    2    H2   GLY   1           HT2      GLY   1   1.486   2.649  -2.231
    3    H3   GLY   1           HT3      GLY   1   1.911   4.271  -2.446
    4    HA2  GLY   1           HA1      GLY   1   1.865   3.125  -4.553
    5    HA3  GLY   1           HA2      GLY   1   3.484   3.680  -4.151
    6    H    PHE   2           HN       PHE   2   1.385   0.911  -4.449
    7    HA   PHE   2           HA       PHE   2   3.713  -0.848  -4.121
    8    HB2  PHE   2           HB2      PHE   2   0.799  -1.595  -4.234
    9    HB3  PHE   2           HB1      PHE   2   2.134  -2.685  -3.904
   10    HD1  PHE   2           HD1      PHE   2  -0.330  -0.620  -2.467
   11    HD2  PHE   2           HD2      PHE   2   3.608  -2.099  -1.854
   12    HE1  PHE   2           HE1      PHE   2  -0.532  -0.147  -0.066
   13    HE2  PHE   2           HE2      PHE   2   3.416  -1.632   0.546
   14    HZ   PHE   2           HZ       PHE   2   1.341  -0.656   1.448
   15    H    ARG   3           HN       ARG   3   4.557  -1.773  -5.839
   16    HA   ARG   3           HA       ARG   3   3.053  -1.604  -8.353
   17    HB2  ARG   3           HB2      ARG   3   6.014  -1.254  -7.921
   18    HB3  ARG   3           HB1      ARG   3   5.271  -1.433  -9.504
   19    HG2  ARG   3           HG2      ARG   3   3.895   0.577  -9.015
   20    HG3  ARG   3           HG1      ARG   3   4.819   0.792  -7.530
   21    HD2  ARG   3           HD2      ARG   3   5.973   0.731 -10.315
   22    HD3  ARG   3           HD1      ARG   3   5.645   2.190  -9.384
   23    HE   ARG   3           HE       ARG   3   7.262   0.705  -7.767
   24   HH11  ARG   3          HH11      ARG   3   7.510   1.956 -11.035
   25   HH12  ARG   3          HH12      ARG   3   9.232   2.086 -11.002
   26   HH21  ARG   3          HH21      ARG   3   9.560   0.892  -7.707
   27   HH22  ARG   3          HH22      ARG   3  10.405   1.482  -9.097
   28    H    SER   4           HN       SER   4   2.806  -3.347  -9.509
   29    HA   SER   4           HA       SER   4   4.435  -5.708  -8.943
   30    HB2  SER   4           HB2      SER   4   1.439  -5.728  -9.401
   31    HB3  SER   4           HB1      SER   4   2.462  -7.124  -9.062
   32    HG   SER   4           HG       SER   4   2.972  -6.028  -7.028
   33    H    ALA   5           HN       ALA   5   5.579  -5.045 -10.824
   34    HA   ALA   5           HA       ALA   5   4.076  -5.195 -13.318
   35    HB1  ALA   5           HB1      ALA   5   6.830  -4.077 -12.824
   36    HB2  ALA   5           HB2      ALA   5   5.353  -3.140 -13.047
   37    HB3  ALA   5           HB3      ALA   5   5.993  -4.112 -14.374
   38    H    CYS   6           HN       CYS   6   3.987  -7.472 -13.049
   39    HA   CYS   6           HA       CYS   6   6.468  -8.882 -13.516
   40    HB2  CYS   6           HB2      CYS   6   5.053 -10.928 -13.559
   41    HB3  CYS   6           HB1      CYS   6   4.908 -10.001 -12.075
   42    HA   PRO   7           HA       PRO   7   6.843 -10.998 -14.429
   43    HB2  PRO   7           HB2      PRO   7   8.857 -11.549 -16.135
   44    HB3  PRO   7           HB1      PRO   7   7.254 -12.277 -16.303
   45    HG2  PRO   7           HG2      PRO   7   8.451  -9.970 -17.782
   46    HG3  PRO   7           HG1      PRO   7   7.459 -11.303 -18.400
   47    HD2  PRO   7           HD2      PRO   7   6.482  -8.797 -17.842
   48    HD3  PRO   7           HD1      PRO   7   5.496 -10.274 -17.805
   49    HA   PRO   8           HA       PRO   8   8.118 -11.887 -13.443
   50    HB2  PRO   8           HB2      PRO   8  10.250 -12.576 -12.118
   51    HB3  PRO   8           HB1      PRO   8  10.409 -12.270 -13.855
   52    HG2  PRO   8           HG2      PRO   8  11.289 -10.579 -11.557
   53    HG3  PRO   8           HG1      PRO   8  11.999 -10.723 -13.179
   54    HD2  PRO   8           HD2      PRO   8  10.077  -8.765 -12.217
   55    HD3  PRO   8           HD1      PRO   8  10.845  -8.855 -13.818
   56    H    PHE   9           HN       PHE   9   7.059  -9.529 -11.969
   57    HA   PHE   9           HA       PHE   9   7.108 -10.644  -9.268
   58    HB2  PHE   9           HB2      PHE   9   7.848  -7.782  -9.877
   59    HB3  PHE   9           HB1      PHE   9   7.391  -8.342  -8.278
   60    HD1  PHE   9           HD1      PHE   9   8.785 -10.465  -7.464
   61    HD2  PHE   9           HD2      PHE   9  10.068  -7.639 -10.366
   62    HE1  PHE   9           HE1      PHE   9  11.125 -11.065  -7.007
   63    HE2  PHE   9           HE2      PHE   9  12.408  -8.236  -9.921
   64    HZ   PHE   9           HZ       PHE   9  12.941  -9.952  -8.238
   65    H    CYS  10           HN       CYS  10   4.940 -11.202  -9.351
   66    HA   CYS  10           HA       CYS  10   3.241  -9.102  -8.467
   67    HB2  CYS  10           HB2      CYS  10   1.402  -9.359 -10.085
   68    HB3  CYS  10           HB1      CYS  10   2.857  -8.747 -10.853
   69    HN1  NH2  11           H1       CYS  10   3.306 -10.370  -6.640
   70    HN2  NH2  11           H2       CYS  10   2.377 -11.819  -6.495
  Start of MODEL   27
    1    H1   GLY   1           HT1      GLY   1   6.719   2.263  -0.925
    2    H2   GLY   1           HT2      GLY   1   7.765   1.209  -1.740
    3    H3   GLY   1           HT3      GLY   1   6.619   0.598  -0.664
    4    HA2  GLY   1           HA1      GLY   1   4.829   1.292  -2.078
    5    HA3  GLY   1           HA2      GLY   1   5.994   2.008  -3.181
    6    H    PHE   2           HN       PHE   2   4.021  -0.509  -2.915
    7    HA   PHE   2           HA       PHE   2   5.900  -2.431  -4.083
    8    HB2  PHE   2           HB2      PHE   2   3.135  -2.836  -2.964
    9    HB3  PHE   2           HB1      PHE   2   4.073  -4.094  -3.749
   10    HD1  PHE   2           HD1      PHE   2   3.439  -2.362  -0.679
   11    HD2  PHE   2           HD2      PHE   2   6.275  -4.763  -2.744
   12    HE1  PHE   2           HE1      PHE   2   4.519  -2.918   1.459
   13    HE2  PHE   2           HE2      PHE   2   7.359  -5.325  -0.617
   14    HZ   PHE   2           HZ       PHE   2   6.481  -4.403   1.493
   15    H    ARG   3           HN       ARG   3   5.720  -3.066  -6.098
   16    HA   ARG   3           HA       ARG   3   3.384  -2.230  -7.647
   17    HB2  ARG   3           HB2      ARG   3   6.262  -1.793  -8.402
   18    HB3  ARG   3           HB1      ARG   3   4.936  -1.697  -9.553
   19    HG2  ARG   3           HG2      ARG   3   3.929   0.089  -8.237
   20    HG3  ARG   3           HG1      ARG   3   5.277   0.009  -7.101
   21    HD2  ARG   3           HD2      ARG   3   5.447   0.695 -10.029
   22    HD3  ARG   3           HD1      ARG   3   5.577   1.832  -8.689
   23    HE   ARG   3           HE       ARG   3   7.494  -0.360  -8.770
   24   HH11  ARG   3          HH11      ARG   3   6.856   3.040  -9.358
   25   HH12  ARG   3          HH12      ARG   3   8.532   3.467  -9.414
   26   HH21  ARG   3          HH21      ARG   3   9.711   0.216  -8.865
   27   HH22  ARG   3          HH22      ARG   3  10.151   1.869  -9.147
   28    H    SER   4           HN       SER   4   2.518  -3.898  -8.576
   29    HA   SER   4           HA       SER   4   4.113  -6.302  -8.911
   30    HB2  SER   4           HB2      SER   4   1.116  -5.932  -9.004
   31    HB3  SER   4           HB1      SER   4   1.968  -7.469  -9.156
   32    HG   SER   4           HG       SER   4   1.197  -6.261  -6.938
   33    H    ALA   5           HN       ALA   5   5.170  -5.399 -10.684
   34    HA   ALA   5           HA       ALA   5   3.588  -5.464 -13.147
   35    HB1  ALA   5           HB1      ALA   5   5.374  -4.126 -14.177
   36    HB2  ALA   5           HB2      ALA   5   6.200  -4.052 -12.621
   37    HB3  ALA   5           HB3      ALA   5   4.617  -3.296 -12.817
   38    H    CYS   6           HN       CYS   6   3.784  -7.772 -12.991
   39    HA   CYS   6           HA       CYS   6   6.391  -8.885 -13.477
   40    HB2  CYS   6           HB2      CYS   6   5.027 -11.020 -13.918
   41    HB3  CYS   6           HB1      CYS   6   5.027 -10.366 -12.289
   42    HA   PRO   7           HA       PRO   7   6.898 -10.966 -14.529
   43    HB2  PRO   7           HB2      PRO   7   8.978 -11.027 -16.540
   44    HB3  PRO   7           HB1      PRO   7   7.809 -12.284 -16.138
   45    HG2  PRO   7           HG2      PRO   7   7.794 -10.891 -18.501
   46    HG3  PRO   7           HG1      PRO   7   6.353 -11.633 -17.783
   47    HD2  PRO   7           HD2      PRO   7   7.252  -8.773 -17.704
   48    HD3  PRO   7           HD1      PRO   7   5.619  -9.434 -17.930
   49    HA   PRO   8           HA       PRO   8   8.057 -11.877 -13.482
   50    HB2  PRO   8           HB2      PRO   8  10.140 -12.668 -12.095
   51    HB3  PRO   8           HB1      PRO   8  10.313 -12.416 -13.839
   52    HG2  PRO   8           HG2      PRO   8  11.373 -10.782 -11.599
   53    HG3  PRO   8           HG1      PRO   8  11.954 -10.903 -13.268
   54    HD2  PRO   8           HD2      PRO   8  10.123  -8.933 -12.100
   55    HD3  PRO   8           HD1      PRO   8  10.896  -8.917 -13.701
   56    H    PHE   9           HN       PHE   9   7.095  -9.499 -11.987
   57    HA   PHE   9           HA       PHE   9   7.086 -10.655  -9.293
   58    HB2  PHE   9           HB2      PHE   9   7.775  -7.769  -9.862
   59    HB3  PHE   9           HB1      PHE   9   7.403  -8.405  -8.269
   60    HD1  PHE   9           HD1      PHE   9   8.875 -10.553  -7.642
   61    HD2  PHE   9           HD2      PHE   9   9.967  -7.518 -10.408
   62    HE1  PHE   9           HE1      PHE   9  11.245 -11.119  -7.317
   63    HE2  PHE   9           HE2      PHE   9  12.334  -8.079 -10.097
   64    HZ   PHE   9           HZ       PHE   9  12.982  -9.882  -8.549
   65    H    CYS  10           HN       CYS  10   4.955 -11.169  -9.219
   66    HA   CYS  10           HA       CYS  10   3.230  -9.022  -8.528
   67    HB2  CYS  10           HB2      CYS  10   1.374  -9.579 -10.111
   68    HB3  CYS  10           HB1      CYS  10   2.773  -8.855 -10.886
   69    HN1  NH2  11           H1       CYS  10   3.290 -10.087  -6.584
   70    HN2  NH2  11           H2       CYS  10   2.414 -11.550  -6.302
  Start of MODEL   28
    1    H1   GLY   1           HT1      GLY   1   5.011   5.563  -6.879
    2    H2   GLY   1           HT2      GLY   1   5.779   5.298  -5.399
    3    H3   GLY   1           HT3      GLY   1   4.429   6.306  -5.476
    4    HA2  GLY   1           HA1      GLY   1   3.856   4.164  -4.541
    5    HA3  GLY   1           HA2      GLY   1   3.023   4.460  -6.061
    6    H    PHE   2           HN       PHE   2   3.919   1.963  -4.600
    7    HA   PHE   2           HA       PHE   2   5.815   0.825  -6.487
    8    HB2  PHE   2           HB2      PHE   2   4.502  -0.370  -4.043
    9    HB3  PHE   2           HB1      PHE   2   5.702  -1.186  -5.036
   10    HD1  PHE   2           HD1      PHE   2   5.177   0.901  -2.229
   11    HD2  PHE   2           HD2      PHE   2   7.975   0.011  -5.306
   12    HE1  PHE   2           HE1      PHE   2   6.975   1.913  -0.888
   13    HE2  PHE   2           HE2      PHE   2   9.774   1.017  -3.970
   14    HZ   PHE   2           HZ       PHE   2   9.275   1.971  -1.755
   15    H    ARG   3           HN       ARG   3   5.387  -0.876  -7.842
   16    HA   ARG   3           HA       ARG   3   2.583  -1.668  -8.181
   17    HB2  ARG   3           HB2      ARG   3   4.402  -0.592 -10.324
   18    HB3  ARG   3           HB1      ARG   3   2.930  -1.486 -10.667
   19    HG2  ARG   3           HG2      ARG   3   1.591   0.208  -9.620
   20    HG3  ARG   3           HG1      ARG   3   3.034   1.067  -9.078
   21    HD2  ARG   3           HD2      ARG   3   2.298   0.557 -11.945
   22    HD3  ARG   3           HD1      ARG   3   1.998   2.067 -11.083
   23    HE   ARG   3           HE       ARG   3   4.698   1.492 -10.812
   24   HH11  ARG   3          HH11      ARG   3   2.488   2.235 -13.422
   25   HH12  ARG   3          HH12      ARG   3   3.685   2.983 -14.412
   26   HH21  ARG   3          HH21      ARG   3   6.300   2.491 -12.095
   27   HH22  ARG   3          HH22      ARG   3   5.890   3.132 -13.648
   28    H    SER   4           HN       SER   4   2.305  -3.687  -9.185
   29    HA   SER   4           HA       SER   4   4.667  -5.386  -9.076
   30    HB2  SER   4           HB2      SER   4   1.739  -6.140  -9.083
   31    HB3  SER   4           HB1      SER   4   3.096  -7.246  -8.883
   32    HG   SER   4           HG       SER   4   3.514  -5.459  -7.087
   33    H    ALA   5           HN       ALA   5   5.348  -4.592 -11.080
   34    HA   ALA   5           HA       ALA   5   3.760  -5.221 -13.418
   35    HB1  ALA   5           HB1      ALA   5   6.419  -3.830 -13.214
   36    HB2  ALA   5           HB2      ALA   5   4.846  -3.043 -13.361
   37    HB3  ALA   5           HB3      ALA   5   5.469  -4.039 -14.682
   38    H    CYS   6           HN       CYS   6   3.916  -7.453 -13.045
   39    HA   CYS   6           HA       CYS   6   6.466  -8.713 -13.498
   40    HB2  CYS   6           HB2      CYS   6   5.155 -10.837 -13.520
   41    HB3  CYS   6           HB1      CYS   6   4.933  -9.882 -12.067
   42    HA   PRO   7           HA       PRO   7   6.784 -10.991 -14.370
   43    HB2  PRO   7           HB2      PRO   7   8.759 -11.284 -16.481
   44    HB3  PRO   7           HB1      PRO   7   7.612 -12.477 -15.873
   45    HG2  PRO   7           HG2      PRO   7   7.436 -11.369 -18.357
   46    HG3  PRO   7           HG1      PRO   7   6.029 -11.949 -17.447
   47    HD2  PRO   7           HD2      PRO   7   7.046  -9.148 -17.776
   48    HD3  PRO   7           HD1      PRO   7   5.376  -9.750 -17.815
   49    HA   PRO   8           HA       PRO   8   8.016 -11.916 -13.368
   50    HB2  PRO   8           HB2      PRO   8  10.136 -12.636 -11.981
   51    HB3  PRO   8           HB1      PRO   8  10.238 -12.534 -13.743
   52    HG2  PRO   8           HG2      PRO   8  11.445 -10.758 -11.701
   53    HG3  PRO   8           HG1      PRO   8  11.918 -11.003 -13.391
   54    HD2  PRO   8           HD2      PRO   8  10.188  -8.928 -12.248
   55    HD3  PRO   8           HD1      PRO   8  10.880  -9.027 -13.883
   56    H    PHE   9           HN       PHE   9   7.089  -9.463 -11.975
   57    HA   PHE   9           HA       PHE   9   7.195 -10.474  -9.217
   58    HB2  PHE   9           HB2      PHE   9   7.634  -7.570  -9.943
   59    HB3  PHE   9           HB1      PHE   9   7.450  -8.191  -8.311
   60    HD1  PHE   9           HD1      PHE   9   9.163 -10.165  -7.741
   61    HD2  PHE   9           HD2      PHE   9   9.742  -7.165 -10.702
   62    HE1  PHE   9           HE1      PHE   9  11.594 -10.510  -7.614
   63    HE2  PHE   9           HE2      PHE   9  12.172  -7.509 -10.580
   64    HZ   PHE   9           HZ       PHE   9  13.102  -9.184  -9.036
   65    H    CYS  10           HN       CYS  10   5.041 -11.193  -9.336
   66    HA   CYS  10           HA       CYS  10   3.223  -9.201  -8.471
   67    HB2  CYS  10           HB2      CYS  10   1.430  -9.473 -10.120
   68    HB3  CYS  10           HB1      CYS  10   2.877  -8.814 -10.861
   69    HN1  NH2  11           H1       CYS  10   2.888 -10.278  -6.665
   70    HN2  NH2  11           H2       CYS  10   2.169 -11.845  -6.569