*HEADER    CYTOKINE                                10-JUL-18   6E1L              
*TITLE     GRN3ALA                                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: GRANULIN;                                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: OPISTHORCHIS VIVERRINI;                         
*SOURCE   4 ORGANISM_TAXID: 6198                                                 
*KEYWDS    WOUND HEALING AGENT, GRANULIN, STRUCTURE FROM CYANA 3.97, CYTOKINE    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    15                                                                    
*AUTHOR    M.DASTPEYMAN,P.BANSAL,D.WILSON,J.SOTILLO,P.BRINDLEY,A.LOUKAS,M.SMOUT, 
*AUTHOR   2 N.DALY                                                               
*REVDAT   1   06-FEB-19 6E1L    0                                                
# Restraints file 1: hbond.upl
3 ASP O 6 TYR H 2.2
3 ASP O 6 TYR N 3.2
8 CYSS O 12 GLN H 2.2
8 CYSS O 12 GLN N 3.2
22 GLY O 15 CYSS H 2.2
22 GLY O 15 CYSS N 3.2
13 THR O  24 CYSS H 2.2
13 THR O  24 CYSS N 3.2
4 ALA O  8 CYSS H 2.2
4 ALA O  8 CYSS N 3.2
5 VAL O  9 ARG H 2.2
5 VAL O  9 ARG N 3.2
15 CYSS  O  22 GLY H 2.2
15 CYSS  O  22 GLY N 3.2

# Restraints file 2: GRN3ALA.aco

# Phi/Psi Angles From 'Strong' TALOS-N Predictions: 
#    error margins are set to conservative default values of double the 
#    standard deviation observed in TALOS-N capped at a minimum of +/-20 degree.
   2   ALA  PHI     -79.9   -39.9
   2   ALA  PSI     -52.8   -12.8
   3   ASP  PHI     -84.1   -44.1
   3   ASP  PSI     -57.3   -17.3
   4   ALA  PHI     -87.6   -47.6
   4   ALA  PSI     -60.0   -20.0
   5   VAL  PHI     -85.5   -45.5
   5   VAL  PSI     -60.4   -20.4
   6   TYR  PHI     -85.5   -45.5
   6   TYR  PSI     -62.7   -22.7
   7   THR  PHI     -86.0   -46.0
   7   THR  PSI     -57.4   -17.4
   8   CYSS  PHI     -86.3   -46.3
   8   CYSS  PSI     -57.0   -17.0
   9   ARG  PHI     -91.4   -51.4
   9   ARG  PSI     -59.1   -19.1
  10   ALA  PHI     -95.6   -55.6
  10   ALA  PSI     -52.9   -12.9
  12   GLN  PHI    -160.7  -114.4
  12   GLN  PSI     134.9   174.9
  13   THR  PHI    -168.1  -115.7
  13   THR  PSI     121.9   166.2
  14   CYSS  PHI    -160.9   -54.6
  14   CYSS  PSI     107.6   163.8
  15   CYSS  PHI    -192.7   -68.4
  15   CYSS  PSI     127.4   176.3
  17   GLY  PHI     -81.6   -41.6
  18   LEU  PHI     -87.2   -47.2
  18   LEU  PSI     -62.4   -22.4
 19   HIS  PHI     -84.4   -44.4
  19   HIS  PSI     -57.5   -17.5
   20   GLY  PSI     -50.8   -10.8
  21   TYR  PHI    -130.3   -81.1
    23   CYSS  PHI    -111.3   -48.5
  23   CYSS  PSI     125.2   167.1

# Phi/Psi Angles From 'Generous' TALOS-N Predictions: 
#    error margins are set to default values of triple the standard
#    deviation observed in TALOS-N capped at a minimum of +/-30 degree.
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   CYS   1           H        CYS   1   1.807   0.001   0.856
    2    HA   CYS   1           HA       CYS   1   1.867   0.912  -1.771
    3    HB2  CYS   1           HB2      CYS   1   4.137  -0.133  -1.869
    4    HB3  CYS   1           HB3      CYS   1   3.880   0.878  -0.451
    5    H    ALA   2           H        ALA   2  -0.206  -0.611  -2.106
    6    HA   ALA   2           HA       ALA   2   0.190  -3.307  -2.799
    7    HB1  ALA   2           HB1      ALA   2  -1.897  -2.487  -4.391
    8    HB2  ALA   2           HB2      ALA   2  -2.027  -3.064  -2.729
    9    HB3  ALA   2           HB3      ALA   2  -1.935  -1.334  -3.057
   10    H    ASP   3           H        ASP   3   0.255  -0.352  -4.762
   11    HA   ASP   3           HA       ASP   3   0.678  -1.637  -7.241
   12    HB2  ASP   3           HB2      ASP   3   1.193   1.166  -6.262
   13    HB3  ASP   3           HB3      ASP   3   1.595   0.669  -7.903
   14    H    ALA   4           H        ALA   4   2.938  -0.139  -4.942
   15    HA   ALA   4           HA       ALA   4   5.303  -0.463  -6.322
   16    HB1  ALA   4           HB1      ALA   4   5.639  -1.078  -3.509
   17    HB2  ALA   4           HB2      ALA   4   6.216   0.304  -4.441
   18    HB3  ALA   4           HB3      ALA   4   4.587   0.315  -3.765
   19    H    VAL   5           H        VAL   5   3.411  -2.856  -4.609
   20    HA   VAL   5           HA       VAL   5   5.215  -4.900  -4.240
   21    HB   VAL   5           HB       VAL   5   2.353  -5.188  -5.166
   22   HG11  VAL   5          HG11      VAL   5   3.515  -7.267  -5.456
   23   HG12  VAL   5          HG12      VAL   5   4.228  -7.145  -3.846
   24   HG13  VAL   5          HG13      VAL   5   2.491  -7.394  -4.026
   25   HG21  VAL   5          HG21      VAL   5   3.582  -4.463  -2.599
   26   HG22  VAL   5          HG22      VAL   5   1.955  -4.154  -3.207
   27   HG23  VAL   5          HG23      VAL   5   2.352  -5.724  -2.507
   28    H    TYR   6           H        TYR   6   3.647  -3.875  -7.212
   29    HA   TYR   6           HA       TYR   6   4.140  -6.025  -8.867
   30    HB2  TYR   6           HB2      TYR   6   3.896  -3.087  -9.301
   31    HB3  TYR   6           HB3      TYR   6   4.504  -4.065 -10.632
   32    HD1  TYR   6           HD1      TYR   6   3.075  -5.946 -11.508
   33    HD2  TYR   6           HD2      TYR   6   1.595  -3.041  -8.775
   34    HE1  TYR   6           HE1      TYR   6   0.772  -6.556 -12.117
   35    HE2  TYR   6           HE2      TYR   6  -0.713  -3.644  -9.375
   36    HH   TYR   6           HH       TYR   6  -1.407  -5.877 -11.993
   37    H    THR   7           H        THR   7   6.232  -3.143  -8.628
   38    HA   THR   7           HA       THR   7   8.404  -4.414  -9.967
   39    HB   THR   7           HB       THR   7   8.922  -2.052  -8.233
   40    HG1  THR   7           HG1      THR   7   7.109  -2.107 -10.409
   41   HG21  THR   7          HG21      THR   7  10.224  -3.334 -10.320
   42   HG22  THR   7          HG22      THR   7  10.616  -1.746  -9.660
   43   HG23  THR   7          HG23      THR   7   9.554  -1.882 -11.062
   44    H    CYS   8           H        CYS   8   7.651  -3.725  -6.581
   45    HA   CYS   8           HA       CYS   8  10.052  -4.413  -5.394
   46    HB2  CYS   8           HB2      CYS   8   7.223  -4.338  -4.540
   47    HB3  CYS   8           HB3      CYS   8   8.283  -5.348  -3.563
   48    H    ARG   9           H        ARG   9   7.485  -6.488  -6.598
   49    HA   ARG   9           HA       ARG   9   8.163  -8.910  -5.465
   50    HB2  ARG   9           HB2      ARG   9   6.908  -8.118  -8.054
   51    HB3  ARG   9           HB3      ARG   9   7.376  -9.798  -7.834
   52    HG2  ARG   9           HG2      ARG   9   5.753  -8.452  -5.729
   53    HG3  ARG   9           HG3      ARG   9   4.974  -8.998  -7.216
   54    HD2  ARG   9           HD2      ARG   9   4.735 -10.871  -5.924
   55    HD3  ARG   9           HD3      ARG   9   6.283 -11.218  -6.693
   56    HE   ARG   9           HE       ARG   9   6.575  -9.831  -4.209
   57   HH11  ARG   9          HH11      ARG   9   6.079 -12.957  -5.658
   58   HH12  ARG   9          HH12      ARG   9   6.764 -13.828  -4.326
   59   HH21  ARG   9          HH21      ARG   9   7.479 -10.965  -2.449
   60   HH22  ARG   9          HH22      ARG   9   7.559 -12.694  -2.501
   61    H    ALA  10           H        ALA  10   9.675  -7.224  -8.147
   62    HA   ALA  10           HA       ALA  10  11.245  -9.256  -9.206
   63    HB1  ALA  10           HB1      ALA  10  12.329  -7.630 -10.374
   64    HB2  ALA  10           HB2      ALA  10  10.916  -6.709  -9.856
   65    HB3  ALA  10           HB3      ALA  10  12.441  -6.549  -8.985
   66    H    GLY  11           H        GLY  11  11.966  -7.040  -6.520
   67    HA2  GLY  11           HA2      GLY  11  13.270  -8.721  -4.849
   68    HA3  GLY  11           HA3      GLY  11  14.518  -8.299  -6.013
   69    H    GLN  12           H        GLN  12  11.985  -6.602  -4.158
   70    HA   GLN  12           HA       GLN  12  14.025  -4.843  -3.045
   71    HB2  GLN  12           HB2      GLN  12  11.577  -3.660  -4.344
   72    HB3  GLN  12           HB3      GLN  12  12.996  -2.817  -3.737
   73    HG2  GLN  12           HG2      GLN  12  14.315  -4.026  -5.520
   74    HG3  GLN  12           HG3      GLN  12  12.764  -4.518  -6.199
   75   HE21  GLN  12          HE21      GLN  12  14.927  -1.868  -5.603
   76   HE22  GLN  12          HE22      GLN  12  14.148  -0.730  -6.643
   77    H    THR  13           H        THR  13  12.866  -3.205  -1.504
   78    HA   THR  13           HA       THR  13  10.842  -4.720   0.012
   79    HB   THR  13           HB       THR  13  12.513  -2.658   1.369
   80    HG1  THR  13           HG1      THR  13  13.413  -5.246   0.595
   81   HG21  THR  13          HG21      THR  13  10.952  -3.597   2.809
   82   HG22  THR  13          HG22      THR  13  12.387  -4.573   3.127
   83   HG23  THR  13          HG23      THR  13  11.106  -5.200   2.091
   84    H    CYS  14           H        CYS  14   9.254  -3.494   1.178
   85    HA   CYS  14           HA       CYS  14   8.472  -1.085  -0.263
   86    HB2  CYS  14           HB2      CYS  14   7.084  -3.243   1.027
   87    HB3  CYS  14           HB3      CYS  14   6.563  -1.714   1.727
   88    H    CYS  15           H        CYS  15   9.340   0.743   0.480
   89    HA   CYS  15           HA       CYS  15   9.470   1.143   3.396
   90    HB2  CYS  15           HB2      CYS  15  11.065   2.641   1.314
   91    HB3  CYS  15           HB3      CYS  15  11.311   2.636   3.057
   92    H    ARG  16           H        ARG  16   9.466   3.620   3.907
   93    HA   ARG  16           HA       ARG  16   7.009   4.673   2.727
   94    HB2  ARG  16           HB2      ARG  16   8.486   5.147   5.287
   95    HB3  ARG  16           HB3      ARG  16   7.382   6.379   4.690
   96    HG2  ARG  16           HG2      ARG  16   5.625   4.567   4.576
   97    HG3  ARG  16           HG3      ARG  16   6.750   3.553   5.483
   98    HD2  ARG  16           HD2      ARG  16   5.901   6.280   6.425
   99    HD3  ARG  16           HD3      ARG  16   5.004   4.816   6.829
  100    HE   ARG  16           HE       ARG  16   7.533   4.217   7.576
  101   HH11  ARG  16          HH11      ARG  16   5.408   6.891   8.251
  102   HH12  ARG  16          HH12      ARG  16   6.078   7.196   9.820
  103   HH21  ARG  16          HH21      ARG  16   8.424   4.610   9.639
  104   HH22  ARG  16          HH22      ARG  16   7.794   5.899  10.608
  105    H    GLY  17           H        GLY  17   7.804   5.480   0.765
  106    HA2  GLY  17           HA2      GLY  17  10.056   7.120   0.462
  107    HA3  GLY  17           HA3      GLY  17   8.680   7.078  -0.630
  108    H    LEU  18           H        LEU  18   9.445   9.424  -0.719
  109    HA   LEU  18           HA       LEU  18   8.957  11.169   1.440
  110    HB2  LEU  18           HB2      LEU  18   9.138  12.948  -0.152
  111    HB3  LEU  18           HB3      LEU  18  10.341  11.717  -0.530
  112    HG   LEU  18           HG       LEU  18   8.431  10.918  -2.201
  113   HD11  LEU  18          HD11      LEU  18   7.975  13.726  -2.758
  114   HD12  LEU  18          HD12      LEU  18   7.296  13.233  -1.207
  115   HD13  LEU  18          HD13      LEU  18   6.831  12.386  -2.682
  116   HD21  LEU  18          HD21      LEU  18  10.044  13.302  -3.013
  117   HD22  LEU  18          HD22      LEU  18   9.707  11.818  -3.906
  118   HD23  LEU  18          HD23      LEU  18  10.847  11.798  -2.559
  119    H    HIS  19           H        HIS  19   6.924  10.017  -1.199
  120    HA   HIS  19           HA       HIS  19   4.717  11.727  -0.532
  121    HB2  HIS  19           HB2      HIS  19   5.292  10.632  -2.819
  122    HB3  HIS  19           HB3      HIS  19   4.468   9.218  -2.167
  123    HD1  HIS  19           HD1      HIS  19   2.016   9.153  -2.516
  124    HD2  HIS  19           HD2      HIS  19   3.526  13.013  -2.811
  125    HE1  HIS  19           HE1      HIS  19   0.070  10.585  -3.215
  126    H    GLY  20           H        GLY  20   5.459   8.279  -0.087
  127    HA2  GLY  20           HA2      GLY  20   4.366   7.979   2.413
  128    HA3  GLY  20           HA3      GLY  20   3.021   7.733   1.309
  129    H    TYR  21           H        TYR  21   4.203   6.387  -0.762
  130    HA   TYR  21           HA       TYR  21   5.355   3.990   0.495
  131    HB2  TYR  21           HB2      TYR  21   3.006   4.175  -1.375
  132    HB3  TYR  21           HB3      TYR  21   3.965   2.704  -1.266
  133    HD1  TYR  21           HD1      TYR  21   0.991   3.901  -0.291
  134    HD2  TYR  21           HD2      TYR  21   4.509   2.309   1.496
  135    HE1  TYR  21           HE1      TYR  21  -0.328   3.193   1.660
  136    HE2  TYR  21           HE2      TYR  21   3.199   1.596   3.452
  137    HH   TYR  21           HH       TYR  21  -0.151   1.465   3.473
  138    H    GLY  22           H        GLY  22   7.003   3.044  -0.585
  139    HA2  GLY  22           HA2      GLY  22   7.435   3.341  -3.388
  140    HA3  GLY  22           HA3      GLY  22   8.483   4.414  -2.472
  141    H    CYS  23           H        CYS  23   8.792   1.817  -4.129
  142    HA   CYS  23           HA       CYS  23   9.817  -0.125  -2.317
  143    HB2  CYS  23           HB2      CYS  23  10.025   0.259  -5.296
  144    HB3  CYS  23           HB3      CYS  23  10.893  -1.034  -4.474
  145    H    CYS  24           H        CYS  24  11.905  -0.579  -1.718
  146    HA   CYS  24           HA       CYS  24  13.793   1.628  -1.999
  147    HB2  CYS  24           HB2      CYS  24  13.467  -0.654  -0.107
  148    HB3  CYS  24           HB3      CYS  24  15.084   0.004  -0.336
  Start of MODEL    2
    1    H1   CYS   1           H        CYS   1   0.867  -0.640   1.536
    2    HA   CYS   1           HA       CYS   1   1.399  -0.293  -0.738
    3    HB2  CYS   1           HB2      CYS   1   3.755  -1.221  -1.003
    4    HB3  CYS   1           HB3      CYS   1   3.472  -0.202   0.405
    5    H    ALA   2           H        ALA   2  -0.497  -1.798  -1.367
    6    HA   ALA   2           HA       ALA   2   0.082  -4.432  -2.253
    7    HB1  ALA   2           HB1      ALA   2  -2.162  -4.188  -1.940
    8    HB2  ALA   2           HB2      ALA   2  -2.183  -2.536  -2.558
    9    HB3  ALA   2           HB3      ALA   2  -2.083  -3.895  -3.677
   10    H    ASP   3           H        ASP   3  -0.362  -1.375  -4.033
   11    HA   ASP   3           HA       ASP   3   0.250  -2.398  -6.572
   12    HB2  ASP   3           HB2      ASP   3  -0.856  -0.252  -6.309
   13    HB3  ASP   3           HB3      ASP   3   0.554   0.408  -5.487
   14    H    ALA   4           H        ALA   4   2.304  -0.896  -4.109
   15    HA   ALA   4           HA       ALA   4   4.676  -0.671  -5.498
   16    HB1  ALA   4           HB1      ALA   4   3.893  -0.360  -2.876
   17    HB2  ALA   4           HB2      ALA   4   5.092  -1.651  -2.791
   18    HB3  ALA   4           HB3      ALA   4   5.517  -0.099  -3.513
   19    H    VAL   5           H        VAL   5   3.161  -3.537  -4.181
   20    HA   VAL   5           HA       VAL   5   5.242  -5.335  -4.105
   21    HB   VAL   5           HB       VAL   5   2.432  -5.877  -5.077
   22   HG11  VAL   5          HG11      VAL   5   4.689  -7.679  -4.274
   23   HG12  VAL   5          HG12      VAL   5   3.009  -8.192  -4.110
   24   HG13  VAL   5          HG13      VAL   5   3.650  -7.764  -5.696
   25   HG21  VAL   5          HG21      VAL   5   2.989  -6.768  -2.411
   26   HG22  VAL   5          HG22      VAL   5   3.362  -5.050  -2.554
   27   HG23  VAL   5          HG23      VAL   5   1.754  -5.641  -2.974
   28    H    TYR   6           H        TYR   6   3.463  -4.161  -6.907
   29    HA   TYR   6           HA       TYR   6   4.277  -5.944  -8.847
   30    HB2  TYR   6           HB2      TYR   6   3.522  -3.061  -8.865
   31    HB3  TYR   6           HB3      TYR   6   4.254  -3.727 -10.320
   32    HD1  TYR   6           HD1      TYR   6   3.144  -5.666 -11.467
   33    HD2  TYR   6           HD2      TYR   6   1.264  -3.510  -8.318
   34    HE1  TYR   6           HE1      TYR   6   0.965  -6.577 -12.153
   35    HE2  TYR   6           HE2      TYR   6  -0.920  -4.415  -8.994
   36    HH   TYR   6           HH       TYR   6  -1.207  -6.679 -11.718
   37    H    THR   7           H        THR   7   5.846  -2.803  -8.206
   38    HA   THR   7           HA       THR   7   8.161  -3.444  -9.724
   39    HB   THR   7           HB       THR   7   9.140  -1.401  -8.752
   40    HG1  THR   7           HG1      THR   7   6.728  -1.279  -7.233
   41   HG21  THR   7          HG21      THR   7   7.699   0.131  -9.806
   42   HG22  THR   7          HG22      THR   7   6.267  -0.830  -9.433
   43   HG23  THR   7          HG23      THR   7   7.419  -1.395 -10.643
   44    H    CYS   8           H        CYS   8   7.337  -3.659  -6.313
   45    HA   CYS   8           HA       CYS   8   9.885  -4.078  -5.252
   46    HB2  CYS   8           HB2      CYS   8   7.108  -4.612  -4.401
   47    HB3  CYS   8           HB3      CYS   8   8.334  -5.616  -3.634
   48    H    ARG   9           H        ARG   9   7.647  -6.299  -6.808
   49    HA   ARG   9           HA       ARG   9   8.753  -8.737  -6.143
   50    HB2  ARG   9           HB2      ARG   9   7.312  -7.722  -8.559
   51    HB3  ARG   9           HB3      ARG   9   8.019  -9.332  -8.602
   52    HG2  ARG   9           HG2      ARG   9   6.244  -8.539  -6.336
   53    HG3  ARG   9           HG3      ARG   9   5.552  -9.031  -7.883
   54    HD2  ARG   9           HD2      ARG   9   5.638 -11.053  -6.814
   55    HD3  ARG   9           HD3      ARG   9   7.212 -11.051  -7.609
   56    HE   ARG   9           HE       ARG   9   7.228  -9.955  -4.945
   57   HH11  ARG   9          HH11      ARG   9   7.517 -12.835  -6.879
   58   HH12  ARG   9          HH12      ARG   9   8.421 -13.705  -5.684
   59   HH21  ARG   9          HH21      ARG   9   8.417 -11.090  -3.363
   60   HH22  ARG   9          HH22      ARG   9   8.931 -12.712  -3.684
   61    H    ALA  10           H        ALA  10   9.853  -6.377  -8.503
   62    HA   ALA  10           HA       ALA  10  11.698  -7.900  -9.915
   63    HB1  ALA  10           HB1      ALA  10  11.053  -5.628 -10.549
   64    HB2  ALA  10           HB2      ALA  10  11.926  -4.990  -9.155
   65    HB3  ALA  10           HB3      ALA  10  12.806  -5.798 -10.452
   66    H    GLY  11           H        GLY  11  11.997  -6.318  -6.777
   67    HA2  GLY  11           HA2      GLY  11  13.643  -7.888  -5.445
   68    HA3  GLY  11           HA3      GLY  11  14.789  -7.160  -6.561
   69    H    GLN  12           H        GLN  12  12.116  -6.038  -4.479
   70    HA   GLN  12           HA       GLN  12  13.959  -4.217  -3.145
   71    HB2  GLN  12           HB2      GLN  12  11.370  -3.166  -4.273
   72    HB3  GLN  12           HB3      GLN  12  12.692  -2.250  -3.560
   73    HG2  GLN  12           HG2      GLN  12  14.096  -3.151  -5.511
   74    HG3  GLN  12           HG3      GLN  12  12.546  -3.554  -6.248
   75   HE21  GLN  12          HE21      GLN  12  14.132  -0.838  -4.605
   76   HE22  GLN  12          HE22      GLN  12  13.517   0.383  -5.662
   77    H    THR  13           H        THR  13  12.648  -2.942  -1.398
   78    HA   THR  13           HA       THR  13  10.780  -4.836  -0.125
   79    HB   THR  13           HB       THR  13  12.357  -2.942   1.553
   80    HG1  THR  13           HG1      THR  13  13.384  -5.241   0.246
   81   HG21  THR  13          HG21      THR  13  12.369  -5.222   2.896
   82   HG22  THR  13          HG22      THR  13  11.006  -5.580   1.837
   83   HG23  THR  13          HG23      THR  13  10.956  -4.167   2.891
   84    H    CYS  14           H        CYS  14   9.146  -3.917   1.245
   85    HA   CYS  14           HA       CYS  14   8.009  -1.531   0.140
   86    HB2  CYS  14           HB2      CYS  14   6.589  -3.405   0.825
   87    HB3  CYS  14           HB3      CYS  14   7.130  -3.221   2.490
   88    H    CYS  15           H        CYS  15   8.461   0.471   0.744
   89    HA   CYS  15           HA       CYS  15   9.024   1.033   3.561
   90    HB2  CYS  15           HB2      CYS  15  10.925   2.476   2.964
   91    HB3  CYS  15           HB3      CYS  15  11.218   0.802   2.503
   92    H    ARG  16           H        ARG  16   9.121   3.491   3.903
   93    HA   ARG  16           HA       ARG  16   6.776   4.620   2.597
   94    HB2  ARG  16           HB2      ARG  16   8.285   5.167   5.107
   95    HB3  ARG  16           HB3      ARG  16   7.396   6.499   4.380
   96    HG2  ARG  16           HG2      ARG  16   5.341   5.185   4.471
   97    HG3  ARG  16           HG3      ARG  16   6.232   3.843   5.191
   98    HD2  ARG  16           HD2      ARG  16   6.189   6.577   6.434
   99    HD3  ARG  16           HD3      ARG  16   4.936   5.382   6.766
  100    HE   ARG  16           HE       ARG  16   7.379   4.142   7.204
  101   HH11  ARG  16          HH11      ARG  16   5.551   6.799   8.514
  102   HH12  ARG  16          HH12      ARG  16   6.212   6.639  10.107
  103   HH21  ARG  16          HH21      ARG  16   8.257   3.921   9.298
  104   HH22  ARG  16          HH22      ARG  16   7.752   5.002  10.552
  105    H    GLY  17           H        GLY  17   7.346   5.400   0.623
  106    HA2  GLY  17           HA2      GLY  17   9.792   6.733   0.076
  107    HA3  GLY  17           HA3      GLY  17   8.371   6.717  -0.958
  108    H    LEU  18           H        LEU  18   9.800   8.980  -0.914
  109    HA   LEU  18           HA       LEU  18   9.319  10.888   1.019
  110    HB2  LEU  18           HB2      LEU  18   9.866  12.517  -0.584
  111    HB3  LEU  18           HB3      LEU  18  10.776  11.075  -1.031
  112    HG   LEU  18           HG       LEU  18   8.182  11.851  -2.348
  113   HD11  LEU  18          HD11      LEU  18   9.485  12.801  -4.150
  114   HD12  LEU  18          HD12      LEU  18  10.982  12.455  -3.285
  115   HD13  LEU  18          HD13      LEU  18   9.846  13.639  -2.640
  116   HD21  LEU  18          HD21      LEU  18  10.193   9.714  -2.676
  117   HD22  LEU  18          HD22      LEU  18   9.570  10.440  -4.158
  118   HD23  LEU  18          HD23      LEU  18   8.460   9.705  -3.001
  119    H    HIS  19           H        HIS  19   7.198   9.728  -1.518
  120    HA   HIS  19           HA       HIS  19   5.204  11.760  -1.065
  121    HB2  HIS  19           HB2      HIS  19   5.059   9.183  -2.645
  122    HB3  HIS  19           HB3      HIS  19   3.845  10.458  -2.661
  123    HD1  HIS  19           HD1      HIS  19   5.870  12.861  -2.858
  124    HD2  HIS  19           HD2      HIS  19   5.902   9.462  -5.247
  125    HE1  HIS  19           HE1      HIS  19   7.061  13.533  -4.968
  126    H    GLY  20           H        GLY  20   5.563   8.304  -0.330
  127    HA2  GLY  20           HA2      GLY  20   4.414   8.284   2.144
  128    HA3  GLY  20           HA3      GLY  20   3.044   8.164   1.050
  129    H    TYR  21           H        TYR  21   3.901   6.535  -0.917
  130    HA   TYR  21           HA       TYR  21   4.758   4.082   0.469
  131    HB2  TYR  21           HB2      TYR  21   2.577   4.325  -1.613
  132    HB3  TYR  21           HB3      TYR  21   3.170   2.811  -0.939
  133    HD1  TYR  21           HD1      TYR  21   0.691   5.276  -0.677
  134    HD2  TYR  21           HD2      TYR  21   3.079   2.684   1.706
  135    HE1  TYR  21           HE1      TYR  21  -0.948   5.454   1.148
  136    HE2  TYR  21           HE2      TYR  21   1.447   2.854   3.538
  137    HH   TYR  21           HH       TYR  21  -0.893   5.186   3.704
  138    H    GLY  22           H        GLY  22   6.368   2.994  -0.479
  139    HA2  GLY  22           HA2      GLY  22   6.775   2.912  -3.299
  140    HA3  GLY  22           HA3      GLY  22   7.903   4.021  -2.533
  141    H    CYS  23           H        CYS  23   8.909   1.900  -3.873
  142    HA   CYS  23           HA       CYS  23   9.564  -0.109  -1.835
  143    HB2  CYS  23           HB2      CYS  23   9.815  -0.106  -4.841
  144    HB3  CYS  23           HB3      CYS  23  10.571  -1.334  -3.831
  145    H    CYS  24           H        CYS  24  11.682  -0.577  -1.278
  146    HA   CYS  24           HA       CYS  24  13.675   1.420  -2.133
  147    HB2  CYS  24           HB2      CYS  24  13.252   0.081   0.536
  148    HB3  CYS  24           HB3      CYS  24  14.760   0.890   0.120
  Start of MODEL    3
    1    H1   CYS   1           H        CYS   1   2.008   0.363  -0.705
    2    HA   CYS   1           HA       CYS   1   2.603   1.117  -3.480
    3    HB2  CYS   1           HB2      CYS   1   4.696  -0.155  -3.172
    4    HB3  CYS   1           HB3      CYS   1   4.522   1.126  -1.976
    5    H    ALA   2           H        ALA   2   0.243  -0.326  -2.995
    6    HA   ALA   2           HA       ALA   2   0.363  -3.079  -3.164
    7    HB1  ALA   2           HB1      ALA   2  -1.755  -2.098  -2.877
    8    HB2  ALA   2           HB2      ALA   2  -1.589  -1.117  -4.333
    9    HB3  ALA   2           HB3      ALA   2  -1.808  -2.861  -4.466
   10    H    ASP   3           H        ASP   3   0.292  -0.769  -5.879
   11    HA   ASP   3           HA       ASP   3   0.632  -2.737  -7.885
   12    HB2  ASP   3           HB2      ASP   3  -0.286  -0.431  -8.251
   13    HB3  ASP   3           HB3      ASP   3   1.350   0.195  -8.064
   14    H    ALA   4           H        ALA   4   2.906  -0.557  -6.255
   15    HA   ALA   4           HA       ALA   4   5.210  -1.103  -7.667
   16    HB1  ALA   4           HB1      ALA   4   6.155   0.188  -6.122
   17    HB2  ALA   4           HB2      ALA   4   4.577   0.262  -5.337
   18    HB3  ALA   4           HB3      ALA   4   5.757  -0.946  -4.831
   19    H    VAL   5           H        VAL   5   3.583  -3.063  -5.269
   20    HA   VAL   5           HA       VAL   5   5.538  -4.842  -4.513
   21    HB   VAL   5           HB       VAL   5   2.656  -5.500  -5.138
   22   HG11  VAL   5          HG11      VAL   5   3.120  -7.275  -3.334
   23   HG12  VAL   5          HG12      VAL   5   3.716  -7.569  -4.968
   24   HG13  VAL   5          HG13      VAL   5   4.821  -7.007  -3.713
   25   HG21  VAL   5          HG21      VAL   5   2.127  -4.310  -3.340
   26   HG22  VAL   5          HG22      VAL   5   3.185  -5.323  -2.357
   27   HG23  VAL   5          HG23      VAL   5   3.820  -3.867  -3.123
   28    H    TYR   6           H        TYR   6   3.769  -4.699  -7.542
   29    HA   TYR   6           HA       TYR   6   4.318  -7.178  -8.621
   30    HB2  TYR   6           HB2      TYR   6   3.859  -4.468  -9.771
   31    HB3  TYR   6           HB3      TYR   6   4.471  -5.720 -10.846
   32    HD1  TYR   6           HD1      TYR   6   3.136  -7.836 -11.132
   33    HD2  TYR   6           HD2      TYR   6   1.586  -4.416  -9.131
   34    HE1  TYR   6           HE1      TYR   6   0.854  -8.706 -11.425
   35    HE2  TYR   6           HE2      TYR   6  -0.700  -5.277  -9.418
   36    HH   TYR   6           HH       TYR   6  -1.320  -8.291 -11.183
   37    H    THR   7           H        THR   7   6.228  -4.230  -9.255
   38    HA   THR   7           HA       THR   7   8.415  -5.707 -10.345
   39    HB   THR   7           HB       THR   7   8.527  -2.852  -9.379
   40    HG1  THR   7           HG1      THR   7   6.892  -2.681 -10.770
   41   HG21  THR   7          HG21      THR   7  10.082  -4.507 -11.344
   42   HG22  THR   7          HG22      THR   7  10.678  -3.536  -9.997
   43   HG23  THR   7          HG23      THR   7  10.057  -2.747 -11.447
   44    H    CYS   8           H        CYS   8   7.841  -4.038  -7.267
   45    HA   CYS   8           HA       CYS   8  10.325  -4.300  -6.098
   46    HB2  CYS   8           HB2      CYS   8   7.577  -4.443  -4.852
   47    HB3  CYS   8           HB3      CYS   8   9.062  -4.365  -3.909
   48    H    ARG   9           H        ARG   9   7.794  -6.705  -6.468
   49    HA   ARG   9           HA       ARG   9   8.626  -8.661  -4.712
   50    HB2  ARG   9           HB2      ARG   9   7.156  -8.651  -7.287
   51    HB3  ARG   9           HB3      ARG   9   7.802 -10.199  -6.759
   52    HG2  ARG   9           HG2      ARG   9   6.465 -10.259  -4.868
   53    HG3  ARG   9           HG3      ARG   9   6.189  -8.516  -4.889
   54    HD2  ARG   9           HD2      ARG   9   4.618  -8.655  -6.585
   55    HD3  ARG   9           HD3      ARG   9   5.222 -10.211  -7.152
   56    HE   ARG   9           HE       ARG   9   3.276  -9.755  -5.088
   57   HH11  ARG   9          HH11      ARG   9   5.662 -11.963  -6.333
   58   HH12  ARG   9          HH12      ARG   9   4.936 -13.360  -5.610
   59   HH21  ARG   9          HH21      ARG   9   2.310 -11.586  -4.131
   60   HH22  ARG   9          HH22      ARG   9   3.029 -13.145  -4.359
   61    H    ALA  10           H        ALA  10   9.947  -7.803  -7.848
   62    HA   ALA  10           HA       ALA  10  11.550 -10.015  -8.350
   63    HB1  ALA  10           HB1      ALA  10  12.920  -8.521  -9.722
   64    HB2  ALA  10           HB2      ALA  10  11.197  -8.242  -9.980
   65    HB3  ALA  10           HB3      ALA  10  12.132  -7.125  -8.986
   66    H    GLY  11           H        GLY  11  12.440  -7.010  -6.641
   67    HA2  GLY  11           HA2      GLY  11  14.001  -8.343  -4.699
   68    HA3  GLY  11           HA3      GLY  11  15.050  -7.738  -5.972
   69    H    GLN  12           H        GLN  12  12.331  -6.596  -3.966
   70    HA   GLN  12           HA       GLN  12  13.881  -4.383  -2.997
   71    HB2  GLN  12           HB2      GLN  12  12.142  -4.041  -5.305
   72    HB3  GLN  12           HB3      GLN  12  11.686  -2.987  -3.973
   73    HG2  GLN  12           HG2      GLN  12  14.276  -2.499  -3.928
   74    HG3  GLN  12           HG3      GLN  12  14.162  -3.020  -5.609
   75   HE21  GLN  12          HE21      GLN  12  13.665  -0.496  -3.406
   76   HE22  GLN  12          HE22      GLN  12  12.924   0.628  -4.488
   77    H    THR  13           H        THR  13  12.629  -3.029  -1.472
   78    HA   THR  13           HA       THR  13  10.337  -4.495  -0.339
   79    HB   THR  13           HB       THR  13  12.113  -2.939   1.481
   80    HG1  THR  13           HG1      THR  13  12.736  -5.469   0.342
   81   HG21  THR  13          HG21      THR  13  11.478  -5.304   2.685
   82   HG22  THR  13          HG22      THR  13  10.084  -5.054   1.635
   83   HG23  THR  13          HG23      THR  13  10.531  -3.823   2.816
   84    H    CYS  14           H        CYS  14   8.811  -3.218   0.852
   85    HA   CYS  14           HA       CYS  14   8.396  -0.627  -0.339
   86    HB2  CYS  14           HB2      CYS  14   6.623  -2.438   0.268
   87    HB3  CYS  14           HB3      CYS  14   6.716  -1.745   1.884
   88    H    CYS  15           H        CYS  15   8.672   1.333   0.568
   89    HA   CYS  15           HA       CYS  15   9.317   1.492   3.425
   90    HB2  CYS  15           HB2      CYS  15  10.918   2.947   1.317
   91    HB3  CYS  15           HB3      CYS  15  11.246   2.864   3.045
   92    H    ARG  16           H        ARG  16   9.562   3.960   4.001
   93    HA   ARG  16           HA       ARG  16   7.047   5.167   3.292
   94    HB2  ARG  16           HB2      ARG  16   9.239   5.785   5.230
   95    HB3  ARG  16           HB3      ARG  16   8.087   7.047   4.816
   96    HG2  ARG  16           HG2      ARG  16   7.104   6.137   6.671
   97    HG3  ARG  16           HG3      ARG  16   6.316   5.217   5.388
   98    HD2  ARG  16           HD2      ARG  16   6.946   3.611   6.975
   99    HD3  ARG  16           HD3      ARG  16   8.172   3.499   5.712
  100    HE   ARG  16           HE       ARG  16   8.987   5.293   7.749
  101   HH11  ARG  16          HH11      ARG  16   8.618   1.903   7.051
  102   HH12  ARG  16          HH12      ARG  16   9.862   1.408   8.151
  103   HH21  ARG  16          HH21      ARG  16  10.626   4.654   9.200
  104   HH22  ARG  16          HH22      ARG  16  11.002   2.974   9.374
  105    H    GLY  17           H        GLY  17   6.926   6.079   1.327
  106    HA2  GLY  17           HA2      GLY  17   9.181   7.398   0.113
  107    HA3  GLY  17           HA3      GLY  17   7.561   7.268  -0.557
  108    H    LEU  18           H        LEU  18   8.777   9.600  -0.937
  109    HA   LEU  18           HA       LEU  18   8.639  11.552   1.031
  110    HB2  LEU  18           HB2      LEU  18   8.537  11.553  -1.936
  111    HB3  LEU  18           HB3      LEU  18   8.069  13.033  -1.100
  112    HG   LEU  18           HG       LEU  18  10.397  12.614   0.120
  113   HD11  LEU  18          HD11      LEU  18  10.406  10.739  -2.056
  114   HD12  LEU  18          HD12      LEU  18  11.605  10.991  -0.788
  115   HD13  LEU  18          HD13      LEU  18  11.679  11.940  -2.273
  116   HD21  LEU  18          HD21      LEU  18   9.651  14.601  -1.185
  117   HD22  LEU  18          HD22      LEU  18  10.223  13.797  -2.647
  118   HD23  LEU  18          HD23      LEU  18  11.363  14.221  -1.369
  119    H    HIS  19           H        HIS  19   6.127  10.405  -1.181
  120    HA   HIS  19           HA       HIS  19   4.168  12.272  -0.214
  121    HB2  HIS  19           HB2      HIS  19   4.264  11.184  -2.542
  122    HB3  HIS  19           HB3      HIS  19   3.569   9.763  -1.769
  123    HD1  HIS  19           HD1      HIS  19   1.416  10.036  -3.204
  124    HD2  HIS  19           HD2      HIS  19   2.206  13.224  -0.659
  125    HE1  HIS  19           HE1      HIS  19  -0.704  11.388  -3.141
  126    H    GLY  20           H        GLY  20   4.956   8.877   0.342
  127    HA2  GLY  20           HA2      GLY  20   4.078   8.740   2.944
  128    HA3  GLY  20           HA3      GLY  20   2.666   8.353   1.974
  129    H    TYR  21           H        TYR  21   3.691   6.873  -0.061
  130    HA   TYR  21           HA       TYR  21   5.080   4.645   1.267
  131    HB2  TYR  21           HB2      TYR  21   2.644   4.482  -0.515
  132    HB3  TYR  21           HB3      TYR  21   3.617   3.089  -0.053
  133    HD1  TYR  21           HD1      TYR  21   1.216   5.600   1.109
  134    HD2  TYR  21           HD2      TYR  21   3.536   2.206   2.204
  135    HE1  TYR  21           HE1      TYR  21  -0.117   5.359   3.162
  136    HE2  TYR  21           HE2      TYR  21   2.209   1.955   4.260
  137    HH   TYR  21           HH       TYR  21   0.065   2.572   5.153
  138    H    GLY  22           H        GLY  22   6.299   3.266  -0.120
  139    HA2  GLY  22           HA2      GLY  22   6.593   3.257  -2.809
  140    HA3  GLY  22           HA3      GLY  22   7.481   4.698  -2.334
  141    H    CYS  23           H        CYS  23   8.092   1.797  -3.342
  142    HA   CYS  23           HA       CYS  23   9.649   0.517  -1.397
  143    HB2  CYS  23           HB2      CYS  23   9.479   0.420  -4.371
  144    HB3  CYS  23           HB3      CYS  23  10.884  -0.313  -3.604
  145    H    CYS  24           H        CYS  24  11.820   0.573  -0.896
  146    HA   CYS  24           HA       CYS  24  13.119   3.049  -0.979
  147    HB2  CYS  24           HB2      CYS  24  13.976   0.263  -0.287
  148    HB3  CYS  24           HB3      CYS  24  15.186   1.538  -0.399
  Start of MODEL    4
    1    H1   CYS   1           H        CYS   1   2.003   1.238   0.504
    2    HA   CYS   1           HA       CYS   1   2.305   0.887  -1.808
    3    HB2  CYS   1           HB2      CYS   1   4.249  -0.751  -1.979
    4    HB3  CYS   1           HB3      CYS   1   4.458   0.598  -0.867
    5    H    ALA   2           H        ALA   2   0.168   0.049  -2.334
    6    HA   ALA   2           HA       ALA   2  -0.242  -2.799  -2.401
    7    HB1  ALA   2           HB1      ALA   2  -2.146  -1.374  -2.039
    8    HB2  ALA   2           HB2      ALA   2  -1.849  -0.526  -3.556
    9    HB3  ALA   2           HB3      ALA   2  -2.345  -2.218  -3.575
   10    H    ASP   3           H        ASP   3   0.123  -0.267  -4.884
   11    HA   ASP   3           HA       ASP   3   0.316  -2.167  -7.017
   12    HB2  ASP   3           HB2      ASP   3  -0.499   0.263  -7.162
   13    HB3  ASP   3           HB3      ASP   3   1.205   0.709  -7.157
   14    H    ALA   4           H        ALA   4   2.601  -0.316  -5.083
   15    HA   ALA   4           HA       ALA   4   4.933  -0.660  -6.513
   16    HB1  ALA   4           HB1      ALA   4   4.258   0.266  -3.983
   17    HB2  ALA   4           HB2      ALA   4   5.407  -1.039  -3.687
   18    HB3  ALA   4           HB3      ALA   4   5.853   0.308  -4.735
   19    H    VAL   5           H        VAL   5   3.188  -2.980  -4.561
   20    HA   VAL   5           HA       VAL   5   5.079  -4.921  -4.093
   21    HB   VAL   5           HB       VAL   5   2.203  -5.374  -4.902
   22   HG11  VAL   5          HG11      VAL   5   3.489  -7.418  -5.091
   23   HG12  VAL   5          HG12      VAL   5   4.151  -7.180  -3.473
   24   HG13  VAL   5          HG13      VAL   5   2.430  -7.503  -3.684
   25   HG21  VAL   5          HG21      VAL   5   1.737  -4.354  -2.975
   26   HG22  VAL   5          HG22      VAL   5   2.466  -5.741  -2.166
   27   HG23  VAL   5          HG23      VAL   5   3.436  -4.307  -2.505
   28    H    TYR   6           H        TYR   6   3.387  -4.193  -7.086
   29    HA   TYR   6           HA       TYR   6   3.925  -6.445  -8.584
   30    HB2  TYR   6           HB2      TYR   6   3.531  -3.565  -9.231
   31    HB3  TYR   6           HB3      TYR   6   4.157  -4.608 -10.503
   32    HD1  TYR   6           HD1      TYR   6   2.803  -6.556 -11.273
   33    HD2  TYR   6           HD2      TYR   6   1.247  -3.653  -8.580
   34    HE1  TYR   6           HE1      TYR   6   0.520  -7.322 -11.777
   35    HE2  TYR   6           HE2      TYR   6  -1.040  -4.412  -9.075
   36    HH   TYR   6           HH       TYR   6  -2.306  -5.680 -10.433
   37    H    THR   7           H        THR   7   5.907  -3.476  -8.571
   38    HA   THR   7           HA       THR   7   8.086  -4.730  -9.915
   39    HB   THR   7           HB       THR   7   9.334  -2.664  -9.429
   40    HG1  THR   7           HG1      THR   7   7.000  -1.878  -7.990
   41   HG21  THR   7          HG21      THR   7   8.176  -2.273 -11.352
   42   HG22  THR   7          HG22      THR   7   7.385  -1.073 -10.329
   43   HG23  THR   7          HG23      THR   7   6.616  -2.633 -10.614
   44    H    CYS   8           H        CYS   8   7.305  -4.065  -6.553
   45    HA   CYS   8           HA       CYS   8   9.746  -4.473  -5.334
   46    HB2  CYS   8           HB2      CYS   8   7.168  -4.113  -4.464
   47    HB3  CYS   8           HB3      CYS   8   7.508  -5.755  -3.930
   48    H    ARG   9           H        ARG   9   7.496  -6.838  -6.624
   49    HA   ARG   9           HA       ARG   9   8.430  -9.173  -5.497
   50    HB2  ARG   9           HB2      ARG   9   7.156  -8.490  -8.101
   51    HB3  ARG   9           HB3      ARG   9   7.860 -10.092  -7.932
   52    HG2  ARG   9           HG2      ARG   9   5.864  -8.955  -5.993
   53    HG3  ARG   9           HG3      ARG   9   5.417  -9.919  -7.402
   54    HD2  ARG   9           HD2      ARG   9   7.304 -10.841  -5.240
   55    HD3  ARG   9           HD3      ARG   9   5.582 -11.216  -5.278
   56    HE   ARG   9           HE       ARG   9   6.460 -12.064  -7.695
   57   HH11  ARG   9          HH11      ARG   9   7.493 -12.652  -4.423
   58   HH12  ARG   9          HH12      ARG   9   8.080 -14.247  -4.756
   59   HH21  ARG   9          HH21      ARG   9   7.230 -14.163  -8.147
   60   HH22  ARG   9          HH22      ARG   9   7.931 -15.106  -6.875
   61    H    ALA  10           H        ALA  10   9.823  -7.266  -8.094
   62    HA   ALA  10           HA       ALA  10  11.669  -9.071  -9.118
   63    HB1  ALA  10           HB1      ALA  10  11.125  -6.780 -10.003
   64    HB2  ALA  10           HB2      ALA  10  12.197  -6.130  -8.762
   65    HB3  ALA  10           HB3      ALA  10  12.836  -7.206 -10.005
   66    H    GLY  11           H        GLY  11  12.106  -6.738  -6.456
   67    HA2  GLY  11           HA2      GLY  11  13.475  -8.264  -4.687
   68    HA3  GLY  11           HA3      GLY  11  14.723  -7.792  -5.832
   69    H    GLN  12           H        GLN  12  12.024  -6.232  -4.094
   70    HA   GLN  12           HA       GLN  12  13.916  -4.203  -3.145
   71    HB2  GLN  12           HB2      GLN  12  11.205  -3.566  -4.319
   72    HB3  GLN  12           HB3      GLN  12  12.344  -2.407  -3.647
   73    HG2  GLN  12           HG2      GLN  12  13.175  -4.153  -5.918
   74    HG3  GLN  12           HG3      GLN  12  12.170  -2.736  -6.217
   75   HE21  GLN  12          HE21      GLN  12  15.224  -3.820  -4.856
   76   HE22  GLN  12          HE22      GLN  12  16.064  -2.327  -5.075
   77    H    THR  13           H        THR  13  12.695  -2.716  -1.503
   78    HA   THR  13           HA       THR  13  10.929  -4.381   0.165
   79    HB   THR  13           HB       THR  13  12.043  -3.566   2.181
   80    HG1  THR  13           HG1      THR  13  13.432  -2.026   0.306
   81   HG21  THR  13          HG21      THR  13  14.306  -4.564   0.515
   82   HG22  THR  13          HG22      THR  13  12.882  -5.586   0.712
   83   HG23  THR  13          HG23      THR  13  13.791  -5.057   2.127
   84    H    CYS  14           H        CYS  14   9.133  -3.398   0.852
   85    HA   CYS  14           HA       CYS  14   8.308  -0.922  -0.093
   86    HB2  CYS  14           HB2      CYS  14   6.855  -2.773   0.834
   87    HB3  CYS  14           HB3      CYS  14   7.297  -2.213   2.444
   88    H    CYS  15           H        CYS  15   8.999   1.047   0.374
   89    HA   CYS  15           HA       CYS  15   9.921   1.604   3.118
   90    HB2  CYS  15           HB2      CYS  15  10.999   2.705   0.514
   91    HB3  CYS  15           HB3      CYS  15  11.469   3.283   2.110
   92    H    ARG  16           H        ARG  16   9.881   4.021   3.597
   93    HA   ARG  16           HA       ARG  16   7.292   5.071   2.696
   94    HB2  ARG  16           HB2      ARG  16   8.939   5.869   5.103
   95    HB3  ARG  16           HB3      ARG  16   7.317   6.431   4.720
   96    HG2  ARG  16           HG2      ARG  16   6.529   4.076   4.915
   97    HG3  ARG  16           HG3      ARG  16   8.144   3.639   5.476
   98    HD2  ARG  16           HD2      ARG  16   7.098   3.978   7.482
   99    HD3  ARG  16           HD3      ARG  16   7.721   5.599   7.179
  100    HE   ARG  16           HE       ARG  16   5.569   6.342   7.037
  101   HH11  ARG  16          HH11      ARG  16   5.592   2.892   6.566
  102   HH12  ARG  16          HH12      ARG  16   3.865   2.754   6.538
  103   HH21  ARG  16          HH21      ARG  16   3.295   6.172   7.002
  104   HH22  ARG  16          HH22      ARG  16   2.560   4.620   6.785
  105    H    GLY  17           H        GLY  17   8.427   5.739   0.679
  106    HA2  GLY  17           HA2      GLY  17  10.469   7.649   0.608
  107    HA3  GLY  17           HA3      GLY  17   9.278   7.397  -0.659
  108    H    LEU  18           H        LEU  18   9.777   9.823  -0.742
  109    HA   LEU  18           HA       LEU  18   8.854  11.596   1.206
  110    HB2  LEU  18           HB2      LEU  18   9.257  11.784  -1.749
  111    HB3  LEU  18           HB3      LEU  18   8.497  13.116  -0.881
  112    HG   LEU  18           HG       LEU  18  11.159  12.055  -0.008
  113   HD11  LEU  18          HD11      LEU  18  12.331  13.394  -1.509
  114   HD12  LEU  18          HD12      LEU  18  10.894  14.305  -1.970
  115   HD13  LEU  18          HD13      LEU  18  11.091  12.637  -2.508
  116   HD21  LEU  18          HD21      LEU  18   9.400  14.097   0.840
  117   HD22  LEU  18          HD22      LEU  18  10.818  14.882   0.144
  118   HD23  LEU  18          HD23      LEU  18  11.009  13.716   1.454
  119    H    HIS  19           H        HIS  19   7.177  10.443  -1.722
  120    HA   HIS  19           HA       HIS  19   4.758  11.723  -1.363
  121    HB2  HIS  19           HB2      HIS  19   5.547  10.257  -3.320
  122    HB3  HIS  19           HB3      HIS  19   4.934   8.895  -2.387
  123    HD1  HIS  19           HD1      HIS  19   3.787  11.955  -4.234
  124    HD2  HIS  19           HD2      HIS  19   2.172   8.618  -2.360
  125    HE1  HIS  19           HE1      HIS  19   1.356  11.934  -4.876
  126    H    GLY  20           H        GLY  20   5.749   8.543  -0.111
  127    HA2  GLY  20           HA2      GLY  20   4.738   8.562   2.360
  128    HA3  GLY  20           HA3      GLY  20   3.279   8.318   1.410
  129    H    TYR  21           H        TYR  21   4.018   6.604  -0.528
  130    HA   TYR  21           HA       TYR  21   5.172   4.292   0.880
  131    HB2  TYR  21           HB2      TYR  21   2.593   4.432  -0.670
  132    HB3  TYR  21           HB3      TYR  21   3.439   2.909  -0.417
  133    HD1  TYR  21           HD1      TYR  21   1.194   5.322   0.995
  134    HD2  TYR  21           HD2      TYR  21   3.859   2.152   1.971
  135    HE1  TYR  21           HE1      TYR  21   0.105   5.090   3.188
  136    HE2  TYR  21           HE2      TYR  21   2.777   1.910   4.167
  137    HH   TYR  21           HH       TYR  21   0.392   4.196   5.301
  138    H    GLY  22           H        GLY  22   6.527   3.028  -0.292
  139    HA2  GLY  22           HA2      GLY  22   6.562   2.700  -3.057
  140    HA3  GLY  22           HA3      GLY  22   7.618   4.057  -2.693
  141    H    CYS  23           H        CYS  23   7.843   1.031  -3.523
  142    HA   CYS  23           HA       CYS  23   9.494  -0.107  -1.486
  143    HB2  CYS  23           HB2      CYS  23   8.783  -0.847  -4.303
  144    HB3  CYS  23           HB3      CYS  23  10.109  -1.675  -3.494
  145    H    CYS  24           H        CYS  24  11.576   0.246  -1.105
  146    HA   CYS  24           HA       CYS  24  13.098   2.183  -2.369
  147    HB2  CYS  24           HB2      CYS  24  13.801  -0.150  -0.616
  148    HB3  CYS  24           HB3      CYS  24  15.074   0.846  -1.314
  Start of MODEL    5
    1    H1   CYS   1           H        CYS   1   2.867   1.228  -0.857
    2    HA   CYS   1           HA       CYS   1   3.020   1.224  -3.688
    3    HB2  CYS   1           HB2      CYS   1   5.074  -0.134  -3.343
    4    HB3  CYS   1           HB3      CYS   1   5.041   1.326  -2.359
    5    H    ALA   2           H        ALA   2   0.645  -0.038  -2.970
    6    HA   ALA   2           HA       ALA   2   0.701  -2.820  -2.839
    7    HB1  ALA   2           HB1      ALA   2  -1.488  -1.782  -4.458
    8    HB2  ALA   2           HB2      ALA   2  -1.524  -2.645  -2.920
    9    HB3  ALA   2           HB3      ALA   2  -1.259  -0.901  -2.947
   10    H    ASP   3           H        ASP   3   0.392  -0.748  -5.724
   11    HA   ASP   3           HA       ASP   3   0.513  -2.907  -7.564
   12    HB2  ASP   3           HB2      ASP   3   0.781   0.076  -7.813
   13    HB3  ASP   3           HB3      ASP   3   1.091  -0.971  -9.195
   14    H    ALA   4           H        ALA   4   2.918  -0.766  -6.154
   15    HA   ALA   4           HA       ALA   4   5.079  -1.358  -7.829
   16    HB1  ALA   4           HB1      ALA   4   6.027  -0.989  -5.170
   17    HB2  ALA   4           HB2      ALA   4   6.045   0.148  -6.519
   18    HB3  ALA   4           HB3      ALA   4   4.655   0.087  -5.435
   19    H    VAL   5           H        VAL   5   3.690  -3.122  -5.147
   20    HA   VAL   5           HA       VAL   5   5.715  -4.845  -4.444
   21    HB   VAL   5           HB       VAL   5   2.788  -5.534  -4.736
   22   HG11  VAL   5          HG11      VAL   5   5.112  -6.985  -3.581
   23   HG12  VAL   5          HG12      VAL   5   3.555  -7.108  -2.759
   24   HG13  VAL   5          HG13      VAL   5   3.706  -7.607  -4.445
   25   HG21  VAL   5          HG21      VAL   5   2.522  -4.042  -3.099
   26   HG22  VAL   5          HG22      VAL   5   3.370  -5.185  -2.057
   27   HG23  VAL   5          HG23      VAL   5   4.261  -3.886  -2.851
   28    H    TYR   6           H        TYR   6   3.655  -4.935  -7.287
   29    HA   TYR   6           HA       TYR   6   4.107  -7.490  -8.219
   30    HB2  TYR   6           HB2      TYR   6   3.533  -4.876  -9.529
   31    HB3  TYR   6           HB3      TYR   6   4.037  -6.214 -10.555
   32    HD1  TYR   6           HD1      TYR   6   2.679  -8.331 -10.548
   33    HD2  TYR   6           HD2      TYR   6   1.336  -4.762  -8.661
   34    HE1  TYR   6           HE1      TYR   6   0.380  -9.204 -10.545
   35    HE2  TYR   6           HE2      TYR   6  -0.966  -5.625  -8.652
   36    HH   TYR   6           HH       TYR   6  -2.288  -7.358 -10.087
   37    H    THR   7           H        THR   7   5.936  -4.609  -9.266
   38    HA   THR   7           HA       THR   7   8.010  -6.173 -10.448
   39    HB   THR   7           HB       THR   7   9.223  -3.953 -10.589
   40    HG1  THR   7           HG1      THR   7   6.748  -2.857  -9.731
   41   HG21  THR   7          HG21      THR   7   6.550  -4.527 -11.778
   42   HG22  THR   7          HG22      THR   7   8.132  -4.433 -12.553
   43   HG23  THR   7          HG23      THR   7   7.291  -2.956 -12.082
   44    H    CYS   8           H        CYS   8   7.723  -4.303  -7.449
   45    HA   CYS   8           HA       CYS   8  10.311  -4.479  -6.511
   46    HB2  CYS   8           HB2      CYS   8   7.688  -4.522  -5.018
   47    HB3  CYS   8           HB3      CYS   8   9.247  -4.423  -4.206
   48    H    ARG   9           H        ARG   9   7.774  -6.907  -6.470
   49    HA   ARG   9           HA       ARG   9   8.788  -8.739  -4.677
   50    HB2  ARG   9           HB2      ARG   9   7.030  -8.862  -7.042
   51    HB3  ARG   9           HB3      ARG   9   7.794 -10.384  -6.604
   52    HG2  ARG   9           HG2      ARG   9   6.868 -10.231  -4.366
   53    HG3  ARG   9           HG3      ARG   9   6.147  -8.669  -4.756
   54    HD2  ARG   9           HD2      ARG   9   5.514 -10.993  -6.501
   55    HD3  ARG   9           HD3      ARG   9   4.765 -10.919  -4.907
   56    HE   ARG   9           HE       ARG   9   4.524  -8.490  -6.434
   57   HH11  ARG   9          HH11      ARG   9   3.126 -11.601  -5.736
   58   HH12  ARG   9          HH12      ARG   9   1.529 -11.138  -6.221
   59   HH21  ARG   9          HH21      ARG   9   2.425  -7.868  -7.076
   60   HH22  ARG   9          HH22      ARG   9   1.131  -9.015  -6.984
   61    H    ALA  10           H        ALA  10   9.826  -8.052  -7.951
   62    HA   ALA  10           HA       ALA  10  11.368 -10.295  -8.496
   63    HB1  ALA  10           HB1      ALA  10  12.394  -7.631  -9.327
   64    HB2  ALA  10           HB2      ALA  10  12.229  -9.121 -10.257
   65    HB3  ALA  10           HB3      ALA  10  10.807  -8.138  -9.904
   66    H    GLY  11           H        GLY  11  12.101  -7.475  -6.524
   67    HA2  GLY  11           HA2      GLY  11  13.849  -8.602  -4.785
   68    HA3  GLY  11           HA3      GLY  11  14.869  -8.213  -6.163
   69    H    GLN  12           H        GLN  12  12.432  -6.714  -4.043
   70    HA   GLN  12           HA       GLN  12  14.186  -4.425  -3.688
   71    HB2  GLN  12           HB2      GLN  12  11.418  -4.200  -4.874
   72    HB3  GLN  12           HB3      GLN  12  12.303  -2.837  -4.200
   73    HG2  GLN  12           HG2      GLN  12  13.321  -4.541  -6.458
   74    HG3  GLN  12           HG3      GLN  12  12.415  -3.045  -6.680
   75   HE21  GLN  12          HE21      GLN  12  13.583  -1.293  -6.952
   76   HE22  GLN  12          HE22      GLN  12  15.207  -1.054  -6.416
   77    H    THR  13           H        THR  13  13.007  -2.782  -2.168
   78    HA   THR  13           HA       THR  13  11.457  -4.272  -0.157
   79    HB   THR  13           HB       THR  13  12.685  -3.030   1.622
   80    HG1  THR  13           HG1      THR  13  13.526  -1.514  -0.207
   81   HG21  THR  13          HG21      THR  13  14.841  -4.447   0.181
   82   HG22  THR  13          HG22      THR  13  13.353  -5.357   0.442
   83   HG23  THR  13          HG23      THR  13  14.226  -4.681   1.817
   84    H    CYS  14           H        CYS  14   9.595  -3.314   0.301
   85    HA   CYS  14           HA       CYS  14   9.024  -0.665  -0.659
   86    HB2  CYS  14           HB2      CYS  14   7.512  -2.953   0.332
   87    HB3  CYS  14           HB3      CYS  14   6.892  -1.424   0.947
   88    H    CYS  15           H        CYS  15   9.820   1.024   0.416
   89    HA   CYS  15           HA       CYS  15   9.822   0.963   3.354
   90    HB2  CYS  15           HB2      CYS  15  11.253   2.940   1.576
   91    HB3  CYS  15           HB3      CYS  15  11.511   2.659   3.295
   92    H    ARG  16           H        ARG  16   9.620   3.335   4.259
   93    HA   ARG  16           HA       ARG  16   7.018   4.280   3.361
   94    HB2  ARG  16           HB2      ARG  16   7.813   3.850   5.826
   95    HB3  ARG  16           HB3      ARG  16   8.499   5.462   5.678
   96    HG2  ARG  16           HG2      ARG  16   5.614   4.871   5.089
   97    HG3  ARG  16           HG3      ARG  16   6.196   5.303   6.698
   98    HD2  ARG  16           HD2      ARG  16   7.254   7.340   5.538
   99    HD3  ARG  16           HD3      ARG  16   6.181   6.953   4.193
  100    HE   ARG  16           HE       ARG  16   4.452   7.829   5.394
  101   HH11  ARG  16          HH11      ARG  16   7.045   7.048   7.583
  102   HH12  ARG  16          HH12      ARG  16   6.266   7.750   8.962
  103   HH21  ARG  16          HH21      ARG  16   3.416   8.755   7.203
  104   HH22  ARG  16          HH22      ARG  16   4.202   8.720   8.745
  105    H    GLY  17           H        GLY  17   7.438   5.425   1.485
  106    HA2  GLY  17           HA2      GLY  17   9.515   7.375   1.290
  107    HA3  GLY  17           HA3      GLY  17   8.193   7.148   0.156
  108    H    LEU  18           H        LEU  18   8.835   9.656   0.467
  109    HA   LEU  18           HA       LEU  18   7.911  11.131   2.608
  110    HB2  LEU  18           HB2      LEU  18   8.162  11.686  -0.313
  111    HB3  LEU  18           HB3      LEU  18   7.371  12.871   0.726
  112    HG   LEU  18           HG       LEU  18  10.116  11.861   1.380
  113   HD11  LEU  18          HD11      LEU  18  10.865  12.685  -0.555
  114   HD12  LEU  18          HD12      LEU  18  10.531  14.269   0.144
  115   HD13  LEU  18          HD13      LEU  18   9.340  13.500  -0.904
  116   HD21  LEU  18          HD21      LEU  18   8.875  13.156   3.055
  117   HD22  LEU  18          HD22      LEU  18   8.700  14.475   1.896
  118   HD23  LEU  18          HD23      LEU  18  10.301  14.019   2.480
  119    H    HIS  19           H        HIS  19   6.087  10.532  -0.403
  120    HA   HIS  19           HA       HIS  19   3.655  11.566   0.436
  121    HB2  HIS  19           HB2      HIS  19   4.179   9.283  -1.478
  122    HB3  HIS  19           HB3      HIS  19   2.638  10.119  -1.315
  123    HD1  HIS  19           HD1      HIS  19   5.791  10.242  -3.112
  124    HD2  HIS  19           HD2      HIS  19   2.827  12.955  -2.053
  125    HE1  HIS  19           HE1      HIS  19   6.139  12.235  -4.606
  126    H    GLY  20           H        GLY  20   5.032   8.362   0.940
  127    HA2  GLY  20           HA2      GLY  20   3.864   7.748   3.306
  128    HA3  GLY  20           HA3      GLY  20   2.620   7.322   2.139
  129    H    TYR  21           H        TYR  21   3.983   6.217   0.092
  130    HA   TYR  21           HA       TYR  21   5.560   4.047   1.299
  131    HB2  TYR  21           HB2      TYR  21   3.340   3.744  -0.733
  132    HB3  TYR  21           HB3      TYR  21   4.414   2.448  -0.217
  133    HD1  TYR  21           HD1      TYR  21   1.441   4.340   0.545
  134    HD2  TYR  21           HD2      TYR  21   4.339   1.687   2.177
  135    HE1  TYR  21           HE1      TYR  21  -0.085   3.826   2.403
  136    HE2  TYR  21           HE2      TYR  21   2.820   1.164   4.040
  137    HH   TYR  21           HH       TYR  21   0.221   1.236   4.371
  138    H    GLY  22           H        GLY  22   6.941   2.896  -0.215
  139    HA2  GLY  22           HA2      GLY  22   7.372   3.506  -2.871
  140    HA3  GLY  22           HA3      GLY  22   8.300   4.692  -1.966
  141    H    CYS  23           H        CYS  23   8.761   2.059  -3.649
  142    HA   CYS  23           HA       CYS  23  10.228   0.373  -1.872
  143    HB2  CYS  23           HB2      CYS  23   9.666   0.479  -4.772
  144    HB3  CYS  23           HB3      CYS  23  11.182  -0.296  -4.323
  145    H    CYS  24           H        CYS  24  12.231   0.611  -1.142
  146    HA   CYS  24           HA       CYS  24  13.795   2.882  -1.727
  147    HB2  CYS  24           HB2      CYS  24  14.332   0.318  -0.250
  148    HB3  CYS  24           HB3      CYS  24  15.609   1.505  -0.495
  Start of MODEL    6
    1    H1   CYS   1           H        CYS   1   3.023   0.049   1.397
    2    HA   CYS   1           HA       CYS   1   2.758   0.599  -1.236
    3    HB2  CYS   1           HB2      CYS   1   4.576  -1.145  -1.628
    4    HB3  CYS   1           HB3      CYS   1   4.927   0.101  -0.435
    5    H    ALA   2           H        ALA   2   0.574  -0.043  -1.770
    6    HA   ALA   2           HA       ALA   2  -0.069  -2.838  -1.994
    7    HB1  ALA   2           HB1      ALA   2  -2.171  -2.114  -2.893
    8    HB2  ALA   2           HB2      ALA   2  -1.763  -1.080  -1.523
    9    HB3  ALA   2           HB3      ALA   2  -1.545  -0.489  -3.170
   10    H    ASP   3           H        ASP   3   0.515  -0.205  -4.322
   11    HA   ASP   3           HA       ASP   3   0.598  -2.075  -6.530
   12    HB2  ASP   3           HB2      ASP   3   1.075  -0.040  -7.891
   13    HB3  ASP   3           HB3      ASP   3  -0.405   0.081  -6.945
   14    H    ALA   4           H        ALA   4   2.844  -0.235  -4.567
   15    HA   ALA   4           HA       ALA   4   5.156  -0.359  -6.055
   16    HB1  ALA   4           HB1      ALA   4   4.473   0.096  -3.315
   17    HB2  ALA   4           HB2      ALA   4   5.925  -0.901  -3.403
   18    HB3  ALA   4           HB3      ALA   4   5.877   0.660  -4.222
   19    H    VAL   5           H        VAL   5   3.560  -2.914  -4.276
   20    HA   VAL   5           HA       VAL   5   5.545  -4.799  -4.013
   21    HB   VAL   5           HB       VAL   5   3.196  -5.054  -3.212
   22   HG11  VAL   5          HG11      VAL   5   2.458  -6.208  -5.859
   23   HG12  VAL   5          HG12      VAL   5   1.427  -5.549  -4.588
   24   HG13  VAL   5          HG13      VAL   5   2.351  -4.463  -5.626
   25   HG21  VAL   5          HG21      VAL   5   3.983  -7.449  -4.841
   26   HG22  VAL   5          HG22      VAL   5   4.924  -6.930  -3.444
   27   HG23  VAL   5          HG23      VAL   5   3.235  -7.396  -3.245
   28    H    TYR   6           H        TYR   6   3.837  -3.820  -6.905
   29    HA   TYR   6           HA       TYR   6   4.366  -5.915  -8.619
   30    HB2  TYR   6           HB2      TYR   6   3.966  -2.988  -8.971
   31    HB3  TYR   6           HB3      TYR   6   4.612  -3.886 -10.341
   32    HD1  TYR   6           HD1      TYR   6   3.200  -5.190 -11.701
   33    HD2  TYR   6           HD2      TYR   6   1.757  -3.723  -7.977
   34    HE1  TYR   6           HE1      TYR   6   0.927  -5.911 -12.304
   35    HE2  TYR   6           HE2      TYR   6  -0.520  -4.441  -8.570
   36    HH   TYR   6           HH       TYR   6  -1.207  -6.568 -10.978
   37    H    THR   7           H        THR   7   6.345  -2.955  -8.379
   38    HA   THR   7           HA       THR   7   8.525  -4.102  -9.810
   39    HB   THR   7           HB       THR   7   8.781  -1.706  -8.009
   40    HG1  THR   7           HG1      THR   7   7.020  -1.111  -9.143
   41   HG21  THR   7          HG21      THR   7  10.778  -2.621  -9.191
   42   HG22  THR   7          HG22      THR   7  10.379  -0.966  -9.651
   43   HG23  THR   7          HG23      THR   7   9.963  -2.303 -10.721
   44    H    CYS   8           H        CYS   8   7.789  -3.626  -6.395
   45    HA   CYS   8           HA       CYS   8  10.265  -4.211  -5.282
   46    HB2  CYS   8           HB2      CYS   8   7.454  -4.319  -4.366
   47    HB3  CYS   8           HB3      CYS   8   8.595  -5.293  -3.446
   48    H    ARG   9           H        ARG   9   7.773  -6.364  -6.508
   49    HA   ARG   9           HA       ARG   9   8.595  -8.789  -5.483
   50    HB2  ARG   9           HB2      ARG   9   7.178  -7.935  -7.947
   51    HB3  ARG   9           HB3      ARG   9   7.818  -9.572  -7.930
   52    HG2  ARG   9           HG2      ARG   9   6.610  -9.633  -5.579
   53    HG3  ARG   9           HG3      ARG   9   5.634  -8.369  -6.328
   54    HD2  ARG   9           HD2      ARG   9   4.772  -9.784  -7.914
   55    HD3  ARG   9           HD3      ARG   9   6.171 -10.856  -7.871
   56    HE   ARG   9           HE       ARG   9   5.154 -12.061  -6.212
   57   HH11  ARG   9          HH11      ARG   9   3.542  -8.993  -6.550
   58   HH12  ARG   9          HH12      ARG   9   2.247  -9.408  -5.476
   59   HH21  ARG   9          HH21      ARG   9   3.454 -12.619  -4.797
   60   HH22  ARG   9          HH22      ARG   9   2.198 -11.471  -4.479
   61    H    ALA  10           H        ALA  10   9.941  -6.946  -8.155
   62    HA   ALA  10           HA       ALA  10  11.587  -8.863  -9.309
   63    HB1  ALA  10           HB1      ALA  10  11.099  -6.319  -9.879
   64    HB2  ALA  10           HB2      ALA  10  12.645  -6.103  -9.057
   65    HB3  ALA  10           HB3      ALA  10  12.536  -7.153 -10.470
   66    H    GLY  11           H        GLY  11  12.070  -6.908  -6.420
   67    HA2  GLY  11           HA2      GLY  11  13.543  -8.434  -4.863
   68    HA3  GLY  11           HA3      GLY  11  14.757  -8.010  -6.061
   69    H    GLN  12           H        GLN  12  12.333  -6.451  -3.966
   70    HA   GLN  12           HA       GLN  12  14.373  -4.537  -3.129
   71    HB2  GLN  12           HB2      GLN  12  11.646  -3.580  -3.980
   72    HB3  GLN  12           HB3      GLN  12  13.061  -2.611  -3.590
   73    HG2  GLN  12           HG2      GLN  12  14.116  -3.888  -5.614
   74    HG3  GLN  12           HG3      GLN  12  12.430  -4.138  -6.064
   75   HE21  GLN  12          HE21      GLN  12  12.497  -2.849  -7.863
   76   HE22  GLN  12          HE22      GLN  12  12.668  -1.132  -7.791
   77    H    THR  13           H        THR  13  13.341  -3.033  -1.377
   78    HA   THR  13           HA       THR  13  11.743  -4.749   0.410
   79    HB   THR  13           HB       THR  13  12.819  -3.282   2.249
   80    HG1  THR  13           HG1      THR  13  13.824  -2.004   0.321
   81   HG21  THR  13          HG21      THR  13  14.033  -5.108   2.678
   82   HG22  THR  13          HG22      THR  13  15.035  -4.858   1.248
   83   HG23  THR  13          HG23      THR  13  13.507  -5.727   1.113
   84    H    CYS  14           H        CYS  14   9.837  -3.996   1.074
   85    HA   CYS  14           HA       CYS  14   8.816  -1.529   0.111
   86    HB2  CYS  14           HB2      CYS  14   7.807  -3.851   1.545
   87    HB3  CYS  14           HB3      CYS  14   7.108  -2.352   2.148
   88    H    CYS  15           H        CYS  15   9.469   0.374   0.867
   89    HA   CYS  15           HA       CYS  15   9.621   0.729   3.786
   90    HB2  CYS  15           HB2      CYS  15  11.516   2.211   3.528
   91    HB3  CYS  15           HB3      CYS  15  11.888   0.670   2.761
   92    H    ARG  16           H        ARG  16   9.709   3.231   4.249
   93    HA   ARG  16           HA       ARG  16   7.230   4.284   3.326
   94    HB2  ARG  16           HB2      ARG  16   9.368   5.162   5.200
   95    HB3  ARG  16           HB3      ARG  16   8.285   6.397   4.571
   96    HG2  ARG  16           HG2      ARG  16   7.367   3.888   5.956
   97    HG3  ARG  16           HG3      ARG  16   7.588   5.447   6.753
   98    HD2  ARG  16           HD2      ARG  16   5.697   4.848   4.481
   99    HD3  ARG  16           HD3      ARG  16   5.253   5.106   6.167
  100    HE   ARG  16           HE       ARG  16   6.686   7.333   5.183
  101   HH11  ARG  16          HH11      ARG  16   3.581   5.773   4.976
  102   HH12  ARG  16          HH12      ARG  16   2.725   7.236   4.615
  103   HH21  ARG  16          HH21      ARG  16   5.570   9.265   4.708
  104   HH22  ARG  16          HH22      ARG  16   3.857   9.221   4.462
  105    H    GLY  17           H        GLY  17   6.903   5.251   1.440
  106    HA2  GLY  17           HA2      GLY  17   9.117   6.264  -0.116
  107    HA3  GLY  17           HA3      GLY  17   7.431   6.214  -0.607
  108    H    LEU  18           H        LEU  18   8.442   8.400  -1.409
  109    HA   LEU  18           HA       LEU  18   8.764  10.516   0.425
  110    HB2  LEU  18           HB2      LEU  18   7.853  10.710  -2.440
  111    HB3  LEU  18           HB3      LEU  18   8.603  11.982  -1.478
  112    HG   LEU  18           HG       LEU  18  10.131   9.468  -1.946
  113   HD11  LEU  18          HD11      LEU  18   9.776  11.653  -3.992
  114   HD12  LEU  18          HD12      LEU  18   9.284   9.968  -4.155
  115   HD13  LEU  18          HD13      LEU  18  10.996  10.380  -4.060
  116   HD21  LEU  18          HD21      LEU  18  11.921  10.726  -1.386
  117   HD22  LEU  18          HD22      LEU  18  10.695  11.722  -0.601
  118   HD23  LEU  18          HD23      LEU  18  11.302  12.165  -2.197
  119    H    HIS  19           H        HIS  19   5.970   9.502  -1.525
  120    HA   HIS  19           HA       HIS  19   4.263  11.475  -0.273
  121    HB2  HIS  19           HB2      HIS  19   4.062  10.764  -2.690
  122    HB3  HIS  19           HB3      HIS  19   3.440   9.223  -2.110
  123    HD1  HIS  19           HD1      HIS  19   1.030   9.163  -1.268
  124    HD2  HIS  19           HD2      HIS  19   2.315  12.964  -2.346
  125    HE1  HIS  19           HE1      HIS  19  -1.042  10.586  -1.308
  126    H    GLY  20           H        GLY  20   4.756   7.981  -0.164
  127    HA2  GLY  20           HA2      GLY  20   3.748   7.796   2.487
  128    HA3  GLY  20           HA3      GLY  20   2.555   7.214   1.336
  129    H    TYR  21           H        TYR  21   3.996   5.888  -0.511
  130    HA   TYR  21           HA       TYR  21   5.560   3.908   1.003
  131    HB2  TYR  21           HB2      TYR  21   3.439   3.301  -1.068
  132    HB3  TYR  21           HB3      TYR  21   4.482   2.109  -0.300
  133    HD1  TYR  21           HD1      TYR  21   1.284   3.319  -0.272
  134    HD2  TYR  21           HD2      TYR  21   4.448   2.454   2.437
  135    HE1  TYR  21           HE1      TYR  21  -0.351   3.071   1.549
  136    HE2  TYR  21           HE2      TYR  21   2.822   2.203   4.266
  137    HH   TYR  21           HH       TYR  21  -0.655   2.681   3.710
  138    H    GLY  22           H        GLY  22   7.124   2.742  -0.205
  139    HA2  GLY  22           HA2      GLY  22   7.575   3.218  -2.979
  140    HA3  GLY  22           HA3      GLY  22   8.635   4.212  -1.991
  141    H    CYS  23           H        CYS  23   9.161   1.923  -3.841
  142    HA   CYS  23           HA       CYS  23  10.081  -0.216  -2.141
  143    HB2  CYS  23           HB2      CYS  23  10.290   0.343  -5.093
  144    HB3  CYS  23           HB3      CYS  23  11.132  -1.010  -4.346
  145    H    CYS  24           H        CYS  24  11.990  -0.348  -1.169
  146    HA   CYS  24           HA       CYS  24  14.015   1.671  -1.767
  147    HB2  CYS  24           HB2      CYS  24  13.367  -0.046   0.575
  148    HB3  CYS  24           HB3      CYS  24  15.053   0.408   0.350
  Start of MODEL    7
    1    H1   CYS   1           H        CYS   1   2.117   0.378  -0.647
    2    HA   CYS   1           HA       CYS   1   2.819   0.928  -3.456
    3    HB2  CYS   1           HB2      CYS   1   4.587  -0.831  -3.137
    4    HB3  CYS   1           HB3      CYS   1   4.829   0.631  -2.187
    5    H    ALA   2           H        ALA   2   0.380   0.201  -3.455
    6    HA   ALA   2           HA       ALA   2  -0.194  -2.562  -3.183
    7    HB1  ALA   2           HB1      ALA   2  -1.984  -1.415  -5.047
    8    HB2  ALA   2           HB2      ALA   2  -2.255  -1.759  -3.338
    9    HB3  ALA   2           HB3      ALA   2  -1.625  -0.188  -3.832
   10    H    ASP   3           H        ASP   3   0.334  -0.534  -6.067
   11    HA   ASP   3           HA       ASP   3   0.461  -2.871  -7.770
   12    HB2  ASP   3           HB2      ASP   3   0.862  -1.214  -9.583
   13    HB3  ASP   3           HB3      ASP   3  -0.604  -0.889  -8.661
   14    H    ALA   4           H        ALA   4   2.662  -0.557  -6.323
   15    HA   ALA   4           HA       ALA   4   4.971  -0.972  -7.763
   16    HB1  ALA   4           HB1      ALA   4   5.876   0.314  -6.190
   17    HB2  ALA   4           HB2      ALA   4   4.305   0.296  -5.387
   18    HB3  ALA   4           HB3      ALA   4   5.543  -0.873  -4.929
   19    H    VAL   5           H        VAL   5   3.455  -3.069  -5.408
   20    HA   VAL   5           HA       VAL   5   5.491  -4.783  -4.721
   21    HB   VAL   5           HB       VAL   5   3.150  -4.903  -3.866
   22   HG11  VAL   5          HG11      VAL   5   1.391  -5.691  -5.079
   23   HG12  VAL   5          HG12      VAL   5   2.330  -4.971  -6.389
   24   HG13  VAL   5          HG13      VAL   5   2.406  -6.709  -6.100
   25   HG21  VAL   5          HG21      VAL   5   5.032  -6.893  -4.107
   26   HG22  VAL   5          HG22      VAL   5   3.600  -6.947  -3.078
   27   HG23  VAL   5          HG23      VAL   5   3.558  -7.669  -4.687
   28    H    TYR   6           H        TYR   6   3.756  -4.567  -7.751
   29    HA   TYR   6           HA       TYR   6   4.341  -6.996  -8.920
   30    HB2  TYR   6           HB2      TYR   6   3.854  -4.250  -9.953
   31    HB3  TYR   6           HB3      TYR   6   4.534  -5.423 -11.076
   32    HD1  TYR   6           HD1      TYR   6   3.178  -7.084 -12.062
   33    HD2  TYR   6           HD2      TYR   6   1.658  -4.772  -8.830
   34    HE1  TYR   6           HE1      TYR   6   0.932  -7.999 -12.472
   35    HE2  TYR   6           HE2      TYR   6  -0.592  -5.682  -9.229
   36    HH   TYR   6           HH       TYR   6  -1.784  -6.724 -11.476
   37    H    THR   7           H        THR   7   6.246  -4.010  -9.365
   38    HA   THR   7           HA       THR   7   8.454  -5.403 -10.513
   39    HB   THR   7           HB       THR   7   9.618  -3.286 -10.491
   40    HG1  THR   7           HG1      THR   7   7.536  -2.482  -8.724
   41   HG21  THR   7          HG21      THR   7   7.980  -1.862 -11.663
   42   HG22  THR   7          HG22      THR   7   6.683  -2.916 -11.101
   43   HG23  THR   7          HG23      THR   7   7.910  -3.539 -12.203
   44    H    CYS   8           H        CYS   8   7.822  -3.977  -7.327
   45    HA   CYS   8           HA       CYS   8  10.290  -4.321  -6.142
   46    HB2  CYS   8           HB2      CYS   8   7.547  -4.627  -4.905
   47    HB3  CYS   8           HB3      CYS   8   9.042  -4.481  -3.987
   48    H    ARG   9           H        ARG   9   7.758  -6.691  -6.710
   49    HA   ARG   9           HA       ARG   9   8.587  -8.772  -5.099
   50    HB2  ARG   9           HB2      ARG   9   7.141  -8.593  -7.692
   51    HB3  ARG   9           HB3      ARG   9   7.744 -10.174  -7.213
   52    HG2  ARG   9           HG2      ARG   9   6.195  -8.584  -5.235
   53    HG3  ARG   9           HG3      ARG   9   5.334  -9.376  -6.556
   54    HD2  ARG   9           HD2      ARG   9   6.513 -11.501  -5.903
   55    HD3  ARG   9           HD3      ARG   9   7.083 -10.654  -4.465
   56    HE   ARG   9           HE       ARG   9   4.296 -10.387  -4.631
   57   HH11  ARG   9          HH11      ARG   9   6.718 -12.818  -4.046
   58   HH12  ARG   9          HH12      ARG   9   5.690 -13.787  -3.043
   59   HH21  ARG   9          HH21      ARG   9   2.933 -11.654  -3.312
   60   HH22  ARG   9          HH22      ARG   9   3.537 -13.124  -2.627
   61    H    ALA  10           H        ALA  10   9.888  -7.709  -8.185
   62    HA   ALA  10           HA       ALA  10  11.495  -9.881  -8.828
   63    HB1  ALA  10           HB1      ALA  10  12.808  -8.344 -10.164
   64    HB2  ALA  10           HB2      ALA  10  11.092  -7.965 -10.317
   65    HB3  ALA  10           HB3      ALA  10  12.127  -6.969  -9.293
   66    H    GLY  11           H        GLY  11  12.386  -6.976  -6.955
   67    HA2  GLY  11           HA2      GLY  11  13.947  -8.388  -5.084
   68    HA3  GLY  11           HA3      GLY  11  15.004  -7.767  -6.344
   69    H    GLN  12           H        GLN  12  12.294  -6.608  -4.332
   70    HA   GLN  12           HA       GLN  12  13.895  -4.475  -3.271
   71    HB2  GLN  12           HB2      GLN  12  12.252  -4.011  -5.612
   72    HB3  GLN  12           HB3      GLN  12  11.730  -3.011  -4.262
   73    HG2  GLN  12           HG2      GLN  12  13.321  -1.592  -4.865
   74    HG3  GLN  12           HG3      GLN  12  14.471  -2.760  -4.216
   75   HE21  GLN  12          HE21      GLN  12  12.497  -2.576  -7.161
   76   HE22  GLN  12          HE22      GLN  12  13.805  -2.839  -8.259
   77    H    THR  13           H        THR  13  12.839  -3.318  -1.575
   78    HA   THR  13           HA       THR  13  10.435  -4.693  -0.565
   79    HB   THR  13           HB       THR  13  12.225  -3.215   1.305
   80    HG1  THR  13           HG1      THR  13  12.796  -5.766   0.170
   81   HG21  THR  13          HG21      THR  13  10.755  -4.148   2.702
   82   HG22  THR  13          HG22      THR  13  11.490  -5.706   2.323
   83   HG23  THR  13          HG23      THR  13  10.081  -5.152   1.419
   84    H    CYS  14           H        CYS  14   8.923  -3.427   0.658
   85    HA   CYS  14           HA       CYS  14   8.536  -0.807  -0.472
   86    HB2  CYS  14           HB2      CYS  14   6.733  -2.577   0.086
   87    HB3  CYS  14           HB3      CYS  14   6.874  -1.989   1.739
   88    H    CYS  15           H        CYS  15   8.844   1.134   0.468
   89    HA   CYS  15           HA       CYS  15   9.630   1.194   3.302
   90    HB2  CYS  15           HB2      CYS  15  10.963   2.770   1.089
   91    HB3  CYS  15           HB3      CYS  15  11.384   2.812   2.799
   92    H    ARG  16           H        ARG  16   9.492   3.398   4.251
   93    HA   ARG  16           HA       ARG  16   6.988   4.612   3.482
   94    HB2  ARG  16           HB2      ARG  16   7.671   4.201   5.866
   95    HB3  ARG  16           HB3      ARG  16   8.881   5.463   5.676
   96    HG2  ARG  16           HG2      ARG  16   7.028   7.038   5.101
   97    HG3  ARG  16           HG3      ARG  16   5.892   5.760   5.536
   98    HD2  ARG  16           HD2      ARG  16   6.061   7.024   7.483
   99    HD3  ARG  16           HD3      ARG  16   7.162   5.677   7.768
  100    HE   ARG  16           HE       ARG  16   8.881   7.172   7.863
  101   HH11  ARG  16          HH11      ARG  16   6.197   8.661   6.219
  102   HH12  ARG  16          HH12      ARG  16   6.954  10.217   6.118
  103   HH21  ARG  16          HH21      ARG  16   9.887   9.215   7.737
  104   HH22  ARG  16          HH22      ARG  16   9.053  10.531   6.981
  105    H    GLY  17           H        GLY  17   7.608   5.470   1.419
  106    HA2  GLY  17           HA2      GLY  17   9.724   7.269   1.009
  107    HA3  GLY  17           HA3      GLY  17   8.278   7.158   0.017
  108    H    LEU  18           H        LEU  18   9.062   9.578   0.066
  109    HA   LEU  18           HA       LEU  18   8.539  11.200   2.279
  110    HB2  LEU  18           HB2      LEU  18   8.174  11.964  -0.611
  111    HB3  LEU  18           HB3      LEU  18   8.489  13.047   0.743
  112    HG   LEU  18           HG       LEU  18  10.451  10.958  -0.182
  113   HD11  LEU  18          HD11      LEU  18   9.715  13.445  -1.437
  114   HD12  LEU  18          HD12      LEU  18  10.839  12.200  -1.980
  115   HD13  LEU  18          HD13      LEU  18  11.394  13.478  -0.898
  116   HD21  LEU  18          HD21      LEU  18  11.997  12.664   0.974
  117   HD22  LEU  18          HD22      LEU  18  11.023  11.592   1.981
  118   HD23  LEU  18          HD23      LEU  18  10.520  13.264   1.729
  119    H    HIS  19           H        HIS  19   6.439  10.503  -0.517
  120    HA   HIS  19           HA       HIS  19   4.196  11.901   0.403
  121    HB2  HIS  19           HB2      HIS  19   4.563  11.012  -1.927
  122    HB3  HIS  19           HB3      HIS  19   4.139   9.416  -1.315
  123    HD1  HIS  19           HD1      HIS  19   2.005   9.182  -2.680
  124    HD2  HIS  19           HD2      HIS  19   2.070  12.585  -0.298
  125    HE1  HIS  19           HE1      HIS  19  -0.336  10.097  -2.751
  126    H    GLY  20           H        GLY  20   4.879   8.402   0.584
  127    HA2  GLY  20           HA2      GLY  20   3.974   8.075   3.208
  128    HA3  GLY  20           HA3      GLY  20   2.611   7.769   2.141
  129    H    TYR  21           H        TYR  21   3.706   6.459   0.046
  130    HA   TYR  21           HA       TYR  21   5.067   4.137   1.236
  131    HB2  TYR  21           HB2      TYR  21   2.575   4.211  -0.429
  132    HB3  TYR  21           HB3      TYR  21   3.633   2.806  -0.497
  133    HD1  TYR  21           HD1      TYR  21   0.929   4.326   1.204
  134    HD2  TYR  21           HD2      TYR  21   4.250   1.734   1.799
  135    HE1  TYR  21           HE1      TYR  21  -0.137   3.435   3.234
  136    HE2  TYR  21           HE2      TYR  21   3.193   0.836   3.829
  137    HH   TYR  21           HH       TYR  21   1.225   2.031   5.561
  138    H    GLY  22           H        GLY  22   6.483   3.007  -0.105
  139    HA2  GLY  22           HA2      GLY  22   6.825   3.213  -2.827
  140    HA3  GLY  22           HA3      GLY  22   7.714   4.573  -2.157
  141    H    CYS  23           H        CYS  23   8.279   1.740  -3.419
  142    HA   CYS  23           HA       CYS  23   9.814   0.350  -1.486
  143    HB2  CYS  23           HB2      CYS  23   9.490   0.229  -4.447
  144    HB3  CYS  23           HB3      CYS  23  10.902  -0.552  -3.743
  145    H    CYS  24           H        CYS  24  12.019   0.297  -1.121
  146    HA   CYS  24           HA       CYS  24  13.406   2.756  -1.449
  147    HB2  CYS  24           HB2      CYS  24  14.125   0.060  -0.344
  148    HB3  CYS  24           HB3      CYS  24  15.374   1.279  -0.579
  Start of MODEL    8
    1    H1   CYS   1           H        CYS   1   2.345   1.911  -1.733
    2    HA   CYS   1           HA       CYS   1   3.160   0.811  -3.555
    3    HB2  CYS   1           HB2      CYS   1   4.757  -1.065  -3.014
    4    HB3  CYS   1           HB3      CYS   1   5.083   0.452  -2.182
    5    H    ALA   2           H        ALA   2   0.529   0.205  -3.117
    6    HA   ALA   2           HA       ALA   2  -0.129  -2.504  -2.901
    7    HB1  ALA   2           HB1      ALA   2  -2.254  -1.884  -3.423
    8    HB2  ALA   2           HB2      ALA   2  -1.592  -0.294  -3.039
    9    HB3  ALA   2           HB3      ALA   2  -1.741  -0.805  -4.720
   10    H    ASP   3           H        ASP   3   0.351  -0.543  -5.840
   11    HA   ASP   3           HA       ASP   3   0.287  -2.908  -7.509
   12    HB2  ASP   3           HB2      ASP   3   1.036  -0.125  -8.394
   13    HB3  ASP   3           HB3      ASP   3   0.361  -1.433  -9.362
   14    H    ALA   4           H        ALA   4   2.661  -0.678  -6.210
   15    HA   ALA   4           HA       ALA   4   4.875  -1.224  -7.752
   16    HB1  ALA   4           HB1      ALA   4   4.367  -0.085  -5.172
   17    HB2  ALA   4           HB2      ALA   4   5.819  -1.085  -5.112
   18    HB3  ALA   4           HB3      ALA   4   5.699   0.224  -6.287
   19    H    VAL   5           H        VAL   5   3.378  -3.209  -5.292
   20    HA   VAL   5           HA       VAL   5   5.365  -5.005  -4.669
   21    HB   VAL   5           HB       VAL   5   3.064  -5.000  -3.703
   22   HG11  VAL   5          HG11      VAL   5   2.037  -4.989  -6.083
   23   HG12  VAL   5          HG12      VAL   5   2.210  -6.742  -5.980
   24   HG13  VAL   5          HG13      VAL   5   1.223  -5.881  -4.798
   25   HG21  VAL   5          HG21      VAL   5   4.816  -7.146  -4.127
   26   HG22  VAL   5          HG22      VAL   5   3.598  -6.988  -2.862
   27   HG23  VAL   5          HG23      VAL   5   3.193  -7.788  -4.381
   28    H    TYR   6           H        TYR   6   3.502  -4.752  -7.618
   29    HA   TYR   6           HA       TYR   6   3.907  -7.224  -8.771
   30    HB2  TYR   6           HB2      TYR   6   3.517  -4.472  -9.826
   31    HB3  TYR   6           HB3      TYR   6   4.091  -5.690 -10.959
   32    HD1  TYR   6           HD1      TYR   6   2.614  -7.284 -11.875
   33    HD2  TYR   6           HD2      TYR   6   1.348  -4.882  -8.599
   34    HE1  TYR   6           HE1      TYR   6   0.312  -8.093 -12.180
   35    HE2  TYR   6           HE2      TYR   6  -0.958  -5.685  -8.894
   36    HH   TYR   6           HH       TYR   6  -2.112  -7.648  -9.872
   37    H    THR   7           H        THR   7   5.937  -4.354  -9.389
   38    HA   THR   7           HA       THR   7   8.039  -5.957 -10.512
   39    HB   THR   7           HB       THR   7   9.286  -3.859 -10.716
   40    HG1  THR   7           HG1      THR   7   7.083  -2.723  -9.303
   41   HG21  THR   7          HG21      THR   7   7.949  -4.045 -12.570
   42   HG22  THR   7          HG22      THR   7   7.328  -2.534 -11.905
   43   HG23  THR   7          HG23      THR   7   6.458  -4.043 -11.629
   44    H    CYS   8           H        CYS   8   7.506  -4.227  -7.476
   45    HA   CYS   8           HA       CYS   8  10.012  -4.409  -6.337
   46    HB2  CYS   8           HB2      CYS   8   7.270  -4.556  -5.089
   47    HB3  CYS   8           HB3      CYS   8   8.744  -4.518  -4.127
   48    H    ARG   9           H        ARG   9   7.535  -6.878  -6.639
   49    HA   ARG   9           HA       ARG   9   8.432  -8.789  -4.866
   50    HB2  ARG   9           HB2      ARG   9   6.965  -8.874  -7.452
   51    HB3  ARG   9           HB3      ARG   9   7.614 -10.391  -6.845
   52    HG2  ARG   9           HG2      ARG   9   5.997  -8.650  -5.041
   53    HG3  ARG   9           HG3      ARG   9   5.195  -9.668  -6.238
   54    HD2  ARG   9           HD2      ARG   9   5.251 -11.066  -4.408
   55    HD3  ARG   9           HD3      ARG   9   6.722 -11.539  -5.258
   56    HE   ARG   9           HE       ARG   9   7.962 -10.698  -3.520
   57   HH11  ARG   9          HH11      ARG   9   4.672  -9.593  -3.238
   58   HH12  ARG   9          HH12      ARG   9   4.896  -8.924  -1.656
   59   HH21  ARG   9          HH21      ARG   9   8.268  -9.820  -1.438
   60   HH22  ARG   9          HH22      ARG   9   6.942  -9.052  -0.633
   61    H    ALA  10           H        ALA  10   9.709  -7.934  -8.020
   62    HA   ALA  10           HA       ALA  10  11.355 -10.114  -8.516
   63    HB1  ALA  10           HB1      ALA  10  12.386  -8.828 -10.129
   64    HB2  ALA  10           HB2      ALA  10  10.839  -8.000  -9.942
   65    HB3  ALA  10           HB3      ALA  10  12.286  -7.352  -9.168
   66    H    GLY  11           H        GLY  11  11.849  -7.345  -6.404
   67    HA2  GLY  11           HA2      GLY  11  13.467  -8.449  -4.551
   68    HA3  GLY  11           HA3      GLY  11  14.597  -8.061  -5.840
   69    H    GLN  12           H        GLN  12  12.017  -6.577  -3.889
   70    HA   GLN  12           HA       GLN  12  13.725  -4.246  -3.499
   71    HB2  GLN  12           HB2      GLN  12  10.909  -4.072  -4.584
   72    HB3  GLN  12           HB3      GLN  12  11.860  -2.700  -4.033
   73    HG2  GLN  12           HG2      GLN  12  12.747  -4.522  -6.249
   74    HG3  GLN  12           HG3      GLN  12  11.785  -3.070  -6.517
   75   HE21  GLN  12          HE21      GLN  12  12.930  -1.385  -7.099
   76   HE22  GLN  12          HE22      GLN  12  14.556  -1.038  -6.631
   77    H    THR  13           H        THR  13  12.503  -2.648  -1.966
   78    HA   THR  13           HA       THR  13  10.962  -4.160   0.028
   79    HB   THR  13           HB       THR  13  12.237  -2.971   1.833
   80    HG1  THR  13           HG1      THR  13  13.145  -1.427   0.175
   81   HG21  THR  13          HG21      THR  13  14.408  -4.446   0.609
   82   HG22  THR  13          HG22      THR  13  12.872  -5.295   0.439
   83   HG23  THR  13          HG23      THR  13  13.453  -4.833   2.039
   84    H    CYS  14           H        CYS  14   9.136  -3.152   0.522
   85    HA   CYS  14           HA       CYS  14   8.483  -0.589  -0.464
   86    HB2  CYS  14           HB2      CYS  14   6.892  -2.502   0.107
   87    HB3  CYS  14           HB3      CYS  14   7.048  -1.995   1.786
   88    H    CYS  15           H        CYS  15   9.232   1.282   0.259
   89    HA   CYS  15           HA       CYS  15   9.744   1.572   3.148
   90    HB2  CYS  15           HB2      CYS  15  11.079   3.063   0.879
   91    HB3  CYS  15           HB3      CYS  15  11.454   3.220   2.592
   92    H    ARG  16           H        ARG  16   9.706   3.988   3.795
   93    HA   ARG  16           HA       ARG  16   7.219   5.132   2.721
   94    HB2  ARG  16           HB2      ARG  16   8.537   5.644   5.393
   95    HB3  ARG  16           HB3      ARG  16   6.979   6.266   4.867
   96    HG2  ARG  16           HG2      ARG  16   5.999   4.112   4.919
   97    HG3  ARG  16           HG3      ARG  16   7.569   3.330   5.110
   98    HD2  ARG  16           HD2      ARG  16   7.790   4.060   7.322
   99    HD3  ARG  16           HD3      ARG  16   6.545   5.294   7.132
  100    HE   ARG  16           HE       ARG  16   5.511   2.660   6.769
  101   HH11  ARG  16          HH11      ARG  16   6.454   4.997   9.170
  102   HH12  ARG  16          HH12      ARG  16   5.401   4.362  10.391
  103   HH21  ARG  16          HH21      ARG  16   4.121   1.814   8.367
  104   HH22  ARG  16          HH22      ARG  16   4.075   2.551   9.933
  105    H    GLY  17           H        GLY  17   8.168   6.259   0.992
  106    HA2  GLY  17           HA2      GLY  17  10.354   8.066   1.379
  107    HA3  GLY  17           HA3      GLY  17   9.339   7.951  -0.051
  108    H    LEU  18           H        LEU  18   9.635  10.336   0.038
  109    HA   LEU  18           HA       LEU  18   8.518  11.911   2.081
  110    HB2  LEU  18           HB2      LEU  18   9.172  12.389  -0.798
  111    HB3  LEU  18           HB3      LEU  18   8.325  13.620   0.137
  112    HG   LEU  18           HG       LEU  18  11.037  12.490   0.825
  113   HD11  LEU  18          HD11      LEU  18  10.385  14.271  -1.209
  114   HD12  LEU  18          HD12      LEU  18  11.978  13.998  -0.506
  115   HD13  LEU  18          HD13      LEU  18  10.949  15.286   0.118
  116   HD21  LEU  18          HD21      LEU  18   9.132  14.212   2.218
  117   HD22  LEU  18          HD22      LEU  18  10.750  14.902   2.087
  118   HD23  LEU  18          HD23      LEU  18  10.523  13.322   2.837
  119    H    HIS  19           H        HIS  19   7.138  10.547  -0.865
  120    HA   HIS  19           HA       HIS  19   4.633  11.869  -0.665
  121    HB2  HIS  19           HB2      HIS  19   5.779  10.555  -2.660
  122    HB3  HIS  19           HB3      HIS  19   4.861   9.205  -1.998
  123    HD1  HIS  19           HD1      HIS  19   2.441  11.273  -1.192
  124    HD2  HIS  19           HD2      HIS  19   4.104  10.565  -4.933
  125    HE1  HIS  19           HE1      HIS  19   0.677  11.949  -2.851
  126    H    GLY  20           H        GLY  20   5.808   8.702   0.401
  127    HA2  GLY  20           HA2      GLY  20   4.604   8.296   2.701
  128    HA3  GLY  20           HA3      GLY  20   3.214   8.138   1.636
  129    H    TYR  21           H        TYR  21   4.138   6.732  -0.466
  130    HA   TYR  21           HA       TYR  21   5.286   4.284   0.694
  131    HB2  TYR  21           HB2      TYR  21   2.813   4.576  -0.995
  132    HB3  TYR  21           HB3      TYR  21   3.705   3.060  -0.935
  133    HD1  TYR  21           HD1      TYR  21   1.152   4.984   0.574
  134    HD2  TYR  21           HD2      TYR  21   4.146   2.091   1.446
  135    HE1  TYR  21           HE1      TYR  21  -0.054   4.364   2.626
  136    HE2  TYR  21           HE2      TYR  21   2.948   1.461   3.499
  137    HH   TYR  21           HH       TYR  21   1.052   3.024   5.076
  138    H    GLY  22           H        GLY  22   6.802   3.272  -0.512
  139    HA2  GLY  22           HA2      GLY  22   7.051   3.283  -3.281
  140    HA3  GLY  22           HA3      GLY  22   7.979   4.653  -2.691
  141    H    CYS  23           H        CYS  23   8.399   1.688  -3.773
  142    HA   CYS  23           HA       CYS  23   9.943   0.369  -1.823
  143    HB2  CYS  23           HB2      CYS  23   9.586   0.140  -4.770
  144    HB3  CYS  23           HB3      CYS  23  11.002  -0.630  -4.062
  145    H    CYS  24           H        CYS  24  12.099   0.378  -1.354
  146    HA   CYS  24           HA       CYS  24  13.554   2.759  -1.886
  147    HB2  CYS  24           HB2      CYS  24  14.136   0.188  -0.465
  148    HB3  CYS  24           HB3      CYS  24  15.462   1.287  -0.830
  Start of MODEL    9
    1    H1   CYS   1           H        CYS   1   1.902   2.168  -1.521
    2    HA   CYS   1           HA       CYS   1   3.117   0.540  -2.572
    3    HB2  CYS   1           HB2      CYS   1   3.938   0.606  -0.133
    4    HB3  CYS   1           HB3      CYS   1   3.048  -0.899   0.073
    5    H    ALA   2           H        ALA   2   0.299   0.206  -2.844
    6    HA   ALA   2           HA       ALA   2  -0.326  -2.583  -2.481
    7    HB1  ALA   2           HB1      ALA   2  -2.436  -2.057  -3.551
    8    HB2  ALA   2           HB2      ALA   2  -2.057  -0.843  -2.327
    9    HB3  ALA   2           HB3      ALA   2  -1.822  -0.476  -4.036
   10    H    ASP   3           H        ASP   3   0.160  -0.469  -5.311
   11    HA   ASP   3           HA       ASP   3   0.270  -2.754  -7.085
   12    HB2  ASP   3           HB2      ASP   3   0.568  -1.088  -8.864
   13    HB3  ASP   3           HB3      ASP   3  -0.807  -0.685  -7.839
   14    H    ALA   4           H        ALA   4   2.484  -0.484  -5.592
   15    HA   ALA   4           HA       ALA   4   4.776  -0.845  -7.072
   16    HB1  ALA   4           HB1      ALA   4   5.220  -0.837  -4.169
   17    HB2  ALA   4           HB2      ALA   4   5.813   0.263  -5.414
   18    HB3  ALA   4           HB3      ALA   4   4.183   0.456  -4.770
   19    H    VAL   5           H        VAL   5   3.292  -3.025  -4.774
   20    HA   VAL   5           HA       VAL   5   5.342  -4.758  -4.175
   21    HB   VAL   5           HB       VAL   5   3.018  -4.911  -3.284
   22   HG11  VAL   5          HG11      VAL   5   2.279  -6.594  -5.633
   23   HG12  VAL   5          HG12      VAL   5   1.242  -5.742  -4.487
   24   HG13  VAL   5          HG13      VAL   5   2.102  -4.842  -5.737
   25   HG21  VAL   5          HG21      VAL   5   4.876  -6.808  -3.403
   26   HG22  VAL   5          HG22      VAL   5   3.291  -7.089  -2.682
   27   HG23  VAL   5          HG23      VAL   5   3.616  -7.620  -4.332
   28    H    TYR   6           H        TYR   6   3.553  -4.445  -7.166
   29    HA   TYR   6           HA       TYR   6   4.124  -6.832  -8.425
   30    HB2  TYR   6           HB2      TYR   6   3.621  -4.053  -9.363
   31    HB3  TYR   6           HB3      TYR   6   4.269  -5.197 -10.533
   32    HD1  TYR   6           HD1      TYR   6   2.874  -6.790 -11.561
   33    HD2  TYR   6           HD2      TYR   6   1.455  -4.629  -8.181
   34    HE1  TYR   6           HE1      TYR   6   0.615  -7.684 -11.945
   35    HE2  TYR   6           HE2      TYR   6  -0.807  -5.518  -8.555
   36    HH   TYR   6           HH       TYR   6  -1.774  -6.951 -11.382
   37    H    THR   7           H        THR   7   6.004  -3.828  -8.845
   38    HA   THR   7           HA       THR   7   8.189  -5.147 -10.089
   39    HB   THR   7           HB       THR   7   8.380  -2.471  -8.719
   40    HG1  THR   7           HG1      THR   7   6.857  -1.820 -10.028
   41   HG21  THR   7          HG21      THR   7   9.922  -3.977 -10.726
   42   HG22  THR   7          HG22      THR   7  10.448  -2.739  -9.586
   43   HG23  THR   7          HG23      THR   7   9.667  -2.272 -11.096
   44    H    CYS   8           H        CYS   8   7.615  -3.974  -6.795
   45    HA   CYS   8           HA       CYS   8  10.111  -4.390  -5.688
   46    HB2  CYS   8           HB2      CYS   8   7.477  -3.898  -4.733
   47    HB3  CYS   8           HB3      CYS   8   8.145  -5.226  -3.790
   48    H    ARG   9           H        ARG   9   7.573  -6.720  -6.380
   49    HA   ARG   9           HA       ARG   9   8.586  -8.904  -4.953
   50    HB2  ARG   9           HB2      ARG   9   6.811  -8.619  -7.348
   51    HB3  ARG   9           HB3      ARG   9   7.373 -10.216  -6.871
   52    HG2  ARG   9           HG2      ARG   9   6.031  -8.382  -4.918
   53    HG3  ARG   9           HG3      ARG   9   5.108  -9.430  -5.997
   54    HD2  ARG   9           HD2      ARG   9   7.284 -10.443  -4.181
   55    HD3  ARG   9           HD3      ARG   9   5.592 -10.351  -3.693
   56    HE   ARG   9           HE       ARG   9   5.603 -11.742  -6.065
   57   HH11  ARG   9          HH11      ARG   9   7.042 -12.116  -2.917
   58   HH12  ARG   9          HH12      ARG   9   7.059 -13.847  -2.987
   59   HH21  ARG   9          HH21      ARG   9   5.620 -14.020  -6.169
   60   HH22  ARG   9          HH22      ARG   9   6.251 -14.929  -4.838
   61    H    ALA  10           H        ALA  10   9.402  -7.615  -8.113
   62    HA   ALA  10           HA       ALA  10  10.844  -9.738  -9.175
   63    HB1  ALA  10           HB1      ALA  10  11.727  -8.233 -10.709
   64    HB2  ALA  10           HB2      ALA  10  10.214  -7.469 -10.223
   65    HB3  ALA  10           HB3      ALA  10  11.742  -6.905  -9.548
   66    H    GLY  11           H        GLY  11  12.078  -7.009  -7.231
   67    HA2  GLY  11           HA2      GLY  11  13.847  -8.545  -5.703
   68    HA3  GLY  11           HA3      GLY  11  14.736  -7.942  -7.095
   69    H    GLN  12           H        GLN  12  12.505  -6.759  -4.579
   70    HA   GLN  12           HA       GLN  12  14.357  -4.707  -3.806
   71    HB2  GLN  12           HB2      GLN  12  13.021  -3.907  -5.915
   72    HB3  GLN  12           HB3      GLN  12  11.719  -3.660  -4.759
   73    HG2  GLN  12           HG2      GLN  12  12.597  -1.739  -4.117
   74    HG3  GLN  12           HG3      GLN  12  14.124  -2.527  -3.721
   75   HE21  GLN  12          HE21      GLN  12  12.359  -1.766  -6.709
   76   HE22  GLN  12          HE22      GLN  12  13.693  -1.012  -7.506
   77    H    THR  13           H        THR  13  13.341  -3.258  -2.093
   78    HA   THR  13           HA       THR  13  11.400  -4.822  -0.517
   79    HB   THR  13           HB       THR  13  12.525  -3.723   1.502
   80    HG1  THR  13           HG1      THR  13  13.803  -2.356  -0.162
   81   HG21  THR  13          HG21      THR  13  13.999  -5.521   1.765
   82   HG22  THR  13          HG22      THR  13  14.362  -5.595   0.041
   83   HG23  THR  13          HG23      THR  13  12.792  -6.132   0.635
   84    H    CYS  14           H        CYS  14   9.569  -3.809  -0.037
   85    HA   CYS  14           HA       CYS  14   9.062  -1.148  -0.862
   86    HB2  CYS  14           HB2      CYS  14   7.287  -2.818  -0.796
   87    HB3  CYS  14           HB3      CYS  14   7.466  -2.971   0.949
   88    H    CYS  15           H        CYS  15   9.343   0.724   0.160
   89    HA   CYS  15           HA       CYS  15   9.763   0.684   3.075
   90    HB2  CYS  15           HB2      CYS  15  11.191   2.542   1.170
   91    HB3  CYS  15           HB3      CYS  15  11.509   2.312   2.887
   92    H    ARG  16           H        ARG  16   9.554   2.970   4.006
   93    HA   ARG  16           HA       ARG  16   7.059   4.092   2.981
   94    HB2  ARG  16           HB2      ARG  16   7.601   3.421   5.468
   95    HB3  ARG  16           HB3      ARG  16   8.352   5.010   5.516
   96    HG2  ARG  16           HG2      ARG  16   5.519   4.587   4.615
   97    HG3  ARG  16           HG3      ARG  16   5.958   4.866   6.302
   98    HD2  ARG  16           HD2      ARG  16   7.205   6.937   5.390
   99    HD3  ARG  16           HD3      ARG  16   6.209   6.709   3.953
  100    HE   ARG  16           HE       ARG  16   4.447   6.679   6.049
  101   HH11  ARG  16          HH11      ARG  16   6.830   8.905   4.832
  102   HH12  ARG  16          HH12      ARG  16   5.985  10.314   5.381
  103   HH21  ARG  16          HH21      ARG  16   3.325   8.526   6.778
  104   HH22  ARG  16          HH22      ARG  16   3.992  10.098   6.489
  105    H    GLY  17           H        GLY  17   7.709   5.362   1.261
  106    HA2  GLY  17           HA2      GLY  17   9.909   7.134   1.309
  107    HA3  GLY  17           HA3      GLY  17   8.561   7.202   0.184
  108    H    LEU  18           H        LEU  18   9.747   9.512   1.082
  109    HA   LEU  18           HA       LEU  18   8.749  10.718   3.354
  110    HB2  LEU  18           HB2      LEU  18   9.292  12.790   2.381
  111    HB3  LEU  18           HB3      LEU  18  10.447  11.627   1.734
  112    HG   LEU  18           HG       LEU  18   7.996  12.507   0.224
  113   HD11  LEU  18          HD11      LEU  18   9.285  14.138  -0.904
  114   HD12  LEU  18          HD12      LEU  18  10.775  13.600  -0.131
  115   HD13  LEU  18          HD13      LEU  18   9.532  14.413   0.820
  116   HD21  LEU  18          HD21      LEU  18   8.907  10.452  -0.585
  117   HD22  LEU  18          HD22      LEU  18  10.547  11.099  -0.543
  118   HD23  LEU  18          HD23      LEU  18   9.378  11.731  -1.704
  119    H    HIS  19           H        HIS  19   7.180  10.172   0.270
  120    HA   HIS  19           HA       HIS  19   4.912  11.832   0.848
  121    HB2  HIS  19           HB2      HIS  19   5.636  11.373  -1.467
  122    HB3  HIS  19           HB3      HIS  19   5.245   9.671  -1.244
  123    HD1  HIS  19           HD1      HIS  19   2.744   9.019  -1.243
  124    HD2  HIS  19           HD2      HIS  19   3.444  13.066  -1.868
  125    HE1  HIS  19           HE1      HIS  19   0.556   9.963  -2.046
  126    H    GLY  20           H        GLY  20   5.658   8.387   1.053
  127    HA2  GLY  20           HA2      GLY  20   4.148   7.707   3.185
  128    HA3  GLY  20           HA3      GLY  20   2.970   7.705   1.881
  129    H    TYR  21           H        TYR  21   4.283   6.625  -0.206
  130    HA   TYR  21           HA       TYR  21   5.293   4.040   0.768
  131    HB2  TYR  21           HB2      TYR  21   3.401   4.338  -1.568
  132    HB3  TYR  21           HB3      TYR  21   3.958   2.842  -0.827
  133    HD1  TYR  21           HD1      TYR  21   1.172   4.734  -1.170
  134    HD2  TYR  21           HD2      TYR  21   3.525   3.023   1.934
  135    HE1  TYR  21           HE1      TYR  21  -0.788   4.749   0.316
  136    HE2  TYR  21           HE2      TYR  21   1.571   3.032   3.429
  137    HH   TYR  21           HH       TYR  21  -1.452   4.554   2.490
  138    H    GLY  22           H        GLY  22   6.858   3.049  -0.482
  139    HA2  GLY  22           HA2      GLY  22   7.568   3.709  -3.101
  140    HA3  GLY  22           HA3      GLY  22   8.510   4.737  -2.032
  141    H    CYS  23           H        CYS  23   8.754   2.066  -3.792
  142    HA   CYS  23           HA       CYS  23   9.991   0.267  -1.927
  143    HB2  CYS  23           HB2      CYS  23   9.649   0.329  -4.907
  144    HB3  CYS  23           HB3      CYS  23  10.770  -0.814  -4.175
  145    H    CYS  24           H        CYS  24  12.164  -0.183  -1.667
  146    HA   CYS  24           HA       CYS  24  13.958   1.998  -2.388
  147    HB2  CYS  24           HB2      CYS  24  14.252  -0.345  -0.503
  148    HB3  CYS  24           HB3      CYS  24  15.544   0.807  -0.828
  Start of MODEL   10
    1    H1   CYS   1           H        CYS   1   1.723   0.883  -0.091
    2    HA   CYS   1           HA       CYS   1   2.743   0.187  -2.251
    3    HB2  CYS   1           HB2      CYS   1   4.787  -0.751  -1.357
    4    HB3  CYS   1           HB3      CYS   1   4.187   0.478  -0.249
    5    H    ALA   2           H        ALA   2   0.390  -1.420  -2.010
    6    HA   ALA   2           HA       ALA   2   1.172  -4.189  -2.152
    7    HB1  ALA   2           HB1      ALA   2  -1.048  -3.364  -1.299
    8    HB2  ALA   2           HB2      ALA   2  -1.474  -3.015  -2.975
    9    HB3  ALA   2           HB3      ALA   2  -1.126  -4.672  -2.480
   10    H    ASP   3           H        ASP   3  -0.140  -1.832  -4.483
   11    HA   ASP   3           HA       ASP   3   0.010  -3.457  -6.748
   12    HB2  ASP   3           HB2      ASP   3   0.254  -0.450  -6.531
   13    HB3  ASP   3           HB3      ASP   3  -0.006  -1.329  -8.035
   14    H    ALA   4           H        ALA   4   2.430  -1.393  -5.235
   15    HA   ALA   4           HA       ALA   4   4.365  -1.471  -7.263
   16    HB1  ALA   4           HB1      ALA   4   4.207  -0.127  -4.989
   17    HB2  ALA   4           HB2      ALA   4   5.248  -1.436  -4.427
   18    HB3  ALA   4           HB3      ALA   4   5.753  -0.429  -5.784
   19    H    VAL   5           H        VAL   5   3.526  -3.765  -4.759
   20    HA   VAL   5           HA       VAL   5   5.759  -5.360  -4.616
   21    HB   VAL   5           HB       VAL   5   2.885  -6.293  -4.667
   22   HG11  VAL   5          HG11      VAL   5   4.441  -8.136  -5.019
   23   HG12  VAL   5          HG12      VAL   5   5.355  -7.651  -3.589
   24   HG13  VAL   5          HG13      VAL   5   3.699  -8.237  -3.423
   25   HG21  VAL   5          HG21      VAL   5   4.627  -5.096  -2.570
   26   HG22  VAL   5          HG22      VAL   5   2.910  -4.849  -2.887
   27   HG23  VAL   5          HG23      VAL   5   3.457  -6.328  -2.098
   28    H    TYR   6           H        TYR   6   3.422  -5.120  -7.205
   29    HA   TYR   6           HA       TYR   6   3.836  -7.441  -8.615
   30    HB2  TYR   6           HB2      TYR   6   3.111  -4.658  -9.368
   31    HB3  TYR   6           HB3      TYR   6   3.597  -5.738 -10.670
   32    HD1  TYR   6           HD1      TYR   6   2.173  -7.514 -11.399
   33    HD2  TYR   6           HD2      TYR   6   1.119  -5.189  -7.995
   34    HE1  TYR   6           HE1      TYR   6  -0.089  -8.478 -11.448
   35    HE2  TYR   6           HE2      TYR   6  -1.146  -6.148  -8.034
   36    HH   TYR   6           HH       TYR   6  -1.997  -8.796  -9.397
   37    H    THR   7           H        THR   7   5.559  -4.384  -9.271
   38    HA   THR   7           HA       THR   7   7.608  -5.792 -10.744
   39    HB   THR   7           HB       THR   7   8.639  -3.368 -10.695
   40    HG1  THR   7           HG1      THR   7   7.103  -2.602  -9.127
   41   HG21  THR   7          HG21      THR   7   6.159  -4.153 -12.225
   42   HG22  THR   7          HG22      THR   7   7.837  -4.378 -12.720
   43   HG23  THR   7          HG23      THR   7   7.158  -2.754 -12.614
   44    H    CYS   8           H        CYS   8   7.371  -3.994  -7.699
   45    HA   CYS   8           HA       CYS   8  10.017  -3.975  -6.925
   46    HB2  CYS   8           HB2      CYS   8   7.531  -4.308  -5.238
   47    HB3  CYS   8           HB3      CYS   8   9.131  -4.001  -4.570
   48    H    ARG   9           H        ARG   9   7.752  -6.628  -6.942
   49    HA   ARG   9           HA       ARG   9   8.913  -8.420  -5.203
   50    HB2  ARG   9           HB2      ARG   9   7.178  -8.590  -7.555
   51    HB3  ARG   9           HB3      ARG   9   8.153 -10.032  -7.304
   52    HG2  ARG   9           HG2      ARG   9   6.626  -8.851  -5.027
   53    HG3  ARG   9           HG3      ARG   9   5.806  -9.857  -6.223
   54    HD2  ARG   9           HD2      ARG   9   7.532 -11.618  -5.798
   55    HD3  ARG   9           HD3      ARG   9   8.136 -10.624  -4.473
   56    HE   ARG   9           HE       ARG   9   5.376 -11.030  -4.137
   57   HH11  ARG   9          HH11      ARG   9   8.385 -12.775  -4.000
   58   HH12  ARG   9          HH12      ARG   9   7.817 -13.923  -2.834
   59   HH21  ARG   9          HH21      ARG   9   4.616 -12.535  -2.602
   60   HH22  ARG   9          HH22      ARG   9   5.672 -13.786  -2.039
   61    H    ALA  10           H        ALA  10   9.975  -7.457  -8.391
   62    HA   ALA  10           HA       ALA  10  11.744  -9.505  -9.009
   63    HB1  ALA  10           HB1      ALA  10  11.052  -7.533 -10.448
   64    HB2  ALA  10           HB2      ALA  10  12.304  -6.615  -9.610
   65    HB3  ALA  10           HB3      ALA  10  12.739  -8.038 -10.557
   66    H    GLY  11           H        GLY  11  12.211  -6.663  -6.957
   67    HA2  GLY  11           HA2      GLY  11  14.060  -7.830  -5.252
   68    HA3  GLY  11           HA3      GLY  11  14.993  -7.065  -6.530
   69    H    GLN  12           H        GLN  12  12.283  -6.322  -4.336
   70    HA   GLN  12           HA       GLN  12  13.632  -3.949  -3.411
   71    HB2  GLN  12           HB2      GLN  12  11.273  -3.811  -5.248
   72    HB3  GLN  12           HB3      GLN  12  11.459  -2.595  -3.992
   73    HG2  GLN  12           HG2      GLN  12  13.818  -2.265  -4.922
   74    HG3  GLN  12           HG3      GLN  12  13.246  -3.166  -6.325
   75   HE21  GLN  12          HE21      GLN  12  11.095  -2.335  -7.192
   76   HE22  GLN  12          HE22      GLN  12  10.947  -0.620  -7.334
   77    H    THR  13           H        THR  13  12.556  -2.947  -1.604
   78    HA   THR  13           HA       THR  13  10.631  -4.757  -0.296
   79    HB   THR  13           HB       THR  13  12.291  -2.894   1.333
   80    HG1  THR  13           HG1      THR  13  13.241  -5.326   0.185
   81   HG21  THR  13          HG21      THR  13  11.006  -5.583   1.665
   82   HG22  THR  13          HG22      THR  13  10.791  -4.119   2.626
   83   HG23  THR  13          HG23      THR  13  12.280  -5.054   2.764
   84    H    CYS  14           H        CYS  14   9.100  -3.763   1.176
   85    HA   CYS  14           HA       CYS  14   7.918  -1.419   0.048
   86    HB2  CYS  14           HB2      CYS  14   6.572  -3.263   0.991
   87    HB3  CYS  14           HB3      CYS  14   7.212  -2.900   2.591
   88    H    CYS  15           H        CYS  15   8.338   0.625   0.529
   89    HA   CYS  15           HA       CYS  15   9.252   1.313   3.226
   90    HB2  CYS  15           HB2      CYS  15  10.575   2.450   0.762
   91    HB3  CYS  15           HB3      CYS  15  11.070   2.650   2.439
   92    H    ARG  16           H        ARG  16   9.426   3.861   3.315
   93    HA   ARG  16           HA       ARG  16   7.305   5.122   1.755
   94    HB2  ARG  16           HB2      ARG  16   6.427   6.123   3.952
   95    HB3  ARG  16           HB3      ARG  16   5.992   4.461   3.577
   96    HG2  ARG  16           HG2      ARG  16   7.809   3.686   5.055
   97    HG3  ARG  16           HG3      ARG  16   8.142   5.367   5.479
   98    HD2  ARG  16           HD2      ARG  16   6.536   5.331   7.012
   99    HD3  ARG  16           HD3      ARG  16   5.351   4.856   5.796
  100    HE   ARG  16           HE       ARG  16   6.638   2.539   6.385
  101   HH11  ARG  16          HH11      ARG  16   5.015   4.963   8.285
  102   HH12  ARG  16          HH12      ARG  16   4.510   3.849   9.513
  103   HH21  ARG  16          HH21      ARG  16   5.981   1.063   7.995
  104   HH22  ARG  16          HH22      ARG  16   5.061   1.631   9.347
  105    H    GLY  17           H        GLY  17   8.162   6.917   0.952
  106    HA2  GLY  17           HA2      GLY  17  10.479   8.137   2.175
  107    HA3  GLY  17           HA3      GLY  17   9.704   8.632   0.677
  108    H    LEU  18           H        LEU  18   9.378  10.760   0.956
  109    HA   LEU  18           HA       LEU  18   8.396  11.784   3.488
  110    HB2  LEU  18           HB2      LEU  18   8.612  13.985   2.418
  111    HB3  LEU  18           HB3      LEU  18  10.103  13.049   2.360
  112    HG   LEU  18           HG       LEU  18   9.114  12.417  -0.044
  113   HD11  LEU  18          HD11      LEU  18   8.415  15.026  -0.638
  114   HD12  LEU  18          HD12      LEU  18   7.541  14.678   0.853
  115   HD13  LEU  18          HD13      LEU  18   7.328  13.640  -0.556
  116   HD21  LEU  18          HD21      LEU  18  11.317  13.295   0.300
  117   HD22  LEU  18          HD22      LEU  18  10.673  14.886   0.705
  118   HD23  LEU  18          HD23      LEU  18  10.522  14.266  -0.940
  119    H    HIS  19           H        HIS  19   7.250  11.265   0.207
  120    HA   HIS  19           HA       HIS  19   4.830  12.693   0.413
  121    HB2  HIS  19           HB2      HIS  19   5.896  10.568  -1.387
  122    HB3  HIS  19           HB3      HIS  19   4.162  10.876  -1.411
  123    HD1  HIS  19           HD1      HIS  19   4.097  13.911  -1.224
  124    HD2  HIS  19           HD2      HIS  19   6.762  11.821  -3.630
  125    HE1  HIS  19           HE1      HIS  19   4.792  15.529  -3.020
  126    H    GLY  20           H        GLY  20   5.404   9.173   0.641
  127    HA2  GLY  20           HA2      GLY  20   3.791   8.778   2.897
  128    HA3  GLY  20           HA3      GLY  20   2.792   8.530   1.473
  129    H    TYR  21           H        TYR  21   4.533   7.308  -0.254
  130    HA   TYR  21           HA       TYR  21   5.421   4.904   1.192
  131    HB2  TYR  21           HB2      TYR  21   4.597   3.684  -0.972
  132    HB3  TYR  21           HB3      TYR  21   3.447   4.085   0.299
  133    HD1  TYR  21           HD1      TYR  21   4.938   6.200  -2.390
  134    HD2  TYR  21           HD2      TYR  21   1.412   4.484  -0.740
  135    HE1  TYR  21           HE1      TYR  21   3.578   7.443  -4.019
  136    HE2  TYR  21           HE2      TYR  21   0.042   5.721  -2.365
  137    HH   TYR  21           HH       TYR  21   1.534   7.722  -4.879
  138    H    GLY  22           H        GLY  22   6.533   3.413  -0.664
  139    HA2  GLY  22           HA2      GLY  22   7.895   4.413  -2.805
  140    HA3  GLY  22           HA3      GLY  22   8.860   4.922  -1.427
  141    H    CYS  23           H        CYS  23   9.323   2.966  -3.672
  142    HA   CYS  23           HA       CYS  23   9.742   0.517  -2.107
  143    HB2  CYS  23           HB2      CYS  23   8.999   1.035  -4.841
  144    HB3  CYS  23           HB3      CYS  23  10.476   0.078  -4.795
  145    H    CYS  24           H        CYS  24  11.707   0.014  -1.407
  146    HA   CYS  24           HA       CYS  24  13.965   1.657  -2.164
  147    HB2  CYS  24           HB2      CYS  24  13.753  -0.642  -0.208
  148    HB3  CYS  24           HB3      CYS  24  15.170   0.382  -0.417
  Start of MODEL   11
    1    H1   CYS   1           H        CYS   1   1.142   0.233  -0.290
    2    HA   CYS   1           HA       CYS   1   1.334   0.100  -2.824
    3    HB2  CYS   1           HB2      CYS   1   3.697  -0.613  -2.805
    4    HB3  CYS   1           HB3      CYS   1   3.338   0.509  -1.496
    5    H    ALA   2           H        ALA   2  -0.566  -1.812  -2.483
    6    HA   ALA   2           HA       ALA   2   0.212  -4.475  -2.815
    7    HB1  ALA   2           HB1      ALA   2  -2.022  -4.872  -3.653
    8    HB2  ALA   2           HB2      ALA   2  -2.085  -3.751  -2.292
    9    HB3  ALA   2           HB3      ALA   2  -2.250  -3.147  -3.941
   10    H    ASP   3           H        ASP   3  -0.663  -2.076  -5.304
   11    HA   ASP   3           HA       ASP   3  -0.103  -3.730  -7.511
   12    HB2  ASP   3           HB2      ASP   3  -0.465  -0.796  -7.100
   13    HB3  ASP   3           HB3      ASP   3   0.233  -1.344  -8.621
   14    H    ALA   4           H        ALA   4   1.898  -1.481  -5.674
   15    HA   ALA   4           HA       ALA   4   4.136  -1.432  -7.349
   16    HB1  ALA   4           HB1      ALA   4   3.461  -0.308  -4.931
   17    HB2  ALA   4           HB2      ALA   4   4.805  -1.372  -4.517
   18    HB3  ALA   4           HB3      ALA   4   5.010  -0.135  -5.757
   19    H    VAL   5           H        VAL   5   3.051  -3.809  -5.027
   20    HA   VAL   5           HA       VAL   5   5.332  -5.256  -4.520
   21    HB   VAL   5           HB       VAL   5   2.579  -6.384  -5.049
   22   HG11  VAL   5          HG11      VAL   5   5.093  -7.563  -3.960
   23   HG12  VAL   5          HG12      VAL   5   3.537  -8.112  -3.331
   24   HG13  VAL   5          HG13      VAL   5   3.899  -8.267  -5.051
   25   HG21  VAL   5          HG21      VAL   5   2.137  -5.024  -3.286
   26   HG22  VAL   5          HG22      VAL   5   2.793  -6.394  -2.388
   27   HG23  VAL   5          HG23      VAL   5   3.814  -5.000  -2.740
   28    H    TYR   6           H        TYR   6   3.352  -5.248  -7.424
   29    HA   TYR   6           HA       TYR   6   4.276  -7.498  -8.724
   30    HB2  TYR   6           HB2      TYR   6   3.199  -4.874  -9.609
   31    HB3  TYR   6           HB3      TYR   6   4.002  -5.858 -10.826
   32    HD1  TYR   6           HD1      TYR   6   3.147  -8.191 -11.258
   33    HD2  TYR   6           HD2      TYR   6   1.011  -5.381  -8.883
   34    HE1  TYR   6           HE1      TYR   6   1.096  -9.517 -11.545
   35    HE2  TYR   6           HE2      TYR   6  -1.046  -6.700  -9.162
   36    HH   TYR   6           HH       TYR   6  -1.683  -8.673 -11.345
   37    H    THR   7           H        THR   7   5.627  -4.207  -8.950
   38    HA   THR   7           HA       THR   7   7.904  -5.068 -10.453
   39    HB   THR   7           HB       THR   7   8.752  -2.703  -9.775
   40    HG1  THR   7           HG1      THR   7   6.008  -2.248  -9.275
   41   HG21  THR   7          HG21      THR   7   7.815  -1.881 -11.692
   42   HG22  THR   7          HG22      THR   7   6.212  -2.510 -11.309
   43   HG23  THR   7          HG23      THR   7   7.462  -3.593 -11.921
   44    H    CYS   8           H        CYS   8   7.352  -4.123  -7.079
   45    HA   CYS   8           HA       CYS   8   9.942  -4.177  -6.129
   46    HB2  CYS   8           HB2      CYS   8   7.430  -5.104  -4.718
   47    HB3  CYS   8           HB3      CYS   8   8.957  -4.732  -3.924
   48    H    ARG   9           H        ARG   9   7.774  -6.861  -6.796
   49    HA   ARG   9           HA       ARG   9   9.063  -8.937  -5.515
   50    HB2  ARG   9           HB2      ARG   9   7.387  -8.725  -7.966
   51    HB3  ARG   9           HB3      ARG   9   8.262 -10.228  -7.707
   52    HG2  ARG   9           HG2      ARG   9   6.626  -9.090  -5.491
   53    HG3  ARG   9           HG3      ARG   9   5.831  -9.942  -6.817
   54    HD2  ARG   9           HD2      ARG   9   6.201 -11.693  -5.400
   55    HD3  ARG   9           HD3      ARG   9   7.703 -11.734  -6.322
   56    HE   ARG   9           HE       ARG   9   8.095 -10.069  -4.120
   57   HH11  ARG   9          HH11      ARG   9   7.476 -13.426  -4.802
   58   HH12  ARG   9          HH12      ARG   9   8.301 -14.000  -3.390
   59   HH21  ARG   9          HH21      ARG   9   9.184 -10.811  -2.259
   60   HH22  ARG   9          HH22      ARG   9   9.271 -12.511  -1.944
   61    H    ALA  10           H        ALA  10   9.900  -7.335  -8.527
   62    HA   ALA  10           HA       ALA  10  11.760  -9.125  -9.551
   63    HB1  ALA  10           HB1      ALA  10  10.933  -7.144 -10.751
   64    HB2  ALA  10           HB2      ALA  10  11.891  -6.115  -9.685
   65    HB3  ALA  10           HB3      ALA  10  12.694  -7.250 -10.769
   66    H    GLY  11           H        GLY  11  12.279  -6.433  -7.278
   67    HA2  GLY  11           HA2      GLY  11  14.175  -7.708  -5.706
   68    HA3  GLY  11           HA3      GLY  11  15.068  -6.895  -6.984
   69    H    GLN  12           H        GLN  12  12.350  -6.137  -4.797
   70    HA   GLN  12           HA       GLN  12  13.789  -3.945  -3.631
   71    HB2  GLN  12           HB2      GLN  12  12.738  -3.202  -5.932
   72    HB3  GLN  12           HB3      GLN  12  11.259  -3.111  -4.985
   73    HG2  GLN  12           HG2      GLN  12  11.984  -1.335  -3.759
   74    HG3  GLN  12           HG3      GLN  12  13.683  -1.780  -3.912
   75   HE21  GLN  12          HE21      GLN  12  10.990  -0.901  -6.056
   76   HE22  GLN  12          HE22      GLN  12  11.896   0.213  -7.017
   77    H    THR  13           H        THR  13  12.619  -2.933  -1.880
   78    HA   THR  13           HA       THR  13  10.385  -4.590  -0.903
   79    HB   THR  13           HB       THR  13  11.230  -3.827   1.418
   80    HG1  THR  13           HG1      THR  13  12.844  -2.391   0.246
   81   HG21  THR  13          HG21      THR  13  12.936  -5.764  -0.150
   82   HG22  THR  13          HG22      THR  13  11.346  -6.143   0.514
   83   HG23  THR  13          HG23      THR  13  12.682  -5.746   1.594
   84    H    CYS  14           H        CYS  14   8.753  -3.553   0.310
   85    HA   CYS  14           HA       CYS  14   8.229  -0.853  -0.538
   86    HB2  CYS  14           HB2      CYS  14   6.538  -2.799  -0.239
   87    HB3  CYS  14           HB3      CYS  14   6.572  -2.360   1.466
   88    H    CYS  15           H        CYS  15   8.490   0.977   0.585
   89    HA   CYS  15           HA       CYS  15   8.822   0.886   3.480
   90    HB2  CYS  15           HB2      CYS  15  10.898   2.167   3.434
   91    HB3  CYS  15           HB3      CYS  15  11.103   0.645   2.574
   92    H    ARG  16           H        ARG  16   9.222   3.278   4.259
   93    HA   ARG  16           HA       ARG  16   6.996   4.800   3.227
   94    HB2  ARG  16           HB2      ARG  16   8.807   5.008   5.596
   95    HB3  ARG  16           HB3      ARG  16   7.901   6.428   5.093
   96    HG2  ARG  16           HG2      ARG  16   5.853   5.449   5.568
   97    HG3  ARG  16           HG3      ARG  16   6.514   3.814   5.519
   98    HD2  ARG  16           HD2      ARG  16   7.479   4.005   7.621
   99    HD3  ARG  16           HD3      ARG  16   7.466   5.767   7.575
  100    HE   ARG  16           HE       ARG  16   4.821   4.816   7.529
  101   HH11  ARG  16          HH11      ARG  16   7.554   5.068   9.670
  102   HH12  ARG  16          HH12      ARG  16   6.588   5.139  11.106
  103   HH21  ARG  16          HH21      ARG  16   3.538   4.909   9.413
  104   HH22  ARG  16          HH22      ARG  16   4.304   5.047  10.959
  105    H    GLY  17           H        GLY  17   7.586   5.558   1.210
  106    HA2  GLY  17           HA2      GLY  17  10.052   6.720   0.547
  107    HA3  GLY  17           HA3      GLY  17   8.542   6.984  -0.312
  108    H    LEU  18           H        LEU  18   9.597   9.148  -0.576
  109    HA   LEU  18           HA       LEU  18   9.945  10.906   1.590
  110    HB2  LEU  18           HB2      LEU  18   9.586  11.216  -1.349
  111    HB3  LEU  18           HB3      LEU  18   9.448  12.645  -0.328
  112    HG   LEU  18           HG       LEU  18  11.865  10.878  -0.173
  113   HD11  LEU  18          HD11      LEU  18  11.182  12.898  -2.270
  114   HD12  LEU  18          HD12      LEU  18  11.945  11.317  -2.442
  115   HD13  LEU  18          HD13      LEU  18  12.855  12.665  -1.762
  116   HD21  LEU  18          HD21      LEU  18  11.029  13.077   1.256
  117   HD22  LEU  18          HD22      LEU  18  12.140  13.766   0.072
  118   HD23  LEU  18          HD23      LEU  18  12.685  12.479   1.149
  119    H    HIS  19           H        HIS  19   7.293  10.894  -0.800
  120    HA   HIS  19           HA       HIS  19   5.629  12.679   0.527
  121    HB2  HIS  19           HB2      HIS  19   5.161  10.509  -1.478
  122    HB3  HIS  19           HB3      HIS  19   3.775  11.297  -0.731
  123    HD1  HIS  19           HD1      HIS  19   4.020  14.098  -0.892
  124    HD2  HIS  19           HD2      HIS  19   5.925  11.752  -3.743
  125    HE1  HIS  19           HE1      HIS  19   4.444  15.625  -2.844
  126    H    GLY  20           H        GLY  20   6.025   9.211   0.952
  127    HA2  GLY  20           HA2      GLY  20   5.259   9.090   3.586
  128    HA3  GLY  20           HA3      GLY  20   3.764   8.901   2.682
  129    H    TYR  21           H        TYR  21   4.419   7.356   0.588
  130    HA   TYR  21           HA       TYR  21   5.696   4.967   1.733
  131    HB2  TYR  21           HB2      TYR  21   3.765   3.868   0.158
  132    HB3  TYR  21           HB3      TYR  21   3.617   4.098   1.897
  133    HD1  TYR  21           HD1      TYR  21   2.468   5.165  -1.382
  134    HD2  TYR  21           HD2      TYR  21   2.309   5.996   2.788
  135    HE1  TYR  21           HE1      TYR  21   0.497   6.590  -1.747
  136    HE2  TYR  21           HE2      TYR  21   0.338   7.423   2.434
  137    HH   TYR  21           HH       TYR  21  -0.534   8.812   0.108
  138    H    GLY  22           H        GLY  22   6.142   3.294  -0.006
  139    HA2  GLY  22           HA2      GLY  22   6.221   3.390  -2.633
  140    HA3  GLY  22           HA3      GLY  22   7.351   4.689  -2.278
  141    H    CYS  23           H        CYS  23   7.659   1.995  -3.575
  142    HA   CYS  23           HA       CYS  23   9.158   0.318  -1.866
  143    HB2  CYS  23           HB2      CYS  23   8.191   0.159  -4.454
  144    HB3  CYS  23           HB3      CYS  23   9.937   0.194  -4.679
  145    H    CYS  24           H        CYS  24  11.251   0.310  -1.288
  146    HA   CYS  24           HA       CYS  24  12.833   2.643  -1.772
  147    HB2  CYS  24           HB2      CYS  24  13.135   0.138  -0.183
  148    HB3  CYS  24           HB3      CYS  24  14.592   1.047  -0.572
  Start of MODEL   12
    1    H1   CYS   1           H        CYS   1   1.522  -1.348   1.436
    2    HA   CYS   1           HA       CYS   1   1.842   0.253  -1.012
    3    HB2  CYS   1           HB2      CYS   1   4.146  -0.693  -1.084
    4    HB3  CYS   1           HB3      CYS   1   3.834   0.274   0.353
    5    H    ALA   2           H        ALA   2  -0.189  -1.391  -1.293
    6    HA   ALA   2           HA       ALA   2   0.359  -4.049  -2.035
    7    HB1  ALA   2           HB1      ALA   2  -1.890  -3.394  -1.549
    8    HB2  ALA   2           HB2      ALA   2  -1.877  -2.201  -2.849
    9    HB3  ALA   2           HB3      ALA   2  -1.825  -3.922  -3.231
   10    H    ASP   3           H        ASP   3  -0.085  -1.149  -4.060
   11    HA   ASP   3           HA       ASP   3   0.454  -2.378  -6.518
   12    HB2  ASP   3           HB2      ASP   3   1.029   0.499  -5.780
   13    HB3  ASP   3           HB3      ASP   3   0.762  -0.144  -7.398
   14    H    ALA   4           H        ALA   4   2.606  -0.791  -4.200
   15    HA   ALA   4           HA       ALA   4   4.953  -0.721  -5.644
   16    HB1  ALA   4           HB1      ALA   4   5.961  -0.208  -3.691
   17    HB2  ALA   4           HB2      ALA   4   4.298  -0.091  -3.116
   18    HB3  ALA   4           HB3      ALA   4   5.228  -1.562  -2.830
   19    H    VAL   5           H        VAL   5   3.378  -3.458  -4.138
   20    HA   VAL   5           HA       VAL   5   5.401  -5.316  -3.996
   21    HB   VAL   5           HB       VAL   5   2.564  -5.831  -4.900
   22   HG11  VAL   5          HG11      VAL   5   3.054  -8.094  -3.825
   23   HG12  VAL   5          HG12      VAL   5   3.777  -7.776  -5.403
   24   HG13  VAL   5          HG13      VAL   5   4.756  -7.647  -3.941
   25   HG21  VAL   5          HG21      VAL   5   3.186  -6.528  -2.170
   26   HG22  VAL   5          HG22      VAL   5   3.486  -4.817  -2.473
   27   HG23  VAL   5          HG23      VAL   5   1.896  -5.505  -2.802
   28    H    TYR   6           H        TYR   6   3.646  -4.203  -6.830
   29    HA   TYR   6           HA       TYR   6   4.332  -6.121  -8.690
   30    HB2  TYR   6           HB2      TYR   6   3.744  -3.203  -8.840
   31    HB3  TYR   6           HB3      TYR   6   4.420  -3.978 -10.268
   32    HD1  TYR   6           HD1      TYR   6   3.183  -5.873 -11.335
   33    HD2  TYR   6           HD2      TYR   6   1.475  -3.525  -8.224
   34    HE1  TYR   6           HE1      TYR   6   0.947  -6.686 -11.957
   35    HE2  TYR   6           HE2      TYR   6  -0.766  -4.333  -8.837
   36    HH   TYR   6           HH       TYR   6  -1.859  -5.266 -11.001
   37    H    THR   7           H        THR   7   6.089  -3.050  -8.218
   38    HA   THR   7           HA       THR   7   8.349  -3.924  -9.714
   39    HB   THR   7           HB       THR   7   9.438  -1.866  -8.566
   40    HG1  THR   7           HG1      THR   7   6.733  -1.206  -8.037
   41   HG21  THR   7          HG21      THR   7   8.156  -0.325 -10.056
   42   HG22  THR   7          HG22      THR   7   7.028  -1.644 -10.370
   43   HG23  THR   7          HG23      THR   7   8.716  -1.792 -10.858
   44    H    CYS   8           H        CYS   8   7.582  -3.752  -6.276
   45    HA   CYS   8           HA       CYS   8  10.091  -4.245  -5.196
   46    HB2  CYS   8           HB2      CYS   8   7.293  -4.643  -4.305
   47    HB3  CYS   8           HB3      CYS   8   8.521  -5.563  -3.442
   48    H    ARG   9           H        ARG   9   7.759  -6.469  -6.596
   49    HA   ARG   9           HA       ARG   9   8.745  -8.902  -5.747
   50    HB2  ARG   9           HB2      ARG   9   7.201  -7.947  -8.063
   51    HB3  ARG   9           HB3      ARG   9   8.061  -9.457  -8.332
   52    HG2  ARG   9           HG2      ARG   9   6.187  -8.957  -6.030
   53    HG3  ARG   9           HG3      ARG   9   5.733  -9.749  -7.540
   54    HD2  ARG   9           HD2      ARG   9   7.883 -11.214  -6.903
   55    HD3  ARG   9           HD3      ARG   9   7.371 -10.740  -5.284
   56    HE   ARG   9           HE       ARG   9   5.599 -12.167  -5.478
   57   HH11  ARG   9          HH11      ARG   9   6.867 -11.513  -8.653
   58   HH12  ARG   9          HH12      ARG   9   5.849 -12.672  -9.441
   59   HH21  ARG   9          HH21      ARG   9   4.253 -13.697  -6.504
   60   HH22  ARG   9          HH22      ARG   9   4.362 -13.913  -8.218
   61    H    ALA  10           H        ALA  10   9.978  -6.769  -8.251
   62    HA   ALA  10           HA       ALA  10  11.755  -8.473  -9.536
   63    HB1  ALA  10           HB1      ALA  10  11.144  -6.098 -10.161
   64    HB2  ALA  10           HB2      ALA  10  12.342  -5.578  -8.974
   65    HB3  ALA  10           HB3      ALA  10  12.838  -6.546 -10.362
   66    H    GLY  11           H        GLY  11  12.331  -6.398  -6.696
   67    HA2  GLY  11           HA2      GLY  11  13.858  -8.100  -5.213
   68    HA3  GLY  11           HA3      GLY  11  15.007  -7.394  -6.340
   69    H    GLN  12           H        GLN  12  12.301  -6.205  -4.339
   70    HA   GLN  12           HA       GLN  12  14.127  -4.365  -3.010
   71    HB2  GLN  12           HB2      GLN  12  11.577  -3.321  -4.229
   72    HB3  GLN  12           HB3      GLN  12  12.891  -2.399  -3.511
   73    HG2  GLN  12           HG2      GLN  12  14.332  -3.366  -5.402
   74    HG3  GLN  12           HG3      GLN  12  12.796  -3.778  -6.163
   75   HE21  GLN  12          HE21      GLN  12  11.404  -2.113  -6.813
   76   HE22  GLN  12          HE22      GLN  12  11.972  -0.499  -7.047
   77    H    THR  13           H        THR  13  12.862  -3.080  -1.285
   78    HA   THR  13           HA       THR  13  10.862  -4.866  -0.058
   79    HB   THR  13           HB       THR  13  12.547  -3.117   1.671
   80    HG1  THR  13           HG1      THR  13  13.420  -5.491   0.376
   81   HG21  THR  13          HG21      THR  13  11.220  -4.249   3.095
   82   HG22  THR  13          HG22      THR  13  12.352  -5.577   2.836
   83   HG23  THR  13          HG23      THR  13  10.853  -5.501   1.910
   84    H    CYS  14           H        CYS  14   9.278  -3.855   1.305
   85    HA   CYS  14           HA       CYS  14   8.367  -1.347   0.237
   86    HB2  CYS  14           HB2      CYS  14   6.796  -3.169   0.785
   87    HB3  CYS  14           HB3      CYS  14   7.235  -3.027   2.484
   88    H    CYS  15           H        CYS  15   8.773   0.612   1.012
   89    HA   CYS  15           HA       CYS  15   9.279   0.990   3.857
   90    HB2  CYS  15           HB2      CYS  15  11.297   2.412   3.317
   91    HB3  CYS  15           HB3      CYS  15  11.518   0.679   3.095
   92    H    ARG  16           H        ARG  16   9.694   3.476   4.216
   93    HA   ARG  16           HA       ARG  16   7.411   4.810   3.032
   94    HB2  ARG  16           HB2      ARG  16   7.652   5.079   5.392
   95    HB3  ARG  16           HB3      ARG  16   9.333   5.568   5.230
   96    HG2  ARG  16           HG2      ARG  16   8.797   7.702   4.853
   97    HG3  ARG  16           HG3      ARG  16   7.471   7.276   3.769
   98    HD2  ARG  16           HD2      ARG  16   7.333   7.071   6.772
   99    HD3  ARG  16           HD3      ARG  16   6.773   8.467   5.852
  100    HE   ARG  16           HE       ARG  16   5.510   6.273   4.758
  101   HH11  ARG  16          HH11      ARG  16   5.664   7.832   7.867
  102   HH12  ARG  16          HH12      ARG  16   4.062   7.361   8.328
  103   HH21  ARG  16          HH21      ARG  16   3.399   5.646   5.354
  104   HH22  ARG  16          HH22      ARG  16   2.775   6.116   6.899
  105    H    GLY  17           H        GLY  17   7.718   5.652   1.062
  106    HA2  GLY  17           HA2      GLY  17  10.284   6.704   0.249
  107    HA3  GLY  17           HA3      GLY  17   8.822   6.643  -0.725
  108    H    LEU  18           H        LEU  18   9.048   8.752  -1.469
  109    HA   LEU  18           HA       LEU  18   9.401  10.973   0.278
  110    HB2  LEU  18           HB2      LEU  18   8.274  10.991  -2.514
  111    HB3  LEU  18           HB3      LEU  18   9.005  12.343  -1.652
  112    HG   LEU  18           HG       LEU  18  10.555   9.870  -2.380
  113   HD11  LEU  18          HD11      LEU  18   9.518  11.007  -4.383
  114   HD12  LEU  18          HD12      LEU  18  11.277  10.889  -4.383
  115   HD13  LEU  18          HD13      LEU  18  10.496  12.417  -3.976
  116   HD21  LEU  18          HD21      LEU  18  11.630  11.157  -0.701
  117   HD22  LEU  18          HD22      LEU  18  11.284  12.668  -1.543
  118   HD23  LEU  18          HD23      LEU  18  12.442  11.525  -2.223
  119    H    HIS  19           H        HIS  19   6.594  10.063  -1.732
  120    HA   HIS  19           HA       HIS  19   4.788  11.812  -0.493
  121    HB2  HIS  19           HB2      HIS  19   4.438  10.698  -2.701
  122    HB3  HIS  19           HB3      HIS  19   4.131   9.189  -1.848
  123    HD1  HIS  19           HD1      HIS  19   2.457  12.128  -3.130
  124    HD2  HIS  19           HD2      HIS  19   1.776   9.393  -0.078
  125    HE1  HIS  19           HE1      HIS  19   0.028  12.380  -2.531
  126    H    GLY  20           H        GLY  20   5.099   8.278  -0.069
  127    HA2  GLY  20           HA2      GLY  20   4.632   8.509   2.764
  128    HA3  GLY  20           HA3      GLY  20   3.268   7.825   1.892
  129    H    TYR  21           H        TYR  21   4.374   6.209   0.055
  130    HA   TYR  21           HA       TYR  21   6.147   4.403   1.553
  131    HB2  TYR  21           HB2      TYR  21   4.608   2.656   0.126
  132    HB3  TYR  21           HB3      TYR  21   4.354   3.060   1.820
  133    HD1  TYR  21           HD1      TYR  21   3.074   3.374  -1.564
  134    HD2  TYR  21           HD2      TYR  21   2.596   4.677   2.458
  135    HE1  TYR  21           HE1      TYR  21   0.825   4.209  -2.108
  136    HE2  TYR  21           HE2      TYR  21   0.345   5.514   1.925
  137    HH   TYR  21           HH       TYR  21  -1.422   4.640  -0.470
  138    H    GLY  22           H        GLY  22   6.748   2.491  -0.083
  139    HA2  GLY  22           HA2      GLY  22   6.920   2.651  -2.765
  140    HA3  GLY  22           HA3      GLY  22   8.123   3.827  -2.255
  141    H    CYS  23           H        CYS  23   8.917   1.711  -3.759
  142    HA   CYS  23           HA       CYS  23   9.959  -0.337  -1.970
  143    HB2  CYS  23           HB2      CYS  23  10.078   0.001  -4.970
  144    HB3  CYS  23           HB3      CYS  23  10.866  -1.317  -4.109
  145    H    CYS  24           H        CYS  24  11.965  -0.363  -1.184
  146    HA   CYS  24           HA       CYS  24  13.738   1.839  -1.777
  147    HB2  CYS  24           HB2      CYS  24  13.716  -0.396   0.220
  148    HB3  CYS  24           HB3      CYS  24  15.207   0.493  -0.071
  Start of MODEL   13
    1    H1   CYS   1           H        CYS   1   1.842  -0.025   1.146
    2    HA   CYS   1           HA       CYS   1   2.044   0.569  -1.564
    3    HB2  CYS   1           HB2      CYS   1   4.145  -0.816  -1.486
    4    HB3  CYS   1           HB3      CYS   1   4.035   0.425  -0.243
    5    H    ALA   2           H        ALA   2  -0.155  -0.607  -1.954
    6    HA   ALA   2           HA       ALA   2  -0.085  -3.435  -2.320
    7    HB1  ALA   2           HB1      ALA   2  -2.251  -3.198  -3.318
    8    HB2  ALA   2           HB2      ALA   2  -2.160  -2.121  -1.924
    9    HB3  ALA   2           HB3      ALA   2  -2.004  -1.468  -3.555
   10    H    ASP   3           H        ASP   3  -0.061  -0.704  -4.611
   11    HA   ASP   3           HA       ASP   3   0.391  -2.347  -6.889
   12    HB2  ASP   3           HB2      ASP   3   0.813   0.624  -6.502
   13    HB3  ASP   3           HB3      ASP   3   0.853  -0.207  -8.054
   14    H    ALA   4           H        ALA   4   2.481  -0.565  -4.693
   15    HA   ALA   4           HA       ALA   4   4.868  -0.574  -6.072
   16    HB1  ALA   4           HB1      ALA   4   5.314  -1.239  -3.300
   17    HB2  ALA   4           HB2      ALA   4   5.653   0.260  -4.167
   18    HB3  ALA   4           HB3      ALA   4   4.057  -0.013  -3.468
   19    H    VAL   5           H        VAL   5   3.253  -3.222  -4.452
   20    HA   VAL   5           HA       VAL   5   5.274  -5.063  -4.145
   21    HB   VAL   5           HB       VAL   5   2.459  -5.629  -5.088
   22   HG11  VAL   5          HG11      VAL   5   3.559  -7.628  -5.454
   23   HG12  VAL   5          HG12      VAL   5   4.673  -7.383  -4.107
   24   HG13  VAL   5          HG13      VAL   5   2.993  -7.821  -3.795
   25   HG21  VAL   5          HG21      VAL   5   2.182  -6.167  -2.601
   26   HG22  VAL   5          HG22      VAL   5   3.670  -5.250  -2.366
   27   HG23  VAL   5          HG23      VAL   5   2.252  -4.467  -3.064
   28    H    TYR   6           H        TYR   6   3.599  -4.122  -7.087
   29    HA   TYR   6           HA       TYR   6   4.336  -6.145  -8.810
   30    HB2  TYR   6           HB2      TYR   6   3.752  -3.242  -9.148
   31    HB3  TYR   6           HB3      TYR   6   4.468  -4.099 -10.509
   32    HD1  TYR   6           HD1      TYR   6   3.267  -6.107 -11.446
   33    HD2  TYR   6           HD2      TYR   6   1.461  -3.479  -8.628
   34    HE1  TYR   6           HE1      TYR   6   1.049  -6.960 -12.081
   35    HE2  TYR   6           HE2      TYR   6  -0.762  -4.326  -9.254
   36    HH   TYR   6           HH       TYR   6  -1.258  -7.122 -10.932
   37    H    THR   7           H        THR   7   6.078  -3.048  -8.471
   38    HA   THR   7           HA       THR   7   8.380  -4.005  -9.849
   39    HB   THR   7           HB       THR   7   9.396  -1.864  -8.661
   40    HG1  THR   7           HG1      THR   7   7.334  -1.788  -7.357
   41   HG21  THR   7          HG21      THR   7   7.306  -1.094 -10.594
   42   HG22  THR   7          HG22      THR   7   8.391  -2.382 -11.117
   43   HG23  THR   7          HG23      THR   7   9.047  -0.817 -10.635
   44    H    CYS   8           H        CYS   8   7.522  -3.620  -6.448
   45    HA   CYS   8           HA       CYS   8   9.996  -4.043  -5.270
   46    HB2  CYS   8           HB2      CYS   8   7.172  -4.450  -4.434
   47    HB3  CYS   8           HB3      CYS   8   8.413  -5.243  -3.469
   48    H    ARG   9           H        ARG   9   7.715  -6.358  -6.605
   49    HA   ARG   9           HA       ARG   9   8.684  -8.732  -5.588
   50    HB2  ARG   9           HB2      ARG   9   7.359  -7.972  -8.154
   51    HB3  ARG   9           HB3      ARG   9   8.023  -9.593  -8.001
   52    HG2  ARG   9           HG2      ARG   9   6.132  -8.447  -5.974
   53    HG3  ARG   9           HG3      ARG   9   5.574  -9.285  -7.423
   54    HD2  ARG   9           HD2      ARG   9   7.059 -11.210  -6.713
   55    HD3  ARG   9           HD3      ARG   9   7.239 -10.378  -5.169
   56    HE   ARG   9           HE       ARG   9   4.505 -10.772  -5.964
   57   HH11  ARG   9          HH11      ARG   9   7.249 -12.170  -4.343
   58   HH12  ARG   9          HH12      ARG   9   6.295 -13.243  -3.373
   59   HH21  ARG   9          HH21      ARG   9   3.237 -12.179  -4.693
   60   HH22  ARG   9          HH22      ARG   9   4.013 -13.247  -3.573
   61    H    ALA  10           H        ALA  10   9.982  -6.739  -8.173
   62    HA   ALA  10           HA       ALA  10  11.802  -8.505  -9.308
   63    HB1  ALA  10           HB1      ALA  10  11.233  -6.225 -10.150
   64    HB2  ALA  10           HB2      ALA  10  12.275  -5.559  -8.891
   65    HB3  ALA  10           HB3      ALA  10  12.959  -6.590 -10.148
   66    H    GLY  11           H        GLY  11  12.359  -6.198  -6.641
   67    HA2  GLY  11           HA2      GLY  11  13.836  -7.838  -5.003
   68    HA3  GLY  11           HA3      GLY  11  15.003  -7.168  -6.133
   69    H    GLN  12           H        GLN  12  12.234  -5.947  -4.239
   70    HA   GLN  12           HA       GLN  12  13.995  -4.001  -2.973
   71    HB2  GLN  12           HB2      GLN  12  11.439  -3.081  -4.277
   72    HB3  GLN  12           HB3      GLN  12  12.718  -2.093  -3.583
   73    HG2  GLN  12           HG2      GLN  12  14.228  -3.007  -5.389
   74    HG3  GLN  12           HG3      GLN  12  12.774  -3.664  -6.139
   75   HE21  GLN  12          HE21      GLN  12  11.367  -2.313  -7.172
   76   HE22  GLN  12          HE22      GLN  12  11.692  -0.641  -7.461
   77    H    THR  13           H        THR  13  12.764  -2.731  -1.271
   78    HA   THR  13           HA       THR  13  10.780  -4.500   0.004
   79    HB   THR  13           HB       THR  13  12.357  -2.575   1.646
   80    HG1  THR  13           HG1      THR  13  13.360  -5.007   0.560
   81   HG21  THR  13          HG21      THR  13  11.032  -3.691   3.095
   82   HG22  THR  13          HG22      THR  13  12.275  -4.937   2.976
   83   HG23  THR  13          HG23      THR  13  10.811  -5.055   2.000
   84    H    CYS  14           H        CYS  14   9.132  -3.489   1.288
   85    HA   CYS  14           HA       CYS  14   8.138  -1.074   0.074
   86    HB2  CYS  14           HB2      CYS  14   6.593  -2.886   0.609
   87    HB3  CYS  14           HB3      CYS  14   7.026  -2.779   2.312
   88    H    CYS  15           H        CYS  15   9.009   0.804   0.674
   89    HA   CYS  15           HA       CYS  15   9.336   1.314   3.558
   90    HB2  CYS  15           HB2      CYS  15  10.999   2.581   1.379
   91    HB3  CYS  15           HB3      CYS  15  11.266   2.660   3.117
   92    H    ARG  16           H        ARG  16   9.332   3.716   4.055
   93    HA   ARG  16           HA       ARG  16   6.980   4.874   2.811
   94    HB2  ARG  16           HB2      ARG  16   8.633   5.923   5.113
   95    HB3  ARG  16           HB3      ARG  16   7.036   6.480   4.632
   96    HG2  ARG  16           HG2      ARG  16   6.205   4.152   5.118
   97    HG3  ARG  16           HG3      ARG  16   7.780   3.837   5.849
   98    HD2  ARG  16           HD2      ARG  16   6.090   6.177   6.674
   99    HD3  ARG  16           HD3      ARG  16   5.873   4.579   7.388
  100    HE   ARG  16           HE       ARG  16   7.965   6.434   7.945
  101   HH11  ARG  16          HH11      ARG  16   7.204   3.043   7.753
  102   HH12  ARG  16          HH12      ARG  16   8.433   2.570   8.880
  103   HH21  ARG  16          HH21      ARG  16   9.586   5.825   9.430
  104   HH22  ARG  16          HH22      ARG  16   9.786   4.153   9.834
  105    H    GLY  17           H        GLY  17   7.518   5.711   0.845
  106    HA2  GLY  17           HA2      GLY  17   9.926   7.153   0.350
  107    HA3  GLY  17           HA3      GLY  17   8.529   7.070  -0.714
  108    H    LEU  18           H        LEU  18   8.254   9.165  -1.259
  109    HA   LEU  18           HA       LEU  18   8.362  11.239   0.768
  110    HB2  LEU  18           HB2      LEU  18   7.737  11.414  -2.176
  111    HB3  LEU  18           HB3      LEU  18   7.999  12.780  -1.094
  112    HG   LEU  18           HG       LEU  18  10.101  10.709  -1.713
  113   HD11  LEU  18          HD11      LEU  18   9.492  11.867  -3.760
  114   HD12  LEU  18          HD12      LEU  18  11.080  12.389  -3.202
  115   HD13  LEU  18          HD13      LEU  18   9.674  13.424  -2.954
  116   HD21  LEU  18          HD21      LEU  18  11.222  13.162  -0.988
  117   HD22  LEU  18          HD22      LEU  18  11.168  11.684  -0.027
  118   HD23  LEU  18          HD23      LEU  18   9.899  12.897   0.148
  119    H    HIS  19           H        HIS  19   5.974  10.351  -1.733
  120    HA   HIS  19           HA       HIS  19   3.846  11.793  -0.637
  121    HB2  HIS  19           HB2      HIS  19   2.403  10.227  -1.998
  122    HB3  HIS  19           HB3      HIS  19   3.674  11.051  -2.897
  123    HD1  HIS  19           HD1      HIS  19   5.831   9.559  -3.454
  124    HD2  HIS  19           HD2      HIS  19   2.474   7.497  -2.134
  125    HE1  HIS  19           HE1      HIS  19   6.228   7.156  -4.081
  126    H    GLY  20           H        GLY  20   4.950   8.496  -0.048
  127    HA2  GLY  20           HA2      GLY  20   3.941   8.356   2.548
  128    HA3  GLY  20           HA3      GLY  20   2.730   7.652   1.487
  129    H    TYR  21           H        TYR  21   4.136   6.276  -0.339
  130    HA   TYR  21           HA       TYR  21   5.886   4.481   1.198
  131    HB2  TYR  21           HB2      TYR  21   4.635   2.761  -0.522
  132    HB3  TYR  21           HB3      TYR  21   4.194   2.990   1.166
  133    HD1  TYR  21           HD1      TYR  21   3.210   3.517  -2.289
  134    HD2  TYR  21           HD2      TYR  21   2.265   4.420   1.760
  135    HE1  TYR  21           HE1      TYR  21   0.963   4.238  -2.981
  136    HE2  TYR  21           HE2      TYR  21   0.015   5.142   1.080
  137    HH   TYR  21           HH       TYR  21  -1.556   4.515  -1.041
  138    H    GLY  22           H        GLY  22   6.792   2.756  -0.509
  139    HA2  GLY  22           HA2      GLY  22   7.217   3.200  -3.145
  140    HA3  GLY  22           HA3      GLY  22   8.307   4.350  -2.384
  141    H    CYS  23           H        CYS  23   8.555   1.695  -3.959
  142    HA   CYS  23           HA       CYS  23   9.760  -0.195  -2.252
  143    HB2  CYS  23           HB2      CYS  23  10.020   0.298  -5.219
  144    HB3  CYS  23           HB3      CYS  23  10.801  -1.052  -4.401
  145    H    CYS  24           H        CYS  24  11.736  -0.334  -1.391
  146    HA   CYS  24           HA       CYS  24  13.525   1.890  -1.587
  147    HB2  CYS  24           HB2      CYS  24  13.375  -0.620  -0.014
  148    HB3  CYS  24           HB3      CYS  24  14.980   0.067  -0.242
  Start of MODEL   14
    1    H1   CYS   1           H        CYS   1   1.256   1.602  -0.803
    2    HA   CYS   1           HA       CYS   1   3.139   0.723  -2.869
    3    HB2  CYS   1           HB2      CYS   1   3.710   0.973  -0.342
    4    HB3  CYS   1           HB3      CYS   1   2.858  -0.557  -0.167
    5    H    ALA   2           H        ALA   2   0.327   0.413  -3.307
    6    HA   ALA   2           HA       ALA   2  -0.363  -2.336  -2.788
    7    HB1  ALA   2           HB1      ALA   2  -2.262  -1.052  -2.834
    8    HB2  ALA   2           HB2      ALA   2  -1.678  -0.038  -4.154
    9    HB3  ALA   2           HB3      ALA   2  -2.251  -1.672  -4.485
   10    H    ASP   3           H        ASP   3   0.326  -0.435  -5.725
   11    HA   ASP   3           HA       ASP   3   0.519  -2.843  -7.320
   12    HB2  ASP   3           HB2      ASP   3   1.055   0.040  -8.066
   13    HB3  ASP   3           HB3      ASP   3   0.949  -1.311  -9.191
   14    H    ALA   4           H        ALA   4   2.664  -0.486  -5.861
   15    HA   ALA   4           HA       ALA   4   5.038  -0.973  -7.164
   16    HB1  ALA   4           HB1      ALA   4   4.757  -0.547  -4.193
   17    HB2  ALA   4           HB2      ALA   4   6.167  -0.190  -5.192
   18    HB3  ALA   4           HB3      ALA   4   4.681   0.736  -5.402
   19    H    VAL   5           H        VAL   5   3.385  -2.967  -4.814
   20    HA   VAL   5           HA       VAL   5   5.367  -4.664  -3.950
   21    HB   VAL   5           HB       VAL   5   2.985  -4.742  -3.220
   22   HG11  VAL   5          HG11      VAL   5   1.313  -5.806  -4.472
   23   HG12  VAL   5          HG12      VAL   5   2.139  -4.763  -5.631
   24   HG13  VAL   5          HG13      VAL   5   2.476  -6.495  -5.604
   25   HG21  VAL   5          HG21      VAL   5   3.384  -6.754  -2.337
   26   HG22  VAL   5          HG22      VAL   5   3.398  -7.538  -3.917
   27   HG23  VAL   5          HG23      VAL   5   4.858  -6.761  -3.305
   28    H    TYR   6           H        TYR   6   3.798  -4.562  -7.077
   29    HA   TYR   6           HA       TYR   6   4.635  -7.075  -8.036
   30    HB2  TYR   6           HB2      TYR   6   3.605  -4.564  -9.243
   31    HB3  TYR   6           HB3      TYR   6   4.460  -5.667 -10.315
   32    HD1  TYR   6           HD1      TYR   6   3.510  -7.796 -10.924
   33    HD2  TYR   6           HD2      TYR   6   1.502  -5.241  -8.177
   34    HE1  TYR   6           HE1      TYR   6   1.472  -9.153 -11.160
   35    HE2  TYR   6           HE2      TYR   6  -0.541  -6.592  -8.405
   36    HH   TYR   6           HH       TYR   6  -1.253  -8.752  -9.081
   37    H    THR   7           H        THR   7   6.017  -3.834  -8.580
   38    HA   THR   7           HA       THR   7   8.307  -4.783  -9.955
   39    HB   THR   7           HB       THR   7   8.347  -2.184  -8.469
   40    HG1  THR   7           HG1      THR   7   6.490  -1.715  -9.383
   41   HG21  THR   7          HG21      THR   7   9.357  -1.457 -10.663
   42   HG22  THR   7          HG22      THR   7   9.328  -3.152 -11.151
   43   HG23  THR   7          HG23      THR   7  10.292  -2.650  -9.762
   44    H    CYS   8           H        CYS   8   7.645  -4.030  -6.578
   45    HA   CYS   8           HA       CYS   8  10.328  -4.229  -5.677
   46    HB2  CYS   8           HB2      CYS   8   7.746  -4.597  -4.144
   47    HB3  CYS   8           HB3      CYS   8   9.337  -4.371  -3.425
   48    H    ARG   9           H        ARG   9   7.735  -6.545  -6.125
   49    HA   ARG   9           HA       ARG   9   8.632  -8.693  -4.649
   50    HB2  ARG   9           HB2      ARG   9   7.008  -8.375  -7.106
   51    HB3  ARG   9           HB3      ARG   9   7.666  -9.979  -6.812
   52    HG2  ARG   9           HG2      ARG   9   6.481 -10.232  -4.819
   53    HG3  ARG   9           HG3      ARG   9   6.162  -8.501  -4.686
   54    HD2  ARG   9           HD2      ARG   9   4.134  -9.119  -5.475
   55    HD3  ARG   9           HD3      ARG   9   4.959  -8.988  -7.028
   56    HE   ARG   9           HE       ARG   9   5.118 -11.598  -5.818
   57   HH11  ARG   9          HH11      ARG   9   3.285  -9.489  -7.895
   58   HH12  ARG   9          HH12      ARG   9   2.493 -10.784  -8.729
   59   HH21  ARG   9          HH21      ARG   9   4.081 -13.312  -6.909
   60   HH22  ARG   9          HH22      ARG   9   2.945 -12.958  -8.167
   61    H    ALA  10           H        ALA  10   9.870  -7.425  -7.653
   62    HA   ALA  10           HA       ALA  10  11.348  -9.578  -8.592
   63    HB1  ALA  10           HB1      ALA  10  12.910  -7.730  -9.483
   64    HB2  ALA  10           HB2      ALA  10  11.232  -7.754 -10.028
   65    HB3  ALA  10           HB3      ALA  10  11.739  -6.614  -8.781
   66    H    GLY  11           H        GLY  11  12.426  -6.983  -6.389
   67    HA2  GLY  11           HA2      GLY  11  13.878  -8.615  -4.670
   68    HA3  GLY  11           HA3      GLY  11  14.990  -8.108  -5.933
   69    H    GLN  12           H        GLN  12  12.381  -6.457  -4.151
   70    HA   GLN  12           HA       GLN  12  14.351  -4.587  -3.072
   71    HB2  GLN  12           HB2      GLN  12  11.865  -3.684  -4.536
   72    HB3  GLN  12           HB3      GLN  12  13.043  -2.643  -3.748
   73    HG2  GLN  12           HG2      GLN  12  13.876  -2.456  -5.818
   74    HG3  GLN  12           HG3      GLN  12  14.657  -3.987  -5.425
   75   HE21  GLN  12          HE21      GLN  12  13.780  -2.832  -8.000
   76   HE22  GLN  12          HE22      GLN  12  12.747  -4.022  -8.707
   77    H    THR  13           H        THR  13  13.122  -2.956  -1.578
   78    HA   THR  13           HA       THR  13  11.067  -4.441  -0.075
   79    HB   THR  13           HB       THR  13  12.000  -3.611   2.016
   80    HG1  THR  13           HG1      THR  13  13.662  -2.192   0.259
   81   HG21  THR  13          HG21      THR  13  13.255  -5.488   0.293
   82   HG22  THR  13          HG22      THR  13  13.244  -5.457   2.057
   83   HG23  THR  13          HG23      THR  13  14.520  -4.626   1.167
   84    H    CYS  14           H        CYS  14   9.357  -3.290   0.712
   85    HA   CYS  14           HA       CYS  14   8.956  -0.654  -0.403
   86    HB2  CYS  14           HB2      CYS  14   7.157  -2.371  -0.398
   87    HB3  CYS  14           HB3      CYS  14   7.121  -2.290   1.360
   88    H    CYS  15           H        CYS  15   9.033   1.244   0.645
   89    HA   CYS  15           HA       CYS  15   9.158   1.254   3.573
   90    HB2  CYS  15           HB2      CYS  15  11.086   2.854   1.888
   91    HB3  CYS  15           HB3      CYS  15  11.102   2.643   3.636
   92    H    ARG  16           H        ARG  16   9.251   3.694   4.306
   93    HA   ARG  16           HA       ARG  16   6.925   4.939   3.102
   94    HB2  ARG  16           HB2      ARG  16   7.143   6.538   5.023
   95    HB3  ARG  16           HB3      ARG  16   6.937   4.855   5.491
   96    HG2  ARG  16           HG2      ARG  16   9.722   5.405   5.264
   97    HG3  ARG  16           HG3      ARG  16   8.968   6.650   6.261
   98    HD2  ARG  16           HD2      ARG  16   8.301   3.779   6.733
   99    HD3  ARG  16           HD3      ARG  16   9.826   4.425   7.337
  100    HE   ARG  16           HE       ARG  16   7.912   6.197   8.179
  101   HH11  ARG  16          HH11      ARG  16   8.500   2.787   8.560
  102   HH12  ARG  16          HH12      ARG  16   7.750   2.699  10.119
  103   HH21  ARG  16          HH21      ARG  16   6.922   6.094  10.232
  104   HH22  ARG  16          HH22      ARG  16   6.852   4.580  11.069
  105    H    GLY  17           H        GLY  17   7.335   6.063   1.290
  106    HA2  GLY  17           HA2      GLY  17   9.801   7.438   0.828
  107    HA3  GLY  17           HA3      GLY  17   8.364   7.510  -0.181
  108    H    LEU  18           H        LEU  18   8.329   9.697  -0.507
  109    HA   LEU  18           HA       LEU  18   8.462  11.506   1.757
  110    HB2  LEU  18           HB2      LEU  18   8.219  13.270   0.048
  111    HB3  LEU  18           HB3      LEU  18   9.577  12.187  -0.251
  112    HG   LEU  18           HG       LEU  18   7.652  11.020  -1.763
  113   HD11  LEU  18          HD11      LEU  18   7.076  13.574  -2.838
  114   HD12  LEU  18          HD12      LEU  18   6.638  13.598  -1.131
  115   HD13  LEU  18          HD13      LEU  18   5.954  12.373  -2.198
  116   HD21  LEU  18          HD21      LEU  18   8.743  12.142  -3.673
  117   HD22  LEU  18          HD22      LEU  18   9.898  11.506  -2.502
  118   HD23  LEU  18          HD23      LEU  18   9.544  13.234  -2.544
  119    H    HIS  19           H        HIS  19   6.092  10.538  -0.703
  120    HA   HIS  19           HA       HIS  19   3.999  12.150   0.397
  121    HB2  HIS  19           HB2      HIS  19   2.541  10.839  -1.170
  122    HB3  HIS  19           HB3      HIS  19   3.908  11.635  -1.946
  123    HD1  HIS  19           HD1      HIS  19   5.868  10.086  -2.752
  124    HD2  HIS  19           HD2      HIS  19   2.512   8.079  -1.349
  125    HE1  HIS  19           HE1      HIS  19   6.134   7.708  -3.526
  126    H    GLY  20           H        GLY  20   5.021   8.800   0.713
  127    HA2  GLY  20           HA2      GLY  20   3.920   8.412   3.232
  128    HA3  GLY  20           HA3      GLY  20   2.711   7.873   2.077
  129    H    TYR  21           H        TYR  21   4.111   6.644   0.144
  130    HA   TYR  21           HA       TYR  21   5.749   4.625   1.521
  131    HB2  TYR  21           HB2      TYR  21   4.454   3.198  -0.457
  132    HB3  TYR  21           HB3      TYR  21   4.058   3.171   1.258
  133    HD1  TYR  21           HD1      TYR  21   3.006   4.232  -2.047
  134    HD2  TYR  21           HD2      TYR  21   2.201   4.576   2.117
  135    HE1  TYR  21           HE1      TYR  21   0.768   5.115  -2.558
  136    HE2  TYR  21           HE2      TYR  21  -0.039   5.459   1.617
  137    HH   TYR  21           HH       TYR  21  -1.541   5.876   0.024
  138    H    GLY  22           H        GLY  22   6.665   3.069  -0.321
  139    HA2  GLY  22           HA2      GLY  22   7.204   3.587  -2.865
  140    HA3  GLY  22           HA3      GLY  22   8.148   4.852  -2.092
  141    H    CYS  23           H        CYS  23   8.537   2.045  -3.537
  142    HA   CYS  23           HA       CYS  23   9.937   0.363  -1.826
  143    HB2  CYS  23           HB2      CYS  23   9.381   0.454  -4.560
  144    HB3  CYS  23           HB3      CYS  23  11.139   0.450  -4.468
  145    H    CYS  24           H        CYS  24  11.825   0.504  -0.809
  146    HA   CYS  24           HA       CYS  24  13.360   2.816  -0.713
  147    HB2  CYS  24           HB2      CYS  24  13.690   0.020   0.211
  148    HB3  CYS  24           HB3      CYS  24  15.163   0.977   0.094
  Start of MODEL   15
    1    H1   CYS   1           H        CYS   1   2.473   1.096   0.641
    2    HA   CYS   1           HA       CYS   1   2.436   1.104  -2.114
    3    HB2  CYS   1           HB2      CYS   1   4.522  -0.322  -1.940
    4    HB3  CYS   1           HB3      CYS   1   4.540   1.169  -1.004
    5    H    ALA   2           H        ALA   2   0.270  -0.041  -2.288
    6    HA   ALA   2           HA       ALA   2   0.299  -2.914  -2.086
    7    HB1  ALA   2           HB1      ALA   2  -1.678  -0.927  -2.243
    8    HB2  ALA   2           HB2      ALA   2  -1.876  -1.936  -3.676
    9    HB3  ALA   2           HB3      ALA   2  -1.906  -2.668  -2.071
   10    H    ASP   3           H        ASP   3   0.568  -0.510  -4.647
   11    HA   ASP   3           HA       ASP   3   0.623  -2.523  -6.727
   12    HB2  ASP   3           HB2      ASP   3   0.879   0.477  -6.706
   13    HB3  ASP   3           HB3      ASP   3   1.212  -0.462  -8.159
   14    H    ALA   4           H        ALA   4   2.892  -0.520  -4.954
   15    HA   ALA   4           HA       ALA   4   5.169  -0.731  -6.487
   16    HB1  ALA   4           HB1      ALA   4   5.820  -1.104  -3.704
   17    HB2  ALA   4           HB2      ALA   4   6.097   0.292  -4.747
   18    HB3  ALA   4           HB3      ALA   4   4.559   0.114  -3.902
   19    H    VAL   5           H        VAL   5   3.648  -3.159  -4.481
   20    HA   VAL   5           HA       VAL   5   5.661  -4.997  -4.120
   21    HB   VAL   5           HB       VAL   5   3.977  -6.721  -3.998
   22   HG11  VAL   5          HG11      VAL   5   2.989  -5.916  -2.137
   23   HG12  VAL   5          HG12      VAL   5   4.048  -4.533  -2.422
   24   HG13  VAL   5          HG13      VAL   5   2.368  -4.484  -2.957
   25   HG21  VAL   5          HG21      VAL   5   2.461  -4.852  -5.728
   26   HG22  VAL   5          HG22      VAL   5   2.541  -6.614  -5.759
   27   HG23  VAL   5          HG23      VAL   5   1.541  -5.798  -4.557
   28    H    TYR   6           H        TYR   6   3.892  -4.250  -7.042
   29    HA   TYR   6           HA       TYR   6   4.399  -6.463  -8.607
   30    HB2  TYR   6           HB2      TYR   6   3.975  -3.573  -9.162
   31    HB3  TYR   6           HB3      TYR   6   4.615  -4.557 -10.474
   32    HD1  TYR   6           HD1      TYR   6   3.200  -5.948 -11.735
   33    HD2  TYR   6           HD2      TYR   6   1.786  -4.272  -8.088
   34    HE1  TYR   6           HE1      TYR   6   0.928  -6.730 -12.263
   35    HE2  TYR   6           HE2      TYR   6  -0.489  -5.051  -8.606
   36    HH   TYR   6           HH       TYR   6  -1.141  -7.206 -11.235
   37    H    THR   7           H        THR   7   6.374  -3.490  -8.618
   38    HA   THR   7           HA       THR   7   8.547  -4.801  -9.950
   39    HB   THR   7           HB       THR   7   8.027  -2.367 -10.221
   40    HG1  THR   7           HG1      THR   7  10.539  -3.420  -9.599
   41   HG21  THR   7          HG21      THR   7   8.760  -0.796  -8.528
   42   HG22  THR   7          HG22      THR   7   9.291  -2.119  -7.489
   43   HG23  THR   7          HG23      THR   7   7.575  -1.900  -7.832
   44    H    CYS   8           H        CYS   8   7.775  -3.928  -6.640
   45    HA   CYS   8           HA       CYS   8  10.286  -4.254  -5.468
   46    HB2  CYS   8           HB2      CYS   8   7.484  -4.269  -4.537
   47    HB3  CYS   8           HB3      CYS   8   8.624  -5.117  -3.497
   48    H    ARG   9           H        ARG   9   7.842  -6.618  -6.360
   49    HA   ARG   9           HA       ARG   9   8.811  -8.845  -5.002
   50    HB2  ARG   9           HB2      ARG   9   6.987  -8.326  -7.196
   51    HB3  ARG   9           HB3      ARG   9   7.889  -9.813  -7.455
   52    HG2  ARG   9           HG2      ARG   9   6.929 -10.872  -5.681
   53    HG3  ARG   9           HG3      ARG   9   6.672  -9.373  -4.785
   54    HD2  ARG   9           HD2      ARG   9   4.621  -9.109  -5.628
   55    HD3  ARG   9           HD3      ARG   9   5.167  -9.456  -7.268
   56    HE   ARG   9           HE       ARG   9   3.961 -11.297  -5.410
   57   HH11  ARG   9          HH11      ARG   9   5.942 -10.953  -8.252
   58   HH12  ARG   9          HH12      ARG   9   5.599 -12.545  -8.843
   59   HH21  ARG   9          HH21      ARG   9   3.501 -13.395  -6.178
   60   HH22  ARG   9          HH22      ARG   9   4.210 -13.933  -7.663
   61    H    ALA  10           H        ALA  10   9.864  -7.377  -8.014
   62    HA   ALA  10           HA       ALA  10  11.469  -9.402  -9.032
   63    HB1  ALA  10           HB1      ALA  10  12.330  -6.544  -9.206
   64    HB2  ALA  10           HB2      ALA  10  12.399  -7.811 -10.431
   65    HB3  ALA  10           HB3      ALA  10  10.852  -7.079 -10.005
   66    H    GLY  11           H        GLY  11  12.160  -7.011  -6.528
   67    HA2  GLY  11           HA2      GLY  11  13.885  -8.431  -5.004
   68    HA3  GLY  11           HA3      GLY  11  14.923  -7.828  -6.288
   69    H    GLN  12           H        GLN  12  12.392  -6.591  -4.098
   70    HA   GLN  12           HA       GLN  12  14.183  -4.569  -3.096
   71    HB2  GLN  12           HB2      GLN  12  12.911  -3.841  -5.354
   72    HB3  GLN  12           HB3      GLN  12  11.685  -3.395  -4.174
   73    HG2  GLN  12           HG2      GLN  12  13.174  -1.533  -4.749
   74    HG3  GLN  12           HG3      GLN  12  13.235  -1.949  -3.037
   75   HE21  GLN  12          HE21      GLN  12  15.127  -2.545  -2.147
   76   HE22  GLN  12          HE22      GLN  12  16.618  -2.670  -3.011
   77    H    THR  13           H        THR  13  12.996  -3.118  -1.496
   78    HA   THR  13           HA       THR  13  10.960  -4.722  -0.091
   79    HB   THR  13           HB       THR  13  12.587  -2.716   1.396
   80    HG1  THR  13           HG1      THR  13  13.528  -5.256   0.517
   81   HG21  THR  13          HG21      THR  13  11.027  -5.170   1.943
   82   HG22  THR  13          HG22      THR  13  11.180  -3.690   2.888
   83   HG23  THR  13          HG23      THR  13  12.455  -4.907   2.944
   84    H    CYS  14           H        CYS  14   9.344  -3.565   1.111
   85    HA   CYS  14           HA       CYS  14   8.432  -1.212  -0.288
   86    HB2  CYS  14           HB2      CYS  14   7.247  -3.287   1.298
   87    HB3  CYS  14           HB3      CYS  14   6.791  -1.722   1.965
   88    H    CYS  15           H        CYS  15   9.210   0.721   0.220
   89    HA   CYS  15           HA       CYS  15   9.840   1.297   3.037
   90    HB2  CYS  15           HB2      CYS  15  11.043   2.171   0.455
   91    HB3  CYS  15           HB3      CYS  15  11.051   3.319   1.790
   92    H    ARG  16           H        ARG  16   9.702   3.805   3.429
   93    HA   ARG  16           HA       ARG  16   6.943   4.532   2.826
   94    HB2  ARG  16           HB2      ARG  16   8.964   5.609   4.792
   95    HB3  ARG  16           HB3      ARG  16   7.389   6.349   4.535
   96    HG2  ARG  16           HG2      ARG  16   6.251   4.490   5.399
   97    HG3  ARG  16           HG3      ARG  16   7.680   3.461   5.286
   98    HD2  ARG  16           HD2      ARG  16   7.487   5.872   7.082
   99    HD3  ARG  16           HD3      ARG  16   7.103   4.232   7.602
  100    HE   ARG  16           HE       ARG  16   9.699   4.400   6.438
  101   HH11  ARG  16          HH11      ARG  16   7.891   5.013   9.349
  102   HH12  ARG  16          HH12      ARG  16   9.264   4.849  10.392
  103   HH21  ARG  16          HH21      ARG  16  11.515   4.182   7.801
  104   HH22  ARG  16          HH22      ARG  16  11.325   4.377   9.511
  105    H    GLY  17           H        GLY  17   7.285   5.115   0.614
  106    HA2  GLY  17           HA2      GLY  17   9.136   6.944  -0.352
  107    HA3  GLY  17           HA3      GLY  17   7.548   6.672  -1.053
  108    H    LEU  18           H        LEU  18   8.349   9.119  -1.380
  109    HA   LEU  18           HA       LEU  18   8.134  11.003   0.624
  110    HB2  LEU  18           HB2      LEU  18   7.631  11.027  -2.307
  111    HB3  LEU  18           HB3      LEU  18   7.115  12.422  -1.361
  112    HG   LEU  18           HG       LEU  18   9.619  12.290  -0.494
  113   HD11  LEU  18          HD11      LEU  18  10.961  11.793  -2.678
  114   HD12  LEU  18          HD12      LEU  18   9.585  10.755  -3.051
  115   HD13  LEU  18          HD13      LEU  18  10.524  10.481  -1.584
  116   HD21  LEU  18          HD21      LEU  18  10.209  13.883  -2.323
  117   HD22  LEU  18          HD22      LEU  18   8.691  14.248  -1.503
  118   HD23  LEU  18          HD23      LEU  18   8.673  13.485  -3.094
  119    H    HIS  19           H        HIS  19   5.505  10.148  -1.635
  120    HA   HIS  19           HA       HIS  19   3.460  11.510  -0.373
  121    HB2  HIS  19           HB2      HIS  19   3.356   8.914  -1.920
  122    HB3  HIS  19           HB3      HIS  19   1.931   9.839  -1.454
  123    HD1  HIS  19           HD1      HIS  19   2.246  12.542  -2.315
  124    HD2  HIS  19           HD2      HIS  19   4.068   9.481  -4.452
  125    HE1  HIS  19           HE1      HIS  19   2.687  13.489  -4.602
  126    H    GLY  20           H        GLY  20   4.822   8.357   0.376
  127    HA2  GLY  20           HA2      GLY  20   4.260   8.302   3.041
  128    HA3  GLY  20           HA3      GLY  20   2.788   7.693   2.300
  129    H    TYR  21           H        TYR  21   3.631   6.133   0.284
  130    HA   TYR  21           HA       TYR  21   5.503   4.217   1.496
  131    HB2  TYR  21           HB2      TYR  21   3.758   2.578   0.178
  132    HB3  TYR  21           HB3      TYR  21   3.714   2.906   1.907
  133    HD1  TYR  21           HD1      TYR  21   2.063   3.418  -1.289
  134    HD2  TYR  21           HD2      TYR  21   2.094   4.537   2.816
  135    HE1  TYR  21           HE1      TYR  21  -0.206   4.336  -1.528
  136    HE2  TYR  21           HE2      TYR  21  -0.176   5.457   2.588
  137    HH   TYR  21           HH       TYR  21  -2.220   4.904   0.853
  138    H    GLY  22           H        GLY  22   6.244   2.549  -0.119
  139    HA2  GLY  22           HA2      GLY  22   6.079   2.439  -2.769
  140    HA3  GLY  22           HA3      GLY  22   6.972   3.940  -2.576
  141    H    CYS  23           H        CYS  23   7.796   1.427  -3.834
  142    HA   CYS  23           HA       CYS  23   9.488  -0.138  -2.318
  143    HB2  CYS  23           HB2      CYS  23   9.722   0.767  -5.190
  144    HB3  CYS  23           HB3      CYS  23  10.797  -0.428  -4.472
  145    H    CYS  24           H        CYS  24  11.495   0.052  -1.481
  146    HA   CYS  24           HA       CYS  24  12.563   2.506  -0.809
  147    HB2  CYS  24           HB2      CYS  24  14.109  -0.072  -1.147
  148    HB3  CYS  24           HB3      CYS  24  14.586   1.309  -0.164