NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type
616844 5x36 36052 cing 1-original 3 MR format nomenclature mapping


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   THR   1           H1       THR   1 -11.644  -0.306  -4.376
    2    H2   THR   1           H2       THR   1 -10.705  -1.646  -3.973
    3    H3   THR   1           H3       THR   1 -11.119  -1.345  -5.592
    4    HA   THR   1           HA       THR   1  -8.860  -0.668  -5.148
    5    HB   THR   1           HB       THR   1  -9.257   1.844  -5.667
    6    HG1  THR   1           HG1      THR   1 -11.439   2.269  -6.279
    7   HG21  THR   1          HG21      THR   1  -8.750   0.147  -7.389
    8   HG22  THR   1          HG22      THR   1  -9.938   1.313  -7.970
    9   HG23  THR   1          HG23      THR   1 -10.458  -0.286  -7.451
   10    H    GLN   2           H        GLN   2  -7.452  -0.039  -3.692
   11    HA   GLN   2           HA       GLN   2  -8.273   0.824  -1.086
   12    HB2  GLN   2           HB2      GLN   2  -6.368  -0.721  -1.443
   13    HB3  GLN   2           HB3      GLN   2  -5.518   0.540  -2.318
   14    HG2  GLN   2           HG2      GLN   2  -4.755   0.248   0.005
   15    HG3  GLN   2           HG3      GLN   2  -5.334   1.868  -0.367
   16   HE21  GLN   2          HE21      GLN   2  -5.878   2.406   1.547
   17   HE22  GLN   2          HE22      GLN   2  -7.121   1.714   2.569
   18    H    SER   3           H        SER   3  -7.827   2.812  -0.088
   19    HA   SER   3           HA       SER   3  -8.246   4.963  -1.885
   20    HB2  SER   3           HB2      SER   3  -8.526   6.283   0.107
   21    HB3  SER   3           HB3      SER   3  -9.469   4.805   0.262
   22    H    HIS   4           H        HIS   4  -7.154   6.986  -1.285
   23    HA   HIS   4           HA       HIS   4  -4.350   6.743  -1.923
   24    HB2  HIS   4           HB2      HIS   4  -5.994   8.453  -2.869
   25    HB3  HIS   4           HB3      HIS   4  -5.952   9.243  -1.315
   26    HD1  HIS   4           HD1      HIS   4  -5.061  11.319  -2.828
   27    HD2  HIS   4           HD2      HIS   4  -2.495   8.101  -2.440
   28    HE1  HIS   4           HE1      HIS   4  -2.857  12.116  -3.677
   29    HE2  HIS   4           HE2      HIS   4  -1.548   9.981  -3.856
   30    H    TYR   5           H        TYR   5  -2.695   7.028  -0.430
   31    HA   TYR   5           HA       TYR   5  -1.590   7.358   1.462
   32    HB2  TYR   5           HB2      TYR   5  -4.055   8.807   2.334
   33    HB3  TYR   5           HB3      TYR   5  -2.634   8.681   3.379
   34    HD1  TYR   5           HD1      TYR   5  -4.238  10.470   0.733
   35    HD2  TYR   5           HD2      TYR   5  -0.465   9.665   2.491
   36    HE1  TYR   5           HE1      TYR   5  -3.322  12.450  -0.362
   37    HE2  TYR   5           HE2      TYR   5   0.475  11.644   1.400
   38    HH   TYR   5           HH       TYR   5  -1.496  13.998  -0.051
   39    H    GLY   6           H        GLY   6  -3.753   5.250   0.957
   40    HA2  GLY   6           HA2      GLY   6  -4.014   4.203   3.677
   41    HA3  GLY   6           HA3      GLY   6  -4.884   3.679   2.247
   42    H    GLN   7           H        GLN   7  -3.586   1.830   3.923
   43    HA   GLN   7           HA       GLN   7  -1.015   1.168   2.830
   44    HB2  GLN   7           HB2      GLN   7  -1.837   0.664   5.197
   45    HB3  GLN   7           HB3      GLN   7  -2.823  -0.599   4.477
   46    HG2  GLN   7           HG2      GLN   7  -0.825  -1.724   3.664
   47    HG3  GLN   7           HG3      GLN   7   0.195  -0.460   4.339
   48   HE21  GLN   7          HE21      GLN   7   0.392  -3.209   4.981
   49   HE22  GLN   7          HE22      GLN   7   0.004  -3.406   6.629
   50    H    CYS   8           H        CYS   8  -0.703   0.071   0.996
   51    HA   CYS   8           HA       CYS   8  -3.048  -1.207  -0.241
   52    HB2  CYS   8           HB2      CYS   8  -1.774  -0.971  -2.335
   53    HB3  CYS   8           HB3      CYS   8  -2.232   0.538  -1.575
   54    H    GLY   9           H        GLY   9  -0.757  -2.409   1.562
   55    HA2  GLY   9           HA2      GLY   9  -0.959  -4.932   1.320
   56    HA3  GLY   9           HA3      GLY   9  -0.453  -4.650  -0.328
   57    H    GLY  10           H        GLY  10   0.507  -4.538   2.976
   58    HA2  GLY  10           HA2      GLY  10   3.277  -4.877   2.119
   59    HA3  GLY  10           HA3      GLY  10   2.736  -4.545   3.774
   60    H    ILE  11           H        ILE  11   4.322  -6.668   3.640
   61    HA   ILE  11           HA       ILE  11   2.974  -9.087   3.080
   62    HB   ILE  11           HB       ILE  11   5.241  -8.585   5.042
   63   HG12  ILE  11          HG12      ILE  11   5.310  -9.497   2.152
   64   HG13  ILE  11          HG13      ILE  11   5.767  -7.898   2.730
   65   HG21  ILE  11          HG21      ILE  11   4.293 -11.158   3.761
   66   HG22  ILE  11          HG22      ILE  11   4.089 -10.712   5.454
   67   HG23  ILE  11          HG23      ILE  11   5.707 -10.993   4.807
   68   HD11  ILE  11          HD11      ILE  11   7.603  -8.877   3.994
   69   HD12  ILE  11          HD12      ILE  11   7.716  -9.297   2.281
   70   HD13  ILE  11          HD13      ILE  11   7.124 -10.483   3.447
   71    H    GLY  12           H        GLY  12   1.135  -9.679   4.021
   72    HA2  GLY  12           HA2      GLY  12   0.210 -10.610   6.068
   73    HA3  GLY  12           HA3      GLY  12   0.861  -9.210   6.912
   74    H    TYR  13           H        TYR  13  -0.064  -7.827   4.210
   75    HA   TYR  13           HA       TYR  13  -2.805  -7.296   5.175
   76    HB2  TYR  13           HB2      TYR  13  -1.199  -5.344   5.031
   77    HB3  TYR  13           HB3      TYR  13  -1.053  -5.648   3.312
   78    HD1  TYR  13           HD1      TYR  13  -2.987  -4.073   5.919
   79    HD2  TYR  13           HD2      TYR  13  -3.091  -5.227   1.822
   80    HE1  TYR  13           HE1      TYR  13  -4.860  -2.513   5.518
   81    HE2  TYR  13           HE2      TYR  13  -4.965  -3.651   1.439
   82    HH   TYR  13           HH       TYR  13  -5.768  -1.254   3.504
   83    H    SER  14           H        SER  14  -4.158  -8.606   4.051
   84    HA   SER  14           HA       SER  14  -3.530  -9.089   1.227
   85    HB2  SER  14           HB2      SER  14  -5.149 -10.797   3.119
   86    HB3  SER  14           HB3      SER  14  -4.681 -11.217   1.472
   87    HG   SER  14           HG       SER  14  -2.455 -10.563   2.684
   88    H    GLY  15           H        GLY  15  -5.272  -7.066   2.861
   89    HA2  GLY  15           HA2      GLY  15  -7.947  -7.244   1.810
   90    HA3  GLY  15           HA3      GLY  15  -7.160  -5.885   2.566
   91    HA   PRO  16           HA       PRO  16  -7.838  -4.486  -1.714
   92    HB2  PRO  16           HB2      PRO  16  -7.634  -1.913  -0.252
   93    HB3  PRO  16           HB3      PRO  16  -8.835  -2.434  -1.436
   94    HG2  PRO  16           HG2      PRO  16  -9.414  -2.292   1.166
   95    HG3  PRO  16           HG3      PRO  16 -10.080  -3.572   0.144
   96    HD2  PRO  16           HD2      PRO  16  -7.837  -3.740   2.136
   97    HD3  PRO  16           HD3      PRO  16  -9.095  -4.914   1.727
   98    H    THR  17           H        THR  17  -5.835  -5.066  -2.454
   99    HA   THR  17           HA       THR  17  -3.497  -3.502  -1.699
  100    HB   THR  17           HB       THR  17  -2.360  -5.291  -3.127
  101    HG1  THR  17           HG1      THR  17  -3.842  -6.284  -4.280
  102   HG21  THR  17          HG21      THR  17  -2.492  -6.981  -1.349
  103   HG22  THR  17          HG22      THR  17  -3.948  -6.213  -0.716
  104   HG23  THR  17          HG23      THR  17  -2.408  -5.363  -0.650
  105    H    VAL  18           H        VAL  18  -5.854  -3.579  -4.025
  106    HA   VAL  18           HA       VAL  18  -4.151  -2.517  -6.147
  107    HB   VAL  18           HB       VAL  18  -7.131  -3.123  -6.211
  108   HG11  VAL  18          HG11      VAL  18  -6.496  -1.423  -7.838
  109   HG12  VAL  18          HG12      VAL  18  -6.920  -2.933  -8.646
  110   HG13  VAL  18          HG13      VAL  18  -5.225  -2.477  -8.463
  111   HG21  VAL  18          HG21      VAL  18  -6.528  -5.103  -7.532
  112   HG22  VAL  18          HG22      VAL  18  -5.801  -5.163  -5.923
  113   HG23  VAL  18          HG23      VAL  18  -4.822  -4.720  -7.318
  114    H    CYS  19           H        CYS  19  -3.759  -0.424  -5.978
  115    HA   CYS  19           HA       CYS  19  -5.294   1.351  -4.425
  116    HB2  CYS  19           HB2      CYS  19  -3.137   1.822  -6.469
  117    HB3  CYS  19           HB3      CYS  19  -3.785   3.044  -5.384
  118    H    ALA  20           H        ALA  20  -6.405   3.226  -5.137
  119    HA   ALA  20           HA       ALA  20  -8.174   2.919  -7.303
  120    HB1  ALA  20           HB1      ALA  20  -8.663   4.369  -5.379
  121    HB2  ALA  20           HB2      ALA  20  -8.747   5.289  -6.877
  122    HB3  ALA  20           HB3      ALA  20  -7.337   5.435  -5.833
  123    H    SER  21           H        SER  21  -8.164   3.953  -9.362
  124    HA   SER  21           HA       SER  21  -5.660   4.017 -10.591
  125    HB2  SER  21           HB2      SER  21  -8.282   5.152 -11.576
  126    HB3  SER  21           HB3      SER  21  -6.879   4.746 -12.566
  127    HG   SER  21           HG       SER  21  -7.171   2.588 -11.417
  128    H    GLY  22           H        GLY  22  -4.211   5.523 -10.831
  129    HA2  GLY  22           HA2      GLY  22  -3.606   7.819 -11.173
  130    HA3  GLY  22           HA3      GLY  22  -4.912   8.262 -10.075
  131    H    THR  23           H        THR  23  -4.121   5.824  -8.388
  132    HA   THR  23           HA       THR  23  -1.881   7.174  -7.089
  133    HB   THR  23           HB       THR  23  -2.549   6.097  -4.985
  134    HG1  THR  23           HG1      THR  23  -4.482   4.868  -6.648
  135   HG21  THR  23          HG21      THR  23  -4.671   7.274  -4.596
  136   HG22  THR  23          HG22      THR  23  -4.829   7.531  -6.334
  137   HG23  THR  23          HG23      THR  23  -3.492   8.266  -5.445
  138    H    THR  24           H        THR  24  -0.143   6.021  -6.440
  139    HA   THR  24           HA       THR  24   0.137   3.422  -7.751
  140    HB   THR  24           HB       THR  24   2.623   3.935  -7.610
  141    HG1  THR  24           HG1      THR  24   1.550   6.325  -6.521
  142   HG21  THR  24          HG21      THR  24   1.359   4.229  -9.698
  143   HG22  THR  24          HG22      THR  24   2.574   5.495  -9.527
  144   HG23  THR  24          HG23      THR  24   0.884   5.848  -9.183
  145    H    CYS  25           H        CYS  25   0.793   1.640  -6.541
  146    HA   CYS  25           HA       CYS  25   0.714   1.973  -3.678
  147    HB2  CYS  25           HB2      CYS  25  -0.436   0.020  -4.627
  148    HB3  CYS  25           HB3      CYS  25   1.065  -0.566  -5.333
  149    H    GLN  26           H        GLN  26   2.446   2.826  -2.854
  150    HA   GLN  26           HA       GLN  26   5.040   1.994  -3.873
  151    HB2  GLN  26           HB2      GLN  26   4.201   4.359  -2.212
  152    HB3  GLN  26           HB3      GLN  26   5.866   4.026  -2.658
  153    HG2  GLN  26           HG2      GLN  26   5.253   4.202  -5.031
  154    HG3  GLN  26           HG3      GLN  26   3.587   4.515  -4.573
  155   HE21  GLN  26          HE21      GLN  26   3.529   6.442  -5.562
  156   HE22  GLN  26          HE22      GLN  26   4.356   7.847  -5.000
  157    H    VAL  27           H        VAL  27   6.052   0.534  -2.819
  158    HA   VAL  27           HA       VAL  27   5.324  -0.250  -0.153
  159    HB   VAL  27           HB       VAL  27   7.705  -1.141  -1.826
  160   HG11  VAL  27          HG11      VAL  27   7.981  -1.662   0.546
  161   HG12  VAL  27          HG12      VAL  27   7.720  -3.135  -0.384
  162   HG13  VAL  27          HG13      VAL  27   6.408  -2.451   0.568
  163   HG21  VAL  27          HG21      VAL  27   5.610  -1.582  -2.999
  164   HG22  VAL  27          HG22      VAL  27   4.977  -2.408  -1.573
  165   HG23  VAL  27          HG23      VAL  27   6.352  -3.086  -2.448
  166    H    LEU  28           H        LEU  28   6.054   0.735   1.564
  167    HA   LEU  28           HA       LEU  28   8.376   2.504   1.287
  168    HB2  LEU  28           HB2      LEU  28   6.194   2.463   3.377
  169    HB3  LEU  28           HB3      LEU  28   7.472   3.661   3.255
  170    HG   LEU  28           HG       LEU  28   5.314   3.205   1.181
  171   HD11  LEU  28          HD11      LEU  28   4.463   5.365   1.842
  172   HD12  LEU  28          HD12      LEU  28   5.656   5.456   3.142
  173   HD13  LEU  28          HD13      LEU  28   4.397   4.217   3.177
  174   HD21  LEU  28          HD21      LEU  28   7.465   5.263   1.388
  175   HD22  LEU  28          HD22      LEU  28   6.155   5.275   0.203
  176   HD23  LEU  28          HD23      LEU  28   7.358   3.973   0.186
  177    H    ASN  29           H        ASN  29   6.957   0.014   3.267
  178    HA   ASN  29           HA       ASN  29   9.587  -0.691   4.314
  179    HB2  ASN  29           HB2      ASN  29   7.005  -0.509   5.935
  180    HB3  ASN  29           HB3      ASN  29   8.501  -1.211   6.505
  181   HD21  ASN  29          HD21      ASN  29   6.816   1.740   5.823
  182   HD22  ASN  29          HD22      ASN  29   7.931   2.803   6.600
  183    HA   PRO  30           HA       PRO  30   8.331  -4.747   3.019
  184    HB2  PRO  30           HB2      PRO  30   8.491  -5.755   5.804
  185    HB3  PRO  30           HB3      PRO  30   9.256  -6.396   4.347
  186    HG2  PRO  30           HG2      PRO  30  10.712  -5.054   6.106
  187    HG3  PRO  30           HG3      PRO  30  10.943  -4.778   4.370
  188    HD2  PRO  30           HD2      PRO  30   9.503  -3.100   6.381
  189    HD3  PRO  30           HD3      PRO  30  10.545  -2.586   5.042
  190    H    TYR  31           H        TYR  31   6.689  -3.538   5.895
  191    HA   TYR  31           HA       TYR  31   4.368  -5.186   5.128
  192    HB2  TYR  31           HB2      TYR  31   4.785  -3.840   7.807
  193    HB3  TYR  31           HB3      TYR  31   3.613  -5.078   7.393
  194    HD1  TYR  31           HD1      TYR  31   4.348  -7.423   7.084
  195    HD2  TYR  31           HD2      TYR  31   7.059  -4.413   8.364
  196    HE1  TYR  31           HE1      TYR  31   5.916  -9.158   7.812
  197    HE2  TYR  31           HE2      TYR  31   8.642  -6.135   9.097
  198    HH   TYR  31           HH       TYR  31   8.268  -9.420   8.256
  199    H    TYR  32           H        TYR  32   5.533  -1.945   5.642
  200    HA   TYR  32           HA       TYR  32   2.849  -0.884   5.327
  201    HB2  TYR  32           HB2      TYR  32   4.234   0.085   7.119
  202    HB3  TYR  32           HB3      TYR  32   5.404   0.609   5.916
  203    HD1  TYR  32           HD1      TYR  32   5.350   2.901   5.458
  204    HD2  TYR  32           HD2      TYR  32   1.701   0.870   6.368
  205    HE1  TYR  32           HE1      TYR  32   4.149   4.985   5.268
  206    HE2  TYR  32           HE2      TYR  32   0.486   2.978   6.151
  207    HH   TYR  32           HH       TYR  32   1.909   5.807   4.842
  208    H    SER  33           H        SER  33   2.109  -0.518   3.393
  209    HA   SER  33           HA       SER  33   3.859   0.667   1.365
  210    HB2  SER  33           HB2      SER  33   1.712  -1.427   0.856
  211    HB3  SER  33           HB3      SER  33   2.792  -0.720  -0.347
  212    HG   SER  33           HG       SER  33   3.354  -2.860   0.526
  213    H    GLN  34           H        GLN  34   2.731   2.293   0.165
  214    HA   GLN  34           HA       GLN  34   0.002   2.806   1.094
  215    HB2  GLN  34           HB2      GLN  34   1.319   4.127   2.565
  216    HB3  GLN  34           HB3      GLN  34   2.324   4.710   1.250
  217    HG2  GLN  34           HG2      GLN  34   0.475   5.998   0.362
  218    HG3  GLN  34           HG3      GLN  34  -0.584   5.353   1.616
  219   HE21  GLN  34          HE21      GLN  34  -0.546   6.252   3.619
  220   HE22  GLN  34          HE22      GLN  34   0.433   7.618   4.016
  221    H    CYS  35           H        CYS  35  -1.357   3.591  -0.383
  222    HA   CYS  35           HA       CYS  35  -0.535   3.845  -3.133
  223    HB2  CYS  35           HB2      CYS  35  -3.189   4.591  -1.878
  224    HB3  CYS  35           HB3      CYS  35  -2.852   4.421  -3.595
  225    H    LEU  36           H        LEU  36   0.461   5.595  -3.840
  226    HA   LEU  36           HA       LEU  36  -0.384   8.212  -2.842
  227    HB2  LEU  36           HB2      LEU  36   2.379   7.279  -3.581
  228    HB3  LEU  36           HB3      LEU  36   1.953   8.967  -3.422
  229    HG   LEU  36           HG       LEU  36   1.723   6.949  -1.195
  230   HD11  LEU  36          HD11      LEU  36   3.795   9.090  -1.667
  231   HD12  LEU  36          HD12      LEU  36   4.058   7.348  -1.807
  232   HD13  LEU  36          HD13      LEU  36   3.660   8.059  -0.242
  233   HD21  LEU  36          HD21      LEU  36   1.446   8.955   0.199
  234   HD22  LEU  36          HD22      LEU  36   0.147   8.772  -0.966
  235   HD23  LEU  36          HD23      LEU  36   1.429   9.951  -1.255
  236    H1   MAN 101           H1       MAN 101  -8.628   6.506   2.391
  237    H2   MAN 101           H2       MAN 101  -6.533   5.831   3.545
  238    H3   MAN 101           H3       MAN 101  -6.695   3.413   3.200
  239    H4   MAN 101           H4       MAN 101  -9.012   3.503   5.195
  240    H5   MAN 101           H5       MAN 101  -9.097   2.913   2.159
  241    H61  MAN 101           H61      MAN 101 -11.163   3.130   4.370
  242    H62  MAN 101           H62      MAN 101 -10.848   1.719   3.328
  243    HO2  MAN 101           HO2      MAN 101  -8.285   6.824   4.702
  244    HO3  MAN 101           HO3      MAN 101  -6.958   4.183   5.929
  245    HO4  MAN 101           HO4      MAN 101  -7.669   1.654   5.176
  246    HO6  MAN 101           HO6      MAN 101 -11.695   4.297   2.409
  Start of MODEL    2
    1    H1   THR   1           H1       THR   1 -11.754   0.806  -5.042
    2    H2   THR   1           H2       THR   1 -11.566  -0.672  -4.243
    3    H3   THR   1           H3       THR   1 -11.560  -0.624  -5.947
    4    HA   THR   1           HA       THR   1  -9.348  -0.842  -5.192
    5    HB   THR   1           HB       THR   1  -8.471   1.428  -5.947
    6    HG1  THR   1           HG1      THR   1 -10.230   2.702  -6.951
    7   HG21  THR   1          HG21      THR   1 -10.476   0.005  -7.706
    8   HG22  THR   1          HG22      THR   1  -8.778  -0.442  -7.496
    9   HG23  THR   1          HG23      THR   1  -9.201   1.093  -8.253
   10    H    GLN   2           H        GLN   2  -7.588  -0.006  -3.974
   11    HA   GLN   2           HA       GLN   2  -8.271   0.745  -1.322
   12    HB2  GLN   2           HB2      GLN   2  -6.388  -0.770  -1.796
   13    HB3  GLN   2           HB3      GLN   2  -5.580   0.497  -2.700
   14    HG2  GLN   2           HG2      GLN   2  -4.636   0.282  -0.425
   15    HG3  GLN   2           HG3      GLN   2  -5.388   1.835  -0.727
   16   HE21  GLN   2          HE21      GLN   2  -5.764   2.270   1.198
   17   HE22  GLN   2          HE22      GLN   2  -6.905   1.472   2.267
   18    H    SER   3           H        SER   3  -7.850   2.641  -0.245
   19    HA   SER   3           HA       SER   3  -8.263   4.933  -1.864
   20    HB2  SER   3           HB2      SER   3  -8.699   6.027   0.275
   21    HB3  SER   3           HB3      SER   3  -9.570   4.503   0.146
   22    H    HIS   4           H        HIS   4  -7.165   6.833  -1.530
   23    HA   HIS   4           HA       HIS   4  -4.342   6.685  -1.942
   24    HB2  HIS   4           HB2      HIS   4  -5.971   8.431  -2.902
   25    HB3  HIS   4           HB3      HIS   4  -5.952   9.187  -1.325
   26    HD1  HIS   4           HD1      HIS   4  -5.044  11.298  -2.776
   27    HD2  HIS   4           HD2      HIS   4  -2.457   8.072  -2.452
   28    HE1  HIS   4           HE1      HIS   4  -2.813  12.160  -3.485
   29    HE2  HIS   4           HE2      HIS   4  -1.441  10.066  -3.706
   30    H    TYR   5           H        TYR   5  -2.725   6.913  -0.442
   31    HA   TYR   5           HA       TYR   5  -1.639   7.145   1.439
   32    HB2  TYR   5           HB2      TYR   5  -4.000   8.794   2.260
   33    HB3  TYR   5           HB3      TYR   5  -2.710   8.453   3.411
   34    HD1  TYR   5           HD1      TYR   5  -0.465   9.342   3.021
   35    HD2  TYR   5           HD2      TYR   5  -3.688  10.360   0.460
   36    HE1  TYR   5           HE1      TYR   5   0.845  11.207   2.139
   37    HE2  TYR   5           HE2      TYR   5  -2.380  12.235  -0.445
   38    HH   TYR   5           HH       TYR   5  -0.505  13.663   0.309
   39    H    GLY   6           H        GLY   6  -4.020   5.208   0.966
   40    HA2  GLY   6           HA2      GLY   6  -4.181   4.025   3.629
   41    HA3  GLY   6           HA3      GLY   6  -5.024   3.526   2.179
   42    H    GLN   7           H        GLN   7  -3.787   1.628   3.735
   43    HA   GLN   7           HA       GLN   7  -1.138   1.120   2.745
   44    HB2  GLN   7           HB2      GLN   7  -1.972   0.503   5.064
   45    HB3  GLN   7           HB3      GLN   7  -2.936  -0.753   4.303
   46    HG2  GLN   7           HG2      GLN   7  -0.936  -1.835   3.485
   47    HG3  GLN   7           HG3      GLN   7   0.070  -0.553   4.146
   48   HE21  GLN   7          HE21      GLN   7   0.281  -3.320   4.764
   49   HE22  GLN   7          HE22      GLN   7  -0.088  -3.512   6.420
   50    H    CYS   8           H        CYS   8  -0.622  -0.129   1.035
   51    HA   CYS   8           HA       CYS   8  -2.924  -1.246  -0.437
   52    HB2  CYS   8           HB2      CYS   8  -1.626  -0.815  -2.458
   53    HB3  CYS   8           HB3      CYS   8  -2.014   0.631  -1.531
   54    H    GLY   9           H        GLY   9  -0.471  -2.538   1.299
   55    HA2  GLY   9           HA2      GLY   9  -0.685  -5.091   0.739
   56    HA3  GLY   9           HA3      GLY   9   0.011  -4.569  -0.779
   57    H    GLY  10           H        GLY  10   0.565  -4.575   2.663
   58    HA2  GLY  10           HA2      GLY  10   3.437  -4.815   2.137
   59    HA3  GLY  10           HA3      GLY  10   2.702  -4.466   3.705
   60    H    ILE  11           H        ILE  11   4.434  -6.501   3.703
   61    HA   ILE  11           HA       ILE  11   3.420  -9.039   3.130
   62    HB   ILE  11           HB       ILE  11   5.222  -8.250   5.437
   63   HG12  ILE  11          HG12      ILE  11   5.967  -9.236   2.673
   64   HG13  ILE  11          HG13      ILE  11   6.090  -7.565   3.217
   65   HG21  ILE  11          HG21      ILE  11   4.792 -10.944   4.137
   66   HG22  ILE  11          HG22      ILE  11   4.273 -10.472   5.753
   67   HG23  ILE  11          HG23      ILE  11   5.994 -10.586   5.379
   68   HD11  ILE  11          HD11      ILE  11   7.715  -8.230   4.891
   69   HD12  ILE  11          HD12      ILE  11   8.241  -8.697   3.266
   70   HD13  ILE  11          HD13      ILE  11   7.567  -9.906   4.368
   71    H    GLY  12           H        GLY  12   1.463  -9.704   3.781
   72    HA2  GLY  12           HA2      GLY  12   0.300 -10.794   5.557
   73    HA3  GLY  12           HA3      GLY  12   0.928  -9.582   6.659
   74    H    TYR  13           H        TYR  13   0.101  -7.882   4.032
   75    HA   TYR  13           HA       TYR  13  -2.437  -7.139   5.257
   76    HB2  TYR  13           HB2      TYR  13  -0.868  -5.345   4.609
   77    HB3  TYR  13           HB3      TYR  13  -0.942  -5.888   2.941
   78    HD1  TYR  13           HD1      TYR  13  -2.500  -4.914   1.492
   79    HD2  TYR  13           HD2      TYR  13  -3.118  -4.616   5.678
   80    HE1  TYR  13           HE1      TYR  13  -4.357  -3.383   1.092
   81    HE2  TYR  13           HE2      TYR  13  -4.993  -3.069   5.290
   82    HH   TYR  13           HH       TYR  13  -6.125  -2.354   2.024
   83    H    SER  14           H        SER  14  -4.110  -8.324   4.688
   84    HA   SER  14           HA       SER  14  -4.205  -9.388   1.975
   85    HB2  SER  14           HB2      SER  14  -5.726 -10.241   4.441
   86    HB3  SER  14           HB3      SER  14  -5.683 -11.077   2.885
   87    HG   SER  14           HG       SER  14  -3.286 -11.026   3.262
   88    H    GLY  15           H        GLY  15  -5.057  -6.690   3.108
   89    HA2  GLY  15           HA2      GLY  15  -7.898  -6.609   2.480
   90    HA3  GLY  15           HA3      GLY  15  -6.882  -5.248   2.936
   91    HA   PRO  16           HA       PRO  16  -7.758  -4.896  -1.633
   92    HB2  PRO  16           HB2      PRO  16  -7.742  -2.038  -0.808
   93    HB3  PRO  16           HB3      PRO  16  -8.887  -2.889  -1.851
   94    HG2  PRO  16           HG2      PRO  16  -9.581  -2.203   0.618
   95    HG3  PRO  16           HG3      PRO  16 -10.067  -3.770  -0.053
   96    HD2  PRO  16           HD2      PRO  16  -7.853  -3.156   1.877
   97    HD3  PRO  16           HD3      PRO  16  -9.007  -4.494   1.890
   98    H    THR  17           H        THR  17  -5.863  -5.203  -2.665
   99    HA   THR  17           HA       THR  17  -3.546  -3.585  -1.913
  100    HB   THR  17           HB       THR  17  -2.353  -5.396  -3.304
  101    HG1  THR  17           HG1      THR  17  -4.308  -7.191  -2.640
  102   HG21  THR  17          HG21      THR  17  -2.204  -5.256  -0.865
  103   HG22  THR  17          HG22      THR  17  -2.315  -6.944  -1.378
  104   HG23  THR  17          HG23      THR  17  -3.726  -6.128  -0.709
  105    H    VAL  18           H        VAL  18  -5.937  -3.398  -4.073
  106    HA   VAL  18           HA       VAL  18  -4.165  -2.487  -6.223
  107    HB   VAL  18           HB       VAL  18  -7.140  -3.080  -6.372
  108   HG11  VAL  18          HG11      VAL  18  -6.843  -2.890  -8.806
  109   HG12  VAL  18          HG12      VAL  18  -5.160  -2.433  -8.555
  110   HG13  VAL  18          HG13      VAL  18  -6.453  -1.382  -7.977
  111   HG21  VAL  18          HG21      VAL  18  -6.495  -5.041  -7.692
  112   HG22  VAL  18          HG22      VAL  18  -5.849  -5.123  -6.049
  113   HG23  VAL  18          HG23      VAL  18  -4.799  -4.671  -7.392
  114    H    CYS  19           H        CYS  19  -3.757  -0.417  -6.010
  115    HA   CYS  19           HA       CYS  19  -5.314   1.369  -4.486
  116    HB2  CYS  19           HB2      CYS  19  -3.071   1.842  -6.437
  117    HB3  CYS  19           HB3      CYS  19  -3.743   3.046  -5.343
  118    H    ALA  20           H        ALA  20  -6.376   3.235  -5.189
  119    HA   ALA  20           HA       ALA  20  -8.073   2.960  -7.386
  120    HB1  ALA  20           HB1      ALA  20  -7.301   5.448  -5.860
  121    HB2  ALA  20           HB2      ALA  20  -8.614   4.334  -5.456
  122    HB3  ALA  20           HB3      ALA  20  -8.692   5.285  -6.936
  123    H    SER  21           H        SER  21  -8.075   3.961  -9.394
  124    HA   SER  21           HA       SER  21  -5.663   4.189 -10.733
  125    HB2  SER  21           HB2      SER  21  -8.329   5.421 -11.453
  126    HB3  SER  21           HB3      SER  21  -7.014   5.030 -12.566
  127    HG   SER  21           HG       SER  21  -7.246   2.824 -11.788
  128    H    GLY  22           H        GLY  22  -4.189   5.768 -10.819
  129    HA2  GLY  22           HA2      GLY  22  -3.649   8.090 -11.026
  130    HA3  GLY  22           HA3      GLY  22  -4.984   8.446  -9.931
  131    H    THR  23           H        THR  23  -3.985   5.880  -8.426
  132    HA   THR  23           HA       THR  23  -1.796   7.252  -7.064
  133    HB   THR  23           HB       THR  23  -2.483   6.155  -4.981
  134    HG1  THR  23           HG1      THR  23  -4.430   4.982  -6.669
  135   HG21  THR  23          HG21      THR  23  -4.757   7.629  -6.311
  136   HG22  THR  23          HG22      THR  23  -3.399   8.362  -5.457
  137   HG23  THR  23          HG23      THR  23  -4.573   7.389  -4.574
  138    H    THR  24           H        THR  24  -0.054   6.014  -6.393
  139    HA   THR  24           HA       THR  24   0.091   3.384  -7.699
  140    HB   THR  24           HB       THR  24   2.582   3.741  -7.703
  141    HG1  THR  24           HG1      THR  24   1.781   6.143  -6.487
  142   HG21  THR  24          HG21      THR  24   0.923   5.792  -9.168
  143   HG22  THR  24          HG22      THR  24   1.284   4.154  -9.719
  144   HG23  THR  24          HG23      THR  24   2.576   5.343  -9.570
  145    H    CYS  25           H        CYS  25   0.734   1.618  -6.512
  146    HA   CYS  25           HA       CYS  25   0.713   1.961  -3.663
  147    HB2  CYS  25           HB2      CYS  25  -0.369   0.009  -4.589
  148    HB3  CYS  25           HB3      CYS  25   1.118  -0.545  -5.344
  149    H    GLN  26           H        GLN  26   2.437   2.710  -2.694
  150    HA   GLN  26           HA       GLN  26   5.039   1.933  -3.746
  151    HB2  GLN  26           HB2      GLN  26   4.235   4.235  -1.981
  152    HB3  GLN  26           HB3      GLN  26   5.883   3.906  -2.487
  153    HG2  GLN  26           HG2      GLN  26   5.149   4.178  -4.844
  154    HG3  GLN  26           HG3      GLN  26   3.545   4.607  -4.260
  155   HE21  GLN  26          HE21      GLN  26   3.586   6.619  -5.119
  156   HE22  GLN  26          HE22      GLN  26   4.615   7.886  -4.515
  157    H    VAL  27           H        VAL  27   5.845   0.270  -2.729
  158    HA   VAL  27           HA       VAL  27   5.152  -0.366  -0.031
  159    HB   VAL  27           HB       VAL  27   7.365  -1.531  -1.778
  160   HG11  VAL  27          HG11      VAL  27   6.113  -2.611   0.740
  161   HG12  VAL  27          HG12      VAL  27   7.733  -1.940   0.601
  162   HG13  VAL  27          HG13      VAL  27   7.323  -3.439  -0.247
  163   HG21  VAL  27          HG21      VAL  27   5.164  -1.853  -2.781
  164   HG22  VAL  27          HG22      VAL  27   4.572  -2.557  -1.275
  165   HG23  VAL  27          HG23      VAL  27   5.822  -3.385  -2.201
  166    H    LEU  28           H        LEU  28   5.773   1.015   1.391
  167    HA   LEU  28           HA       LEU  28   8.173   2.617   1.116
  168    HB2  LEU  28           HB2      LEU  28   6.076   2.553   3.280
  169    HB3  LEU  28           HB3      LEU  28   7.329   3.765   3.104
  170    HG   LEU  28           HG       LEU  28   5.085   3.298   1.132
  171   HD11  LEU  28          HD11      LEU  28   4.252   5.442   1.918
  172   HD12  LEU  28          HD12      LEU  28   5.496   5.463   3.178
  173   HD13  LEU  28          HD13      LEU  28   4.240   4.218   3.187
  174   HD21  LEU  28          HD21      LEU  28   7.097   4.157   0.101
  175   HD22  LEU  28          HD22      LEU  28   7.163   5.421   1.338
  176   HD23  LEU  28          HD23      LEU  28   5.829   5.390   0.181
  177    H    ASN  29           H        ASN  29   6.872   0.095   3.148
  178    HA   ASN  29           HA       ASN  29   9.503  -0.413   4.313
  179    HB2  ASN  29           HB2      ASN  29   6.891  -0.549   5.888
  180    HB3  ASN  29           HB3      ASN  29   8.479  -0.918   6.489
  181   HD21  ASN  29          HD21      ASN  29   7.370   1.944   4.739
  182   HD22  ASN  29          HD22      ASN  29   7.735   3.084   5.981
  183    HA   PRO  30           HA       PRO  30   8.506  -4.582   3.119
  184    HB2  PRO  30           HB2      PRO  30   8.664  -5.464   5.960
  185    HB3  PRO  30           HB3      PRO  30   9.483  -6.123   4.541
  186    HG2  PRO  30           HG2      PRO  30  10.851  -4.637   6.248
  187    HG3  PRO  30           HG3      PRO  30  11.085  -4.430   4.502
  188    HD2  PRO  30           HD2      PRO  30   9.546  -2.734   6.420
  189    HD3  PRO  30           HD3      PRO  30  10.579  -2.233   5.065
  190    H    TYR  31           H        TYR  31   6.790  -3.496   6.053
  191    HA   TYR  31           HA       TYR  31   4.540  -5.176   5.179
  192    HB2  TYR  31           HB2      TYR  31   4.893  -3.866   7.892
  193    HB3  TYR  31           HB3      TYR  31   3.679  -5.049   7.433
  194    HD1  TYR  31           HD1      TYR  31   4.215  -7.400   7.314
  195    HD2  TYR  31           HD2      TYR  31   7.227  -4.553   8.263
  196    HE1  TYR  31           HE1      TYR  31   5.705  -9.220   8.038
  197    HE2  TYR  31           HE2      TYR  31   8.719  -6.353   8.982
  198    HH   TYR  31           HH       TYR  31   8.415  -8.717   9.860
  199    H    TYR  32           H        TYR  32   5.589  -1.930   5.675
  200    HA   TYR  32           HA       TYR  32   2.869  -0.971   5.370
  201    HB2  TYR  32           HB2      TYR  32   4.288   0.064   7.120
  202    HB3  TYR  32           HB3      TYR  32   5.345   0.675   5.853
  203    HD1  TYR  32           HD1      TYR  32   1.710   0.597   6.562
  204    HD2  TYR  32           HD2      TYR  32   5.044   2.900   5.284
  205    HE1  TYR  32           HE1      TYR  32   0.268   2.549   6.370
  206    HE2  TYR  32           HE2      TYR  32   3.628   4.864   5.078
  207    HH   TYR  32           HH       TYR  32   1.254   5.429   4.823
  208    H    SER  33           H        SER  33   2.109  -0.705   3.437
  209    HA   SER  33           HA       SER  33   3.792   0.539   1.380
  210    HB2  SER  33           HB2      SER  33   1.625  -1.541   0.922
  211    HB3  SER  33           HB3      SER  33   2.711  -0.863  -0.296
  212    HG   SER  33           HG       SER  33   3.306  -2.996   0.561
  213    H    GLN  34           H        GLN  34   2.677   2.210   0.277
  214    HA   GLN  34           HA       GLN  34  -0.055   2.701   1.201
  215    HB2  GLN  34           HB2      GLN  34   1.231   3.998   2.714
  216    HB3  GLN  34           HB3      GLN  34   2.294   4.561   1.442
  217    HG2  GLN  34           HG2      GLN  34   0.539   5.965   0.550
  218    HG3  GLN  34           HG3      GLN  34  -0.602   5.307   1.721
  219   HE21  GLN  34          HE21      GLN  34  -0.661   6.143   3.755
  220   HE22  GLN  34          HE22      GLN  34   0.327   7.451   4.276
  221    H    CYS  35           H        CYS  35  -1.410   3.506  -0.279
  222    HA   CYS  35           HA       CYS  35  -0.553   3.731  -3.011
  223    HB2  CYS  35           HB2      CYS  35  -3.207   4.521  -1.794
  224    HB3  CYS  35           HB3      CYS  35  -2.841   4.382  -3.508
  225    H    LEU  36           H        LEU  36   0.592   5.409  -3.568
  226    HA   LEU  36           HA       LEU  36  -0.340   8.045  -2.746
  227    HB2  LEU  36           HB2      LEU  36   2.466   7.123  -3.361
  228    HB3  LEU  36           HB3      LEU  36   2.009   8.802  -3.176
  229    HG   LEU  36           HG       LEU  36   1.779   6.714  -1.012
  230   HD11  LEU  36          HD11      LEU  36   3.779   8.941  -1.390
  231   HD12  LEU  36          HD12      LEU  36   4.109   7.214  -1.541
  232   HD13  LEU  36          HD13      LEU  36   3.655   7.891   0.023
  233   HD21  LEU  36          HD21      LEU  36   1.375   9.701  -0.990
  234   HD22  LEU  36          HD22      LEU  36   1.386   8.659   0.432
  235   HD23  LEU  36          HD23      LEU  36   0.127   8.472  -0.786
  236    H1   MAN 101           H1       MAN 101  -9.282   5.704   2.529
  237    H2   MAN 101           H2       MAN 101  -7.203   5.302   3.892
  238    H3   MAN 101           H3       MAN 101  -6.731   3.044   3.203
  239    H4   MAN 101           H4       MAN 101  -9.203   2.315   4.796
  240    H5   MAN 101           H5       MAN 101  -8.728   2.116   1.778
  241    H61  MAN 101           H61      MAN 101 -10.241   0.412   2.839
  242    H62  MAN 101           H62      MAN 101 -11.016   1.412   1.591
  243    HO2  MAN 101           HO2      MAN 101  -8.333   4.543   5.759
  244    HO3  MAN 101           HO3      MAN 101  -6.591   2.163   5.359
  245    HO4  MAN 101           HO4      MAN 101  -8.572   0.201   4.003
  246    HO6  MAN 101           HO6      MAN 101 -11.860   2.705   3.224
  Start of MODEL    3
    1    H1   THR   1           H1       THR   1 -11.300  -1.048  -4.483
    2    H2   THR   1           H2       THR   1 -11.458  -0.691  -6.117
    3    H3   THR   1           H3       THR   1 -11.866   0.477  -4.949
    4    HA   THR   1           HA       THR   1  -9.189  -0.501  -5.556
    5    HB   THR   1           HB       THR   1  -8.977   2.043  -5.895
    6    HG1  THR   1           HG1      THR   1 -11.122   2.859  -6.709
    7   HG21  THR   1          HG21      THR   1 -10.586   0.429  -7.896
    8   HG22  THR   1          HG22      THR   1  -8.831   0.391  -7.731
    9   HG23  THR   1          HG23      THR   1  -9.633   1.871  -8.251
   10    H    GLN   2           H        GLN   2  -7.677  -0.035  -4.059
   11    HA   GLN   2           HA       GLN   2  -8.455   0.675  -1.433
   12    HB2  GLN   2           HB2      GLN   2  -6.607  -0.892  -1.863
   13    HB3  GLN   2           HB3      GLN   2  -5.713   0.367  -2.703
   14    HG2  GLN   2           HG2      GLN   2  -4.911  -0.016  -0.415
   15    HG3  GLN   2           HG3      GLN   2  -5.486   1.625  -0.692
   16   HE21  GLN   2          HE21      GLN   2  -6.060   2.128   1.177
   17   HE22  GLN   2          HE22      GLN   2  -7.255   1.400   2.219
   18    H    SER   3           H        SER   3  -8.065   2.613  -0.338
   19    HA   SER   3           HA       SER   3  -8.354   4.857  -2.036
   20    HB2  SER   3           HB2      SER   3  -8.824   6.045   0.021
   21    HB3  SER   3           HB3      SER   3  -9.699   4.512   0.010
   22    H    HIS   4           H        HIS   4  -7.260   6.828  -1.440
   23    HA   HIS   4           HA       HIS   4  -4.439   6.639  -1.899
   24    HB2  HIS   4           HB2      HIS   4  -6.206   8.434  -2.634
   25    HB3  HIS   4           HB3      HIS   4  -5.911   9.128  -1.052
   26    HD1  HIS   4           HD1      HIS   4  -5.312  10.820  -3.461
   27    HD2  HIS   4           HD2      HIS   4  -2.486   8.292  -1.786
   28    HE1  HIS   4           HE1      HIS   4  -3.115  11.644  -4.288
   29    HE2  HIS   4           HE2      HIS   4  -1.615   9.744  -3.716
   30    H    TYR   5           H        TYR   5  -2.832   6.842  -0.348
   31    HA   TYR   5           HA       TYR   5  -1.787   6.964   1.593
   32    HB2  TYR   5           HB2      TYR   5  -4.219   8.470   2.521
   33    HB3  TYR   5           HB3      TYR   5  -2.869   8.127   3.602
   34    HD1  TYR   5           HD1      TYR   5  -4.159  10.273   1.040
   35    HD2  TYR   5           HD2      TYR   5  -0.600   9.023   2.977
   36    HE1  TYR   5           HE1      TYR   5  -3.013  12.274   0.215
   37    HE2  TYR   5           HE2      TYR   5   0.560  11.017   2.156
   38    HH   TYR   5           HH       TYR   5  -1.038  13.652   0.882
   39    H    GLY   6           H        GLY   6  -4.025   4.982   0.919
   40    HA2  GLY   6           HA2      GLY   6  -4.306   3.764   3.538
   41    HA3  GLY   6           HA3      GLY   6  -5.088   3.298   2.045
   42    H    GLN   7           H        GLN   7  -3.648   1.598   3.864
   43    HA   GLN   7           HA       GLN   7  -1.128   0.937   2.740
   44    HB2  GLN   7           HB2      GLN   7  -1.955   0.383   5.075
   45    HB3  GLN   7           HB3      GLN   7  -2.936  -0.883   4.347
   46    HG2  GLN   7           HG2      GLN   7  -0.916  -1.983   3.551
   47    HG3  GLN   7           HG3      GLN   7   0.088  -0.714   4.243
   48   HE21  GLN   7          HE21      GLN   7   0.349  -3.431   4.939
   49   HE22  GLN   7          HE22      GLN   7  -0.176  -3.638   6.553
   50    H    CYS   8           H        CYS   8  -0.722  -0.187   0.946
   51    HA   CYS   8           HA       CYS   8  -3.040  -1.341  -0.453
   52    HB2  CYS   8           HB2      CYS   8  -1.694  -1.051  -2.482
   53    HB3  CYS   8           HB3      CYS   8  -2.056   0.445  -1.633
   54    H    GLY   9           H        GLY   9  -0.783  -2.635   1.405
   55    HA2  GLY   9           HA2      GLY   9  -0.981  -5.166   1.162
   56    HA3  GLY   9           HA3      GLY   9  -0.515  -4.880  -0.497
   57    H    GLY  10           H        GLY  10   0.591  -4.358   2.769
   58    HA2  GLY  10           HA2      GLY  10   3.346  -4.917   1.906
   59    HA3  GLY  10           HA3      GLY  10   2.851  -4.268   3.476
   60    H    ILE  11           H        ILE  11   4.429  -6.340   3.758
   61    HA   ILE  11           HA       ILE  11   3.280  -8.883   3.635
   62    HB   ILE  11           HB       ILE  11   5.272  -7.882   5.703
   63   HG12  ILE  11          HG12      ILE  11   5.755  -9.274   3.052
   64   HG13  ILE  11          HG13      ILE  11   6.025  -7.565   3.361
   65   HG21  ILE  11          HG21      ILE  11   4.608 -10.700   4.820
   66   HG22  ILE  11          HG22      ILE  11   4.230  -9.983   6.385
   67   HG23  ILE  11          HG23      ILE  11   5.912 -10.256   5.922
   68   HD11  ILE  11          HD11      ILE  11   8.106  -8.812   3.398
   69   HD12  ILE  11          HD12      ILE  11   7.481  -9.851   4.679
   70   HD13  ILE  11          HD13      ILE  11   7.757  -8.136   4.989
   71    H    GLY  12           H        GLY  12   1.476  -9.589   4.502
   72    HA2  GLY  12           HA2      GLY  12   0.424 -10.312   6.536
   73    HA3  GLY  12           HA3      GLY  12   0.834  -8.753   7.237
   74    H    TYR  13           H        TYR  13   0.068  -7.426   4.681
   75    HA   TYR  13           HA       TYR  13  -2.684  -6.955   5.459
   76    HB2  TYR  13           HB2      TYR  13  -1.112  -5.104   4.800
   77    HB3  TYR  13           HB3      TYR  13  -1.128  -5.733   3.167
   78    HD1  TYR  13           HD1      TYR  13  -3.232  -4.185   5.784
   79    HD2  TYR  13           HD2      TYR  13  -2.911  -5.142   1.655
   80    HE1  TYR  13           HE1      TYR  13  -5.174  -2.749   5.299
   81    HE2  TYR  13           HE2      TYR  13  -4.839  -3.723   1.168
   82    HH   TYR  13           HH       TYR  13  -6.558  -2.608   2.068
   83    H    SER  14           H        SER  14  -4.211  -8.222   4.827
   84    HA   SER  14           HA       SER  14  -4.037  -9.616   2.280
   85    HB2  SER  14           HB2      SER  14  -5.964 -10.888   3.404
   86    HB3  SER  14           HB3      SER  14  -4.332 -11.138   4.029
   87    HG   SER  14           HG       SER  14  -6.416 -10.421   5.376
   88    H    GLY  15           H        GLY  15  -5.337  -6.835   3.453
   89    HA2  GLY  15           HA2      GLY  15  -7.974  -6.934   2.344
   90    HA3  GLY  15           HA3      GLY  15  -7.121  -5.497   2.871
   91    HA   PRO  16           HA       PRO  16  -7.707  -5.221  -1.777
   92    HB2  PRO  16           HB2      PRO  16  -7.850  -2.368  -0.917
   93    HB3  PRO  16           HB3      PRO  16  -8.862  -3.242  -2.076
   94    HG2  PRO  16           HG2      PRO  16  -9.819  -2.668   0.318
   95    HG3  PRO  16           HG3      PRO  16 -10.115  -4.263  -0.395
   96    HD2  PRO  16           HD2      PRO  16  -8.116  -3.491   1.708
   97    HD3  PRO  16           HD3      PRO  16  -9.170  -4.910   1.639
   98    H    THR  17           H        THR  17  -5.927  -5.220  -2.957
   99    HA   THR  17           HA       THR  17  -3.598  -3.691  -2.055
  100    HB   THR  17           HB       THR  17  -2.331  -5.409  -3.440
  101    HG1  THR  17           HG1      THR  17  -3.643  -7.426  -3.513
  102   HG21  THR  17          HG21      THR  17  -2.436  -5.467  -0.990
  103   HG22  THR  17          HG22      THR  17  -2.438  -7.101  -1.663
  104   HG23  THR  17          HG23      THR  17  -3.937  -6.386  -1.073
  105    H    VAL  18           H        VAL  18  -5.969  -3.504  -4.265
  106    HA   VAL  18           HA       VAL  18  -4.230  -2.477  -6.387
  107    HB   VAL  18           HB       VAL  18  -7.200  -3.137  -6.474
  108   HG11  VAL  18          HG11      VAL  18  -7.062  -2.682  -8.885
  109   HG12  VAL  18          HG12      VAL  18  -5.390  -2.153  -8.680
  110   HG13  VAL  18          HG13      VAL  18  -6.699  -1.242  -7.932
  111   HG21  VAL  18          HG21      VAL  18  -6.532  -4.918  -8.014
  112   HG22  VAL  18          HG22      VAL  18  -5.744  -5.112  -6.442
  113   HG23  VAL  18          HG23      VAL  18  -4.842  -4.465  -7.808
  114    H    CYS  19           H        CYS  19  -3.785  -0.402  -6.166
  115    HA   CYS  19           HA       CYS  19  -5.279   1.342  -4.549
  116    HB2  CYS  19           HB2      CYS  19  -3.045   1.850  -6.495
  117    HB3  CYS  19           HB3      CYS  19  -3.687   3.031  -5.367
  118    H    ALA  20           H        ALA  20  -6.011   3.426  -5.231
  119    HA   ALA  20           HA       ALA  20  -7.988   3.337  -7.242
  120    HB1  ALA  20           HB1      ALA  20  -8.237   4.609  -5.200
  121    HB2  ALA  20           HB2      ALA  20  -8.325   5.693  -6.594
  122    HB3  ALA  20           HB3      ALA  20  -6.857   5.611  -5.630
  123    H    SER  21           H        SER  21  -8.172   4.919  -9.009
  124    HA   SER  21           HA       SER  21  -6.030   4.759 -10.786
  125    HB2  SER  21           HB2      SER  21  -8.394   6.632 -10.910
  126    HB3  SER  21           HB3      SER  21  -7.484   5.961 -12.260
  127    HG   SER  21           HG       SER  21  -8.410   4.005 -11.948
  128    H    GLY  22           H        GLY  22  -4.238   5.923 -10.719
  129    HA2  GLY  22           HA2      GLY  22  -3.201   8.049 -11.019
  130    HA3  GLY  22           HA3      GLY  22  -4.386   8.739  -9.911
  131    H    THR  23           H        THR  23  -3.845   6.048  -8.367
  132    HA   THR  23           HA       THR  23  -1.583   7.223  -6.937
  133    HB   THR  23           HB       THR  23  -2.376   6.098  -4.917
  134    HG1  THR  23           HG1      THR  23  -4.306   5.045  -6.710
  135   HG21  THR  23          HG21      THR  23  -4.447   7.375  -4.558
  136   HG22  THR  23          HG22      THR  23  -4.556   7.664  -6.293
  137   HG23  THR  23          HG23      THR  23  -3.216   8.340  -5.369
  138    H    THR  24           H        THR  24   0.077   5.989  -6.294
  139    HA   THR  24           HA       THR  24   0.302   3.420  -7.668
  140    HB   THR  24           HB       THR  24   2.807   3.811  -7.327
  141    HG1  THR  24           HG1      THR  24   1.776   6.302  -6.434
  142   HG21  THR  24          HG21      THR  24   1.257   5.694  -9.105
  143   HG22  THR  24          HG22      THR  24   1.741   4.047  -9.505
  144   HG23  THR  24          HG23      THR  24   2.964   5.299  -9.295
  145    H    CYS  25           H        CYS  25   0.798   1.602  -6.511
  146    HA   CYS  25           HA       CYS  25   0.703   1.829  -3.652
  147    HB2  CYS  25           HB2      CYS  25  -0.418  -0.064  -4.658
  148    HB3  CYS  25           HB3      CYS  25   1.055  -0.610  -5.439
  149    H    GLN  26           H        GLN  26   2.430   2.712  -2.802
  150    HA   GLN  26           HA       GLN  26   5.018   1.924  -3.823
  151    HB2  GLN  26           HB2      GLN  26   4.215   4.210  -2.051
  152    HB3  GLN  26           HB3      GLN  26   5.867   3.866  -2.554
  153    HG2  GLN  26           HG2      GLN  26   5.207   4.127  -4.889
  154    HG3  GLN  26           HG3      GLN  26   3.563   4.488  -4.376
  155   HE21  GLN  26          HE21      GLN  26   3.565   6.433  -5.298
  156   HE22  GLN  26          HE22      GLN  26   4.452   7.787  -4.696
  157    H    VAL  27           H        VAL  27   6.055   0.437  -2.856
  158    HA   VAL  27           HA       VAL  27   5.424  -0.413  -0.205
  159    HB   VAL  27           HB       VAL  27   7.820  -1.151  -1.933
  160   HG11  VAL  27          HG11      VAL  27   6.587  -2.581   0.417
  161   HG12  VAL  27          HG12      VAL  27   8.114  -1.703   0.423
  162   HG13  VAL  27          HG13      VAL  27   7.946  -3.167  -0.545
  163   HG21  VAL  27          HG21      VAL  27   5.749  -1.688  -3.109
  164   HG22  VAL  27          HG22      VAL  27   5.160  -2.560  -1.693
  165   HG23  VAL  27          HG23      VAL  27   6.561  -3.161  -2.575
  166    H    LEU  28           H        LEU  28   5.834   1.136   1.212
  167    HA   LEU  28           HA       LEU  28   8.163   2.817   1.035
  168    HB2  LEU  28           HB2      LEU  28   5.990   2.610   3.118
  169    HB3  LEU  28           HB3      LEU  28   7.228   3.850   3.087
  170    HG   LEU  28           HG       LEU  28   5.172   3.460   0.901
  171   HD11  LEU  28          HD11      LEU  28   4.110   4.184   2.976
  172   HD12  LEU  28          HD12      LEU  28   4.124   5.470   1.769
  173   HD13  LEU  28          HD13      LEU  28   5.270   5.506   3.108
  174   HD21  LEU  28          HD21      LEU  28   5.920   5.660   0.175
  175   HD22  LEU  28          HD22      LEU  28   7.237   4.480   0.145
  176   HD23  LEU  28          HD23      LEU  28   7.128   5.659   1.462
  177    H    ASN  29           H        ASN  29   7.004   0.114   2.877
  178    HA   ASN  29           HA       ASN  29   9.662  -0.457   3.851
  179    HB2  ASN  29           HB2      ASN  29   7.223  -0.323   5.690
  180    HB3  ASN  29           HB3      ASN  29   8.813  -0.911   6.117
  181   HD21  ASN  29          HD21      ASN  29   6.892   1.901   5.530
  182   HD22  ASN  29          HD22      ASN  29   7.992   3.061   6.172
  183    HA   PRO  30           HA       PRO  30   8.398  -4.568   2.737
  184    HB2  PRO  30           HB2      PRO  30   8.734  -5.499   5.537
  185    HB3  PRO  30           HB3      PRO  30   9.404  -6.176   4.050
  186    HG2  PRO  30           HG2      PRO  30  10.972  -4.770   5.656
  187    HG3  PRO  30           HG3      PRO  30  11.070  -4.541   3.900
  188    HD2  PRO  30           HD2      PRO  30   9.771  -2.822   5.967
  189    HD3  PRO  30           HD3      PRO  30  10.703  -2.343   4.535
  190    H    TYR  31           H        TYR  31   6.975  -3.567   5.863
  191    HA   TYR  31           HA       TYR  31   4.621  -5.206   5.215
  192    HB2  TYR  31           HB2      TYR  31   5.244  -3.713   7.784
  193    HB3  TYR  31           HB3      TYR  31   3.941  -4.853   7.520
  194    HD1  TYR  31           HD1      TYR  31   4.265  -7.147   7.934
  195    HD2  TYR  31           HD2      TYR  31   7.666  -4.609   7.661
  196    HE1  TYR  31           HE1      TYR  31   5.690  -8.964   8.725
  197    HE2  TYR  31           HE2      TYR  31   9.092  -6.392   8.442
  198    HH   TYR  31           HH       TYR  31   8.942  -8.445   9.694
  199    H    TYR  32           H        TYR  32   5.749  -1.950   5.494
  200    HA   TYR  32           HA       TYR  32   3.028  -0.950   5.315
  201    HB2  TYR  32           HB2      TYR  32   4.618   0.071   6.945
  202    HB3  TYR  32           HB3      TYR  32   5.546   0.667   5.575
  203    HD1  TYR  32           HD1      TYR  32   5.291   2.947   5.328
  204    HD2  TYR  32           HD2      TYR  32   1.915   0.575   6.380
  205    HE1  TYR  32           HE1      TYR  32   3.909   4.927   5.289
  206    HE2  TYR  32           HE2      TYR  32   0.496   2.557   6.336
  207    HH   TYR  32           HH       TYR  32   0.720   4.888   6.604
  208    H    SER  33           H        SER  33   2.179  -0.723   3.405
  209    HA   SER  33           HA       SER  33   3.792   0.483   1.285
  210    HB2  SER  33           HB2      SER  33   1.773  -1.760   0.908
  211    HB3  SER  33           HB3      SER  33   2.740  -0.997  -0.356
  212    HG   SER  33           HG       SER  33   4.435  -1.824   1.487
  213    H    GLN  34           H        GLN  34   2.643   2.110   0.234
  214    HA   GLN  34           HA       GLN  34  -0.121   2.480   1.114
  215    HB2  GLN  34           HB2      GLN  34   1.134   3.786   2.682
  216    HB3  GLN  34           HB3      GLN  34   2.145   4.441   1.408
  217    HG2  GLN  34           HG2      GLN  34   0.301   5.728   0.547
  218    HG3  GLN  34           HG3      GLN  34  -0.787   4.991   1.714
  219   HE21  GLN  34          HE21      GLN  34  -0.838   5.762   3.766
  220   HE22  GLN  34          HE22      GLN  34   0.073   7.130   4.278
  221    H    CYS  35           H        CYS  35  -1.462   3.357  -0.356
  222    HA   CYS  35           HA       CYS  35  -0.572   3.704  -3.063
  223    HB2  CYS  35           HB2      CYS  35  -3.248   4.430  -1.854
  224    HB3  CYS  35           HB3      CYS  35  -2.857   4.288  -3.565
  225    H    LEU  36           H        LEU  36   0.494   5.441  -3.631
  226    HA   LEU  36           HA       LEU  36  -0.357   8.029  -2.590
  227    HB2  LEU  36           HB2      LEU  36   2.413   7.062  -3.259
  228    HB3  LEU  36           HB3      LEU  36   2.021   8.757  -3.027
  229    HG   LEU  36           HG       LEU  36   1.632   6.626  -0.925
  230   HD11  LEU  36          HD11      LEU  36   3.557   7.593   0.183
  231   HD12  LEU  36          HD12      LEU  36   3.781   8.727  -1.147
  232   HD13  LEU  36          HD13      LEU  36   4.015   6.997  -1.414
  233   HD21  LEU  36          HD21      LEU  36   1.441   9.631  -0.831
  234   HD22  LEU  36          HD22      LEU  36   1.336   8.553   0.558
  235   HD23  LEU  36          HD23      LEU  36   0.101   8.493  -0.690
  236    H1   MAN 101           H1       MAN 101  -9.186   6.020   2.323
  237    H2   MAN 101           H2       MAN 101  -7.049   5.584   3.471
  238    H3   MAN 101           H3       MAN 101  -6.872   3.209   2.810
  239    H4   MAN 101           H4       MAN 101  -9.054   2.834   4.859
  240    H5   MAN 101           H5       MAN 101  -9.096   2.355   1.828
  241    H61  MAN 101           H61      MAN 101 -11.227   2.246   3.986
  242    H62  MAN 101           H62      MAN 101 -10.576   0.838   3.144
  243    HO2  MAN 101           HO2      MAN 101  -8.911   6.143   4.692
  244    HO3  MAN 101           HO3      MAN 101  -7.041   3.711   5.598
  245    HO4  MAN 101           HO4      MAN 101  -7.414   1.248   4.689
  246    HO6  MAN 101           HO6      MAN 101 -11.865   3.057   1.866
  Start of MODEL    4
    1    H1   THR   1           H1       THR   1 -11.090  -1.452  -4.145
    2    H2   THR   1           H2       THR   1 -11.497  -0.910  -5.710
    3    H3   THR   1           H3       THR   1 -11.851   0.041  -4.355
    4    HA   THR   1           HA       THR   1  -9.164  -0.608  -5.247
    5    HB   THR   1           HB       THR   1  -9.200   1.941  -5.576
    6    HG1  THR   1           HG1      THR   1 -11.240   2.824  -5.937
    7   HG21  THR   1          HG21      THR   1  -9.052   0.356  -7.447
    8   HG22  THR   1          HG22      THR   1 -10.087   1.725  -7.852
    9   HG23  THR   1          HG23      THR   1 -10.809   0.174  -7.433
   10    H    GLN   2           H        GLN   2  -7.595   0.013  -3.894
   11    HA   GLN   2           HA       GLN   2  -8.267   0.680  -1.199
   12    HB2  GLN   2           HB2      GLN   2  -6.362  -0.817  -1.669
   13    HB3  GLN   2           HB3      GLN   2  -5.593   0.441  -2.618
   14    HG2  GLN   2           HG2      GLN   2  -4.609   0.266  -0.357
   15    HG3  GLN   2           HG3      GLN   2  -5.345   1.822  -0.697
   16   HE21  GLN   2          HE21      GLN   2  -5.741   2.355   1.150
   17   HE22  GLN   2          HE22      GLN   2  -6.821   1.657   2.337
   18    H    SER   3           H        SER   3  -7.893   2.678  -0.184
   19    HA   SER   3           HA       SER   3  -8.255   4.860  -1.974
   20    HB2  SER   3           HB2      SER   3  -8.749   6.117   0.002
   21    HB3  SER   3           HB3      SER   3  -9.571   4.555   0.104
   22    H    HIS   4           H        HIS   4  -7.132   6.808  -1.669
   23    HA   HIS   4           HA       HIS   4  -4.322   6.669  -1.922
   24    HB2  HIS   4           HB2      HIS   4  -5.957   8.410  -2.880
   25    HB3  HIS   4           HB3      HIS   4  -5.969   9.114  -1.273
   26    HD1  HIS   4           HD1      HIS   4  -5.027  11.317  -2.487
   27    HD2  HIS   4           HD2      HIS   4  -2.500   8.031  -2.509
   28    HE1  HIS   4           HE1      HIS   4  -2.792  12.184  -3.217
   29    HE2  HIS   4           HE2      HIS   4  -1.523  10.047  -3.674
   30    H    TYR   5           H        TYR   5  -2.763   6.893  -0.312
   31    HA   TYR   5           HA       TYR   5  -1.766   7.118   1.642
   32    HB2  TYR   5           HB2      TYR   5  -4.183   8.733   2.362
   33    HB3  TYR   5           HB3      TYR   5  -2.916   8.422   3.549
   34    HD1  TYR   5           HD1      TYR   5  -0.601   9.256   3.075
   35    HD2  TYR   5           HD2      TYR   5  -3.942  10.422   0.723
   36    HE1  TYR   5           HE1      TYR   5   0.678  11.160   2.218
   37    HE2  TYR   5           HE2      TYR   5  -2.667  12.330  -0.143
   38    HH   TYR   5           HH       TYR   5  -0.740  13.716   0.547
   39    H    GLY   6           H        GLY   6  -3.922   5.075   1.028
   40    HA2  GLY   6           HA2      GLY   6  -4.190   3.968   3.723
   41    HA3  GLY   6           HA3      GLY   6  -5.031   3.445   2.302
   42    H    GLN   7           H        GLN   7  -3.818   1.489   3.749
   43    HA   GLN   7           HA       GLN   7  -1.142   1.035   2.767
   44    HB2  GLN   7           HB2      GLN   7  -1.947   0.398   5.090
   45    HB3  GLN   7           HB3      GLN   7  -2.918  -0.863   4.338
   46    HG2  GLN   7           HG2      GLN   7  -0.870  -1.911   3.491
   47    HG3  GLN   7           HG3      GLN   7   0.107  -0.658   4.235
   48   HE21  GLN   7          HE21      GLN   7   0.392  -3.404   4.784
   49   HE22  GLN   7          HE22      GLN   7  -0.056  -3.676   6.416
   50    H    CYS   8           H        CYS   8  -0.690  -0.110   0.978
   51    HA   CYS   8           HA       CYS   8  -3.005  -1.258  -0.457
   52    HB2  CYS   8           HB2      CYS   8  -1.674  -0.889  -2.475
   53    HB3  CYS   8           HB3      CYS   8  -2.071   0.579  -1.589
   54    H    GLY   9           H        GLY   9  -0.626  -2.513   1.321
   55    HA2  GLY   9           HA2      GLY   9  -0.808  -5.056   0.937
   56    HA3  GLY   9           HA3      GLY   9  -0.256  -4.649  -0.674
   57    H    GLY  10           H        GLY  10   0.592  -4.534   2.682
   58    HA2  GLY  10           HA2      GLY  10   3.398  -4.803   1.916
   59    HA3  GLY  10           HA3      GLY  10   2.797  -4.462   3.547
   60    H    ILE  11           H        ILE  11   4.441  -6.495   3.557
   61    HA   ILE  11           HA       ILE  11   3.338  -9.004   2.972
   62    HB   ILE  11           HB       ILE  11   5.311  -8.314   5.171
   63   HG12  ILE  11          HG12      ILE  11   5.790  -9.230   2.325
   64   HG13  ILE  11          HG13      ILE  11   6.030  -7.591   2.917
   65   HG21  ILE  11          HG21      ILE  11   4.703 -10.960   3.827
   66   HG22  ILE  11          HG22      ILE  11   4.307 -10.528   5.489
   67   HG23  ILE  11          HG23      ILE  11   5.993 -10.682   4.996
   68   HD11  ILE  11          HD11      ILE  11   8.130  -8.781   2.738
   69   HD12  ILE  11          HD12      ILE  11   7.511 -10.038   3.819
   70   HD13  ILE  11          HD13      ILE  11   7.764  -8.402   4.425
   71    H    GLY  12           H        GLY  12   1.452  -9.690   3.673
   72    HA2  GLY  12           HA2      GLY  12   0.328 -10.822   5.423
   73    HA3  GLY  12           HA3      GLY  12   0.965  -9.653   6.560
   74    H    TYR  13           H        TYR  13  -0.003  -7.992   3.865
   75    HA   TYR  13           HA       TYR  13  -2.434  -7.175   5.263
   76    HB2  TYR  13           HB2      TYR  13  -0.875  -5.416   4.490
   77    HB3  TYR  13           HB3      TYR  13  -1.092  -5.962   2.835
   78    HD1  TYR  13           HD1      TYR  13  -2.697  -4.871   1.505
   79    HD2  TYR  13           HD2      TYR  13  -3.063  -4.709   5.729
   80    HE1  TYR  13           HE1      TYR  13  -4.554  -3.290   1.273
   81    HE2  TYR  13           HE2      TYR  13  -4.941  -3.122   5.508
   82    HH   TYR  13           HH       TYR  13  -6.267  -2.280   2.351
   83    H    SER  14           H        SER  14  -4.152  -8.353   4.836
   84    HA   SER  14           HA       SER  14  -4.495  -9.553   2.213
   85    HB2  SER  14           HB2      SER  14  -6.103  -9.916   4.744
   86    HB3  SER  14           HB3      SER  14  -6.163 -10.930   3.303
   87    HG   SER  14           HG       SER  14  -4.883 -11.843   4.907
   88    H    GLY  15           H        GLY  15  -5.088  -6.635   3.168
   89    HA2  GLY  15           HA2      GLY  15  -7.940  -6.416   2.564
   90    HA3  GLY  15           HA3      GLY  15  -6.869  -5.103   3.042
   91    HA   PRO  16           HA       PRO  16  -7.772  -4.703  -1.526
   92    HB2  PRO  16           HB2      PRO  16  -7.726  -1.853  -0.657
   93    HB3  PRO  16           HB3      PRO  16  -8.852  -2.669  -1.754
   94    HG2  PRO  16           HG2      PRO  16  -9.616  -2.032   0.697
   95    HG3  PRO  16           HG3      PRO  16 -10.068  -3.602   0.005
   96    HD2  PRO  16           HD2      PRO  16  -7.895  -2.965   1.972
   97    HD3  PRO  16           HD3      PRO  16  -9.051  -4.312   1.972
   98    H    THR  17           H        THR  17  -5.959  -5.031  -2.580
   99    HA   THR  17           HA       THR  17  -3.504  -3.592  -1.897
  100    HB   THR  17           HB       THR  17  -2.614  -5.470  -3.441
  101    HG1  THR  17           HG1      THR  17  -4.110  -6.781  -4.163
  102   HG21  THR  17          HG21      THR  17  -2.532  -7.034  -1.535
  103   HG22  THR  17          HG22      THR  17  -3.833  -6.138  -0.751
  104   HG23  THR  17          HG23      THR  17  -2.266  -5.372  -0.995
  105    H    VAL  18           H        VAL  18  -5.985  -3.463  -4.079
  106    HA   VAL  18           HA       VAL  18  -4.257  -2.488  -6.244
  107    HB   VAL  18           HB       VAL  18  -7.244  -3.075  -6.308
  108   HG11  VAL  18          HG11      VAL  18  -5.346  -2.414  -8.564
  109   HG12  VAL  18          HG12      VAL  18  -6.608  -1.360  -7.923
  110   HG13  VAL  18          HG13      VAL  18  -7.044  -2.857  -8.746
  111   HG21  VAL  18          HG21      VAL  18  -5.910  -5.120  -6.050
  112   HG22  VAL  18          HG22      VAL  18  -4.959  -4.678  -7.465
  113   HG23  VAL  18          HG23      VAL  18  -6.674  -5.046  -7.635
  114    H    CYS  19           H        CYS  19  -3.818  -0.394  -5.983
  115    HA   CYS  19           HA       CYS  19  -5.425   1.366  -4.473
  116    HB2  CYS  19           HB2      CYS  19  -3.179   1.909  -6.397
  117    HB3  CYS  19           HB3      CYS  19  -3.853   3.052  -5.248
  118    H    ALA  20           H        ALA  20  -6.511   3.218  -5.201
  119    HA   ALA  20           HA       ALA  20  -8.134   3.029  -7.457
  120    HB1  ALA  20           HB1      ALA  20  -7.209   5.493  -5.966
  121    HB2  ALA  20           HB2      ALA  20  -8.623   4.514  -5.567
  122    HB3  ALA  20           HB3      ALA  20  -8.574   5.424  -7.078
  123    H    SER  21           H        SER  21  -7.880   3.728  -9.559
  124    HA   SER  21           HA       SER  21  -5.312   3.835 -10.602
  125    HB2  SER  21           HB2      SER  21  -7.895   4.825 -11.824
  126    HB3  SER  21           HB3      SER  21  -6.419   4.412 -12.706
  127    HG   SER  21           HG       SER  21  -7.305   2.514 -12.795
  128    H    GLY  22           H        GLY  22  -3.900   5.407 -10.874
  129    HA2  GLY  22           HA2      GLY  22  -3.367   7.714 -11.302
  130    HA3  GLY  22           HA3      GLY  22  -4.732   8.157 -10.284
  131    H    THR  23           H        THR  23  -3.911   5.846  -8.402
  132    HA   THR  23           HA       THR  23  -1.727   7.316  -7.130
  133    HB   THR  23           HB       THR  23  -2.417   6.266  -5.011
  134    HG1  THR  23           HG1      THR  23  -4.351   4.998  -6.661
  135   HG21  THR  23          HG21      THR  23  -4.616   7.355  -4.708
  136   HG22  THR  23          HG22      THR  23  -4.709   7.599  -6.454
  137   HG23  THR  23          HG23      THR  23  -3.441   8.387  -5.511
  138    H    THR  24           H        THR  24   0.056   6.143  -6.344
  139    HA   THR  24           HA       THR  24   0.341   3.540  -7.651
  140    HB   THR  24           HB       THR  24   2.839   3.984  -7.406
  141    HG1  THR  24           HG1      THR  24   1.796   6.384  -6.391
  142   HG21  THR  24          HG21      THR  24   1.227   5.875  -9.129
  143   HG22  THR  24          HG22      THR  24   1.676   4.224  -9.548
  144   HG23  THR  24          HG23      THR  24   2.923   5.461  -9.373
  145    H    CYS  25           H        CYS  25   0.692   1.765  -6.421
  146    HA   CYS  25           HA       CYS  25   0.664   1.999  -3.582
  147    HB2  CYS  25           HB2      CYS  25  -0.426   0.085  -4.592
  148    HB3  CYS  25           HB3      CYS  25   1.056  -0.441  -5.376
  149    H    GLN  26           H        GLN  26   2.409   2.841  -2.682
  150    HA   GLN  26           HA       GLN  26   5.009   2.045  -3.707
  151    HB2  GLN  26           HB2      GLN  26   4.175   4.396  -2.038
  152    HB3  GLN  26           HB3      GLN  26   5.843   4.038  -2.465
  153    HG2  GLN  26           HG2      GLN  26   5.236   4.223  -4.844
  154    HG3  GLN  26           HG3      GLN  26   3.591   4.623  -4.373
  155   HE21  GLN  26          HE21      GLN  26   3.640   6.560  -5.337
  156   HE22  GLN  26          HE22      GLN  26   4.551   7.914  -4.766
  157    H    VAL  27           H        VAL  27   5.928   0.529  -2.704
  158    HA   VAL  27           HA       VAL  27   5.369  -0.230  -0.025
  159    HB   VAL  27           HB       VAL  27   7.623  -1.047  -1.905
  160   HG11  VAL  27          HG11      VAL  27   8.285  -1.399   0.426
  161   HG12  VAL  27          HG12      VAL  27   8.000  -2.938  -0.391
  162   HG13  VAL  27          HG13      VAL  27   6.791  -2.286   0.718
  163   HG21  VAL  27          HG21      VAL  27   5.389  -1.682  -2.657
  164   HG22  VAL  27          HG22      VAL  27   5.086  -2.463  -1.107
  165   HG23  VAL  27          HG23      VAL  27   6.333  -3.097  -2.183
  166    H    LEU  28           H        LEU  28   5.888   1.043   1.551
  167    HA   LEU  28           HA       LEU  28   8.221   2.791   1.408
  168    HB2  LEU  28           HB2      LEU  28   5.935   2.674   3.373
  169    HB3  LEU  28           HB3      LEU  28   7.219   3.868   3.400
  170    HG   LEU  28           HG       LEU  28   5.203   3.531   1.170
  171   HD11  LEU  28          HD11      LEU  28   4.182   4.428   3.177
  172   HD12  LEU  28          HD12      LEU  28   4.323   5.662   1.920
  173   HD13  LEU  28          HD13      LEU  28   5.447   5.657   3.283
  174   HD21  LEU  28          HD21      LEU  28   6.135   5.646   0.362
  175   HD22  LEU  28          HD22      LEU  28   7.313   4.323   0.364
  176   HD23  LEU  28          HD23      LEU  28   7.355   5.549   1.643
  177    H    ASN  29           H        ASN  29   6.909   0.114   3.186
  178    HA   ASN  29           HA       ASN  29   9.530  -0.484   4.319
  179    HB2  ASN  29           HB2      ASN  29   6.914  -0.789   5.891
  180    HB3  ASN  29           HB3      ASN  29   8.488  -1.294   6.423
  181   HD21  ASN  29          HD21      ASN  29   7.526   1.842   5.113
  182   HD22  ASN  29          HD22      ASN  29   7.870   2.739   6.547
  183    HA   PRO  30           HA       PRO  30   8.338  -4.457   2.630
  184    HB2  PRO  30           HB2      PRO  30   8.682  -5.763   5.283
  185    HB3  PRO  30           HB3      PRO  30   9.415  -6.177   3.730
  186    HG2  PRO  30           HG2      PRO  30  10.860  -4.973   5.599
  187    HG3  PRO  30           HG3      PRO  30  11.028  -4.507   3.895
  188    HD2  PRO  30           HD2      PRO  30   9.547  -3.136   6.102
  189    HD3  PRO  30           HD3      PRO  30  10.561  -2.420   4.827
  190    H    TYR  31           H        TYR  31   6.858  -3.648   5.753
  191    HA   TYR  31           HA       TYR  31   4.546  -5.280   4.956
  192    HB2  TYR  31           HB2      TYR  31   5.015  -4.053   7.698
  193    HB3  TYR  31           HB3      TYR  31   3.849  -5.276   7.254
  194    HD1  TYR  31           HD1      TYR  31   4.437  -7.600   7.255
  195    HD2  TYR  31           HD2      TYR  31   7.479  -4.667   7.728
  196    HE1  TYR  31           HE1      TYR  31   6.037  -9.360   7.869
  197    HE2  TYR  31           HE2      TYR  31   9.079  -6.404   8.346
  198    HH   TYR  31           HH       TYR  31   9.183  -8.551   9.133
  199    H    TYR  32           H        TYR  32   5.615  -2.035   5.524
  200    HA   TYR  32           HA       TYR  32   2.890  -1.025   5.329
  201    HB2  TYR  32           HB2      TYR  32   4.368  -0.050   7.059
  202    HB3  TYR  32           HB3      TYR  32   5.438   0.521   5.791
  203    HD1  TYR  32           HD1      TYR  32   5.314   2.822   5.491
  204    HD2  TYR  32           HD2      TYR  32   1.744   0.638   6.335
  205    HE1  TYR  32           HE1      TYR  32   4.035   4.873   5.389
  206    HE2  TYR  32           HE2      TYR  32   0.449   2.706   6.215
  207    HH   TYR  32           HH       TYR  32   1.813   5.645   5.046
  208    H    SER  33           H        SER  33   2.091  -0.702   3.396
  209    HA   SER  33           HA       SER  33   3.774   0.548   1.345
  210    HB2  SER  33           HB2      SER  33   1.646  -1.568   0.854
  211    HB3  SER  33           HB3      SER  33   2.697  -0.834  -0.353
  212    HG   SER  33           HG       SER  33   3.316  -2.983   0.475
  213    H    GLN  34           H        GLN  34   2.685   2.250   0.319
  214    HA   GLN  34           HA       GLN  34  -0.085   2.684   1.171
  215    HB2  GLN  34           HB2      GLN  34   1.137   3.964   2.743
  216    HB3  GLN  34           HB3      GLN  34   2.238   4.564   1.519
  217    HG2  GLN  34           HG2      GLN  34   0.521   5.976   0.597
  218    HG3  GLN  34           HG3      GLN  34  -0.679   5.267   1.671
  219   HE21  GLN  34          HE21      GLN  34  -0.847   6.000   3.735
  220   HE22  GLN  34          HE22      GLN  34   0.059   7.314   4.351
  221    H    CYS  35           H        CYS  35  -1.415   3.510  -0.322
  222    HA   CYS  35           HA       CYS  35  -0.502   3.818  -3.037
  223    HB2  CYS  35           HB2      CYS  35  -3.190   4.618  -1.902
  224    HB3  CYS  35           HB3      CYS  35  -2.769   4.374  -3.595
  225    H    LEU  36           H        LEU  36   0.562   5.555  -3.635
  226    HA   LEU  36           HA       LEU  36  -0.301   8.156  -2.633
  227    HB2  LEU  36           HB2      LEU  36   2.474   7.205  -3.317
  228    HB3  LEU  36           HB3      LEU  36   2.066   8.885  -3.034
  229    HG   LEU  36           HG       LEU  36   1.730   6.683  -0.999
  230   HD11  LEU  36          HD11      LEU  36   3.846   8.824  -1.192
  231   HD12  LEU  36          HD12      LEU  36   4.090   7.094  -1.445
  232   HD13  LEU  36          HD13      LEU  36   3.622   7.696   0.147
  233   HD21  LEU  36          HD21      LEU  36   1.404   8.559   0.560
  234   HD22  LEU  36          HD22      LEU  36   0.153   8.473  -0.673
  235   HD23  LEU  36          HD23      LEU  36   1.438   9.676  -0.807
  236    H1   MAN 101           H1       MAN 101  -8.970   6.342   2.193
  237    H2   MAN 101           H2       MAN 101  -6.767   6.061   3.271
  238    H3   MAN 101           H3       MAN 101  -6.702   3.610   3.328
  239    H4   MAN 101           H4       MAN 101  -8.906   3.915   5.389
  240    H5   MAN 101           H5       MAN 101  -8.939   2.679   2.551
  241    H61  MAN 101           H61      MAN 101 -11.074   3.041   4.681
  242    H62  MAN 101           H62      MAN 101 -10.516   1.492   3.995
  243    HO2  MAN 101           HO2      MAN 101  -8.494   7.081   4.284
  244    HO3  MAN 101           HO3      MAN 101  -6.859   4.875   5.867
  245    HO4  MAN 101           HO4      MAN 101  -7.313   2.272   5.686
  246    HO6  MAN 101           HO6      MAN 101 -11.521   3.559   2.320
  Start of MODEL    5
    1    H1   THR   1           H1       THR   1 -11.700  -0.585  -4.211
    2    H2   THR   1           H2       THR   1 -11.696  -0.451  -5.881
    3    H3   THR   1           H3       THR   1 -11.802   0.953  -4.916
    4    HA   THR   1           HA       THR   1  -9.521  -0.872  -5.136
    5    HB   THR   1           HB       THR   1  -8.435   1.326  -5.869
    6    HG1  THR   1           HG1      THR   1 -10.308   2.515  -7.075
    7   HG21  THR   1          HG21      THR   1  -9.089   1.010  -8.185
    8   HG22  THR   1          HG22      THR   1 -10.493   0.065  -7.687
    9   HG23  THR   1          HG23      THR   1  -8.858  -0.550  -7.396
   10    H    GLN   2           H        GLN   2  -7.633  -0.073  -3.980
   11    HA   GLN   2           HA       GLN   2  -8.275   0.625  -1.320
   12    HB2  GLN   2           HB2      GLN   2  -6.391  -0.878  -1.817
   13    HB3  GLN   2           HB3      GLN   2  -5.581   0.400  -2.708
   14    HG2  GLN   2           HG2      GLN   2  -4.656   0.124  -0.457
   15    HG3  GLN   2           HG3      GLN   2  -5.361   1.715  -0.725
   16   HE21  GLN   2          HE21      GLN   2  -5.924   2.230   1.144
   17   HE22  GLN   2          HE22      GLN   2  -7.039   1.424   2.216
   18    H    SER   3           H        SER   3  -7.961   2.549  -0.238
   19    HA   SER   3           HA       SER   3  -8.332   4.829  -1.866
   20    HB2  SER   3           HB2      SER   3  -8.719   5.964   0.228
   21    HB3  SER   3           HB3      SER   3  -9.601   4.437   0.194
   22    H    HIS   4           H        HIS   4  -7.217   6.755  -1.575
   23    HA   HIS   4           HA       HIS   4  -4.407   6.620  -1.908
   24    HB2  HIS   4           HB2      HIS   4  -6.030   8.388  -2.816
   25    HB3  HIS   4           HB3      HIS   4  -6.021   9.093  -1.217
   26    HD1  HIS   4           HD1      HIS   4  -5.052  11.245  -2.603
   27    HD2  HIS   4           HD2      HIS   4  -2.544   7.970  -2.300
   28    HE1  HIS   4           HE1      HIS   4  -2.790  12.049  -3.318
   29    HE2  HIS   4           HE2      HIS   4  -1.509   9.897  -3.558
   30    H    TYR   5           H        TYR   5  -2.793   6.882  -0.404
   31    HA   TYR   5           HA       TYR   5  -1.715   7.074   1.497
   32    HB2  TYR   5           HB2      TYR   5  -4.161   8.548   2.413
   33    HB3  TYR   5           HB3      TYR   5  -2.762   8.334   3.479
   34    HD1  TYR   5           HD1      TYR   5  -4.226  10.224   0.781
   35    HD2  TYR   5           HD2      TYR   5  -0.567   9.348   2.748
   36    HE1  TYR   5           HE1      TYR   5  -3.198  12.193  -0.266
   37    HE2  TYR   5           HE2      TYR   5   0.473  11.311   1.712
   38    HH   TYR   5           HH       TYR   5  -1.319  13.713   0.063
   39    H    GLY   6           H        GLY   6  -3.960   5.037   0.908
   40    HA2  GLY   6           HA2      GLY   6  -4.148   3.859   3.566
   41    HA3  GLY   6           HA3      GLY   6  -5.015   3.361   2.139
   42    H    GLN   7           H        GLN   7  -3.641   1.572   3.774
   43    HA   GLN   7           HA       GLN   7  -1.065   0.971   2.701
   44    HB2  GLN   7           HB2      GLN   7  -1.901   0.440   5.037
   45    HB3  GLN   7           HB3      GLN   7  -2.885  -0.829   4.310
   46    HG2  GLN   7           HG2      GLN   7  -0.895  -1.980   3.576
   47    HG3  GLN   7           HG3      GLN   7   0.133  -0.692   4.196
   48   HE21  GLN   7          HE21      GLN   7   0.298  -3.411   4.976
   49   HE22  GLN   7          HE22      GLN   7  -0.124  -3.545   6.620
   50    H    CYS   8           H        CYS   8  -0.678  -0.120   0.868
   51    HA   CYS   8           HA       CYS   8  -2.980  -1.358  -0.480
   52    HB2  CYS   8           HB2      CYS   8  -1.657  -1.052  -2.527
   53    HB3  CYS   8           HB3      CYS   8  -2.085   0.442  -1.708
   54    H    GLY   9           H        GLY   9  -0.793  -2.619   1.387
   55    HA2  GLY   9           HA2      GLY   9  -0.922  -5.146   1.103
   56    HA3  GLY   9           HA3      GLY   9  -0.405  -4.829  -0.538
   57    H    GLY  10           H        GLY  10   0.572  -4.400   2.777
   58    HA2  GLY  10           HA2      GLY  10   3.327  -4.944   1.949
   59    HA3  GLY  10           HA3      GLY  10   2.830  -4.345   3.543
   60    H    ILE  11           H        ILE  11   4.356  -6.449   3.811
   61    HA   ILE  11           HA       ILE  11   3.140  -8.975   3.651
   62    HB   ILE  11           HB       ILE  11   5.077  -7.994   5.786
   63   HG12  ILE  11          HG12      ILE  11   5.670  -9.357   3.145
   64   HG13  ILE  11          HG13      ILE  11   5.936  -7.652   3.486
   65   HG21  ILE  11          HG21      ILE  11   4.459 -10.793   4.833
   66   HG22  ILE  11          HG22      ILE  11   3.989 -10.102   6.383
   67   HG23  ILE  11          HG23      ILE  11   5.696 -10.365   6.015
   68   HD11  ILE  11          HD11      ILE  11   7.581  -8.257   5.194
   69   HD12  ILE  11          HD12      ILE  11   8.012  -8.899   3.608
   70   HD13  ILE  11          HD13      ILE  11   7.318  -9.965   4.832
   71    H    GLY  12           H        GLY  12   1.291  -9.628   4.618
   72    HA2  GLY  12           HA2      GLY  12   0.168 -10.144   6.681
   73    HA3  GLY  12           HA3      GLY  12   0.725  -8.600   7.308
   74    H    TYR  13           H        TYR  13   0.021  -7.394   4.607
   75    HA   TYR  13           HA       TYR  13  -2.725  -6.853   5.394
   76    HB2  TYR  13           HB2      TYR  13  -1.168  -4.953   4.884
   77    HB3  TYR  13           HB3      TYR  13  -1.098  -5.514   3.218
   78    HD1  TYR  13           HD1      TYR  13  -2.808  -4.888   1.665
   79    HD2  TYR  13           HD2      TYR  13  -3.365  -4.193   5.819
   80    HE1  TYR  13           HE1      TYR  13  -4.786  -3.547   1.159
   81    HE2  TYR  13           HE2      TYR  13  -5.363  -2.836   5.325
   82    HH   TYR  13           HH       TYR  13  -6.548  -2.487   2.007
   83    H    SER  14           H        SER  14  -4.176  -8.135   4.611
   84    HA   SER  14           HA       SER  14  -3.740  -9.352   1.987
   85    HB2  SER  14           HB2      SER  14  -5.555 -10.248   4.230
   86    HB3  SER  14           HB3      SER  14  -5.130 -11.154   2.776
   87    HG   SER  14           HG       SER  14  -2.834 -10.538   3.809
   88    H    GLY  15           H        GLY  15  -5.152  -6.762   3.152
   89    HA2  GLY  15           HA2      GLY  15  -7.826  -6.945   2.079
   90    HA3  GLY  15           HA3      GLY  15  -7.034  -5.502   2.686
   91    HA   PRO  16           HA       PRO  16  -7.541  -5.029  -1.925
   92    HB2  PRO  16           HB2      PRO  16  -7.717  -2.217  -0.942
   93    HB3  PRO  16           HB3      PRO  16  -8.672  -3.033  -2.190
   94    HG2  PRO  16           HG2      PRO  16  -9.722  -2.597   0.191
   95    HG3  PRO  16           HG3      PRO  16  -9.979  -4.154  -0.623
   96    HD2  PRO  16           HD2      PRO  16  -8.084  -3.484   1.604
   97    HD3  PRO  16           HD3      PRO  16  -9.111  -4.915   1.384
   98    H    THR  17           H        THR  17  -5.703  -5.146  -2.919
   99    HA   THR  17           HA       THR  17  -3.381  -3.605  -2.048
  100    HB   THR  17           HB       THR  17  -2.182  -5.222  -3.598
  101    HG1  THR  17           HG1      THR  17  -4.506  -6.783  -3.354
  102   HG21  THR  17          HG21      THR  17  -2.252  -5.507  -1.151
  103   HG22  THR  17          HG22      THR  17  -2.254  -7.064  -1.980
  104   HG23  THR  17          HG23      THR  17  -3.752  -6.416  -1.302
  105    H    VAL  18           H        VAL  18  -5.792  -3.592  -4.325
  106    HA   VAL  18           HA       VAL  18  -4.183  -2.351  -6.429
  107    HB   VAL  18           HB       VAL  18  -7.141  -3.066  -6.450
  108   HG11  VAL  18          HG11      VAL  18  -7.048  -2.643  -8.861
  109   HG12  VAL  18          HG12      VAL  18  -5.363  -2.143  -8.714
  110   HG13  VAL  18          HG13      VAL  18  -6.633  -1.189  -7.948
  111   HG21  VAL  18          HG21      VAL  18  -5.693  -5.047  -6.413
  112   HG22  VAL  18          HG22      VAL  18  -4.821  -4.421  -7.813
  113   HG23  VAL  18          HG23      VAL  18  -6.517  -4.877  -7.962
  114    H    CYS  19           H        CYS  19  -3.822  -0.292  -6.155
  115    HA   CYS  19           HA       CYS  19  -5.401   1.379  -4.488
  116    HB2  CYS  19           HB2      CYS  19  -3.178   1.997  -6.423
  117    HB3  CYS  19           HB3      CYS  19  -3.847   3.107  -5.235
  118    H    ALA  20           H        ALA  20  -6.408   3.331  -5.210
  119    HA   ALA  20           HA       ALA  20  -8.079   3.008  -7.431
  120    HB1  ALA  20           HB1      ALA  20  -8.730   5.332  -7.016
  121    HB2  ALA  20           HB2      ALA  20  -7.374   5.515  -5.893
  122    HB3  ALA  20           HB3      ALA  20  -8.683   4.387  -5.531
  123    H    SER  21           H        SER  21  -7.916   3.736  -9.486
  124    HA   SER  21           HA       SER  21  -5.477   4.054 -10.728
  125    HB2  SER  21           HB2      SER  21  -8.142   5.176 -11.625
  126    HB3  SER  21           HB3      SER  21  -6.750   4.872 -12.664
  127    HG   SER  21           HG       SER  21  -8.663   3.194 -12.009
  128    H    GLY  22           H        GLY  22  -3.988   5.633 -10.612
  129    HA2  GLY  22           HA2      GLY  22  -3.440   7.971 -10.927
  130    HA3  GLY  22           HA3      GLY  22  -4.928   8.372 -10.079
  131    H    THR  23           H        THR  23  -3.856   5.843  -8.364
  132    HA   THR  23           HA       THR  23  -1.889   7.382  -6.846
  133    HB   THR  23           HB       THR  23  -2.621   6.244  -4.804
  134    HG1  THR  23           HG1      THR  23  -4.505   5.049  -6.551
  135   HG21  THR  23          HG21      THR  23  -4.870   7.661  -6.216
  136   HG22  THR  23          HG22      THR  23  -3.598   8.392  -5.222
  137   HG23  THR  23          HG23      THR  23  -4.805   7.349  -4.483
  138    H    THR  24           H        THR  24  -0.130   6.201  -6.133
  139    HA   THR  24           HA       THR  24   0.098   3.649  -7.544
  140    HB   THR  24           HB       THR  24   2.573   4.102  -7.547
  141    HG1  THR  24           HG1      THR  24   1.669   6.468  -6.279
  142   HG21  THR  24          HG21      THR  24   2.453   5.698  -9.399
  143   HG22  THR  24          HG22      THR  24   0.830   6.158  -8.895
  144   HG23  THR  24          HG23      THR  24   1.133   4.530  -9.498
  145    H    CYS  25           H        CYS  25   0.589   1.865  -6.455
  146    HA   CYS  25           HA       CYS  25   0.653   1.971  -3.608
  147    HB2  CYS  25           HB2      CYS  25  -0.429   0.103  -4.741
  148    HB3  CYS  25           HB3      CYS  25   1.088  -0.357  -5.509
  149    H    GLN  26           H        GLN  26   2.395   2.811  -2.742
  150    HA   GLN  26           HA       GLN  26   4.964   2.058  -3.866
  151    HB2  GLN  26           HB2      GLN  26   4.174   4.327  -2.060
  152    HB3  GLN  26           HB3      GLN  26   5.818   4.019  -2.591
  153    HG2  GLN  26           HG2      GLN  26   5.008   4.263  -4.949
  154    HG3  GLN  26           HG3      GLN  26   3.444   4.741  -4.303
  155   HE21  GLN  26          HE21      GLN  26   3.559   6.725  -5.256
  156   HE22  GLN  26          HE22      GLN  26   4.568   7.990  -4.658
  157    H    VAL  27           H        VAL  27   5.859   0.436  -2.920
  158    HA   VAL  27           HA       VAL  27   5.192  -0.324  -0.253
  159    HB   VAL  27           HB       VAL  27   7.426  -1.363  -2.043
  160   HG11  VAL  27          HG11      VAL  27   7.743  -1.893   0.316
  161   HG12  VAL  27          HG12      VAL  27   7.360  -3.347  -0.609
  162   HG13  VAL  27          HG13      VAL  27   6.126  -2.580   0.389
  163   HG21  VAL  27          HG21      VAL  27   5.245  -1.653  -3.112
  164   HG22  VAL  27          HG22      VAL  27   4.624  -2.430  -1.656
  165   HG23  VAL  27          HG23      VAL  27   5.899  -3.208  -2.594
  166    H    LEU  28           H        LEU  28   5.868   0.910   1.282
  167    HA   LEU  28           HA       LEU  28   8.274   2.513   1.012
  168    HB2  LEU  28           HB2      LEU  28   6.180   2.418   3.185
  169    HB3  LEU  28           HB3      LEU  28   7.472   3.597   3.071
  170    HG   LEU  28           HG       LEU  28   5.260   3.294   1.025
  171   HD11  LEU  28          HD11      LEU  28   4.396   5.380   1.923
  172   HD12  LEU  28          HD12      LEU  28   5.622   5.352   3.193
  173   HD13  LEU  28          HD13      LEU  28   4.374   4.102   3.136
  174   HD21  LEU  28          HD21      LEU  28   7.357   5.388   1.417
  175   HD22  LEU  28          HD22      LEU  28   6.058   5.437   0.223
  176   HD23  LEU  28          HD23      LEU  28   7.319   4.196   0.112
  177    H    ASN  29           H        ASN  29   6.906   0.044   3.103
  178    HA   ASN  29           HA       ASN  29   9.591  -0.632   4.100
  179    HB2  ASN  29           HB2      ASN  29   7.019  -0.836   5.761
  180    HB3  ASN  29           HB3      ASN  29   8.622  -1.275   6.257
  181   HD21  ASN  29          HD21      ASN  29   7.670   1.746   4.698
  182   HD22  ASN  29          HD22      ASN  29   8.017   2.777   6.029
  183    HA   PRO  30           HA       PRO  30   8.302  -4.734   2.787
  184    HB2  PRO  30           HB2      PRO  30   8.661  -5.754   5.558
  185    HB3  PRO  30           HB3      PRO  30   9.341  -6.364   4.047
  186    HG2  PRO  30           HG2      PRO  30  10.879  -5.018   5.731
  187    HG3  PRO  30           HG3      PRO  30  11.012  -4.736   3.987
  188    HD2  PRO  30           HD2      PRO  30   9.661  -3.081   6.077
  189    HD3  PRO  30           HD3      PRO  30  10.632  -2.554   4.688
  190    H    TYR  31           H        TYR  31   6.934  -3.687   5.906
  191    HA   TYR  31           HA       TYR  31   4.529  -5.279   5.310
  192    HB2  TYR  31           HB2      TYR  31   5.330  -3.771   7.813
  193    HB3  TYR  31           HB3      TYR  31   3.862  -4.718   7.639
  194    HD1  TYR  31           HD1      TYR  31   3.872  -6.981   8.200
  195    HD2  TYR  31           HD2      TYR  31   7.575  -5.023   7.515
  196    HE1  TYR  31           HE1      TYR  31   5.065  -8.986   8.941
  197    HE2  TYR  31           HE2      TYR  31   8.782  -6.993   8.241
  198    HH   TYR  31           HH       TYR  31   8.336  -9.002   9.682
  199    H    TYR  32           H        TYR  32   5.700  -2.062   5.473
  200    HA   TYR  32           HA       TYR  32   3.005  -1.001   5.314
  201    HB2  TYR  32           HB2      TYR  32   4.567  -0.035   6.983
  202    HB3  TYR  32           HB3      TYR  32   5.553   0.558   5.655
  203    HD1  TYR  32           HD1      TYR  32   5.334   2.815   5.321
  204    HD2  TYR  32           HD2      TYR  32   1.908   0.561   6.454
  205    HE1  TYR  32           HE1      TYR  32   4.013   4.838   5.256
  206    HE2  TYR  32           HE2      TYR  32   0.539   2.577   6.391
  207    HH   TYR  32           HH       TYR  32   1.629   5.501   5.033
  208    H    SER  33           H        SER  33   2.148  -0.708   3.410
  209    HA   SER  33           HA       SER  33   3.798   0.419   1.264
  210    HB2  SER  33           HB2      SER  33   1.632  -1.691   0.909
  211    HB3  SER  33           HB3      SER  33   2.664  -1.023  -0.355
  212    HG   SER  33           HG       SER  33   3.306  -3.134   0.515
  213    H    GLN  34           H        GLN  34   2.689   2.124   0.224
  214    HA   GLN  34           HA       GLN  34  -0.060   2.550   1.112
  215    HB2  GLN  34           HB2      GLN  34   1.144   3.768   2.740
  216    HB3  GLN  34           HB3      GLN  34   2.264   4.406   1.553
  217    HG2  GLN  34           HG2      GLN  34   0.565   5.870   0.676
  218    HG3  GLN  34           HG3      GLN  34  -0.646   5.127   1.716
  219   HE21  GLN  34          HE21      GLN  34  -0.844   5.803   3.783
  220   HE22  GLN  34          HE22      GLN  34   0.112   7.038   4.490
  221    H    CYS  35           H        CYS  35  -1.376   3.412  -0.339
  222    HA   CYS  35           HA       CYS  35  -0.487   3.806  -3.042
  223    HB2  CYS  35           HB2      CYS  35  -3.159   4.545  -1.833
  224    HB3  CYS  35           HB3      CYS  35  -2.781   4.367  -3.541
  225    H    LEU  36           H        LEU  36   0.645   5.562  -3.497
  226    HA   LEU  36           HA       LEU  36  -0.229   8.122  -2.400
  227    HB2  LEU  36           HB2      LEU  36   2.537   7.193  -3.168
  228    HB3  LEU  36           HB3      LEU  36   2.133   8.858  -2.793
  229    HG   LEU  36           HG       LEU  36   1.819   6.557  -0.863
  230   HD11  LEU  36          HD11      LEU  36   3.728   7.497   0.293
  231   HD12  LEU  36          HD12      LEU  36   3.942   8.696  -0.988
  232   HD13  LEU  36          HD13      LEU  36   4.177   6.978  -1.332
  233   HD21  LEU  36          HD21      LEU  36   0.267   8.365  -0.442
  234   HD22  LEU  36          HD22      LEU  36   1.581   9.537  -0.515
  235   HD23  LEU  36          HD23      LEU  36   1.532   8.349   0.785
  236    H1   MAN 101           H1       MAN 101  -8.966   5.961   2.460
  237    H2   MAN 101           H2       MAN 101  -6.832   5.314   3.656
  238    H3   MAN 101           H3       MAN 101  -6.996   2.887   3.439
  239    H4   MAN 101           H4       MAN 101  -9.432   3.171   5.240
  240    H5   MAN 101           H5       MAN 101  -9.088   2.214   2.376
  241    H61  MAN 101           H61      MAN 101 -10.927   1.147   3.765
  242    H62  MAN 101           H62      MAN 101 -11.449   1.906   2.244
  243    HO2  MAN 101           HO2      MAN 101  -9.310   5.123   5.069
  244    HO3  MAN 101           HO3      MAN 101  -7.343   3.849   6.093
  245    HO4  MAN 101           HO4      MAN 101  -8.058   1.395   5.604
  246    HO6  MAN 101           HO6      MAN 101 -11.779   3.841   3.618
  Start of MODEL    6
    1    H1   THR   1           H1       THR   1 -11.779   0.566  -4.679
    2    H2   THR   1           H2       THR   1 -11.605  -0.988  -4.058
    3    H3   THR   1           H3       THR   1 -11.647  -0.753  -5.743
    4    HA   THR   1           HA       THR   1  -9.418  -1.114  -5.019
    5    HB   THR   1           HB       THR   1  -8.503   1.240  -5.579
    6    HG1  THR   1           HG1      THR   1 -10.690   2.102  -6.771
    7   HG21  THR   1          HG21      THR   1 -10.374  -0.115  -7.531
    8   HG22  THR   1          HG22      THR   1  -8.691  -0.561  -7.239
    9   HG23  THR   1          HG23      THR   1  -9.077   1.009  -7.941
   10    H    GLN   2           H        GLN   2  -7.567   0.040  -3.875
   11    HA   GLN   2           HA       GLN   2  -8.340   0.663  -1.173
   12    HB2  GLN   2           HB2      GLN   2  -6.370  -0.806  -1.632
   13    HB3  GLN   2           HB3      GLN   2  -5.607   0.519  -2.486
   14    HG2  GLN   2           HG2      GLN   2  -4.761   0.222  -0.205
   15    HG3  GLN   2           HG3      GLN   2  -5.453   1.817  -0.505
   16   HE21  GLN   2          HE21      GLN   2  -6.013   2.299   1.403
   17   HE22  GLN   2          HE22      GLN   2  -7.185   1.530   2.431
   18    H    SER   3           H        SER   3  -7.907   2.652  -0.159
   19    HA   SER   3           HA       SER   3  -8.423   4.853  -1.886
   20    HB2  SER   3           HB2      SER   3  -8.748   6.069   0.151
   21    HB3  SER   3           HB3      SER   3  -9.559   4.514   0.298
   22    H    HIS   4           H        HIS   4  -7.326   6.918  -1.291
   23    HA   HIS   4           HA       HIS   4  -4.526   6.677  -1.958
   24    HB2  HIS   4           HB2      HIS   4  -6.155   8.475  -2.823
   25    HB3  HIS   4           HB3      HIS   4  -6.026   9.224  -1.248
   26    HD1  HIS   4           HD1      HIS   4  -5.118  11.237  -2.928
   27    HD2  HIS   4           HD2      HIS   4  -2.600   8.009  -2.322
   28    HE1  HIS   4           HE1      HIS   4  -2.871  11.946  -3.813
   29    HE2  HIS   4           HE2      HIS   4  -1.612   9.780  -3.853
   30    H    TYR   5           H        TYR   5  -2.825   6.963  -0.500
   31    HA   TYR   5           HA       TYR   5  -1.689   7.167   1.365
   32    HB2  TYR   5           HB2      TYR   5  -4.083   8.699   2.307
   33    HB3  TYR   5           HB3      TYR   5  -2.699   8.424   3.371
   34    HD1  TYR   5           HD1      TYR   5  -4.086  10.424   0.719
   35    HD2  TYR   5           HD2      TYR   5  -0.462   9.332   2.642
   36    HE1  TYR   5           HE1      TYR   5  -2.983  12.394  -0.246
   37    HE2  TYR   5           HE2      TYR   5   0.647  11.297   1.692
   38    HH   TYR   5           HH       TYR   5  -0.985  13.841   0.436
   39    H    GLY   6           H        GLY   6  -3.955   5.142   0.888
   40    HA2  GLY   6           HA2      GLY   6  -4.092   4.037   3.583
   41    HA3  GLY   6           HA3      GLY   6  -4.967   3.490   2.162
   42    H    GLN   7           H        GLN   7  -3.696   1.657   3.751
   43    HA   GLN   7           HA       GLN   7  -1.077   1.051   2.750
   44    HB2  GLN   7           HB2      GLN   7  -2.018   0.463   5.037
   45    HB3  GLN   7           HB3      GLN   7  -2.971  -0.768   4.229
   46    HG2  GLN   7           HG2      GLN   7  -0.963  -1.861   3.466
   47    HG3  GLN   7           HG3      GLN   7   0.051  -0.647   4.231
   48   HE21  GLN   7          HE21      GLN   7   0.233  -3.353   4.817
   49   HE22  GLN   7          HE22      GLN   7  -0.318  -3.617   6.425
   50    H    CYS   8           H        CYS   8  -0.643  -0.178   0.995
   51    HA   CYS   8           HA       CYS   8  -2.991  -1.313  -0.396
   52    HB2  CYS   8           HB2      CYS   8  -1.704  -0.893  -2.443
   53    HB3  CYS   8           HB3      CYS   8  -2.206   0.539  -1.549
   54    H    GLY   9           H        GLY   9  -0.518  -2.556   1.292
   55    HA2  GLY   9           HA2      GLY   9  -0.699  -5.105   0.619
   56    HA3  GLY   9           HA3      GLY   9   0.076  -4.507  -0.828
   57    H    GLY  10           H        GLY  10   0.406  -4.642   2.617
   58    HA2  GLY  10           HA2      GLY  10   3.297  -4.809   2.240
   59    HA3  GLY  10           HA3      GLY  10   2.486  -4.510   3.781
   60    H    ILE  11           H        ILE  11   4.313  -6.522   3.673
   61    HA   ILE  11           HA       ILE  11   3.268  -9.044   3.082
   62    HB   ILE  11           HB       ILE  11   5.226  -8.269   5.270
   63   HG12  ILE  11          HG12      ILE  11   5.723  -9.316   2.471
   64   HG13  ILE  11          HG13      ILE  11   5.947  -7.652   2.987
   65   HG21  ILE  11          HG21      ILE  11   4.631 -10.986   4.099
   66   HG22  ILE  11          HG22      ILE  11   4.278 -10.448   5.741
   67   HG23  ILE  11          HG23      ILE  11   5.951 -10.620   5.210
   68   HD11  ILE  11          HD11      ILE  11   7.702  -8.364   4.521
   69   HD12  ILE  11          HD12      ILE  11   8.064  -8.858   2.864
   70   HD13  ILE  11          HD13      ILE  11   7.448 -10.036   4.029
   71    H    GLY  12           H        GLY  12   1.442  -9.873   3.830
   72    HA2  GLY  12           HA2      GLY  12   0.305 -10.904   5.647
   73    HA3  GLY  12           HA3      GLY  12   0.821  -9.582   6.685
   74    H    TYR  13           H        TYR  13   0.106  -7.802   4.230
   75    HA   TYR  13           HA       TYR  13  -2.469  -7.127   5.266
   76    HB2  TYR  13           HB2      TYR  13  -0.889  -5.384   4.514
   77    HB3  TYR  13           HB3      TYR  13  -1.020  -5.989   2.871
   78    HD1  TYR  13           HD1      TYR  13  -3.270  -4.811   5.623
   79    HD2  TYR  13           HD2      TYR  13  -2.447  -4.826   1.456
   80    HE1  TYR  13           HE1      TYR  13  -5.144  -3.253   5.244
   81    HE2  TYR  13           HE2      TYR  13  -4.306  -3.283   1.074
   82    HH   TYR  13           HH       TYR  13  -6.091  -2.327   1.973
   83    H    SER  14           H        SER  14  -4.256  -8.071   4.735
   84    HA   SER  14           HA       SER  14  -4.377  -9.526   2.193
   85    HB2  SER  14           HB2      SER  14  -5.927 -10.002   4.747
   86    HB3  SER  14           HB3      SER  14  -5.834 -11.064   3.336
   87    HG   SER  14           HG       SER  14  -3.603 -10.282   4.911
   88    H    GLY  15           H        GLY  15  -5.042  -6.681   2.921
   89    HA2  GLY  15           HA2      GLY  15  -7.929  -6.547   2.417
   90    HA3  GLY  15           HA3      GLY  15  -6.874  -5.210   2.855
   91    HA   PRO  16           HA       PRO  16  -7.693  -4.917  -1.681
   92    HB2  PRO  16           HB2      PRO  16  -7.775  -2.041  -0.980
   93    HB3  PRO  16           HB3      PRO  16  -8.915  -2.988  -1.941
   94    HG2  PRO  16           HG2      PRO  16  -9.511  -2.156   0.525
   95    HG3  PRO  16           HG3      PRO  16 -10.056  -3.733  -0.078
   96    HD2  PRO  16           HD2      PRO  16  -7.784  -3.099   1.779
   97    HD3  PRO  16           HD3      PRO  16  -8.953  -4.423   1.848
   98    H    THR  17           H        THR  17  -5.819  -5.149  -2.714
   99    HA   THR  17           HA       THR  17  -3.503  -3.553  -1.918
  100    HB   THR  17           HB       THR  17  -2.286  -5.278  -3.259
  101    HG1  THR  17           HG1      THR  17  -3.370  -7.127  -3.827
  102   HG21  THR  17          HG21      THR  17  -2.412  -5.402  -0.824
  103   HG22  THR  17          HG22      THR  17  -2.454  -7.024  -1.520
  104   HG23  THR  17          HG23      THR  17  -3.940  -6.274  -0.930
  105    H    VAL  18           H        VAL  18  -5.889  -3.470  -4.155
  106    HA   VAL  18           HA       VAL  18  -4.142  -2.364  -6.238
  107    HB   VAL  18           HB       VAL  18  -7.100  -3.066  -6.393
  108   HG11  VAL  18          HG11      VAL  18  -6.504  -1.246  -7.913
  109   HG12  VAL  18          HG12      VAL  18  -6.870  -2.722  -8.807
  110   HG13  VAL  18          HG13      VAL  18  -5.195  -2.222  -8.577
  111   HG21  VAL  18          HG21      VAL  18  -5.716  -5.061  -6.209
  112   HG22  VAL  18          HG22      VAL  18  -4.702  -4.498  -7.537
  113   HG23  VAL  18          HG23      VAL  18  -6.385  -4.928  -7.835
  114    H    CYS  19           H        CYS  19  -3.793  -0.256  -5.936
  115    HA   CYS  19           HA       CYS  19  -5.460   1.409  -4.377
  116    HB2  CYS  19           HB2      CYS  19  -3.212   2.069  -6.273
  117    HB3  CYS  19           HB3      CYS  19  -3.919   3.152  -5.085
  118    H    ALA  20           H        ALA  20  -6.697   3.150  -5.051
  119    HA   ALA  20           HA       ALA  20  -8.203   3.012  -7.374
  120    HB1  ALA  20           HB1      ALA  20  -7.465   5.451  -5.730
  121    HB2  ALA  20           HB2      ALA  20  -8.827   4.379  -5.431
  122    HB3  ALA  20           HB3      ALA  20  -8.792   5.366  -6.891
  123    H    SER  21           H        SER  21  -7.629   3.355  -9.431
  124    HA   SER  21           HA       SER  21  -5.039   3.875 -10.193
  125    HB2  SER  21           HB2      SER  21  -7.519   4.336 -11.858
  126    HB3  SER  21           HB3      SER  21  -5.878   4.047 -12.436
  127    HG   SER  21           HG       SER  21  -6.023   2.037 -11.141
  128    H    GLY  22           H        GLY  22  -3.896   5.595 -10.707
  129    HA2  GLY  22           HA2      GLY  22  -3.668   7.958 -11.117
  130    HA3  GLY  22           HA3      GLY  22  -5.098   8.206 -10.115
  131    H    THR  23           H        THR  23  -3.843   5.853  -8.423
  132    HA   THR  23           HA       THR  23  -1.729   7.419  -7.167
  133    HB   THR  23           HB       THR  23  -2.358   6.427  -4.987
  134    HG1  THR  23           HG1      THR  23  -4.482   5.216  -6.454
  135   HG21  THR  23          HG21      THR  23  -4.736   7.660  -6.377
  136   HG22  THR  23          HG22      THR  23  -3.424   8.542  -5.599
  137   HG23  THR  23          HG23      THR  23  -4.513   7.545  -4.631
  138    H    THR  24           H        THR  24   0.051   6.143  -6.390
  139    HA   THR  24           HA       THR  24   0.141   3.500  -7.658
  140    HB   THR  24           HB       THR  24   2.666   3.861  -7.638
  141    HG1  THR  24           HG1      THR  24   1.802   6.345  -6.638
  142   HG21  THR  24          HG21      THR  24   1.339   4.043  -9.696
  143   HG22  THR  24          HG22      THR  24   2.641   5.230  -9.684
  144   HG23  THR  24          HG23      THR  24   0.987   5.730  -9.322
  145    H    CYS  25           H        CYS  25   0.786   1.759  -6.451
  146    HA   CYS  25           HA       CYS  25   0.770   2.121  -3.605
  147    HB2  CYS  25           HB2      CYS  25  -0.408   0.208  -4.519
  148    HB3  CYS  25           HB3      CYS  25   1.065  -0.383  -5.303
  149    H    GLN  26           H        GLN  26   2.544   2.930  -2.781
  150    HA   GLN  26           HA       GLN  26   5.083   1.991  -3.818
  151    HB2  GLN  26           HB2      GLN  26   4.289   4.503  -2.415
  152    HB3  GLN  26           HB3      GLN  26   5.979   4.022  -2.512
  153    HG2  GLN  26           HG2      GLN  26   5.838   3.995  -4.953
  154    HG3  GLN  26           HG3      GLN  26   4.114   4.359  -4.821
  155   HE21  GLN  26          HE21      GLN  26   3.500   6.398  -4.636
  156   HE22  GLN  26          HE22      GLN  26   4.542   7.771  -4.557
  157    H    VAL  27           H        VAL  27   6.068   0.555  -2.807
  158    HA   VAL  27           HA       VAL  27   5.443  -0.209  -0.127
  159    HB   VAL  27           HB       VAL  27   7.727  -1.102  -1.918
  160   HG11  VAL  27          HG11      VAL  27   7.870  -3.072  -0.440
  161   HG12  VAL  27          HG12      VAL  27   6.642  -2.361   0.606
  162   HG13  VAL  27          HG13      VAL  27   8.207  -1.574   0.425
  163   HG21  VAL  27          HG21      VAL  27   5.565  -1.603  -2.912
  164   HG22  VAL  27          HG22      VAL  27   5.035  -2.375  -1.417
  165   HG23  VAL  27          HG23      VAL  27   6.342  -3.087  -2.362
  166    H    LEU  28           H        LEU  28   6.033   1.009   1.450
  167    HA   LEU  28           HA       LEU  28   8.420   2.678   1.306
  168    HB2  LEU  28           HB2      LEU  28   6.184   2.547   3.332
  169    HB3  LEU  28           HB3      LEU  28   7.473   3.739   3.325
  170    HG   LEU  28           HG       LEU  28   5.423   3.429   1.118
  171   HD11  LEU  28          HD11      LEU  28   5.606   5.489   3.307
  172   HD12  LEU  28          HD12      LEU  28   4.369   4.232   3.150
  173   HD13  LEU  28          HD13      LEU  28   4.489   5.510   1.940
  174   HD21  LEU  28          HD21      LEU  28   6.286   5.583   0.380
  175   HD22  LEU  28          HD22      LEU  28   7.525   4.315   0.364
  176   HD23  LEU  28          HD23      LEU  28   7.490   5.509   1.674
  177    H    ASN  29           H        ASN  29   6.980   0.097   3.166
  178    HA   ASN  29           HA       ASN  29   9.583  -0.623   4.239
  179    HB2  ASN  29           HB2      ASN  29   7.024  -0.440   5.889
  180    HB3  ASN  29           HB3      ASN  29   8.547  -1.100   6.445
  181   HD21  ASN  29          HD21      ASN  29   6.742   1.771   5.835
  182   HD22  ASN  29          HD22      ASN  29   7.848   2.878   6.553
  183    HA   PRO  30           HA       PRO  30   8.304  -4.685   2.978
  184    HB2  PRO  30           HB2      PRO  30   8.416  -5.659   5.788
  185    HB3  PRO  30           HB3      PRO  30   9.172  -6.332   4.337
  186    HG2  PRO  30           HG2      PRO  30  10.647  -5.005   6.071
  187    HG3  PRO  30           HG3      PRO  30  10.874  -4.748   4.331
  188    HD2  PRO  30           HD2      PRO  30   9.465  -3.022   6.330
  189    HD3  PRO  30           HD3      PRO  30  10.523  -2.543   4.986
  190    H    TYR  31           H        TYR  31   6.685  -3.644   5.984
  191    HA   TYR  31           HA       TYR  31   4.356  -5.211   5.119
  192    HB2  TYR  31           HB2      TYR  31   4.748  -3.861   7.799
  193    HB3  TYR  31           HB3      TYR  31   3.569  -5.087   7.373
  194    HD1  TYR  31           HD1      TYR  31   4.313  -7.434   7.005
  195    HD2  TYR  31           HD2      TYR  31   6.970  -4.460   8.467
  196    HE1  TYR  31           HE1      TYR  31   5.867  -9.186   7.755
  197    HE2  TYR  31           HE2      TYR  31   8.521  -6.197   9.218
  198    HH   TYR  31           HH       TYR  31   8.376  -8.594   9.871
  199    H    TYR  32           H        TYR  32   5.509  -1.988   5.658
  200    HA   TYR  32           HA       TYR  32   2.834  -0.934   5.284
  201    HB2  TYR  32           HB2      TYR  32   4.260   0.004   7.069
  202    HB3  TYR  32           HB3      TYR  32   5.370   0.580   5.830
  203    HD1  TYR  32           HD1      TYR  32   5.237   2.854   5.435
  204    HD2  TYR  32           HD2      TYR  32   1.684   0.676   6.363
  205    HE1  TYR  32           HE1      TYR  32   3.957   4.891   5.285
  206    HE2  TYR  32           HE2      TYR  32   0.382   2.740   6.200
  207    HH   TYR  32           HH       TYR  32   0.673   5.087   6.324
  208    H    SER  33           H        SER  33   2.123  -0.616   3.328
  209    HA   SER  33           HA       SER  33   3.888   0.599   1.317
  210    HB2  SER  33           HB2      SER  33   1.728  -1.480   0.767
  211    HB3  SER  33           HB3      SER  33   2.830  -0.773  -0.411
  212    HG   SER  33           HG       SER  33   3.307  -2.946   0.471
  213    H    GLN  34           H        GLN  34   2.770   2.306   0.164
  214    HA   GLN  34           HA       GLN  34   0.044   2.758   1.104
  215    HB2  GLN  34           HB2      GLN  34   1.318   4.056   2.626
  216    HB3  GLN  34           HB3      GLN  34   2.357   4.671   1.356
  217    HG2  GLN  34           HG2      GLN  34   0.581   6.052   0.503
  218    HG3  GLN  34           HG3      GLN  34  -0.568   5.308   1.607
  219   HE21  GLN  34          HE21      GLN  34  -0.702   6.025   3.645
  220   HE22  GLN  34          HE22      GLN  34   0.189   7.332   4.298
  221    H    CYS  35           H        CYS  35  -1.324   3.570  -0.307
  222    HA   CYS  35           HA       CYS  35  -0.599   3.837  -3.069
  223    HB2  CYS  35           HB2      CYS  35  -3.171   4.634  -1.689
  224    HB3  CYS  35           HB3      CYS  35  -2.941   4.464  -3.421
  225    H    LEU  36           H        LEU  36   0.529   5.552  -3.672
  226    HA   LEU  36           HA       LEU  36  -0.308   8.182  -2.710
  227    HB2  LEU  36           HB2      LEU  36   2.453   7.203  -3.410
  228    HB3  LEU  36           HB3      LEU  36   2.059   8.894  -3.171
  229    HG   LEU  36           HG       LEU  36   1.758   6.757  -1.061
  230   HD11  LEU  36          HD11      LEU  36   3.901   8.856  -1.388
  231   HD12  LEU  36          HD12      LEU  36   4.112   7.116  -1.612
  232   HD13  LEU  36          HD13      LEU  36   3.709   7.756  -0.020
  233   HD21  LEU  36          HD21      LEU  36   1.510   8.678   0.439
  234   HD22  LEU  36          HD22      LEU  36   0.234   8.608  -0.768
  235   HD23  LEU  36          HD23      LEU  36   1.559   9.761  -0.950
  236    H1   MAN 101           H1       MAN 101  -8.739   6.336   2.298
  237    H2   MAN 101           H2       MAN 101  -6.496   5.862   3.312
  238    H3   MAN 101           H3       MAN 101  -6.619   3.421   3.350
  239    H4   MAN 101           H4       MAN 101  -8.778   3.894   5.407
  240    H5   MAN 101           H5       MAN 101  -8.832   2.651   2.608
  241    H61  MAN 101           H61      MAN 101 -10.447   1.585   4.181
  242    H62  MAN 101           H62      MAN 101 -11.229   2.437   2.834
  243    HO2  MAN 101           HO2      MAN 101  -7.237   6.075   5.436
  244    HO3  MAN 101           HO3      MAN 101  -6.128   3.142   5.529
  245    HO4  MAN 101           HO4      MAN 101  -8.767   1.613   5.462
  246    HO6  MAN 101           HO6      MAN 101 -11.150   4.309   4.517
  Start of MODEL    7
    1    H1   THR   1           H1       THR   1 -11.760  -0.525  -5.956
    2    H2   THR   1           H2       THR   1 -11.834   0.906  -5.065
    3    H3   THR   1           H3       THR   1 -11.813  -0.580  -4.251
    4    HA   THR   1           HA       THR   1  -9.568  -0.917  -5.167
    5    HB   THR   1           HB       THR   1  -8.576   1.370  -5.871
    6    HG1  THR   1           HG1      THR   1 -10.356   2.478  -7.139
    7   HG21  THR   1          HG21      THR   1 -10.414  -0.105  -7.764
    8   HG22  THR   1          HG22      THR   1  -8.767  -0.596  -7.349
    9   HG23  THR   1          HG23      THR   1  -9.043   0.921  -8.205
   10    H    GLN   2           H        GLN   2  -7.700   0.042  -4.025
   11    HA   GLN   2           HA       GLN   2  -8.398   0.751  -1.355
   12    HB2  GLN   2           HB2      GLN   2  -6.539  -0.786  -1.813
   13    HB3  GLN   2           HB3      GLN   2  -5.724   0.443  -2.754
   14    HG2  GLN   2           HG2      GLN   2  -4.763   0.207  -0.505
   15    HG3  GLN   2           HG3      GLN   2  -5.426   1.802  -0.830
   16   HE21  GLN   2          HE21      GLN   2  -5.800   2.316   1.012
   17   HE22  GLN   2          HE22      GLN   2  -6.905   1.667   2.205
   18    H    SER   3           H        SER   3  -7.997   2.722  -0.281
   19    HA   SER   3           HA       SER   3  -8.319   4.990  -1.953
   20    HB2  SER   3           HB2      SER   3  -8.621   6.194   0.118
   21    HB3  SER   3           HB3      SER   3  -9.595   4.731   0.128
   22    H    HIS   4           H        HIS   4  -7.132   6.926  -1.666
   23    HA   HIS   4           HA       HIS   4  -4.306   6.675  -1.936
   24    HB2  HIS   4           HB2      HIS   4  -5.820   8.471  -2.961
   25    HB3  HIS   4           HB3      HIS   4  -5.906   9.197  -1.375
   26    HD1  HIS   4           HD1      HIS   4  -4.834  11.347  -2.637
   27    HD2  HIS   4           HD2      HIS   4  -2.374   8.024  -2.376
   28    HE1  HIS   4           HE1      HIS   4  -2.551  12.158  -3.228
   29    HE2  HIS   4           HE2      HIS   4  -1.298   9.994  -3.561
   30    H    TYR   5           H        TYR   5  -2.748   6.859  -0.392
   31    HA   TYR   5           HA       TYR   5  -1.725   7.072   1.534
   32    HB2  TYR   5           HB2      TYR   5  -4.160   8.604   2.331
   33    HB3  TYR   5           HB3      TYR   5  -2.902   8.252   3.521
   34    HD1  TYR   5           HD1      TYR   5  -3.888  10.256   0.664
   35    HD2  TYR   5           HD2      TYR   5  -0.656   9.236   3.218
   36    HE1  TYR   5           HE1      TYR   5  -2.671  12.242  -0.099
   37    HE2  TYR   5           HE2      TYR   5   0.575  11.208   2.468
   38    HH   TYR   5           HH       TYR   5   0.606  12.737   0.492
   39    H    GLY   6           H        GLY   6  -4.065   5.101   0.903
   40    HA2  GLY   6           HA2      GLY   6  -4.188   3.904   3.556
   41    HA3  GLY   6           HA3      GLY   6  -5.124   3.414   2.182
   42    H    GLN   7           H        GLN   7  -3.750   1.594   3.735
   43    HA   GLN   7           HA       GLN   7  -1.169   1.013   2.672
   44    HB2  GLN   7           HB2      GLN   7  -2.022   0.442   4.976
   45    HB3  GLN   7           HB3      GLN   7  -3.004  -0.815   4.235
   46    HG2  GLN   7           HG2      GLN   7  -0.997  -1.963   3.492
   47    HG3  GLN   7           HG3      GLN   7   0.016  -0.673   4.148
   48   HE21  GLN   7          HE21      GLN   7   0.200  -3.412   4.928
   49   HE22  GLN   7          HE22      GLN   7  -0.302  -3.501   6.568
   50    H    CYS   8           H        CYS   8  -0.684  -0.174   0.914
   51    HA   CYS   8           HA       CYS   8  -2.951  -1.375  -0.542
   52    HB2  CYS   8           HB2      CYS   8  -1.631  -0.995  -2.563
   53    HB3  CYS   8           HB3      CYS   8  -2.030   0.488  -1.704
   54    H    GLY   9           H        GLY   9  -0.873  -2.649   1.378
   55    HA2  GLY   9           HA2      GLY   9  -0.902  -5.160   1.082
   56    HA3  GLY   9           HA3      GLY   9  -0.366  -4.832  -0.553
   57    H    GLY  10           H        GLY  10   0.507  -4.501   2.784
   58    HA2  GLY  10           HA2      GLY  10   3.307  -4.867   2.035
   59    HA3  GLY  10           HA3      GLY  10   2.725  -4.373   3.635
   60    H    ILE  11           H        ILE  11   4.385  -6.497   3.617
   61    HA   ILE  11           HA       ILE  11   3.211  -9.023   3.307
   62    HB   ILE  11           HB       ILE  11   5.225  -8.190   5.425
   63   HG12  ILE  11          HG12      ILE  11   5.742  -9.333   2.676
   64   HG13  ILE  11          HG13      ILE  11   5.917  -7.632   3.093
   65   HG21  ILE  11          HG21      ILE  11   5.924 -10.554   5.389
   66   HG22  ILE  11          HG22      ILE  11   4.607 -10.916   4.273
   67   HG23  ILE  11          HG23      ILE  11   4.251 -10.360   5.910
   68   HD11  ILE  11          HD11      ILE  11   8.064  -8.784   3.079
   69   HD12  ILE  11          HD12      ILE  11   7.452  -9.910   4.298
   70   HD13  ILE  11          HD13      ILE  11   7.650  -8.205   4.697
   71    H    GLY  12           H        GLY  12   1.332  -9.670   4.216
   72    HA2  GLY  12           HA2      GLY  12   0.297 -10.485   6.223
   73    HA3  GLY  12           HA3      GLY  12   0.916  -9.081   7.067
   74    H    TYR  13           H        TYR  13  -0.045  -7.750   4.315
   75    HA   TYR  13           HA       TYR  13  -2.673  -7.082   5.434
   76    HB2  TYR  13           HB2      TYR  13  -1.138  -5.214   4.856
   77    HB3  TYR  13           HB3      TYR  13  -1.113  -5.762   3.194
   78    HD1  TYR  13           HD1      TYR  13  -3.361  -4.372   5.831
   79    HD2  TYR  13           HD2      TYR  13  -2.743  -4.959   1.663
   80    HE1  TYR  13           HE1      TYR  13  -5.228  -2.833   5.325
   81    HE2  TYR  13           HE2      TYR  13  -4.598  -3.445   1.169
   82    HH   TYR  13           HH       TYR  13  -6.239  -2.272   1.972
   83    H    SER  14           H        SER  14  -4.276  -8.297   4.739
   84    HA   SER  14           HA       SER  14  -4.068  -9.662   2.161
   85    HB2  SER  14           HB2      SER  14  -6.032 -10.091   4.408
   86    HB3  SER  14           HB3      SER  14  -5.699 -11.178   3.058
   87    HG   SER  14           HG       SER  14  -3.453 -11.096   3.915
   88    H    GLY  15           H        GLY  15  -5.274  -6.857   3.267
   89    HA2  GLY  15           HA2      GLY  15  -7.934  -6.861   2.167
   90    HA3  GLY  15           HA3      GLY  15  -7.046  -5.481   2.768
   91    HA   PRO  16           HA       PRO  16  -7.545  -4.877  -1.799
   92    HB2  PRO  16           HB2      PRO  16  -7.628  -2.090  -0.790
   93    HB3  PRO  16           HB3      PRO  16  -8.704  -2.893  -1.945
   94    HG2  PRO  16           HG2      PRO  16  -9.512  -2.362   0.526
   95    HG3  PRO  16           HG3      PRO  16  -9.945  -3.888  -0.269
   96    HD2  PRO  16           HD2      PRO  16  -7.840  -3.376   1.802
   97    HD3  PRO  16           HD3      PRO  16  -8.987  -4.720   1.661
   98    H    THR  17           H        THR  17  -5.603  -5.105  -2.699
   99    HA   THR  17           HA       THR  17  -3.366  -3.446  -1.840
  100    HB   THR  17           HB       THR  17  -2.044  -5.089  -3.191
  101    HG1  THR  17           HG1      THR  17  -3.365  -6.012  -4.619
  102   HG21  THR  17          HG21      THR  17  -2.395  -5.398  -0.765
  103   HG22  THR  17          HG22      THR  17  -2.277  -6.942  -1.605
  104   HG23  THR  17          HG23      THR  17  -3.853  -6.327  -1.105
  105    H    VAL  18           H        VAL  18  -5.716  -3.655  -4.200
  106    HA   VAL  18           HA       VAL  18  -4.139  -2.425  -6.303
  107    HB   VAL  18           HB       VAL  18  -7.087  -3.172  -6.240
  108   HG11  VAL  18          HG11      VAL  18  -6.662  -1.305  -7.777
  109   HG12  VAL  18          HG12      VAL  18  -7.063  -2.780  -8.660
  110   HG13  VAL  18          HG13      VAL  18  -5.388  -2.243  -8.559
  111   HG21  VAL  18          HG21      VAL  18  -6.450  -4.999  -7.715
  112   HG22  VAL  18          HG22      VAL  18  -5.548  -5.098  -6.198
  113   HG23  VAL  18          HG23      VAL  18  -4.767  -4.487  -7.651
  114    H    CYS  19           H        CYS  19  -3.776  -0.346  -6.116
  115    HA   CYS  19           HA       CYS  19  -5.295   1.386  -4.466
  116    HB2  CYS  19           HB2      CYS  19  -3.145   1.916  -6.506
  117    HB3  CYS  19           HB3      CYS  19  -3.783   3.095  -5.370
  118    H    ALA  20           H        ALA  20  -6.469   3.212  -5.128
  119    HA   ALA  20           HA       ALA  20  -8.108   2.920  -7.377
  120    HB1  ALA  20           HB1      ALA  20  -8.767   4.244  -5.445
  121    HB2  ALA  20           HB2      ALA  20  -8.811   5.226  -6.909
  122    HB3  ALA  20           HB3      ALA  20  -7.474   5.403  -5.765
  123    H    SER  21           H        SER  21  -7.964   3.768  -9.398
  124    HA   SER  21           HA       SER  21  -5.534   4.074 -10.610
  125    HB2  SER  21           HB2      SER  21  -8.141   5.302 -11.468
  126    HB3  SER  21           HB3      SER  21  -6.799   4.805 -12.509
  127    HG   SER  21           HG       SER  21  -8.583   3.294 -12.316
  128    H    GLY  22           H        GLY  22  -4.086   5.669 -10.683
  129    HA2  GLY  22           HA2      GLY  22  -3.576   8.011 -10.983
  130    HA3  GLY  22           HA3      GLY  22  -4.953   8.381  -9.949
  131    H    THR  23           H        THR  23  -3.924   5.893  -8.342
  132    HA   THR  23           HA       THR  23  -1.798   7.363  -6.972
  133    HB   THR  23           HB       THR  23  -2.474   6.261  -4.863
  134    HG1  THR  23           HG1      THR  23  -4.456   5.060  -6.517
  135   HG21  THR  23          HG21      THR  23  -3.463   8.414  -5.324
  136   HG22  THR  23          HG22      THR  23  -4.642   7.378  -4.521
  137   HG23  THR  23          HG23      THR  23  -4.742   7.648  -6.264
  138    H    THR  24           H        THR  24  -0.021   6.126  -6.213
  139    HA   THR  24           HA       THR  24   0.156   3.578  -7.626
  140    HB   THR  24           HB       THR  24   2.673   4.006  -7.572
  141    HG1  THR  24           HG1      THR  24   1.734   6.425  -6.480
  142   HG21  THR  24          HG21      THR  24   0.930   5.891  -9.167
  143   HG22  THR  24          HG22      THR  24   1.340   4.235  -9.613
  144   HG23  THR  24          HG23      THR  24   2.599   5.470  -9.555
  145    H    CYS  25           H        CYS  25   0.881   1.800  -6.561
  146    HA   CYS  25           HA       CYS  25   0.766   1.959  -3.685
  147    HB2  CYS  25           HB2      CYS  25  -0.370   0.099  -4.738
  148    HB3  CYS  25           HB3      CYS  25   1.108  -0.439  -5.522
  149    H    GLN  26           H        GLN  26   2.485   2.795  -2.819
  150    HA   GLN  26           HA       GLN  26   5.085   1.966  -3.810
  151    HB2  GLN  26           HB2      GLN  26   4.248   4.314  -2.111
  152    HB3  GLN  26           HB3      GLN  26   5.907   3.977  -2.590
  153    HG2  GLN  26           HG2      GLN  26   5.260   4.190  -4.949
  154    HG3  GLN  26           HG3      GLN  26   3.604   4.508  -4.461
  155   HE21  GLN  26          HE21      GLN  26   3.576   6.455  -5.470
  156   HE22  GLN  26          HE22      GLN  26   4.397   7.847  -4.872
  157    H    VAL  27           H        VAL  27   5.995   0.421  -2.756
  158    HA   VAL  27           HA       VAL  27   5.188  -0.291  -0.097
  159    HB   VAL  27           HB       VAL  27   7.466  -1.443  -1.751
  160   HG11  VAL  27          HG11      VAL  27   5.953  -2.625   0.570
  161   HG12  VAL  27          HG12      VAL  27   7.571  -1.940   0.642
  162   HG13  VAL  27          HG13      VAL  27   7.272  -3.393  -0.319
  163   HG21  VAL  27          HG21      VAL  27   5.906  -3.237  -2.387
  164   HG22  VAL  27          HG22      VAL  27   5.371  -1.665  -2.979
  165   HG23  VAL  27          HG23      VAL  27   4.601  -2.383  -1.565
  166    H    LEU  28           H        LEU  28   5.764   1.245   1.225
  167    HA   LEU  28           HA       LEU  28   8.221   2.702   1.079
  168    HB2  LEU  28           HB2      LEU  28   6.059   2.666   3.181
  169    HB3  LEU  28           HB3      LEU  28   7.358   3.837   3.101
  170    HG   LEU  28           HG       LEU  28   5.247   3.497   0.957
  171   HD11  LEU  28          HD11      LEU  28   5.487   5.603   3.097
  172   HD12  LEU  28          HD12      LEU  28   4.267   4.330   3.033
  173   HD13  LEU  28          HD13      LEU  28   4.313   5.575   1.782
  174   HD21  LEU  28          HD21      LEU  28   7.323   5.588   1.440
  175   HD22  LEU  28          HD22      LEU  28   6.085   5.652   0.181
  176   HD23  LEU  28          HD23      LEU  28   7.341   4.401   0.130
  177    H    ASN  29           H        ASN  29   6.911   0.118   3.046
  178    HA   ASN  29           HA       ASN  29   9.579  -0.482   4.065
  179    HB2  ASN  29           HB2      ASN  29   7.092  -0.617   5.867
  180    HB3  ASN  29           HB3      ASN  29   8.719  -1.040   6.295
  181   HD21  ASN  29          HD21      ASN  29   7.568   1.940   4.759
  182   HD22  ASN  29          HD22      ASN  29   8.059   3.017   6.008
  183    HA   PRO  30           HA       PRO  30   8.379  -4.590   2.776
  184    HB2  PRO  30           HB2      PRO  30   8.717  -5.558   5.578
  185    HB3  PRO  30           HB3      PRO  30   9.391  -6.212   4.079
  186    HG2  PRO  30           HG2      PRO  30  10.944  -4.820   5.694
  187    HG3  PRO  30           HG3      PRO  30  11.029  -4.550   3.942
  188    HD2  PRO  30           HD2      PRO  30   9.703  -2.895   6.052
  189    HD3  PRO  30           HD3      PRO  30  10.635  -2.376   4.632
  190    H    TYR  31           H        TYR  31   6.985  -3.625   5.880
  191    HA   TYR  31           HA       TYR  31   4.599  -5.218   5.246
  192    HB2  TYR  31           HB2      TYR  31   5.262  -3.739   7.805
  193    HB3  TYR  31           HB3      TYR  31   3.926  -4.859   7.562
  194    HD1  TYR  31           HD1      TYR  31   4.437  -7.281   7.169
  195    HD2  TYR  31           HD2      TYR  31   7.415  -4.525   8.379
  196    HE1  TYR  31           HE1      TYR  31   5.874  -9.147   7.851
  197    HE2  TYR  31           HE2      TYR  31   8.872  -6.369   9.068
  198    HH   TYR  31           HH       TYR  31   8.413  -8.848   9.839
  199    H    TYR  32           H        TYR  32   5.745  -1.970   5.414
  200    HA   TYR  32           HA       TYR  32   3.023  -0.965   5.323
  201    HB2  TYR  32           HB2      TYR  32   4.590   0.075   6.936
  202    HB3  TYR  32           HB3      TYR  32   5.558   0.629   5.574
  203    HD1  TYR  32           HD1      TYR  32   1.915   0.579   6.264
  204    HD2  TYR  32           HD2      TYR  32   5.335   2.921   5.305
  205    HE1  TYR  32           HE1      TYR  32   0.511   2.560   6.170
  206    HE2  TYR  32           HE2      TYR  32   3.966   4.909   5.208
  207    HH   TYR  32           HH       TYR  32   1.606   5.541   4.918
  208    H    SER  33           H        SER  33   2.149  -0.771   3.404
  209    HA   SER  33           HA       SER  33   3.752   0.404   1.250
  210    HB2  SER  33           HB2      SER  33   1.588  -1.702   0.921
  211    HB3  SER  33           HB3      SER  33   2.624  -1.049  -0.347
  212    HG   SER  33           HG       SER  33   3.293  -3.130   0.477
  213    H    GLN  34           H        GLN  34   2.644   2.102   0.230
  214    HA   GLN  34           HA       GLN  34  -0.107   2.528   1.107
  215    HB2  GLN  34           HB2      GLN  34   1.083   3.768   2.730
  216    HB3  GLN  34           HB3      GLN  34   2.222   4.381   1.547
  217    HG2  GLN  34           HG2      GLN  34   0.517   5.823   0.613
  218    HG3  GLN  34           HG3      GLN  34  -0.684   5.130   1.694
  219   HE21  GLN  34          HE21      GLN  34  -0.855   5.884   3.757
  220   HE22  GLN  34          HE22      GLN  34   0.107   7.160   4.377
  221    H    CYS  35           H        CYS  35  -1.408   3.421  -0.362
  222    HA   CYS  35           HA       CYS  35  -0.483   3.787  -3.054
  223    HB2  CYS  35           HB2      CYS  35  -3.161   4.528  -1.852
  224    HB3  CYS  35           HB3      CYS  35  -2.785   4.400  -3.565
  225    H    LEU  36           H        LEU  36   0.676   5.512  -3.522
  226    HA   LEU  36           HA       LEU  36  -0.127   8.090  -2.430
  227    HB2  LEU  36           HB2      LEU  36   2.610   7.047  -3.089
  228    HB3  LEU  36           HB3      LEU  36   2.279   8.756  -2.880
  229    HG   LEU  36           HG       LEU  36   1.827   6.654  -0.761
  230   HD11  LEU  36          HD11      LEU  36   3.759   7.617   0.346
  231   HD12  LEU  36          HD12      LEU  36   4.021   8.702  -1.022
  232   HD13  LEU  36          HD13      LEU  36   4.209   6.959  -1.231
  233   HD21  LEU  36          HD21      LEU  36   1.668   9.660  -0.710
  234   HD22  LEU  36          HD22      LEU  36   1.563   8.605   0.703
  235   HD23  LEU  36          HD23      LEU  36   0.325   8.525  -0.547
  236    H1   MAN 101           H1       MAN 101  -8.780   6.328   2.318
  237    H2   MAN 101           H2       MAN 101  -6.751   5.523   3.574
  238    H3   MAN 101           H3       MAN 101  -7.125   3.116   3.478
  239    H4   MAN 101           H4       MAN 101  -9.551   3.755   5.205
  240    H5   MAN 101           H5       MAN 101  -9.437   2.737   2.279
  241    H61  MAN 101           H61      MAN 101 -11.621   3.221   4.306
  242    H62  MAN 101           H62      MAN 101 -11.361   1.753   3.332
  243    HO2  MAN 101           HO2      MAN 101  -7.808   5.784   5.616
  244    HO3  MAN 101           HO3      MAN 101  -6.114   4.045   5.401
  245    HO4  MAN 101           HO4      MAN 101  -8.560   1.259   4.194
  246    HO6  MAN 101           HO6      MAN 101 -11.882   4.335   2.228
  Start of MODEL    8
    1    H1   THR   1           H1       THR   1 -11.554  -0.834  -4.252
    2    H2   THR   1           H2       THR   1 -11.763  -0.232  -5.832
    3    H3   THR   1           H3       THR   1 -11.877   0.800  -4.501
    4    HA   THR   1           HA       THR   1  -9.440  -0.576  -5.349
    5    HB   THR   1           HB       THR   1  -8.746   1.849  -5.687
    6    HG1  THR   1           HG1      THR   1 -10.484   2.938  -4.704
    7   HG21  THR   1          HG21      THR   1 -10.858   0.649  -7.484
    8   HG22  THR   1          HG22      THR   1  -9.115   0.363  -7.573
    9   HG23  THR   1          HG23      THR   1  -9.771   1.955  -7.948
   10    H    GLN   2           H        GLN   2  -7.592   0.215  -4.109
   11    HA   GLN   2           HA       GLN   2  -8.267   0.614  -1.365
   12    HB2  GLN   2           HB2      GLN   2  -6.382  -0.873  -1.934
   13    HB3  GLN   2           HB3      GLN   2  -5.567   0.456  -2.751
   14    HG2  GLN   2           HG2      GLN   2  -4.661   0.053  -0.487
   15    HG3  GLN   2           HG3      GLN   2  -5.349   1.658  -0.700
   16   HE21  GLN   2          HE21      GLN   2  -5.868   2.057   1.215
   17   HE22  GLN   2          HE22      GLN   2  -7.029   1.251   2.232
   18    H    SER   3           H        SER   3  -7.972   2.501  -0.214
   19    HA   SER   3           HA       SER   3  -8.350   4.834  -1.705
   20    HB2  SER   3           HB2      SER   3  -8.480   5.937   0.435
   21    HB3  SER   3           HB3      SER   3  -9.443   4.468   0.467
   22    H    HIS   4           H        HIS   4  -7.249   6.744  -1.313
   23    HA   HIS   4           HA       HIS   4  -4.450   6.640  -1.907
   24    HB2  HIS   4           HB2      HIS   4  -6.181   8.346  -2.752
   25    HB3  HIS   4           HB3      HIS   4  -6.126   9.051  -1.147
   26    HD1  HIS   4           HD1      HIS   4  -5.370  11.201  -2.628
   27    HD2  HIS   4           HD2      HIS   4  -2.644   8.099  -2.357
   28    HE1  HIS   4           HE1      HIS   4  -3.198  12.153  -3.413
   29    HE2  HIS   4           HE2      HIS   4  -1.855  10.053  -3.754
   30    H    TYR   5           H        TYR   5  -2.825   6.771  -0.412
   31    HA   TYR   5           HA       TYR   5  -1.714   6.973   1.467
   32    HB2  TYR   5           HB2      TYR   5  -4.069   8.596   2.340
   33    HB3  TYR   5           HB3      TYR   5  -2.832   8.156   3.516
   34    HD1  TYR   5           HD1      TYR   5  -0.784   9.241   3.563
   35    HD2  TYR   5           HD2      TYR   5  -3.434   9.994   0.344
   36    HE1  TYR   5           HE1      TYR   5   0.645  11.090   2.844
   37    HE2  TYR   5           HE2      TYR   5  -2.009  11.858  -0.398
   38    HH   TYR   5           HH       TYR   5   1.113  12.238   0.897
   39    H    GLY   6           H        GLY   6  -4.004   4.997   0.912
   40    HA2  GLY   6           HA2      GLY   6  -4.131   3.772   3.553
   41    HA3  GLY   6           HA3      GLY   6  -5.038   3.301   2.139
   42    H    GLN   7           H        GLN   7  -3.744   1.389   3.617
   43    HA   GLN   7           HA       GLN   7  -1.110   0.873   2.631
   44    HB2  GLN   7           HB2      GLN   7  -2.061   0.198   4.909
   45    HB3  GLN   7           HB3      GLN   7  -2.956  -1.048   4.059
   46    HG2  GLN   7           HG2      GLN   7  -0.929  -2.111   3.369
   47    HG3  GLN   7           HG3      GLN   7   0.058  -0.824   4.056
   48   HE21  GLN   7          HE21      GLN   7   0.313  -3.549   4.741
   49   HE22  GLN   7          HE22      GLN   7  -0.139  -3.723   6.382
   50    H    CYS   8           H        CYS   8  -0.606  -0.249   0.842
   51    HA   CYS   8           HA       CYS   8  -2.883  -1.347  -0.679
   52    HB2  CYS   8           HB2      CYS   8  -1.511  -0.951  -2.665
   53    HB3  CYS   8           HB3      CYS   8  -1.921   0.502  -1.761
   54    H    GLY   9           H        GLY   9  -0.584  -2.705   1.126
   55    HA2  GLY   9           HA2      GLY   9  -0.796  -5.254   0.540
   56    HA3  GLY   9           HA3      GLY   9  -0.053  -4.731  -0.955
   57    H    GLY  10           H        GLY  10   0.444  -4.490   2.490
   58    HA2  GLY  10           HA2      GLY  10   3.291  -4.906   1.990
   59    HA3  GLY  10           HA3      GLY  10   2.593  -4.322   3.507
   60    H    ILE  11           H        ILE  11   4.268  -6.394   3.706
   61    HA   ILE  11           HA       ILE  11   2.969  -8.870   3.591
   62    HB   ILE  11           HB       ILE  11   5.267  -7.968   5.354
   63   HG12  ILE  11          HG12      ILE  11   5.220  -9.503   2.742
   64   HG13  ILE  11          HG13      ILE  11   5.640  -7.807   2.925
   65   HG21  ILE  11          HG21      ILE  11   4.293 -10.769   4.740
   66   HG22  ILE  11          HG22      ILE  11   4.177  -9.960   6.298
   67   HG23  ILE  11          HG23      ILE  11   5.760 -10.369   5.632
   68   HD11  ILE  11          HD11      ILE  11   7.574  -8.429   4.253
   69   HD12  ILE  11          HD12      ILE  11   7.598  -9.223   2.674
   70   HD13  ILE  11          HD13      ILE  11   7.121 -10.125   4.113
   71    H    GLY  12           H        GLY  12   1.364  -9.618   4.788
   72    HA2  GLY  12           HA2      GLY  12   0.292 -10.069   6.852
   73    HA3  GLY  12           HA3      GLY  12   1.001  -8.598   7.507
   74    H    TYR  13           H        TYR  13  -0.037  -7.905   4.467
   75    HA   TYR  13           HA       TYR  13  -2.563  -6.873   5.513
   76    HB2  TYR  13           HB2      TYR  13  -0.930  -5.201   4.632
   77    HB3  TYR  13           HB3      TYR  13  -1.061  -5.969   3.057
   78    HD1  TYR  13           HD1      TYR  13  -2.473  -4.956   1.540
   79    HD2  TYR  13           HD2      TYR  13  -3.334  -4.584   5.675
   80    HE1  TYR  13           HE1      TYR  13  -4.354  -3.490   1.009
   81    HE2  TYR  13           HE2      TYR  13  -5.238  -3.106   5.149
   82    HH   TYR  13           HH       TYR  13  -6.258  -2.559   1.855
   83    H    SER  14           H        SER  14  -4.136  -8.114   5.067
   84    HA   SER  14           HA       SER  14  -4.146  -9.844   2.723
   85    HB2  SER  14           HB2      SER  14  -6.071  -9.811   5.041
   86    HB3  SER  14           HB3      SER  14  -5.669 -11.153   3.970
   87    HG   SER  14           HG       SER  14  -4.253 -11.662   5.487
   88    H    GLY  15           H        GLY  15  -5.023  -6.804   3.272
   89    HA2  GLY  15           HA2      GLY  15  -7.799  -6.871   2.370
   90    HA3  GLY  15           HA3      GLY  15  -6.898  -5.452   2.870
   91    HA   PRO  16           HA       PRO  16  -7.476  -5.331  -1.781
   92    HB2  PRO  16           HB2      PRO  16  -7.792  -2.463  -1.118
   93    HB3  PRO  16           HB3      PRO  16  -8.797  -3.501  -2.138
   94    HG2  PRO  16           HG2      PRO  16  -9.635  -2.718   0.254
   95    HG3  PRO  16           HG3      PRO  16  -9.972  -4.353  -0.342
   96    HD2  PRO  16           HD2      PRO  16  -7.904  -3.447   1.631
   97    HD3  PRO  16           HD3      PRO  16  -8.947  -4.880   1.671
   98    H    THR  17           H        THR  17  -5.703  -5.279  -2.941
   99    HA   THR  17           HA       THR  17  -3.440  -3.577  -2.156
  100    HB   THR  17           HB       THR  17  -2.202  -5.158  -3.659
  101    HG1  THR  17           HG1      THR  17  -3.533  -6.235  -4.891
  102   HG21  THR  17          HG21      THR  17  -2.192  -6.996  -2.029
  103   HG22  THR  17          HG22      THR  17  -3.714  -6.410  -1.354
  104   HG23  THR  17          HG23      THR  17  -2.253  -5.434  -1.207
  105    H    VAL  18           H        VAL  18  -5.980  -3.425  -4.253
  106    HA   VAL  18           HA       VAL  18  -4.375  -2.489  -6.508
  107    HB   VAL  18           HB       VAL  18  -7.379  -2.897  -6.374
  108   HG11  VAL  18          HG11      VAL  18  -6.756  -1.271  -8.061
  109   HG12  VAL  18          HG12      VAL  18  -7.289  -2.771  -8.830
  110   HG13  VAL  18          HG13      VAL  18  -5.570  -2.392  -8.731
  111   HG21  VAL  18          HG21      VAL  18  -6.982  -4.932  -7.707
  112   HG22  VAL  18          HG22      VAL  18  -6.215  -5.021  -6.122
  113   HG23  VAL  18          HG23      VAL  18  -5.242  -4.675  -7.553
  114    H    CYS  19           H        CYS  19  -3.815  -0.426  -6.356
  115    HA   CYS  19           HA       CYS  19  -5.215   1.423  -4.756
  116    HB2  CYS  19           HB2      CYS  19  -2.967   1.765  -6.728
  117    HB3  CYS  19           HB3      CYS  19  -3.560   3.017  -5.650
  118    H    ALA  20           H        ALA  20  -6.290   3.248  -5.377
  119    HA   ALA  20           HA       ALA  20  -8.026   3.080  -7.571
  120    HB1  ALA  20           HB1      ALA  20  -7.252   5.478  -5.911
  121    HB2  ALA  20           HB2      ALA  20  -8.545   4.335  -5.539
  122    HB3  ALA  20           HB3      ALA  20  -8.663   5.369  -6.964
  123    H    SER  21           H        SER  21  -8.118   4.387  -9.434
  124    HA   SER  21           HA       SER  21  -5.714   4.640 -10.843
  125    HB2  SER  21           HB2      SER  21  -8.360   5.999 -11.389
  126    HB3  SER  21           HB3      SER  21  -7.058   5.754 -12.556
  127    HG   SER  21           HG       SER  21  -7.407   3.412 -11.692
  128    H    GLY  22           H        GLY  22  -4.151   6.063 -10.704
  129    HA2  GLY  22           HA2      GLY  22  -3.436   8.367 -10.786
  130    HA3  GLY  22           HA3      GLY  22  -4.777   8.747  -9.713
  131    H    THR  23           H        THR  23  -3.922   6.023  -8.371
  132    HA   THR  23           HA       THR  23  -1.825   7.305  -6.800
  133    HB   THR  23           HB       THR  23  -2.562   6.041  -4.860
  134    HG1  THR  23           HG1      THR  23  -4.400   4.941  -6.726
  135   HG21  THR  23          HG21      THR  23  -3.542   8.234  -5.195
  136   HG22  THR  23          HG22      THR  23  -4.728   7.152  -4.467
  137   HG23  THR  23          HG23      THR  23  -4.820   7.535  -6.187
  138    H    THR  24           H        THR  24  -0.080   6.110  -6.206
  139    HA   THR  24           HA       THR  24   0.223   3.601  -7.689
  140    HB   THR  24           HB       THR  24   2.705   4.138  -7.639
  141    HG1  THR  24           HG1      THR  24   1.671   6.499  -6.455
  142   HG21  THR  24          HG21      THR  24   2.586   5.737  -9.499
  143   HG22  THR  24          HG22      THR  24   0.918   6.113  -9.068
  144   HG23  THR  24          HG23      THR  24   1.335   4.501  -9.648
  145    H    CYS  25           H        CYS  25   0.830   1.793  -6.557
  146    HA   CYS  25           HA       CYS  25   0.808   1.974  -3.710
  147    HB2  CYS  25           HB2      CYS  25  -0.254   0.054  -4.749
  148    HB3  CYS  25           HB3      CYS  25   1.223  -0.440  -5.542
  149    H    GLN  26           H        GLN  26   2.498   2.805  -2.772
  150    HA   GLN  26           HA       GLN  26   5.122   2.106  -3.803
  151    HB2  GLN  26           HB2      GLN  26   4.225   4.382  -2.042
  152    HB3  GLN  26           HB3      GLN  26   5.892   4.106  -2.521
  153    HG2  GLN  26           HG2      GLN  26   5.198   4.315  -4.887
  154    HG3  GLN  26           HG3      GLN  26   3.565   4.683  -4.354
  155   HE21  GLN  26          HE21      GLN  26   3.543   6.629  -5.319
  156   HE22  GLN  26          HE22      GLN  26   4.465   7.992  -4.782
  157    H    VAL  27           H        VAL  27   6.061   0.566  -2.824
  158    HA   VAL  27           HA       VAL  27   5.324  -0.279  -0.184
  159    HB   VAL  27           HB       VAL  27   7.655  -1.207  -1.914
  160   HG11  VAL  27          HG11      VAL  27   7.660  -3.212  -0.498
  161   HG12  VAL  27          HG12      VAL  27   6.380  -2.512   0.492
  162   HG13  VAL  27          HG13      VAL  27   7.971  -1.754   0.447
  163   HG21  VAL  27          HG21      VAL  27   4.906  -2.411  -1.583
  164   HG22  VAL  27          HG22      VAL  27   6.232  -3.111  -2.513
  165   HG23  VAL  27          HG23      VAL  27   5.510  -1.582  -3.017
  166    H    LEU  28           H        LEU  28   5.812   1.149   1.284
  167    HA   LEU  28           HA       LEU  28   8.229   2.714   1.216
  168    HB2  LEU  28           HB2      LEU  28   5.999   2.554   3.235
  169    HB3  LEU  28           HB3      LEU  28   7.307   3.722   3.285
  170    HG   LEU  28           HG       LEU  28   5.286   3.522   1.042
  171   HD11  LEU  28          HD11      LEU  28   5.459   5.483   3.323
  172   HD12  LEU  28          HD12      LEU  28   4.208   4.253   3.074
  173   HD13  LEU  28          HD13      LEU  28   4.375   5.588   1.933
  174   HD21  LEU  28          HD21      LEU  28   7.382   5.552   1.695
  175   HD22  LEU  28          HD22      LEU  28   6.184   5.698   0.403
  176   HD23  LEU  28          HD23      LEU  28   7.415   4.428   0.333
  177    H    ASN  29           H        ASN  29   6.899   0.037   3.008
  178    HA   ASN  29           HA       ASN  29   9.525  -0.612   4.010
  179    HB2  ASN  29           HB2      ASN  29   7.070  -0.491   5.817
  180    HB3  ASN  29           HB3      ASN  29   8.676  -1.018   6.278
  181   HD21  ASN  29          HD21      ASN  29   6.629   1.698   5.687
  182   HD22  ASN  29          HD22      ASN  29   7.682   2.916   6.296
  183    HA   PRO  30           HA       PRO  30   8.338  -4.686   2.797
  184    HB2  PRO  30           HB2      PRO  30   8.608  -5.665   5.603
  185    HB3  PRO  30           HB3      PRO  30   9.341  -6.298   4.126
  186    HG2  PRO  30           HG2      PRO  30  10.799  -4.893   5.834
  187    HG3  PRO  30           HG3      PRO  30  10.991  -4.655   4.088
  188    HD2  PRO  30           HD2      PRO  30   9.578  -2.955   6.092
  189    HD3  PRO  30           HD3      PRO  30  10.563  -2.463   4.696
  190    H    TYR  31           H        TYR  31   6.835  -3.734   5.884
  191    HA   TYR  31           HA       TYR  31   4.519  -5.386   5.171
  192    HB2  TYR  31           HB2      TYR  31   5.112  -4.011   7.819
  193    HB3  TYR  31           HB3      TYR  31   3.844  -5.176   7.492
  194    HD1  TYR  31           HD1      TYR  31   7.554  -4.823   7.649
  195    HD2  TYR  31           HD2      TYR  31   4.241  -7.479   7.754
  196    HE1  TYR  31           HE1      TYR  31   9.046  -6.627   8.280
  197    HE2  TYR  31           HE2      TYR  31   5.735  -9.316   8.387
  198    HH   TYR  31           HH       TYR  31   8.942  -8.739   9.342
  199    H    TYR  32           H        TYR  32   5.591  -2.125   5.596
  200    HA   TYR  32           HA       TYR  32   2.865  -1.177   5.294
  201    HB2  TYR  32           HB2      TYR  32   4.249  -0.165   7.057
  202    HB3  TYR  32           HB3      TYR  32   5.320   0.469   5.810
  203    HD1  TYR  32           HD1      TYR  32   1.685   0.372   6.581
  204    HD2  TYR  32           HD2      TYR  32   4.994   2.676   5.201
  205    HE1  TYR  32           HE1      TYR  32   0.239   2.341   6.414
  206    HE2  TYR  32           HE2      TYR  32   3.602   4.611   5.036
  207    HH   TYR  32           HH       TYR  32   0.381   4.689   6.362
  208    H    SER  33           H        SER  33   2.079  -0.841   3.347
  209    HA   SER  33           HA       SER  33   3.792   0.411   1.313
  210    HB2  SER  33           HB2      SER  33   1.646  -1.684   0.793
  211    HB3  SER  33           HB3      SER  33   2.731  -0.971  -0.398
  212    HG   SER  33           HG       SER  33   3.453  -3.044   0.273
  213    H    GLN  34           H        GLN  34   2.682   2.117   0.213
  214    HA   GLN  34           HA       GLN  34  -0.076   2.576   1.107
  215    HB2  GLN  34           HB2      GLN  34   1.217   3.868   2.631
  216    HB3  GLN  34           HB3      GLN  34   2.259   4.465   1.357
  217    HG2  GLN  34           HG2      GLN  34   0.442   5.820   0.479
  218    HG3  GLN  34           HG3      GLN  34  -0.647   5.146   1.688
  219   HE21  GLN  34          HE21      GLN  34  -0.648   5.992   3.729
  220   HE22  GLN  34          HE22      GLN  34   0.344   7.315   4.202
  221    H    CYS  35           H        CYS  35  -1.439   3.371  -0.407
  222    HA   CYS  35           HA       CYS  35  -0.510   3.716  -3.118
  223    HB2  CYS  35           HB2      CYS  35  -3.256   4.328  -1.988
  224    HB3  CYS  35           HB3      CYS  35  -2.813   4.257  -3.684
  225    H    LEU  36           H        LEU  36   0.577   5.486  -3.572
  226    HA   LEU  36           HA       LEU  36  -0.462   8.037  -2.595
  227    HB2  LEU  36           HB2      LEU  36   2.333   7.229  -3.364
  228    HB3  LEU  36           HB3      LEU  36   1.847   8.898  -3.137
  229    HG   LEU  36           HG       LEU  36   1.677   6.783  -0.991
  230   HD11  LEU  36          HD11      LEU  36   3.600   7.912   0.001
  231   HD12  LEU  36          HD12      LEU  36   3.702   8.973  -1.407
  232   HD13  LEU  36          HD13      LEU  36   4.000   7.242  -1.582
  233   HD21  LEU  36          HD21      LEU  36   0.062   8.580  -0.712
  234   HD22  LEU  36          HD22      LEU  36   1.336   9.779  -0.933
  235   HD23  LEU  36          HD23      LEU  36   1.352   8.722   0.478
  236    H1   MAN 101           H1       MAN 101  -8.398   5.978   2.638
  237    H2   MAN 101           H2       MAN 101  -6.283   5.039   3.671
  238    H3   MAN 101           H3       MAN 101  -6.738   2.659   3.402
  239    H4   MAN 101           H4       MAN 101  -8.951   3.190   5.392
  240    H5   MAN 101           H5       MAN 101  -9.072   2.416   2.405
  241    H61  MAN 101           H61      MAN 101 -11.201   2.761   4.546
  242    H62  MAN 101           H62      MAN 101 -10.936   1.337   3.514
  243    HO2  MAN 101           HO2      MAN 101  -7.723   6.287   4.858
  244    HO3  MAN 101           HO3      MAN 101  -6.847   3.597   6.071
  245    HO4  MAN 101           HO4      MAN 101  -7.802   1.226   5.572
  246    HO6  MAN 101           HO6      MAN 101 -11.352   3.845   2.302
  Start of MODEL    9
    1    H1   THR   1           H1       THR   1 -11.672  -0.071  -4.671
    2    H2   THR   1           H2       THR   1 -10.830  -1.477  -4.245
    3    H3   THR   1           H3       THR   1 -11.185  -1.165  -5.863
    4    HA   THR   1           HA       THR   1  -8.914  -0.654  -5.392
    5    HB   THR   1           HB       THR   1  -9.055   1.858  -5.951
    6    HG1  THR   1           HG1      THR   1 -11.338   2.292  -6.741
    7   HG21  THR   1          HG21      THR   1  -9.825   1.420  -8.235
    8   HG22  THR   1          HG22      THR   1 -10.536  -0.105  -7.716
    9   HG23  THR   1          HG23      THR   1  -8.782   0.117  -7.668
   10    H    GLN   2           H        GLN   2  -7.438   0.039  -4.008
   11    HA   GLN   2           HA       GLN   2  -8.240   0.813  -1.395
   12    HB2  GLN   2           HB2      GLN   2  -6.389  -0.761  -1.742
   13    HB3  GLN   2           HB3      GLN   2  -5.488   0.459  -2.625
   14    HG2  GLN   2           HG2      GLN   2  -4.697   0.200  -0.334
   15    HG3  GLN   2           HG3      GLN   2  -5.319   1.815  -0.654
   16   HE21  GLN   2          HE21      GLN   2  -5.877   2.322   1.206
   17   HE22  GLN   2          HE22      GLN   2  -7.085   1.608   2.249
   18    H    SER   3           H        SER   3  -7.869   2.780  -0.373
   19    HA   SER   3           HA       SER   3  -8.126   5.009  -2.106
   20    HB2  SER   3           HB2      SER   3  -8.605   6.214  -0.044
   21    HB3  SER   3           HB3      SER   3  -9.520   4.705  -0.094
   22    H    HIS   4           H        HIS   4  -7.055   6.961  -1.531
   23    HA   HIS   4           HA       HIS   4  -4.219   6.791  -1.903
   24    HB2  HIS   4           HB2      HIS   4  -5.773   8.519  -2.939
   25    HB3  HIS   4           HB3      HIS   4  -5.910   9.251  -1.356
   26    HD1  HIS   4           HD1      HIS   4  -4.849  11.475  -2.106
   27    HD2  HIS   4           HD2      HIS   4  -2.419   8.182  -2.774
   28    HE1  HIS   4           HE1      HIS   4  -2.638  12.404  -2.802
   29    HE2  HIS   4           HE2      HIS   4  -1.379  10.378  -3.587
   30    H    TYR   5           H        TYR   5  -2.702   6.894  -0.331
   31    HA   TYR   5           HA       TYR   5  -1.673   7.053   1.602
   32    HB2  TYR   5           HB2      TYR   5  -3.929   8.875   2.261
   33    HB3  TYR   5           HB3      TYR   5  -2.815   8.401   3.546
   34    HD1  TYR   5           HD1      TYR   5  -3.124  10.165   0.322
   35    HD2  TYR   5           HD2      TYR   5  -0.611   9.256   3.613
   36    HE1  TYR   5           HE1      TYR   5  -1.520  11.850  -0.443
   37    HE2  TYR   5           HE2      TYR   5   0.991  10.932   2.875
   38    HH   TYR   5           HH       TYR   5   0.274  13.218   0.454
   39    H    GLY   6           H        GLY   6  -3.842   5.134   0.940
   40    HA2  GLY   6           HA2      GLY   6  -4.229   4.017   3.607
   41    HA3  GLY   6           HA3      GLY   6  -5.039   3.561   2.122
   42    H    GLN   7           H        GLN   7  -3.814   1.671   3.777
   43    HA   GLN   7           HA       GLN   7  -1.186   1.061   2.804
   44    HB2  GLN   7           HB2      GLN   7  -2.125   0.485   5.084
   45    HB3  GLN   7           HB3      GLN   7  -3.082  -0.756   4.288
   46    HG2  GLN   7           HG2      GLN   7  -1.069  -1.891   3.585
   47    HG3  GLN   7           HG3      GLN   7  -0.062  -0.629   4.291
   48   HE21  GLN   7          HE21      GLN   7   0.083  -3.356   4.997
   49   HE22  GLN   7          HE22      GLN   7  -0.418  -3.502   6.628
   50    H    CYS   8           H        CYS   8  -0.699  -0.122   1.034
   51    HA   CYS   8           HA       CYS   8  -2.994  -1.246  -0.444
   52    HB2  CYS   8           HB2      CYS   8  -1.694  -0.879  -2.452
   53    HB3  CYS   8           HB3      CYS   8  -1.986   0.600  -1.545
   54    H    GLY   9           H        GLY   9  -0.508  -2.485   1.332
   55    HA2  GLY   9           HA2      GLY   9  -0.763  -5.080   0.818
   56    HA3  GLY   9           HA3      GLY   9  -0.056  -4.557  -0.689
   57    H    GLY  10           H        GLY  10   0.504  -4.411   2.758
   58    HA2  GLY  10           HA2      GLY  10   3.349  -4.782   2.193
   59    HA3  GLY  10           HA3      GLY  10   2.662  -4.321   3.758
   60    H    ILE  11           H        ILE  11   4.356  -6.444   3.730
   61    HA   ILE  11           HA       ILE  11   3.173  -8.959   3.347
   62    HB   ILE  11           HB       ILE  11   5.168  -8.215   5.521
   63   HG12  ILE  11          HG12      ILE  11   5.727  -9.265   2.739
   64   HG13  ILE  11          HG13      ILE  11   5.898  -7.579   3.216
   65   HG21  ILE  11          HG21      ILE  11   4.141 -10.403   5.889
   66   HG22  ILE  11          HG22      ILE  11   5.836 -10.580   5.432
   67   HG23  ILE  11          HG23      ILE  11   4.569 -10.894   4.248
   68   HD11  ILE  11          HD11      ILE  11   7.626  -8.200   4.816
   69   HD12  ILE  11          HD12      ILE  11   8.048  -8.725   3.187
   70   HD13  ILE  11          HD13      ILE  11   7.439  -9.893   4.366
   71    H    GLY  12           H        GLY  12   1.485  -9.869   4.322
   72    HA2  GLY  12           HA2      GLY  12   0.377 -10.607   6.316
   73    HA3  GLY  12           HA3      GLY  12   0.854  -9.100   7.090
   74    H    TYR  13           H        TYR  13   0.099  -7.615   4.610
   75    HA   TYR  13           HA       TYR  13  -2.671  -7.266   5.367
   76    HB2  TYR  13           HB2      TYR  13  -1.193  -5.298   5.067
   77    HB3  TYR  13           HB3      TYR  13  -0.973  -5.733   3.382
   78    HD1  TYR  13           HD1      TYR  13  -2.316  -4.687   1.803
   79    HD2  TYR  13           HD2      TYR  13  -3.700  -4.899   5.802
   80    HE1  TYR  13           HE1      TYR  13  -4.227  -3.256   1.201
   81    HE2  TYR  13           HE2      TYR  13  -5.629  -3.460   5.202
   82    HH   TYR  13           HH       TYR  13  -6.213  -2.545   1.863
   83    H    SER  14           H        SER  14  -4.161  -8.406   4.441
   84    HA   SER  14           HA       SER  14  -3.788  -9.319   1.677
   85    HB2  SER  14           HB2      SER  14  -5.387 -10.577   3.920
   86    HB3  SER  14           HB3      SER  14  -5.155 -11.247   2.303
   87    HG   SER  14           HG       SER  14  -2.889 -11.216   2.757
   88    H    GLY  15           H        GLY  15  -5.041  -6.867   2.988
   89    HA2  GLY  15           HA2      GLY  15  -7.844  -7.027   2.275
   90    HA3  GLY  15           HA3      GLY  15  -6.972  -5.609   2.831
   91    HA   PRO  16           HA       PRO  16  -7.832  -4.831  -1.662
   92    HB2  PRO  16           HB2      PRO  16  -7.763  -2.098  -0.467
   93    HB3  PRO  16           HB3      PRO  16  -8.901  -2.770  -1.641
   94    HG2  PRO  16           HG2      PRO  16  -9.657  -2.439   0.876
   95    HG3  PRO  16           HG3      PRO  16 -10.111  -3.912   0.000
   96    HD2  PRO  16           HD2      PRO  16  -7.936  -3.528   2.033
   97    HD3  PRO  16           HD3      PRO  16  -9.077  -4.868   1.857
   98    H    THR  17           H        THR  17  -5.958  -5.060  -2.727
   99    HA   THR  17           HA       THR  17  -3.595  -3.549  -1.855
  100    HB   THR  17           HB       THR  17  -2.424  -5.362  -3.229
  101    HG1  THR  17           HG1      THR  17  -3.840  -6.522  -4.281
  102   HG21  THR  17          HG21      THR  17  -3.940  -6.173  -0.736
  103   HG22  THR  17          HG22      THR  17  -2.411  -5.298  -0.768
  104   HG23  THR  17          HG23      THR  17  -2.486  -6.961  -1.358
  105    H    VAL  18           H        VAL  18  -5.941  -3.348  -4.101
  106    HA   VAL  18           HA       VAL  18  -4.095  -2.451  -6.205
  107    HB   VAL  18           HB       VAL  18  -7.064  -3.047  -6.471
  108   HG11  VAL  18          HG11      VAL  18  -6.662  -2.929  -8.887
  109   HG12  VAL  18          HG12      VAL  18  -4.981  -2.498  -8.586
  110   HG13  VAL  18          HG13      VAL  18  -6.270  -1.404  -8.092
  111   HG21  VAL  18          HG21      VAL  18  -6.398  -5.081  -7.662
  112   HG22  VAL  18          HG22      VAL  18  -5.795  -5.088  -6.007
  113   HG23  VAL  18          HG23      VAL  18  -4.702  -4.719  -7.340
  114    H    CYS  19           H        CYS  19  -3.724  -0.357  -6.057
  115    HA   CYS  19           HA       CYS  19  -5.311   1.404  -4.542
  116    HB2  CYS  19           HB2      CYS  19  -3.076   1.943  -6.487
  117    HB3  CYS  19           HB3      CYS  19  -3.743   3.089  -5.336
  118    H    ALA  20           H        ALA  20  -6.284   3.337  -5.254
  119    HA   ALA  20           HA       ALA  20  -8.111   3.087  -7.378
  120    HB1  ALA  20           HB1      ALA  20  -8.531   4.445  -5.384
  121    HB2  ALA  20           HB2      ALA  20  -8.689   5.412  -6.852
  122    HB3  ALA  20           HB3      ALA  20  -7.240   5.545  -5.857
  123    H    SER  21           H        SER  21  -8.295   4.576  -9.211
  124    HA   SER  21           HA       SER  21  -5.989   4.478 -10.793
  125    HB2  SER  21           HB2      SER  21  -8.540   6.041 -11.227
  126    HB3  SER  21           HB3      SER  21  -7.367   5.577 -12.465
  127    HG   SER  21           HG       SER  21  -8.015   3.383 -11.161
  128    H    GLY  22           H        GLY  22  -4.306   5.755 -10.728
  129    HA2  GLY  22           HA2      GLY  22  -3.423   7.981 -11.055
  130    HA3  GLY  22           HA3      GLY  22  -4.674   8.570  -9.968
  131    H    THR  23           H        THR  23  -4.036   5.949  -8.375
  132    HA   THR  23           HA       THR  23  -1.784   7.172  -6.961
  133    HB   THR  23           HB       THR  23  -2.518   5.926  -4.968
  134    HG1  THR  23           HG1      THR  23  -4.449   4.948  -6.782
  135   HG21  THR  23          HG21      THR  23  -4.550   7.225  -4.502
  136   HG22  THR  23          HG22      THR  23  -4.670   7.611  -6.218
  137   HG23  THR  23          HG23      THR  23  -3.296   8.195  -5.274
  138    H    THR  24           H        THR  24  -0.063   5.945  -6.343
  139    HA   THR  24           HA       THR  24   0.129   3.345  -7.679
  140    HB   THR  24           HB       THR  24   2.654   3.758  -7.493
  141    HG1  THR  24           HG1      THR  24   1.687   6.185  -6.484
  142   HG21  THR  24          HG21      THR  24   0.997   5.566  -9.246
  143   HG22  THR  24          HG22      THR  24   1.488   3.909  -9.608
  144   HG23  THR  24          HG23      THR  24   2.698   5.184  -9.500
  145    H    CYS  25           H        CYS  25   0.657   1.568  -6.503
  146    HA   CYS  25           HA       CYS  25   0.619   1.811  -3.654
  147    HB2  CYS  25           HB2      CYS  25  -0.439  -0.136  -4.666
  148    HB3  CYS  25           HB3      CYS  25   1.066  -0.642  -5.409
  149    H    GLN  26           H        GLN  26   2.329   2.740  -2.802
  150    HA   GLN  26           HA       GLN  26   4.932   1.976  -3.812
  151    HB2  GLN  26           HB2      GLN  26   4.052   4.303  -2.128
  152    HB3  GLN  26           HB3      GLN  26   5.725   3.991  -2.561
  153    HG2  GLN  26           HG2      GLN  26   5.088   4.142  -4.953
  154    HG3  GLN  26           HG3      GLN  26   3.445   4.532  -4.461
  155   HE21  GLN  26          HE21      GLN  26   3.474   6.478  -5.471
  156   HE22  GLN  26          HE22      GLN  26   4.379   7.830  -4.886
  157    H    VAL  27           H        VAL  27   5.817   0.388  -2.853
  158    HA   VAL  27           HA       VAL  27   5.248  -0.366  -0.168
  159    HB   VAL  27           HB       VAL  27   7.511  -1.266  -1.992
  160   HG11  VAL  27          HG11      VAL  27   7.642  -3.243  -0.549
  161   HG12  VAL  27          HG12      VAL  27   6.393  -2.560   0.491
  162   HG13  VAL  27          HG13      VAL  27   7.956  -1.761   0.361
  163   HG21  VAL  27          HG21      VAL  27   5.341  -1.731  -3.000
  164   HG22  VAL  27          HG22      VAL  27   4.802  -2.509  -1.516
  165   HG23  VAL  27          HG23      VAL  27   6.104  -3.230  -2.466
  166    H    LEU  28           H        LEU  28   5.807   1.047   1.281
  167    HA   LEU  28           HA       LEU  28   8.179   2.685   1.031
  168    HB2  LEU  28           HB2      LEU  28   6.060   2.542   3.176
  169    HB3  LEU  28           HB3      LEU  28   7.340   3.740   3.105
  170    HG   LEU  28           HG       LEU  28   5.167   3.426   1.020
  171   HD11  LEU  28          HD11      LEU  28   4.251   4.219   3.115
  172   HD12  LEU  28          HD12      LEU  28   4.291   5.509   1.910
  173   HD13  LEU  28          HD13      LEU  28   5.491   5.475   3.203
  174   HD21  LEU  28          HD21      LEU  28   7.265   5.507   1.447
  175   HD22  LEU  28          HD22      LEU  28   5.971   5.588   0.245
  176   HD23  LEU  28          HD23      LEU  28   7.223   4.339   0.118
  177    H    ASN  29           H        ASN  29   6.925   0.086   2.981
  178    HA   ASN  29           HA       ASN  29   9.590  -0.512   3.981
  179    HB2  ASN  29           HB2      ASN  29   7.078  -0.377   5.700
  180    HB3  ASN  29           HB3      ASN  29   8.647  -0.948   6.226
  181   HD21  ASN  29          HD21      ASN  29   6.725   1.837   5.490
  182   HD22  ASN  29          HD22      ASN  29   7.796   3.010   6.134
  183    HA   PRO  30           HA       PRO  30   8.362  -4.646   2.890
  184    HB2  PRO  30           HB2      PRO  30   8.661  -5.553   5.714
  185    HB3  PRO  30           HB3      PRO  30   9.370  -6.219   4.241
  186    HG2  PRO  30           HG2      PRO  30  10.864  -4.786   5.892
  187    HG3  PRO  30           HG3      PRO  30  11.016  -4.575   4.137
  188    HD2  PRO  30           HD2      PRO  30   9.626  -2.844   6.139
  189    HD3  PRO  30           HD3      PRO  30  10.610  -2.374   4.737
  190    H    TYR  31           H        TYR  31   6.851  -3.544   5.924
  191    HA   TYR  31           HA       TYR  31   4.525  -5.209   5.235
  192    HB2  TYR  31           HB2      TYR  31   5.118  -3.896   7.909
  193    HB3  TYR  31           HB3      TYR  31   3.875  -5.085   7.556
  194    HD1  TYR  31           HD1      TYR  31   4.410  -7.425   7.325
  195    HD2  TYR  31           HD2      TYR  31   7.487  -4.589   8.066
  196    HE1  TYR  31           HE1      TYR  31   5.982  -9.251   7.817
  197    HE2  TYR  31           HE2      TYR  31   9.054  -6.390   8.556
  198    HH   TYR  31           HH       TYR  31   8.429  -9.584   7.742
  199    H    TYR  32           H        TYR  32   5.630  -1.979   5.682
  200    HA   TYR  32           HA       TYR  32   2.912  -1.006   5.439
  201    HB2  TYR  32           HB2      TYR  32   4.398   0.015   7.132
  202    HB3  TYR  32           HB3      TYR  32   5.403   0.617   5.823
  203    HD1  TYR  32           HD1      TYR  32   1.774   0.551   6.646
  204    HD2  TYR  32           HD2      TYR  32   5.103   2.826   5.251
  205    HE1  TYR  32           HE1      TYR  32   0.354   2.535   6.485
  206    HE2  TYR  32           HE2      TYR  32   3.714   4.789   5.095
  207    HH   TYR  32           HH       TYR  32   0.647   4.940   6.524
  208    H    SER  33           H        SER  33   2.107  -0.743   3.500
  209    HA   SER  33           HA       SER  33   3.775   0.491   1.425
  210    HB2  SER  33           HB2      SER  33   1.682  -1.669   0.979
  211    HB3  SER  33           HB3      SER  33   2.703  -0.933  -0.256
  212    HG   SER  33           HG       SER  33   3.409  -3.043   0.576
  213    H    GLN  34           H        GLN  34   2.646   2.139   0.312
  214    HA   GLN  34           HA       GLN  34  -0.102   2.598   1.204
  215    HB2  GLN  34           HB2      GLN  34   1.142   3.886   2.749
  216    HB3  GLN  34           HB3      GLN  34   2.237   4.464   1.510
  217    HG2  GLN  34           HG2      GLN  34   0.520   5.885   0.598
  218    HG3  GLN  34           HG3      GLN  34  -0.667   5.198   1.702
  219   HE21  GLN  34          HE21      GLN  34  -0.807   5.962   3.751
  220   HE22  GLN  34          HE22      GLN  34   0.162   7.233   4.369
  221    H    CYS  35           H        CYS  35  -1.446   3.436  -0.277
  222    HA   CYS  35           HA       CYS  35  -0.570   3.711  -3.003
  223    HB2  CYS  35           HB2      CYS  35  -3.241   4.448  -1.794
  224    HB3  CYS  35           HB3      CYS  35  -2.864   4.346  -3.507
  225    H    LEU  36           H        LEU  36   0.496   5.405  -3.621
  226    HA   LEU  36           HA       LEU  36  -0.341   8.033  -2.677
  227    HB2  LEU  36           HB2      LEU  36   2.432   7.046  -3.331
  228    HB3  LEU  36           HB3      LEU  36   2.026   8.731  -3.081
  229    HG   LEU  36           HG       LEU  36   1.714   6.566  -1.006
  230   HD11  LEU  36          HD11      LEU  36   4.064   7.006  -1.484
  231   HD12  LEU  36          HD12      LEU  36   3.605   7.628   0.103
  232   HD13  LEU  36          HD13      LEU  36   3.789   8.734  -1.257
  233   HD21  LEU  36          HD21      LEU  36   1.408   9.559  -0.847
  234   HD22  LEU  36          HD22      LEU  36   1.350   8.447   0.520
  235   HD23  LEU  36          HD23      LEU  36   0.113   8.367  -0.725
  236    H1   MAN 101           H1       MAN 101  -9.000   6.202   2.213
  237    H2   MAN 101           H2       MAN 101  -6.864   5.771   3.374
  238    H3   MAN 101           H3       MAN 101  -6.786   3.384   2.818
  239    H4   MAN 101           H4       MAN 101  -8.949   3.158   4.911
  240    H5   MAN 101           H5       MAN 101  -8.998   2.452   1.937
  241    H61  MAN 101           H61      MAN 101 -10.501   1.183   3.484
  242    H62  MAN 101           H62      MAN 101 -11.372   2.127   2.260
  243    HO2  MAN 101           HO2      MAN 101  -9.240   5.022   4.800
  244    HO3  MAN 101           HO3      MAN 101  -6.839   3.980   5.603
  245    HO4  MAN 101           HO4      MAN 101  -7.338   1.520   4.881
  246    HO6  MAN 101           HO6      MAN 101 -11.657   3.771   3.796
  Start of MODEL   10
    1    H1   THR   1           H1       THR   1 -11.926  -0.275  -4.160
    2    H2   THR   1           H2       THR   1 -11.298  -1.872  -4.021
    3    H3   THR   1           H3       THR   1 -11.753  -1.206  -5.528
    4    HA   THR   1           HA       THR   1  -9.347  -1.203  -5.189
    5    HB   THR   1           HB       THR   1 -10.325   1.557  -5.515
    6    HG1  THR   1           HG1      THR   1 -11.220   0.424  -7.671
    7   HG21  THR   1          HG21      THR   1  -8.874  -0.412  -7.293
    8   HG22  THR   1          HG22      THR   1  -8.123   0.849  -6.315
    9   HG23  THR   1          HG23      THR   1  -9.158   1.280  -7.680
   10    H    GLN   2           H        GLN   2  -7.625  -0.143  -4.059
   11    HA   GLN   2           HA       GLN   2  -8.304   0.507  -1.359
   12    HB2  GLN   2           HB2      GLN   2  -6.331  -0.882  -1.914
   13    HB3  GLN   2           HB3      GLN   2  -5.640   0.486  -2.772
   14    HG2  GLN   2           HG2      GLN   2  -4.693   0.180  -0.500
   15    HG3  GLN   2           HG3      GLN   2  -5.465   1.744  -0.747
   16   HE21  GLN   2          HE21      GLN   2  -6.050   2.167   1.207
   17   HE22  GLN   2          HE22      GLN   2  -7.174   1.254   2.176
   18    H    SER   3           H        SER   3  -8.002   2.490  -0.296
   19    HA   SER   3           HA       SER   3  -8.438   4.739  -1.978
   20    HB2  SER   3           HB2      SER   3  -8.834   5.917   0.120
   21    HB3  SER   3           HB3      SER   3  -9.747   4.408   0.067
   22    H    HIS   4           H        HIS   4  -7.378   6.722  -1.454
   23    HA   HIS   4           HA       HIS   4  -4.534   6.594  -1.940
   24    HB2  HIS   4           HB2      HIS   4  -6.251   8.358  -2.812
   25    HB3  HIS   4           HB3      HIS   4  -6.079   9.102  -1.239
   26    HD1  HIS   4           HD1      HIS   4  -5.298  11.018  -3.203
   27    HD2  HIS   4           HD2      HIS   4  -2.612   8.053  -2.125
   28    HE1  HIS   4           HE1      HIS   4  -3.071  11.801  -4.019
   29    HE2  HIS   4           HE2      HIS   4  -1.644   9.770  -3.761
   30    H    TYR   5           H        TYR   5  -2.885   6.920  -0.469
   31    HA   TYR   5           HA       TYR   5  -1.789   7.117   1.405
   32    HB2  TYR   5           HB2      TYR   5  -4.207   8.627   2.317
   33    HB3  TYR   5           HB3      TYR   5  -2.890   8.284   3.438
   34    HD1  TYR   5           HD1      TYR   5  -0.891   9.531   3.374
   35    HD2  TYR   5           HD2      TYR   5  -3.751  10.002   0.272
   36    HE1  TYR   5           HE1      TYR   5   0.355  11.463   2.531
   37    HE2  TYR   5           HE2      TYR   5  -2.518  11.934  -0.582
   38    HH   TYR   5           HH       TYR   5  -0.956  13.615   0.283
   39    H    GLY   6           H        GLY   6  -4.147   5.131   0.898
   40    HA2  GLY   6           HA2      GLY   6  -4.283   3.920   3.519
   41    HA3  GLY   6           HA3      GLY   6  -5.066   3.367   2.052
   42    H    GLN   7           H        GLN   7  -3.728   1.605   3.693
   43    HA   GLN   7           HA       GLN   7  -1.063   1.218   2.700
   44    HB2  GLN   7           HB2      GLN   7  -1.763   0.692   5.049
   45    HB3  GLN   7           HB3      GLN   7  -2.789  -0.590   4.406
   46    HG2  GLN   7           HG2      GLN   7  -0.837  -1.772   3.605
   47    HG3  GLN   7           HG3      GLN   7   0.204  -0.459   4.156
   48   HE21  GLN   7          HE21      GLN   7   0.312  -3.196   4.969
   49   HE22  GLN   7          HE22      GLN   7  -0.017  -3.262   6.652
   50    H    CYS   8           H        CYS   8  -0.635   0.184   0.863
   51    HA   CYS   8           HA       CYS   8  -2.871  -1.155  -0.474
   52    HB2  CYS   8           HB2      CYS   8  -1.531  -0.912  -2.516
   53    HB3  CYS   8           HB3      CYS   8  -1.932   0.613  -1.741
   54    H    GLY   9           H        GLY   9  -0.763  -2.381   1.474
   55    HA2  GLY   9           HA2      GLY   9  -0.913  -4.900   1.273
   56    HA3  GLY   9           HA3      GLY   9  -0.318  -4.656  -0.355
   57    H    GLY  10           H        GLY  10   0.441  -4.528   2.996
   58    HA2  GLY  10           HA2      GLY  10   3.276  -4.781   2.310
   59    HA3  GLY  10           HA3      GLY  10   2.634  -4.461   3.930
   60    H    ILE  11           H        ILE  11   4.312  -6.502   3.914
   61    HA   ILE  11           HA       ILE  11   3.138  -9.007   3.382
   62    HB   ILE  11           HB       ILE  11   5.204  -8.284   5.495
   63   HG12  ILE  11          HG12      ILE  11   5.579  -9.437   2.719
   64   HG13  ILE  11          HG13      ILE  11   5.888  -7.766   3.178
   65   HG21  ILE  11          HG21      ILE  11   5.801 -10.679   5.469
   66   HG22  ILE  11          HG22      ILE  11   4.424 -10.991   4.405
   67   HG23  ILE  11          HG23      ILE  11   4.157 -10.395   6.041
   68   HD11  ILE  11          HD11      ILE  11   7.653  -8.508   4.690
   69   HD12  ILE  11          HD12      ILE  11   7.949  -9.056   3.041
   70   HD13  ILE  11          HD13      ILE  11   7.329 -10.184   4.248
   71    H    GLY  12           H        GLY  12   1.296  -9.708   4.219
   72    HA2  GLY  12           HA2      GLY  12   0.238 -10.645   6.183
   73    HA3  GLY  12           HA3      GLY  12   0.778  -9.231   7.074
   74    H    TYR  13           H        TYR  13  -0.031  -7.799   4.396
   75    HA   TYR  13           HA       TYR  13  -2.673  -7.122   5.433
   76    HB2  TYR  13           HB2      TYR  13  -1.078  -5.319   4.808
   77    HB3  TYR  13           HB3      TYR  13  -1.091  -5.901   3.154
   78    HD1  TYR  13           HD1      TYR  13  -3.156  -4.291   5.775
   79    HD2  TYR  13           HD2      TYR  13  -2.820  -5.198   1.629
   80    HE1  TYR  13           HE1      TYR  13  -4.991  -2.724   5.277
   81    HE2  TYR  13           HE2      TYR  13  -4.643  -3.652   1.131
   82    HH   TYR  13           HH       TYR  13  -6.285  -2.403   2.010
   83    H    SER  14           H        SER  14  -4.335  -8.277   4.752
   84    HA   SER  14           HA       SER  14  -4.168  -9.715   2.221
   85    HB2  SER  14           HB2      SER  14  -6.099  -9.965   4.523
   86    HB3  SER  14           HB3      SER  14  -6.010 -11.037   3.121
   87    HG   SER  14           HG       SER  14  -3.594 -10.917   4.062
   88    H    GLY  15           H        GLY  15  -5.354  -6.848   3.309
   89    HA2  GLY  15           HA2      GLY  15  -7.942  -6.815   2.082
   90    HA3  GLY  15           HA3      GLY  15  -7.072  -5.436   2.722
   91    HA   PRO  16           HA       PRO  16  -7.472  -4.993  -1.869
   92    HB2  PRO  16           HB2      PRO  16  -7.733  -2.165  -0.979
   93    HB3  PRO  16           HB3      PRO  16  -8.702  -3.059  -2.159
   94    HG2  PRO  16           HG2      PRO  16  -9.683  -2.525   0.240
   95    HG3  PRO  16           HG3      PRO  16  -9.954  -4.112  -0.508
   96    HD2  PRO  16           HD2      PRO  16  -7.982  -3.343   1.619
   97    HD3  PRO  16           HD3      PRO  16  -9.033  -4.768   1.519
   98    H    THR  17           H        THR  17  -5.651  -4.911  -2.961
   99    HA   THR  17           HA       THR  17  -3.376  -3.394  -1.905
  100    HB   THR  17           HB       THR  17  -2.083  -4.930  -3.456
  101    HG1  THR  17           HG1      THR  17  -3.393  -5.940  -4.771
  102   HG21  THR  17          HG21      THR  17  -3.679  -6.228  -1.229
  103   HG22  THR  17          HG22      THR  17  -2.205  -5.293  -1.014
  104   HG23  THR  17          HG23      THR  17  -2.153  -6.823  -1.889
  105    H    VAL  18           H        VAL  18  -5.658  -3.497  -4.352
  106    HA   VAL  18           HA       VAL  18  -3.990  -2.267  -6.397
  107    HB   VAL  18           HB       VAL  18  -6.992  -2.753  -6.461
  108   HG11  VAL  18          HG11      VAL  18  -5.063  -2.131  -8.694
  109   HG12  VAL  18          HG12      VAL  18  -6.290  -1.049  -8.039
  110   HG13  VAL  18          HG13      VAL  18  -6.772  -2.514  -8.893
  111   HG21  VAL  18          HG21      VAL  18  -4.784  -4.445  -7.639
  112   HG22  VAL  18          HG22      VAL  18  -6.514  -4.730  -7.827
  113   HG23  VAL  18          HG23      VAL  18  -5.760  -4.874  -6.238
  114    H    CYS  19           H        CYS  19  -3.541  -0.193  -6.064
  115    HA   CYS  19           HA       CYS  19  -5.121   1.528  -4.496
  116    HB2  CYS  19           HB2      CYS  19  -2.906   2.075  -6.453
  117    HB3  CYS  19           HB3      CYS  19  -3.595   3.256  -5.349
  118    H    ALA  20           H        ALA  20  -6.462   3.177  -5.065
  119    HA   ALA  20           HA       ALA  20  -8.066   2.985  -7.315
  120    HB1  ALA  20           HB1      ALA  20  -7.469   5.439  -5.658
  121    HB2  ALA  20           HB2      ALA  20  -8.697   4.226  -5.297
  122    HB3  ALA  20           HB3      ALA  20  -8.849   5.233  -6.738
  123    H    SER  21           H        SER  21  -7.921   3.695  -9.303
  124    HA   SER  21           HA       SER  21  -5.572   4.214 -10.570
  125    HB2  SER  21           HB2      SER  21  -8.316   5.167 -11.401
  126    HB3  SER  21           HB3      SER  21  -6.934   4.915 -12.477
  127    HG   SER  21           HG       SER  21  -6.915   2.728 -11.661
  128    H    GLY  22           H        GLY  22  -4.259   5.849 -10.868
  129    HA2  GLY  22           HA2      GLY  22  -3.812   8.187 -11.119
  130    HA3  GLY  22           HA3      GLY  22  -5.081   8.504  -9.938
  131    H    THR  23           H        THR  23  -4.010   6.051  -8.405
  132    HA   THR  23           HA       THR  23  -1.770   7.496  -7.193
  133    HB   THR  23           HB       THR  23  -2.360   6.468  -5.029
  134    HG1  THR  23           HG1      THR  23  -4.495   5.292  -6.510
  135   HG21  THR  23          HG21      THR  23  -4.495   7.613  -4.639
  136   HG22  THR  23          HG22      THR  23  -4.710   7.774  -6.385
  137   HG23  THR  23          HG23      THR  23  -3.381   8.602  -5.581
  138    H    THR  24           H        THR  24  -0.037   6.220  -6.338
  139    HA   THR  24           HA       THR  24   0.195   3.671  -7.748
  140    HB   THR  24           HB       THR  24   2.684   4.108  -7.619
  141    HG1  THR  24           HG1      THR  24   1.731   6.421  -6.393
  142   HG21  THR  24          HG21      THR  24   1.445   4.451  -9.691
  143   HG22  THR  24          HG22      THR  24   2.688   5.692  -9.506
  144   HG23  THR  24          HG23      THR  24   1.001   6.076  -9.167
  145    H    CYS  25           H        CYS  25   0.859   1.891  -6.616
  146    HA   CYS  25           HA       CYS  25   0.791   2.106  -3.743
  147    HB2  CYS  25           HB2      CYS  25  -0.375   0.250  -4.711
  148    HB3  CYS  25           HB3      CYS  25   1.058  -0.307  -5.567
  149    H    GLN  26           H        GLN  26   2.533   2.722  -2.763
  150    HA   GLN  26           HA       GLN  26   5.101   1.930  -3.883
  151    HB2  GLN  26           HB2      GLN  26   4.356   4.229  -2.081
  152    HB3  GLN  26           HB3      GLN  26   5.989   3.870  -2.627
  153    HG2  GLN  26           HG2      GLN  26   5.348   4.241  -4.927
  154    HG3  GLN  26           HG3      GLN  26   3.670   4.466  -4.450
  155   HE21  GLN  26          HE21      GLN  26   3.564   6.454  -5.342
  156   HE22  GLN  26          HE22      GLN  26   4.335   7.842  -4.660
  157    H    VAL  27           H        VAL  27   5.947   0.280  -2.900
  158    HA   VAL  27           HA       VAL  27   5.246  -0.444  -0.213
  159    HB   VAL  27           HB       VAL  27   7.406  -1.609  -2.022
  160   HG11  VAL  27          HG11      VAL  27   7.328  -3.571  -0.545
  161   HG12  VAL  27          HG12      VAL  27   6.154  -2.753   0.481
  162   HG13  VAL  27          HG13      VAL  27   7.789  -2.121   0.349
  163   HG21  VAL  27          HG21      VAL  27   4.588  -2.571  -1.519
  164   HG22  VAL  27          HG22      VAL  27   5.801  -3.407  -2.488
  165   HG23  VAL  27          HG23      VAL  27   5.181  -1.839  -3.009
  166    H    LEU  28           H        LEU  28   5.909   0.963   1.183
  167    HA   LEU  28           HA       LEU  28   8.367   2.442   0.934
  168    HB2  LEU  28           HB2      LEU  28   6.293   2.391   3.125
  169    HB3  LEU  28           HB3      LEU  28   7.585   3.564   2.975
  170    HG   LEU  28           HG       LEU  28   5.357   3.223   0.956
  171   HD11  LEU  28          HD11      LEU  28   4.502   5.337   1.820
  172   HD12  LEU  28          HD12      LEU  28   5.725   5.318   3.093
  173   HD13  LEU  28          HD13      LEU  28   4.468   4.076   3.047
  174   HD21  LEU  28          HD21      LEU  28   7.392   4.100  -0.009
  175   HD22  LEU  28          HD22      LEU  28   7.482   5.289   1.298
  176   HD23  LEU  28          HD23      LEU  28   6.165   5.373   0.122
  177    H    ASN  29           H        ASN  29   7.066  -0.140   2.882
  178    HA   ASN  29           HA       ASN  29   9.705  -0.793   3.922
  179    HB2  ASN  29           HB2      ASN  29   7.202  -0.500   5.629
  180    HB3  ASN  29           HB3      ASN  29   8.744  -1.109   6.197
  181   HD21  ASN  29          HD21      ASN  29   6.924   1.664   5.309
  182   HD22  ASN  29          HD22      ASN  29   7.990   2.853   5.938
  183    HA   PRO  30           HA       PRO  30   8.283  -4.891   2.982
  184    HB2  PRO  30           HB2      PRO  30   8.427  -5.758   5.810
  185    HB3  PRO  30           HB3      PRO  30   9.188  -6.470   4.384
  186    HG2  PRO  30           HG2      PRO  30  10.632  -5.073   6.127
  187    HG3  PRO  30           HG3      PRO  30  10.930  -4.934   4.386
  188    HD2  PRO  30           HD2      PRO  30   9.523  -3.053   6.226
  189    HD3  PRO  30           HD3      PRO  30  10.594  -2.700   4.852
  190    H    TYR  31           H        TYR  31   6.775  -3.593   5.931
  191    HA   TYR  31           HA       TYR  31   4.383  -5.175   5.257
  192    HB2  TYR  31           HB2      TYR  31   4.948  -3.797   7.893
  193    HB3  TYR  31           HB3      TYR  31   3.717  -4.995   7.549
  194    HD1  TYR  31           HD1      TYR  31   4.272  -7.356   7.455
  195    HD2  TYR  31           HD2      TYR  31   7.298  -4.462   8.151
  196    HE1  TYR  31           HE1      TYR  31   5.823  -9.141   8.137
  197    HE2  TYR  31           HE2      TYR  31   8.846  -6.223   8.827
  198    HH   TYR  31           HH       TYR  31   8.749  -8.455   9.696
  199    H    TYR  32           H        TYR  32   5.624  -1.977   5.669
  200    HA   TYR  32           HA       TYR  32   2.964  -0.870   5.392
  201    HB2  TYR  32           HB2      TYR  32   4.445   0.056   7.121
  202    HB3  TYR  32           HB3      TYR  32   5.543   0.601   5.858
  203    HD1  TYR  32           HD1      TYR  32   5.387   2.840   5.272
  204    HD2  TYR  32           HD2      TYR  32   1.904   0.782   6.624
  205    HE1  TYR  32           HE1      TYR  32   4.122   4.906   5.130
  206    HE2  TYR  32           HE2      TYR  32   0.619   2.853   6.471
  207    HH   TYR  32           HH       TYR  32   1.329   5.378   6.653
  208    H    SER  33           H        SER  33   2.173  -0.512   3.476
  209    HA   SER  33           HA       SER  33   3.895   0.599   1.390
  210    HB2  SER  33           HB2      SER  33   1.706  -1.472   0.978
  211    HB3  SER  33           HB3      SER  33   2.764  -0.804  -0.265
  212    HG   SER  33           HG       SER  33   3.325  -2.953   0.650
  213    H    GLN  34           H        GLN  34   2.760   2.251   0.231
  214    HA   GLN  34           HA       GLN  34   0.033   2.745   1.156
  215    HB2  GLN  34           HB2      GLN  34   1.304   4.039   2.695
  216    HB3  GLN  34           HB3      GLN  34   2.350   4.648   1.427
  217    HG2  GLN  34           HG2      GLN  34   0.560   6.017   0.551
  218    HG3  GLN  34           HG3      GLN  34  -0.567   5.288   1.692
  219   HE21  GLN  34          HE21      GLN  34  -0.727   6.097   3.716
  220   HE22  GLN  34          HE22      GLN  34   0.238   7.394   4.305
  221    H    CYS  35           H        CYS  35  -1.309   3.610  -0.270
  222    HA   CYS  35           HA       CYS  35  -0.497   3.906  -3.013
  223    HB2  CYS  35           HB2      CYS  35  -3.124   4.595  -1.679
  224    HB3  CYS  35           HB3      CYS  35  -2.837   4.553  -3.412
  225    H    LEU  36           H        LEU  36   0.546   5.657  -3.630
  226    HA   LEU  36           HA       LEU  36  -0.364   8.254  -2.660
  227    HB2  LEU  36           HB2      LEU  36   2.451   7.356  -3.288
  228    HB3  LEU  36           HB3      LEU  36   1.991   9.036  -3.084
  229    HG   LEU  36           HG       LEU  36   1.748   6.919  -0.945
  230   HD11  LEU  36          HD11      LEU  36   3.609   8.066   0.123
  231   HD12  LEU  36          HD12      LEU  36   3.744   9.149  -1.262
  232   HD13  LEU  36          HD13      LEU  36   4.083   7.427  -1.453
  233   HD21  LEU  36          HD21      LEU  36   1.349   9.905  -0.882
  234   HD22  LEU  36          HD22      LEU  36   1.339   8.841   0.524
  235   HD23  LEU  36          HD23      LEU  36   0.092   8.676  -0.712
  236    H1   MAN 101           H1       MAN 101  -9.167   5.863   2.427
  237    H2   MAN 101           H2       MAN 101  -7.119   5.177   3.679
  238    H3   MAN 101           H3       MAN 101  -7.152   2.837   3.021
  239    H4   MAN 101           H4       MAN 101  -9.542   2.634   4.883
  240    H5   MAN 101           H5       MAN 101  -9.346   2.199   1.855
  241    H61  MAN 101           H61      MAN 101 -11.097   0.886   3.052
  242    H62  MAN 101           H62      MAN 101 -11.776   2.064   1.906
  243    HO2  MAN 101           HO2      MAN 101  -8.989   5.968   4.760
  244    HO3  MAN 101           HO3      MAN 101  -6.830   1.932   5.065
  245    HO4  MAN 101           HO4      MAN 101  -9.442   0.440   4.166
  246    HO6  MAN 101           HO6      MAN 101 -11.754   3.514   3.874
  Start of MODEL   11
    1    H1   THR   1           H1       THR   1 -10.936  -1.448  -5.640
    2    H2   THR   1           H2       THR   1 -11.373  -0.347  -4.453
    3    H3   THR   1           H3       THR   1 -10.626  -1.786  -3.997
    4    HA   THR   1           HA       THR   1  -8.619  -1.007  -5.148
    5    HB   THR   1           HB       THR   1  -8.761   1.561  -5.533
    6    HG1  THR   1           HG1      THR   1 -10.790   2.355  -5.939
    7   HG21  THR   1          HG21      THR   1  -8.327  -0.057  -7.329
    8   HG22  THR   1          HG22      THR   1  -9.408   1.215  -7.889
    9   HG23  THR   1          HG23      THR   1 -10.053  -0.371  -7.481
   10    H    GLN   2           H        GLN   2  -7.082  -0.044  -3.813
   11    HA   GLN   2           HA       GLN   2  -8.036   0.689  -1.183
   12    HB2  GLN   2           HB2      GLN   2  -6.103  -0.833  -1.386
   13    HB3  GLN   2           HB3      GLN   2  -5.210   0.416  -2.242
   14    HG2  GLN   2           HG2      GLN   2  -4.579   0.228   0.132
   15    HG3  GLN   2           HG3      GLN   2  -5.200   1.816  -0.307
   16   HE21  GLN   2          HE21      GLN   2  -5.867   2.356   1.581
   17   HE22  GLN   2          HE22      GLN   2  -7.146   1.622   2.523
   18    H    SER   3           H        SER   3  -7.662   2.669  -0.177
   19    HA   SER   3           HA       SER   3  -8.004   4.813  -1.998
   20    HB2  SER   3           HB2      SER   3  -8.551   6.094  -0.023
   21    HB3  SER   3           HB3      SER   3  -9.437   4.571  -0.041
   22    H    HIS   4           H        HIS   4  -7.073   6.854  -1.393
   23    HA   HIS   4           HA       HIS   4  -4.240   6.834  -1.825
   24    HB2  HIS   4           HB2      HIS   4  -5.919   8.437  -2.824
   25    HB3  HIS   4           HB3      HIS   4  -6.077   9.169  -1.246
   26    HD1  HIS   4           HD1      HIS   4  -5.333  11.371  -2.567
   27    HD2  HIS   4           HD2      HIS   4  -2.414   8.455  -2.193
   28    HE1  HIS   4           HE1      HIS   4  -3.186  12.505  -3.127
   29    HE2  HIS   4           HE2      HIS   4  -1.531  10.654  -3.232
   30    H    TYR   5           H        TYR   5  -2.690   7.020  -0.310
   31    HA   TYR   5           HA       TYR   5  -1.609   7.256   1.583
   32    HB2  TYR   5           HB2      TYR   5  -3.976   8.885   2.355
   33    HB3  TYR   5           HB3      TYR   5  -2.753   8.509   3.573
   34    HD1  TYR   5           HD1      TYR   5  -3.552  10.456   0.587
   35    HD2  TYR   5           HD2      TYR   5  -0.493   9.420   3.347
   36    HE1  TYR   5           HE1      TYR   5  -2.200  12.345  -0.205
   37    HE2  TYR   5           HE2      TYR   5   0.867  11.294   2.566
   38    HH   TYR   5           HH       TYR   5   1.088  12.684   0.630
   39    H    GLY   6           H        GLY   6  -3.917   5.286   1.071
   40    HA2  GLY   6           HA2      GLY   6  -4.116   4.185   3.756
   41    HA3  GLY   6           HA3      GLY   6  -5.003   3.680   2.336
   42    H    GLN   7           H        GLN   7  -3.650   1.844   4.008
   43    HA   GLN   7           HA       GLN   7  -1.120   1.153   2.836
   44    HB2  GLN   7           HB2      GLN   7  -1.818   0.703   5.244
   45    HB3  GLN   7           HB3      GLN   7  -2.851  -0.575   4.604
   46    HG2  GLN   7           HG2      GLN   7  -0.920  -1.746   3.744
   47    HG3  GLN   7           HG3      GLN   7   0.152  -0.464   4.294
   48   HE21  GLN   7          HE21      GLN   7   0.381  -3.180   5.072
   49   HE22  GLN   7          HE22      GLN   7   0.066  -3.269   6.748
   50    H    CYS   8           H        CYS   8  -0.868   0.038   1.019
   51    HA   CYS   8           HA       CYS   8  -3.233  -1.284  -0.161
   52    HB2  CYS   8           HB2      CYS   8  -1.994  -1.018  -2.276
   53    HB3  CYS   8           HB3      CYS   8  -2.451   0.489  -1.496
   54    H    GLY   9           H        GLY   9  -0.916  -2.467   1.602
   55    HA2  GLY   9           HA2      GLY   9  -1.122  -4.992   1.331
   56    HA3  GLY   9           HA3      GLY   9  -0.678  -4.680  -0.323
   57    H    GLY  10           H        GLY  10   0.491  -4.302   2.933
   58    HA2  GLY  10           HA2      GLY  10   3.207  -4.835   1.968
   59    HA3  GLY  10           HA3      GLY  10   2.764  -4.272   3.588
   60    H    ILE  11           H        ILE  11   4.320  -6.412   3.629
   61    HA   ILE  11           HA       ILE  11   3.038  -8.888   3.380
   62    HB   ILE  11           HB       ILE  11   5.256  -8.138   5.308
   63   HG12  ILE  11          HG12      ILE  11   5.428  -9.329   2.538
   64   HG13  ILE  11          HG13      ILE  11   5.704  -7.631   2.901
   65   HG21  ILE  11          HG21      ILE  11   4.204 -10.265   5.899
   66   HG22  ILE  11          HG22      ILE  11   5.820 -10.539   5.247
   67   HG23  ILE  11          HG23      ILE  11   4.400 -10.833   4.239
   68   HD11  ILE  11          HD11      ILE  11   7.793  -8.789   2.662
   69   HD12  ILE  11          HD12      ILE  11   7.309  -9.959   3.894
   70   HD13  ILE  11          HD13      ILE  11   7.576  -8.272   4.336
   71    H    GLY  12           H        GLY  12   1.274  -9.524   4.352
   72    HA2  GLY  12           HA2      GLY  12   0.340 -10.325   6.439
   73    HA3  GLY  12           HA3      GLY  12   0.864  -8.816   7.173
   74    H    TYR  13           H        TYR  13  -0.067  -7.709   4.357
   75    HA   TYR  13           HA       TYR  13  -2.731  -7.026   5.347
   76    HB2  TYR  13           HB2      TYR  13  -1.106  -5.246   4.589
   77    HB3  TYR  13           HB3      TYR  13  -1.209  -5.925   2.976
   78    HD1  TYR  13           HD1      TYR  13  -3.249  -5.534   1.597
   79    HD2  TYR  13           HD2      TYR  13  -2.900  -3.944   5.533
   80    HE1  TYR  13           HE1      TYR  13  -5.147  -4.035   1.163
   81    HE2  TYR  13           HE2      TYR  13  -4.830  -2.460   5.094
   82    HH   TYR  13           HH       TYR  13  -5.900  -1.456   2.974
   83    H    SER  14           H        SER  14  -4.596  -7.751   4.355
   84    HA   SER  14           HA       SER  14  -4.214  -9.440   1.980
   85    HB2  SER  14           HB2      SER  14  -5.878 -10.084   4.409
   86    HB3  SER  14           HB3      SER  14  -5.696 -11.096   2.972
   87    HG   SER  14           HG       SER  14  -3.376 -10.980   3.464
   88    H    GLY  15           H        GLY  15  -5.518  -6.695   2.743
   89    HA2  GLY  15           HA2      GLY  15  -8.220  -7.154   1.749
   90    HA3  GLY  15           HA3      GLY  15  -7.561  -5.635   2.333
   91    HA   PRO  16           HA       PRO  16  -7.617  -5.096  -2.162
   92    HB2  PRO  16           HB2      PRO  16  -7.847  -2.365  -2.073
   93    HB3  PRO  16           HB3      PRO  16  -9.221  -3.468  -2.032
   94    HG2  PRO  16           HG2      PRO  16  -7.952  -1.953   0.166
   95    HG3  PRO  16           HG3      PRO  16  -9.637  -2.440  -0.038
   96    HD2  PRO  16           HD2      PRO  16  -7.795  -3.680   1.630
   97    HD3  PRO  16           HD3      PRO  16  -9.295  -4.415   1.044
   98    H    THR  17           H        THR  17  -5.664  -5.341  -2.982
   99    HA   THR  17           HA       THR  17  -3.487  -3.764  -1.908
  100    HB   THR  17           HB       THR  17  -2.084  -5.546  -3.094
  101    HG1  THR  17           HG1      THR  17  -3.144  -6.982  -4.168
  102   HG21  THR  17          HG21      THR  17  -3.963  -6.425  -0.894
  103   HG22  THR  17          HG22      THR  17  -2.533  -5.441  -0.657
  104   HG23  THR  17          HG23      THR  17  -2.366  -7.105  -1.236
  105    H    VAL  18           H        VAL  18  -5.557  -3.588  -4.345
  106    HA   VAL  18           HA       VAL  18  -3.595  -2.426  -6.182
  107    HB   VAL  18           HB       VAL  18  -6.474  -3.245  -6.747
  108   HG11  VAL  18          HG11      VAL  18  -5.794  -1.328  -8.105
  109   HG12  VAL  18          HG12      VAL  18  -5.938  -2.775  -9.105
  110   HG13  VAL  18          HG13      VAL  18  -4.347  -2.195  -8.618
  111   HG21  VAL  18          HG21      VAL  18  -4.992  -5.168  -6.463
  112   HG22  VAL  18          HG22      VAL  18  -3.878  -4.492  -7.650
  113   HG23  VAL  18          HG23      VAL  18  -5.495  -4.997  -8.144
  114    H    CYS  19           H        CYS  19  -3.436  -0.305  -6.090
  115    HA   CYS  19           HA       CYS  19  -5.186   1.228  -4.496
  116    HB2  CYS  19           HB2      CYS  19  -2.927   1.999  -6.317
  117    HB3  CYS  19           HB3      CYS  19  -3.772   3.094  -5.231
  118    H    ALA  20           H        ALA  20  -6.248   3.128  -5.162
  119    HA   ALA  20           HA       ALA  20  -7.960   2.868  -7.360
  120    HB1  ALA  20           HB1      ALA  20  -8.500   4.201  -5.384
  121    HB2  ALA  20           HB2      ALA  20  -8.560   5.191  -6.849
  122    HB3  ALA  20           HB3      ALA  20  -7.177   5.304  -5.767
  123    H    SER  21           H        SER  21  -7.910   3.894  -9.375
  124    HA   SER  21           HA       SER  21  -5.404   4.170 -10.551
  125    HB2  SER  21           HB2      SER  21  -8.089   5.150 -11.533
  126    HB3  SER  21           HB3      SER  21  -6.673   4.747 -12.517
  127    HG   SER  21           HG       SER  21  -8.308   3.032 -12.324
  128    H    GLY  22           H        GLY  22  -4.084   5.858 -10.651
  129    HA2  GLY  22           HA2      GLY  22  -3.708   8.254 -10.847
  130    HA3  GLY  22           HA3      GLY  22  -5.102   8.485  -9.793
  131    H    THR  23           H        THR  23  -3.997   6.005  -8.285
  132    HA   THR  23           HA       THR  23  -1.852   7.413  -6.855
  133    HB   THR  23           HB       THR  23  -2.530   6.238  -4.803
  134    HG1  THR  23           HG1      THR  23  -4.425   5.066  -6.529
  135   HG21  THR  23          HG21      THR  23  -3.501   8.414  -5.104
  136   HG22  THR  23          HG22      THR  23  -4.707   7.352  -4.381
  137   HG23  THR  23          HG23      THR  23  -4.792   7.745  -6.099
  138    H    THR  24           H        THR  24  -0.092   6.097  -6.201
  139    HA   THR  24           HA       THR  24  -0.079   3.494  -7.551
  140    HB   THR  24           HB       THR  24   2.418   3.757  -7.655
  141    HG1  THR  24           HG1      THR  24   1.759   6.306  -6.573
  142   HG21  THR  24          HG21      THR  24   2.405   5.338  -9.542
  143   HG22  THR  24          HG22      THR  24   0.809   5.902  -9.051
  144   HG23  THR  24          HG23      THR  24   1.020   4.246  -9.609
  145    H    CYS  25           H        CYS  25   0.545   1.681  -6.425
  146    HA   CYS  25           HA       CYS  25   0.602   1.928  -3.565
  147    HB2  CYS  25           HB2      CYS  25  -0.578   0.032  -4.625
  148    HB3  CYS  25           HB3      CYS  25   0.955  -0.557  -5.274
  149    H    GLN  26           H        GLN  26   2.377   2.836  -2.883
  150    HA   GLN  26           HA       GLN  26   4.928   1.902  -3.907
  151    HB2  GLN  26           HB2      GLN  26   4.221   4.248  -2.140
  152    HB3  GLN  26           HB3      GLN  26   5.846   3.853  -2.691
  153    HG2  GLN  26           HG2      GLN  26   5.197   4.196  -4.990
  154    HG3  GLN  26           HG3      GLN  26   3.530   4.478  -4.503
  155   HE21  GLN  26          HE21      GLN  26   3.483   6.471  -5.420
  156   HE22  GLN  26          HE22      GLN  26   4.321   7.833  -4.776
  157    H    VAL  27           H        VAL  27   5.770   0.250  -2.900
  158    HA   VAL  27           HA       VAL  27   5.089  -0.390  -0.195
  159    HB   VAL  27           HB       VAL  27   7.264  -1.584  -1.954
  160   HG11  VAL  27          HG11      VAL  27   7.554  -2.068   0.413
  161   HG12  VAL  27          HG12      VAL  27   7.118  -3.530  -0.478
  162   HG13  VAL  27          HG13      VAL  27   5.910  -2.691   0.499
  163   HG21  VAL  27          HG21      VAL  27   5.102  -1.814  -3.045
  164   HG22  VAL  27          HG22      VAL  27   4.412  -2.493  -1.571
  165   HG23  VAL  27          HG23      VAL  27   5.657  -3.379  -2.446
  166    H    LEU  28           H        LEU  28   5.764   1.091   1.122
  167    HA   LEU  28           HA       LEU  28   8.244   2.522   0.767
  168    HB2  LEU  28           HB2      LEU  28   6.219   2.612   3.000
  169    HB3  LEU  28           HB3      LEU  28   7.538   3.745   2.779
  170    HG   LEU  28           HG       LEU  28   5.230   3.383   0.852
  171   HD11  LEU  28          HD11      LEU  28   5.763   5.546   2.881
  172   HD12  LEU  28          HD12      LEU  28   4.461   4.350   2.929
  173   HD13  LEU  28          HD13      LEU  28   4.490   5.574   1.660
  174   HD21  LEU  28          HD21      LEU  28   7.275   4.156  -0.220
  175   HD22  LEU  28          HD22      LEU  28   7.401   5.430   1.006
  176   HD23  LEU  28          HD23      LEU  28   6.059   5.443  -0.141
  177    H    ASN  29           H        ASN  29   6.920   0.060   2.861
  178    HA   ASN  29           HA       ASN  29   9.591  -0.559   3.879
  179    HB2  ASN  29           HB2      ASN  29   7.068  -0.611   5.592
  180    HB3  ASN  29           HB3      ASN  29   8.672  -1.070   6.092
  181   HD21  ASN  29          HD21      ASN  29   7.696   1.886   4.432
  182   HD22  ASN  29          HD22      ASN  29   8.127   2.969   5.708
  183    HA   PRO  30           HA       PRO  30   8.322  -4.686   2.726
  184    HB2  PRO  30           HB2      PRO  30   8.600  -5.597   5.543
  185    HB3  PRO  30           HB3      PRO  30   9.294  -6.290   4.073
  186    HG2  PRO  30           HG2      PRO  30  10.841  -4.894   5.706
  187    HG3  PRO  30           HG3      PRO  30  10.981  -4.695   3.949
  188    HD2  PRO  30           HD2      PRO  30   9.665  -2.914   5.958
  189    HD3  PRO  30           HD3      PRO  30  10.629  -2.469   4.536
  190    H    TYR  31           H        TYR  31   6.857  -3.530   5.763
  191    HA   TYR  31           HA       TYR  31   4.497  -5.161   5.104
  192    HB2  TYR  31           HB2      TYR  31   4.982  -3.750   7.744
  193    HB3  TYR  31           HB3      TYR  31   3.843  -5.028   7.385
  194    HD1  TYR  31           HD1      TYR  31   4.595  -7.346   7.139
  195    HD2  TYR  31           HD2      TYR  31   7.307  -4.267   8.202
  196    HE1  TYR  31           HE1      TYR  31   6.233  -9.034   7.846
  197    HE2  TYR  31           HE2      TYR  31   8.950  -5.938   8.915
  198    HH   TYR  31           HH       TYR  31   8.560  -9.264   8.196
  199    H    TYR  32           H        TYR  32   5.665  -1.936   5.439
  200    HA   TYR  32           HA       TYR  32   2.973  -0.871   5.294
  201    HB2  TYR  32           HB2      TYR  32   4.566   0.109   6.915
  202    HB3  TYR  32           HB3      TYR  32   5.555   0.648   5.564
  203    HD1  TYR  32           HD1      TYR  32   1.989   0.794   6.586
  204    HD2  TYR  32           HD2      TYR  32   5.337   2.862   4.965
  205    HE1  TYR  32           HE1      TYR  32   0.666   2.844   6.501
  206    HE2  TYR  32           HE2      TYR  32   4.059   4.901   4.875
  207    HH   TYR  32           HH       TYR  32   1.617   5.575   4.776
  208    H    SER  33           H        SER  33   2.088  -0.552   3.423
  209    HA   SER  33           HA       SER  33   3.698   0.481   1.202
  210    HB2  SER  33           HB2      SER  33   1.427  -1.530   0.945
  211    HB3  SER  33           HB3      SER  33   2.484  -0.956  -0.347
  212    HG   SER  33           HG       SER  33   3.115  -3.035   0.439
  213    H    GLN  34           H        GLN  34   2.628   2.225   0.199
  214    HA   GLN  34           HA       GLN  34  -0.078   2.773   1.164
  215    HB2  GLN  34           HB2      GLN  34   1.246   4.017   2.693
  216    HB3  GLN  34           HB3      GLN  34   2.314   4.584   1.427
  217    HG2  GLN  34           HG2      GLN  34   0.577   6.033   0.564
  218    HG3  GLN  34           HG3      GLN  34  -0.569   5.371   1.729
  219   HE21  GLN  34          HE21      GLN  34  -0.628   6.197   3.783
  220   HE22  GLN  34          HE22      GLN  34   0.411   7.456   4.318
  221    H    CYS  35           H        CYS  35  -1.424   3.642  -0.265
  222    HA   CYS  35           HA       CYS  35  -0.621   3.900  -3.009
  223    HB2  CYS  35           HB2      CYS  35  -3.235   4.694  -1.721
  224    HB3  CYS  35           HB3      CYS  35  -2.922   4.539  -3.447
  225    H    LEU  36           H        LEU  36   0.518   5.575  -3.593
  226    HA   LEU  36           HA       LEU  36  -0.339   8.221  -2.719
  227    HB2  LEU  36           HB2      LEU  36   2.431   7.240  -3.369
  228    HB3  LEU  36           HB3      LEU  36   2.015   8.926  -3.136
  229    HG   LEU  36           HG       LEU  36   1.716   6.794  -1.026
  230   HD11  LEU  36          HD11      LEU  36   3.649   7.800   0.010
  231   HD12  LEU  36          HD12      LEU  36   3.792   8.949  -1.318
  232   HD13  LEU  36          HD13      LEU  36   4.061   7.230  -1.607
  233   HD21  LEU  36          HD21      LEU  36   0.140   8.627  -0.754
  234   HD22  LEU  36          HD22      LEU  36   1.446   9.795  -0.932
  235   HD23  LEU  36          HD23      LEU  36   1.407   8.723   0.468
  236    H1   MAN 101           H1       MAN 101  -9.032   6.198   2.206
  237    H2   MAN 101           H2       MAN 101  -7.064   5.677   3.640
  238    H3   MAN 101           H3       MAN 101  -6.957   3.305   3.358
  239    H4   MAN 101           H4       MAN 101  -9.554   3.223   4.954
  240    H5   MAN 101           H5       MAN 101  -9.023   2.496   2.033
  241    H61  MAN 101           H61      MAN 101 -10.876   1.225   3.216
  242    H62  MAN 101           H62      MAN 101 -11.360   2.081   1.740
  243    HO2  MAN 101           HO2      MAN 101  -8.236   5.495   5.544
  244    HO3  MAN 101           HO3      MAN 101  -6.880   2.803   5.598
  245    HO4  MAN 101           HO4      MAN 101  -9.285   0.962   4.553
  246    HO6  MAN 101           HO6      MAN 101 -11.649   3.789   3.799
  Start of MODEL   12
    1    H1   THR   1           H1       THR   1 -11.548  -0.693  -5.913
    2    H2   THR   1           H2       THR   1 -11.774   0.539  -4.788
    3    H3   THR   1           H3       THR   1 -11.393  -1.007  -4.251
    4    HA   THR   1           HA       THR   1  -9.240  -0.797  -5.254
    5    HB   THR   1           HB       THR   1  -8.680   1.623  -5.916
    6    HG1  THR   1           HG1      THR   1 -10.621   2.641  -6.935
    7   HG21  THR   1          HG21      THR   1  -8.658  -0.226  -7.511
    8   HG22  THR   1          HG22      THR   1  -9.336   1.221  -8.257
    9   HG23  THR   1          HG23      THR   1 -10.403  -0.080  -7.727
   10    H    GLN   2           H        GLN   2  -7.552   0.023  -4.000
   11    HA   GLN   2           HA       GLN   2  -8.271   0.747  -1.351
   12    HB2  GLN   2           HB2      GLN   2  -6.408  -0.785  -1.765
   13    HB3  GLN   2           HB3      GLN   2  -5.573   0.435  -2.709
   14    HG2  GLN   2           HG2      GLN   2  -4.638   0.261  -0.413
   15    HG3  GLN   2           HG3      GLN   2  -5.338   1.822  -0.786
   16   HE21  GLN   2          HE21      GLN   2  -5.680   2.320   1.066
   17   HE22  GLN   2          HE22      GLN   2  -6.821   1.656   2.215
   18    H    SER   3           H        SER   3  -7.958   2.717  -0.306
   19    HA   SER   3           HA       SER   3  -8.229   4.940  -2.029
   20    HB2  SER   3           HB2      SER   3  -8.615   6.165   0.042
   21    HB3  SER   3           HB3      SER   3  -9.614   4.714  -0.044
   22    H    HIS   4           H        HIS   4  -7.086   6.862  -1.725
   23    HA   HIS   4           HA       HIS   4  -4.263   6.632  -1.978
   24    HB2  HIS   4           HB2      HIS   4  -5.814   8.422  -2.996
   25    HB3  HIS   4           HB3      HIS   4  -5.798   9.182  -1.421
   26    HD1  HIS   4           HD1      HIS   4  -4.725  11.286  -2.711
   27    HD2  HIS   4           HD2      HIS   4  -2.364   7.884  -2.605
   28    HE1  HIS   4           HE1      HIS   4  -2.453  12.019  -3.477
   29    HE2  HIS   4           HE2      HIS   4  -1.245   9.828  -3.808
   30    H    TYR   5           H        TYR   5  -2.696   6.902  -0.434
   31    HA   TYR   5           HA       TYR   5  -1.676   7.135   1.460
   32    HB2  TYR   5           HB2      TYR   5  -4.067   8.755   2.258
   33    HB3  TYR   5           HB3      TYR   5  -2.756   8.452   3.406
   34    HD1  TYR   5           HD1      TYR   5  -3.847  10.345   0.506
   35    HD2  TYR   5           HD2      TYR   5  -0.490   9.342   2.908
   36    HE1  TYR   5           HE1      TYR   5  -2.599  12.217  -0.467
   37    HE2  TYR   5           HE2      TYR   5   0.769  11.209   1.946
   38    HH   TYR   5           HH       TYR   5  -0.718  13.635   0.081
   39    H    GLY   6           H        GLY   6  -4.138   5.230   0.989
   40    HA2  GLY   6           HA2      GLY   6  -4.280   4.027   3.639
   41    HA3  GLY   6           HA3      GLY   6  -5.123   3.528   2.213
   42    H    GLN   7           H        GLN   7  -3.780   1.731   3.861
   43    HA   GLN   7           HA       GLN   7  -1.181   1.183   2.806
   44    HB2  GLN   7           HB2      GLN   7  -1.932   0.629   5.157
   45    HB3  GLN   7           HB3      GLN   7  -2.953  -0.620   4.474
   46    HG2  GLN   7           HG2      GLN   7  -1.042  -1.846   3.690
   47    HG3  GLN   7           HG3      GLN   7   0.042  -0.532   4.149
   48   HE21  GLN   7          HE21      GLN   7   0.172  -3.274   5.024
   49   HE22  GLN   7          HE22      GLN   7  -0.020  -3.262   6.726
   50    H    CYS   8           H        CYS   8  -0.749   0.089   1.016
   51    HA   CYS   8           HA       CYS   8  -3.029  -1.130  -0.387
   52    HB2  CYS   8           HB2      CYS   8  -1.687  -0.835  -2.405
   53    HB3  CYS   8           HB3      CYS   8  -2.072   0.660  -1.559
   54    H    GLY   9           H        GLY   9  -0.777  -2.374   1.484
   55    HA2  GLY   9           HA2      GLY   9  -0.908  -4.894   1.239
   56    HA3  GLY   9           HA3      GLY   9  -0.466  -4.602  -0.426
   57    H    GLY  10           H        GLY  10   0.592  -4.549   2.837
   58    HA2  GLY  10           HA2      GLY  10   3.358  -4.752   1.922
   59    HA3  GLY  10           HA3      GLY  10   2.828  -4.548   3.598
   60    H    ILE  11           H        ILE  11   4.447  -6.578   3.465
   61    HA   ILE  11           HA       ILE  11   3.250  -9.031   2.718
   62    HB   ILE  11           HB       ILE  11   5.387  -8.537   4.825
   63   HG12  ILE  11          HG12      ILE  11   5.685  -9.269   1.898
   64   HG13  ILE  11          HG13      ILE  11   5.991  -7.680   2.579
   65   HG21  ILE  11          HG21      ILE  11   4.341 -10.746   5.043
   66   HG22  ILE  11          HG22      ILE  11   6.001 -10.896   4.469
   67   HG23  ILE  11          HG23      ILE  11   4.658 -11.076   3.340
   68   HD11  ILE  11          HD11      ILE  11   7.484 -10.204   3.248
   69   HD12  ILE  11          HD12      ILE  11   7.812  -8.606   3.923
   70   HD13  ILE  11          HD13      ILE  11   8.061  -8.905   2.200
   71    H    GLY  12           H        GLY  12   1.417  -9.776   3.571
   72    HA2  GLY  12           HA2      GLY  12   0.465 -10.876   5.502
   73    HA3  GLY  12           HA3      GLY  12   1.082  -9.556   6.487
   74    H    TYR  13           H        TYR  13   0.152  -7.804   4.092
   75    HA   TYR  13           HA       TYR  13  -2.423  -7.224   5.313
   76    HB2  TYR  13           HB2      TYR  13  -0.883  -5.370   4.709
   77    HB3  TYR  13           HB3      TYR  13  -0.998  -5.841   3.024
   78    HD1  TYR  13           HD1      TYR  13  -2.817  -5.015   1.652
   79    HD2  TYR  13           HD2      TYR  13  -2.924  -4.448   5.876
   80    HE1  TYR  13           HE1      TYR  13  -4.672  -3.429   1.390
   81    HE2  TYR  13           HE2      TYR  13  -4.802  -2.869   5.606
   82    HH   TYR  13           HH       TYR  13  -6.376  -2.441   2.538
   83    H    SER  14           H        SER  14  -4.099  -8.373   4.713
   84    HA   SER  14           HA       SER  14  -4.146  -9.551   2.047
   85    HB2  SER  14           HB2      SER  14  -5.842 -10.127   4.470
   86    HB3  SER  14           HB3      SER  14  -5.766 -11.079   2.982
   87    HG   SER  14           HG       SER  14  -3.314 -10.636   4.011
   88    H    GLY  15           H        GLY  15  -5.184  -6.798   3.396
   89    HA2  GLY  15           HA2      GLY  15  -7.908  -6.676   2.488
   90    HA3  GLY  15           HA3      GLY  15  -6.920  -5.319   3.008
   91    HA   PRO  16           HA       PRO  16  -7.679  -4.923  -1.588
   92    HB2  PRO  16           HB2      PRO  16  -7.756  -2.071  -0.741
   93    HB3  PRO  16           HB3      PRO  16  -8.844  -2.942  -1.831
   94    HG2  PRO  16           HG2      PRO  16  -9.630  -2.296   0.627
   95    HG3  PRO  16           HG3      PRO  16 -10.060  -3.866  -0.077
   96    HD2  PRO  16           HD2      PRO  16  -7.922  -3.217   1.927
   97    HD3  PRO  16           HD3      PRO  16  -9.039  -4.588   1.887
   98    H    THR  17           H        THR  17  -5.788  -5.115  -2.620
   99    HA   THR  17           HA       THR  17  -3.530  -3.474  -1.770
  100    HB   THR  17           HB       THR  17  -2.169  -5.144  -3.039
  101    HG1  THR  17           HG1      THR  17  -3.134  -6.588  -4.155
  102   HG21  THR  17          HG21      THR  17  -2.459  -5.260  -0.621
  103   HG22  THR  17          HG22      THR  17  -2.340  -6.883  -1.313
  104   HG23  THR  17          HG23      THR  17  -3.912  -6.234  -0.827
  105    H    VAL  18           H        VAL  18  -5.852  -3.473  -4.061
  106    HA   VAL  18           HA       VAL  18  -4.069  -2.417  -6.140
  107    HB   VAL  18           HB       VAL  18  -7.021  -3.111  -6.369
  108   HG11  VAL  18          HG11      VAL  18  -6.383  -1.326  -7.916
  109   HG12  VAL  18          HG12      VAL  18  -6.706  -2.822  -8.790
  110   HG13  VAL  18          HG13      VAL  18  -5.043  -2.306  -8.506
  111   HG21  VAL  18          HG21      VAL  18  -4.596  -4.556  -7.432
  112   HG22  VAL  18          HG22      VAL  18  -6.279  -5.000  -7.731
  113   HG23  VAL  18          HG23      VAL  18  -5.616  -5.089  -6.095
  114    H    CYS  19           H        CYS  19  -3.702  -0.371  -5.907
  115    HA   CYS  19           HA       CYS  19  -5.233   1.443  -4.420
  116    HB2  CYS  19           HB2      CYS  19  -3.068   1.866  -6.457
  117    HB3  CYS  19           HB3      CYS  19  -3.718   3.112  -5.401
  118    H    ALA  20           H        ALA  20  -6.370   3.249  -5.065
  119    HA   ALA  20           HA       ALA  20  -8.128   2.994  -7.226
  120    HB1  ALA  20           HB1      ALA  20  -8.629   4.303  -5.235
  121    HB2  ALA  20           HB2      ALA  20  -8.772   5.289  -6.697
  122    HB3  ALA  20           HB3      ALA  20  -7.357   5.450  -5.658
  123    H    SER  21           H        SER  21  -8.247   4.025  -9.147
  124    HA   SER  21           HA       SER  21  -6.056   4.216 -10.726
  125    HB2  SER  21           HB2      SER  21  -7.695   5.576 -12.187
  126    HB3  SER  21           HB3      SER  21  -8.138   3.924 -11.734
  127    HG   SER  21           HG       SER  21  -9.826   5.439 -11.434
  128    H    GLY  22           H        GLY  22  -4.497   5.579 -10.908
  129    HA2  GLY  22           HA2      GLY  22  -3.729   7.834 -11.311
  130    HA3  GLY  22           HA3      GLY  22  -4.865   8.369 -10.079
  131    H    THR  23           H        THR  23  -4.002   5.874  -8.468
  132    HA   THR  23           HA       THR  23  -1.619   7.188  -7.388
  133    HB   THR  23           HB       THR  23  -2.170   6.154  -5.211
  134    HG1  THR  23           HG1      THR  23  -4.392   5.079  -6.656
  135   HG21  THR  23          HG21      THR  23  -4.490   7.631  -6.451
  136   HG22  THR  23          HG22      THR  23  -3.067   8.365  -5.709
  137   HG23  THR  23          HG23      THR  23  -4.201   7.448  -4.722
  138    H    THR  24           H        THR  24   0.017   5.794  -6.393
  139    HA   THR  24           HA       THR  24   0.195   3.191  -7.743
  140    HB   THR  24           HB       THR  24   2.701   3.554  -7.563
  141    HG1  THR  24           HG1      THR  24   1.786   5.973  -6.506
  142   HG21  THR  24          HG21      THR  24   1.514   3.803  -9.697
  143   HG22  THR  24          HG22      THR  24   2.819   4.981  -9.568
  144   HG23  THR  24          HG23      THR  24   1.146   5.483  -9.307
  145    H    CYS  25           H        CYS  25   0.883   1.449  -6.461
  146    HA   CYS  25           HA       CYS  25   0.715   1.878  -3.633
  147    HB2  CYS  25           HB2      CYS  25  -0.353  -0.083  -4.592
  148    HB3  CYS  25           HB3      CYS  25   1.177  -0.639  -5.266
  149    H    GLN  26           H        GLN  26   2.427   2.615  -2.627
  150    HA   GLN  26           HA       GLN  26   5.031   1.830  -3.653
  151    HB2  GLN  26           HB2      GLN  26   4.190   4.224  -2.053
  152    HB3  GLN  26           HB3      GLN  26   5.857   3.860  -2.464
  153    HG2  GLN  26           HG2      GLN  26   5.221   3.937  -4.867
  154    HG3  GLN  26           HG3      GLN  26   3.597   4.404  -4.382
  155   HE21  GLN  26          HE21      GLN  26   3.718   6.310  -5.468
  156   HE22  GLN  26          HE22      GLN  26   4.690   7.642  -4.930
  157    H    VAL  27           H        VAL  27   6.025   0.387  -2.599
  158    HA   VAL  27           HA       VAL  27   5.316  -0.366   0.071
  159    HB   VAL  27           HB       VAL  27   7.667  -1.275  -1.626
  160   HG11  VAL  27          HG11      VAL  27   7.699  -3.254  -0.191
  161   HG12  VAL  27          HG12      VAL  27   6.370  -2.580   0.752
  162   HG13  VAL  27          HG13      VAL  27   7.935  -1.775   0.747
  163   HG21  VAL  27          HG21      VAL  27   5.567  -1.719  -2.784
  164   HG22  VAL  27          HG22      VAL  27   4.931  -2.526  -1.351
  165   HG23  VAL  27          HG23      VAL  27   6.300  -3.221  -2.227
  166    H    LEU  28           H        LEU  28   5.839   1.033   1.540
  167    HA   LEU  28           HA       LEU  28   8.219   2.697   1.336
  168    HB2  LEU  28           HB2      LEU  28   6.009   2.629   3.388
  169    HB3  LEU  28           HB3      LEU  28   7.281   3.834   3.307
  170    HG   LEU  28           HG       LEU  28   5.174   3.399   1.175
  171   HD11  LEU  28          HD11      LEU  28   4.288   5.533   1.900
  172   HD12  LEU  28          HD12      LEU  28   5.460   5.589   3.217
  173   HD13  LEU  28          HD13      LEU  28   4.207   4.339   3.193
  174   HD21  LEU  28          HD21      LEU  28   7.264   5.494   1.526
  175   HD22  LEU  28          HD22      LEU  28   6.015   5.498   0.273
  176   HD23  LEU  28          HD23      LEU  28   7.267   4.241   0.279
  177    H    ASN  29           H        ASN  29   6.856   0.184   3.314
  178    HA   ASN  29           HA       ASN  29   9.488  -0.424   4.438
  179    HB2  ASN  29           HB2      ASN  29   6.847  -0.641   5.967
  180    HB3  ASN  29           HB3      ASN  29   8.422  -1.100   6.548
  181   HD21  ASN  29          HD21      ASN  29   7.694   1.984   4.988
  182   HD22  ASN  29          HD22      ASN  29   7.936   2.970   6.381
  183    HA   PRO  30           HA       PRO  30   8.335  -4.429   2.823
  184    HB2  PRO  30           HB2      PRO  30   8.651  -5.638   5.530
  185    HB3  PRO  30           HB3      PRO  30   9.375  -6.131   3.995
  186    HG2  PRO  30           HG2      PRO  30  10.861  -4.877   5.753
  187    HG3  PRO  30           HG3      PRO  30  10.954  -4.417   4.042
  188    HD2  PRO  30           HD2      PRO  30   9.511  -3.040   6.284
  189    HD3  PRO  30           HD3      PRO  30  10.504  -2.321   5.002
  190    H    TYR  31           H        TYR  31   6.749  -3.497   5.824
  191    HA   TYR  31           HA       TYR  31   4.468  -5.170   5.014
  192    HB2  TYR  31           HB2      TYR  31   4.946  -3.969   7.755
  193    HB3  TYR  31           HB3      TYR  31   3.745  -5.169   7.308
  194    HD1  TYR  31           HD1      TYR  31   7.280  -4.606   8.069
  195    HD2  TYR  31           HD2      TYR  31   4.390  -7.491   6.917
  196    HE1  TYR  31           HE1      TYR  31   8.872  -6.395   8.601
  197    HE2  TYR  31           HE2      TYR  31   5.971  -9.293   7.452
  198    HH   TYR  31           HH       TYR  31   8.853  -8.701   9.169
  199    H    TYR  32           H        TYR  32   5.538  -1.938   5.629
  200    HA   TYR  32           HA       TYR  32   2.828  -0.926   5.410
  201    HB2  TYR  32           HB2      TYR  32   4.310   0.048   7.140
  202    HB3  TYR  32           HB3      TYR  32   5.385   0.617   5.867
  203    HD1  TYR  32           HD1      TYR  32   1.727   0.713   6.510
  204    HD2  TYR  32           HD2      TYR  32   5.234   2.902   5.461
  205    HE1  TYR  32           HE1      TYR  32   0.412   2.749   6.392
  206    HE2  TYR  32           HE2      TYR  32   3.941   4.941   5.343
  207    HH   TYR  32           HH       TYR  32   1.697   5.741   5.160
  208    H    SER  33           H        SER  33   2.050  -0.621   3.486
  209    HA   SER  33           HA       SER  33   3.744   0.583   1.429
  210    HB2  SER  33           HB2      SER  33   1.588  -1.509   0.962
  211    HB3  SER  33           HB3      SER  33   2.648  -0.798  -0.252
  212    HG   SER  33           HG       SER  33   3.223  -2.943   0.595
  213    H    GLN  34           H        GLN  34   2.645   2.219   0.313
  214    HA   GLN  34           HA       GLN  34  -0.084   2.741   1.216
  215    HB2  GLN  34           HB2      GLN  34   1.200   4.035   2.723
  216    HB3  GLN  34           HB3      GLN  34   2.289   4.564   1.451
  217    HG2  GLN  34           HG2      GLN  34   0.586   5.982   0.520
  218    HG3  GLN  34           HG3      GLN  34  -0.599   5.346   1.660
  219   HE21  GLN  34          HE21      GLN  34  -0.678   6.129   3.667
  220   HE22  GLN  34          HE22      GLN  34   0.262   7.430   4.260
  221    H    CYS  35           H        CYS  35  -1.404   3.543  -0.302
  222    HA   CYS  35           HA       CYS  35  -0.489   3.762  -3.004
  223    HB2  CYS  35           HB2      CYS  35  -3.131   4.643  -1.827
  224    HB3  CYS  35           HB3      CYS  35  -2.737   4.491  -3.538
  225    H    LEU  36           H        LEU  36   0.555   5.417  -3.752
  226    HA   LEU  36           HA       LEU  36  -0.075   8.070  -2.742
  227    HB2  LEU  36           HB2      LEU  36   2.617   6.907  -3.404
  228    HB3  LEU  36           HB3      LEU  36   2.336   8.626  -3.202
  229    HG   LEU  36           HG       LEU  36   1.877   6.542  -1.071
  230   HD11  LEU  36          HD11      LEU  36   4.064   8.588  -1.345
  231   HD12  LEU  36          HD12      LEU  36   4.251   6.848  -1.565
  232   HD13  LEU  36          HD13      LEU  36   3.826   7.497   0.019
  233   HD21  LEU  36          HD21      LEU  36   1.710   9.546  -1.028
  234   HD22  LEU  36          HD22      LEU  36   1.636   8.500   0.392
  235   HD23  LEU  36          HD23      LEU  36   0.374   8.406  -0.833
  236    H1   MAN 101           H1       MAN 101  -8.935   6.212   2.241
  237    H2   MAN 101           H2       MAN 101  -6.894   5.398   3.443
  238    H3   MAN 101           H3       MAN 101  -7.261   3.001   3.367
  239    H4   MAN 101           H4       MAN 101  -9.691   3.635   5.063
  240    H5   MAN 101           H5       MAN 101  -9.378   2.544   2.227
  241    H61  MAN 101           H61      MAN 101 -11.242   1.492   3.423
  242    H62  MAN 101           H62      MAN 101 -11.802   2.520   2.091
  243    HO2  MAN 101           HO2      MAN 101  -8.510   6.705   4.415
  244    HO3  MAN 101           HO3      MAN 101  -7.638   4.074   5.983
  245    HO4  MAN 101           HO4      MAN 101  -8.539   1.721   5.569
  246    HO6  MAN 101           HO6      MAN 101 -12.042   2.799   4.883
  Start of MODEL   13
    1    H1   THR   1           H1       THR   1 -11.898   0.764  -4.817
    2    H2   THR   1           H2       THR   1 -11.725  -0.779  -4.190
    3    H3   THR   1           H3       THR   1 -11.779  -0.549  -5.883
    4    HA   THR   1           HA       THR   1  -9.513  -0.877  -5.158
    5    HB   THR   1           HB       THR   1  -8.677   1.497  -5.772
    6    HG1  THR   1           HG1      THR   1 -10.537   2.635  -6.877
    7   HG21  THR   1          HG21      THR   1  -9.248   1.178  -8.136
    8   HG22  THR   1          HG22      THR   1 -10.509   0.036  -7.691
    9   HG23  THR   1          HG23      THR   1  -8.815  -0.361  -7.394
   10    H    GLN   2           H        GLN   2  -7.695   0.068  -3.957
   11    HA   GLN   2           HA       GLN   2  -8.450   0.719  -1.279
   12    HB2  GLN   2           HB2      GLN   2  -6.576  -0.826  -1.731
   13    HB3  GLN   2           HB3      GLN   2  -5.710   0.447  -2.565
   14    HG2  GLN   2           HG2      GLN   2  -4.895   0.080  -0.303
   15    HG3  GLN   2           HG3      GLN   2  -5.524   1.710  -0.545
   16   HE21  GLN   2          HE21      GLN   2  -6.106   2.168   1.402
   17   HE22  GLN   2          HE22      GLN   2  -7.323   1.314   2.327
   18    H    SER   3           H        SER   3  -8.055   2.647  -0.178
   19    HA   SER   3           HA       SER   3  -8.391   4.954  -1.759
   20    HB2  SER   3           HB2      SER   3  -8.567   6.122   0.354
   21    HB3  SER   3           HB3      SER   3  -9.575   4.683   0.379
   22    H    HIS   4           H        HIS   4  -7.324   6.851  -1.225
   23    HA   HIS   4           HA       HIS   4  -4.505   6.719  -1.849
   24    HB2  HIS   4           HB2      HIS   4  -6.148   8.451  -2.753
   25    HB3  HIS   4           HB3      HIS   4  -6.168   9.158  -1.158
   26    HD1  HIS   4           HD1      HIS   4  -5.177  11.391  -1.957
   27    HD2  HIS   4           HD2      HIS   4  -2.762   8.131  -2.809
   28    HE1  HIS   4           HE1      HIS   4  -3.021  12.352  -2.773
   29    HE2  HIS   4           HE2      HIS   4  -1.826  10.351  -3.687
   30    H    TYR   5           H        TYR   5  -2.872   6.990  -0.382
   31    HA   TYR   5           HA       TYR   5  -1.766   7.211   1.521
   32    HB2  TYR   5           HB2      TYR   5  -4.245   8.593   2.490
   33    HB3  TYR   5           HB3      TYR   5  -2.804   8.448   3.518
   34    HD1  TYR   5           HD1      TYR   5  -0.606   9.352   2.238
   35    HD2  TYR   5           HD2      TYR   5  -4.590  10.540   1.366
   36    HE1  TYR   5           HE1      TYR   5   0.237  11.410   1.196
   37    HE2  TYR   5           HE2      TYR   5  -3.759  12.599   0.330
   38    HH   TYR   5           HH       TYR   5  -0.553  12.973  -0.532
   39    H    GLY   6           H        GLY   6  -4.031   5.156   0.929
   40    HA2  GLY   6           HA2      GLY   6  -4.221   3.934   3.564
   41    HA3  GLY   6           HA3      GLY   6  -5.034   3.423   2.087
   42    H    GLN   7           H        GLN   7  -3.815   1.534   3.601
   43    HA   GLN   7           HA       GLN   7  -1.126   1.070   2.670
   44    HB2  GLN   7           HB2      GLN   7  -1.969   0.497   4.973
   45    HB3  GLN   7           HB3      GLN   7  -2.947  -0.766   4.244
   46    HG2  GLN   7           HG2      GLN   7  -0.968  -1.912   3.506
   47    HG3  GLN   7           HG3      GLN   7   0.077  -0.636   4.112
   48   HE21  GLN   7          HE21      GLN   7   0.264  -3.330   4.915
   49   HE22  GLN   7          HE22      GLN   7  -0.173  -3.399   6.579
   50    H    CYS   8           H        CYS   8  -0.569  -0.324   1.016
   51    HA   CYS   8           HA       CYS   8  -2.873  -1.533  -0.393
   52    HB2  CYS   8           HB2      CYS   8  -1.695  -1.023  -2.477
   53    HB3  CYS   8           HB3      CYS   8  -2.195   0.390  -1.554
   54    H    GLY   9           H        GLY   9  -0.225  -2.657   1.223
   55    HA2  GLY   9           HA2      GLY   9  -0.449  -5.230   0.451
   56    HA3  GLY   9           HA3      GLY   9   0.435  -4.561  -0.898
   57    H    GLY  10           H        GLY  10   0.558  -4.728   2.614
   58    HA2  GLY  10           HA2      GLY  10   3.465  -4.984   2.401
   59    HA3  GLY  10           HA3      GLY  10   2.575  -4.631   3.885
   60    H    ILE  11           H        ILE  11   4.367  -6.667   3.933
   61    HA   ILE  11           HA       ILE  11   3.401  -9.226   3.328
   62    HB   ILE  11           HB       ILE  11   5.025  -8.476   5.773
   63   HG12  ILE  11          HG12      ILE  11   6.033  -9.267   3.031
   64   HG13  ILE  11          HG13      ILE  11   6.052  -7.633   3.684
   65   HG21  ILE  11          HG21      ILE  11   4.129 -10.734   5.885
   66   HG22  ILE  11          HG22      ILE  11   5.877 -10.781   5.642
   67   HG23  ILE  11          HG23      ILE  11   4.793 -11.096   4.289
   68   HD11  ILE  11          HD11      ILE  11   7.509  -9.999   4.809
   69   HD12  ILE  11          HD12      ILE  11   7.515  -8.369   5.478
   70   HD13  ILE  11          HD13      ILE  11   8.230  -8.671   3.893
   71    H    GLY  12           H        GLY  12   1.427  -9.950   3.916
   72    HA2  GLY  12           HA2      GLY  12   0.170 -10.988   5.642
   73    HA3  GLY  12           HA3      GLY  12   0.779  -9.768   6.748
   74    H    TYR  13           H        TYR  13   0.030  -8.080   4.060
   75    HA   TYR  13           HA       TYR  13  -2.400  -7.179   5.318
   76    HB2  TYR  13           HB2      TYR  13  -0.810  -5.492   4.509
   77    HB3  TYR  13           HB3      TYR  13  -0.970  -6.110   2.872
   78    HD1  TYR  13           HD1      TYR  13  -3.204  -4.863   5.612
   79    HD2  TYR  13           HD2      TYR  13  -2.311  -4.870   1.454
   80    HE1  TYR  13           HE1      TYR  13  -5.036  -3.266   5.220
   81    HE2  TYR  13           HE2      TYR  13  -4.135  -3.288   1.047
   82    HH   TYR  13           HH       TYR  13  -5.971  -2.311   1.951
   83    H    SER  14           H        SER  14  -4.186  -8.223   4.949
   84    HA   SER  14           HA       SER  14  -4.640  -9.608   2.431
   85    HB2  SER  14           HB2      SER  14  -6.176  -9.595   5.026
   86    HB3  SER  14           HB3      SER  14  -6.547 -10.612   3.632
   87    HG   SER  14           HG       SER  14  -3.977 -10.871   4.188
   88    H    GLY  15           H        GLY  15  -5.029  -6.580   3.307
   89    HA2  GLY  15           HA2      GLY  15  -7.781  -6.114   2.569
   90    HA3  GLY  15           HA3      GLY  15  -6.554  -4.888   2.863
   91    HA   PRO  16           HA       PRO  16  -7.432  -5.264  -1.716
   92    HB2  PRO  16           HB2      PRO  16  -7.821  -2.338  -1.448
   93    HB3  PRO  16           HB3      PRO  16  -8.828  -3.524  -2.284
   94    HG2  PRO  16           HG2      PRO  16  -9.627  -2.428   0.007
   95    HG3  PRO  16           HG3      PRO  16  -9.942  -4.138  -0.337
   96    HD2  PRO  16           HD2      PRO  16  -7.789  -2.920   1.362
   97    HD3  PRO  16           HD3      PRO  16  -8.822  -4.318   1.716
   98    H    THR  17           H        THR  17  -5.626  -5.251  -2.880
   99    HA   THR  17           HA       THR  17  -3.404  -3.590  -2.002
  100    HB   THR  17           HB       THR  17  -2.054  -5.142  -3.405
  101    HG1  THR  17           HG1      THR  17  -3.007  -6.407  -4.675
  102   HG21  THR  17          HG21      THR  17  -2.250  -7.079  -1.895
  103   HG22  THR  17          HG22      THR  17  -3.796  -6.458  -1.311
  104   HG23  THR  17          HG23      THR  17  -2.313  -5.555  -1.009
  105    H    VAL  18           H        VAL  18  -5.790  -3.595  -4.246
  106    HA   VAL  18           HA       VAL  18  -4.204  -2.281  -6.330
  107    HB   VAL  18           HB       VAL  18  -7.122  -3.128  -6.409
  108   HG11  VAL  18          HG11      VAL  18  -6.649  -1.245  -7.898
  109   HG12  VAL  18          HG12      VAL  18  -6.976  -2.709  -8.821
  110   HG13  VAL  18          HG13      VAL  18  -5.316  -2.142  -8.627
  111   HG21  VAL  18          HG21      VAL  18  -5.624  -5.061  -6.314
  112   HG22  VAL  18          HG22      VAL  18  -4.707  -4.422  -7.679
  113   HG23  VAL  18          HG23      VAL  18  -6.384  -4.926  -7.900
  114    H    CYS  19           H        CYS  19  -3.956  -0.198  -5.984
  115    HA   CYS  19           HA       CYS  19  -5.687   1.332  -4.323
  116    HB2  CYS  19           HB2      CYS  19  -3.453   2.203  -6.150
  117    HB3  CYS  19           HB3      CYS  19  -4.169   3.122  -4.836
  118    H    ALA  20           H        ALA  20  -6.769   3.246  -5.030
  119    HA   ALA  20           HA       ALA  20  -8.238   3.078  -7.413
  120    HB1  ALA  20           HB1      ALA  20  -8.947   4.479  -5.534
  121    HB2  ALA  20           HB2      ALA  20  -8.767   5.464  -6.988
  122    HB3  ALA  20           HB3      ALA  20  -7.525   5.501  -5.740
  123    H    SER  21           H        SER  21  -7.559   3.378  -9.455
  124    HA   SER  21           HA       SER  21  -4.912   3.781 -10.043
  125    HB2  SER  21           HB2      SER  21  -7.298   4.168 -11.837
  126    HB3  SER  21           HB3      SER  21  -5.631   3.924 -12.381
  127    HG   SER  21           HG       SER  21  -5.907   1.993 -10.811
  128    H    GLY  22           H        GLY  22  -3.696   5.411 -10.698
  129    HA2  GLY  22           HA2      GLY  22  -3.374   7.722 -11.261
  130    HA3  GLY  22           HA3      GLY  22  -4.797   8.100 -10.277
  131    H    THR  23           H        THR  23  -3.916   5.973  -8.314
  132    HA   THR  23           HA       THR  23  -1.734   7.486  -7.108
  133    HB   THR  23           HB       THR  23  -2.384   6.513  -4.957
  134    HG1  THR  23           HG1      THR  23  -4.496   5.223  -6.374
  135   HG21  THR  23          HG21      THR  23  -4.794   7.578  -6.421
  136   HG22  THR  23          HG22      THR  23  -3.556   8.541  -5.612
  137   HG23  THR  23          HG23      THR  23  -4.616   7.491  -4.669
  138    H    THR  24           H        THR  24   0.043   6.298  -6.352
  139    HA   THR  24           HA       THR  24   0.281   3.705  -7.693
  140    HB   THR  24           HB       THR  24   2.775   4.106  -7.490
  141    HG1  THR  24           HG1      THR  24   1.799   6.418  -6.285
  142   HG21  THR  24          HG21      THR  24   1.580   4.499  -9.593
  143   HG22  THR  24          HG22      THR  24   2.862   5.694  -9.370
  144   HG23  THR  24          HG23      THR  24   1.182   6.135  -9.067
  145    H    CYS  25           H        CYS  25   0.617   1.930  -6.499
  146    HA   CYS  25           HA       CYS  25   0.659   2.152  -3.652
  147    HB2  CYS  25           HB2      CYS  25  -0.515   0.279  -4.647
  148    HB3  CYS  25           HB3      CYS  25   0.946  -0.244  -5.485
  149    H    GLN  26           H        GLN  26   2.419   2.854  -2.740
  150    HA   GLN  26           HA       GLN  26   4.978   2.082  -3.887
  151    HB2  GLN  26           HB2      GLN  26   4.242   4.362  -2.063
  152    HB3  GLN  26           HB3      GLN  26   5.864   4.044  -2.648
  153    HG2  GLN  26           HG2      GLN  26   5.014   4.341  -4.973
  154    HG3  GLN  26           HG3      GLN  26   3.447   4.763  -4.300
  155   HE21  GLN  26          HE21      GLN  26   3.500   6.781  -5.209
  156   HE22  GLN  26          HE22      GLN  26   4.509   8.055  -4.598
  157    H    VAL  27           H        VAL  27   5.897   0.485  -2.923
  158    HA   VAL  27           HA       VAL  27   5.300  -0.318  -0.247
  159    HB   VAL  27           HB       VAL  27   7.610  -1.207  -2.020
  160   HG11  VAL  27          HG11      VAL  27   6.381  -2.533   0.401
  161   HG12  VAL  27          HG12      VAL  27   7.938  -1.724   0.349
  162   HG13  VAL  27          HG13      VAL  27   7.682  -3.199  -0.591
  163   HG21  VAL  27          HG21      VAL  27   6.211  -3.144  -2.596
  164   HG22  VAL  27          HG22      VAL  27   5.460  -1.631  -3.108
  165   HG23  VAL  27          HG23      VAL  27   4.883  -2.457  -1.662
  166    H    LEU  28           H        LEU  28   5.904   0.939   1.303
  167    HA   LEU  28           HA       LEU  28   8.266   2.631   1.073
  168    HB2  LEU  28           HB2      LEU  28   6.103   2.512   3.177
  169    HB3  LEU  28           HB3      LEU  28   7.373   3.717   3.091
  170    HG   LEU  28           HG       LEU  28   5.225   3.337   0.994
  171   HD11  LEU  28          HD11      LEU  28   5.516   5.449   3.121
  172   HD12  LEU  28          HD12      LEU  28   4.271   4.193   3.054
  173   HD13  LEU  28          HD13      LEU  28   4.332   5.444   1.813
  174   HD21  LEU  28          HD21      LEU  28   6.026   5.487   0.173
  175   HD22  LEU  28          HD22      LEU  28   7.266   4.223   0.090
  176   HD23  LEU  28          HD23      LEU  28   7.306   5.432   1.391
  177    H    ASN  29           H        ASN  29   6.878   0.162   3.140
  178    HA   ASN  29           HA       ASN  29   9.529  -0.469   4.226
  179    HB2  ASN  29           HB2      ASN  29   6.902  -0.591   5.776
  180    HB3  ASN  29           HB3      ASN  29   8.467  -1.062   6.375
  181   HD21  ASN  29          HD21      ASN  29   7.618   1.940   4.725
  182   HD22  ASN  29          HD22      ASN  29   7.941   2.986   6.065
  183    HA   PRO  30           HA       PRO  30   8.316  -4.560   2.897
  184    HB2  PRO  30           HB2      PRO  30   8.603  -5.645   5.647
  185    HB3  PRO  30           HB3      PRO  30   9.370  -6.179   4.147
  186    HG2  PRO  30           HG2      PRO  30  10.790  -4.843   5.931
  187    HG3  PRO  30           HG3      PRO  30  10.966  -4.482   4.204
  188    HD2  PRO  30           HD2      PRO  30   9.437  -2.983   6.302
  189    HD3  PRO  30           HD3      PRO  30  10.488  -2.350   5.016
  190    H    TYR  31           H        TYR  31   6.733  -3.456   5.868
  191    HA   TYR  31           HA       TYR  31   4.444  -5.154   5.108
  192    HB2  TYR  31           HB2      TYR  31   4.872  -3.816   7.789
  193    HB3  TYR  31           HB3      TYR  31   3.686  -5.039   7.381
  194    HD1  TYR  31           HD1      TYR  31   7.259  -4.439   8.053
  195    HD2  TYR  31           HD2      TYR  31   4.271  -7.358   7.329
  196    HE1  TYR  31           HE1      TYR  31   8.823  -6.189   8.759
  197    HE2  TYR  31           HE2      TYR  31   5.826  -9.120   8.026
  198    HH   TYR  31           HH       TYR  31   8.673  -8.502   9.677
  199    H    TYR  32           H        TYR  32   5.525  -1.919   5.641
  200    HA   TYR  32           HA       TYR  32   2.831  -0.894   5.316
  201    HB2  TYR  32           HB2      TYR  32   4.311   0.084   7.064
  202    HB3  TYR  32           HB3      TYR  32   5.369   0.650   5.780
  203    HD1  TYR  32           HD1      TYR  32   5.196   2.904   5.320
  204    HD2  TYR  32           HD2      TYR  32   1.709   0.721   6.454
  205    HE1  TYR  32           HE1      TYR  32   3.901   4.929   5.168
  206    HE2  TYR  32           HE2      TYR  32   0.371   2.762   6.287
  207    HH   TYR  32           HH       TYR  32   1.609   5.674   4.920
  208    H    SER  33           H        SER  33   2.092  -0.600   3.364
  209    HA   SER  33           HA       SER  33   3.826   0.610   1.331
  210    HB2  SER  33           HB2      SER  33   1.701  -1.514   0.810
  211    HB3  SER  33           HB3      SER  33   2.802  -0.810  -0.375
  212    HG   SER  33           HG       SER  33   3.522  -2.892   0.382
  213    H    GLN  34           H        GLN  34   2.725   2.305   0.254
  214    HA   GLN  34           HA       GLN  34  -0.035   2.735   1.131
  215    HB2  GLN  34           HB2      GLN  34   1.214   4.028   2.679
  216    HB3  GLN  34           HB3      GLN  34   2.263   4.656   1.421
  217    HG2  GLN  34           HG2      GLN  34   0.472   6.012   0.546
  218    HG3  GLN  34           HG3      GLN  34  -0.665   5.279   1.670
  219   HE21  GLN  34          HE21      GLN  34  -0.765   6.005   3.735
  220   HE22  GLN  34          HE22      GLN  34   0.147   7.346   4.309
  221    H    CYS  35           H        CYS  35  -1.381   3.615  -0.289
  222    HA   CYS  35           HA       CYS  35  -0.575   3.893  -3.043
  223    HB2  CYS  35           HB2      CYS  35  -3.212   4.677  -1.807
  224    HB3  CYS  35           HB3      CYS  35  -2.867   4.360  -3.502
  225    H    LEU  36           H        LEU  36   0.522   5.640  -3.596
  226    HA   LEU  36           HA       LEU  36  -0.369   8.254  -2.626
  227    HB2  LEU  36           HB2      LEU  36   2.405   7.323  -3.346
  228    HB3  LEU  36           HB3      LEU  36   1.983   8.993  -3.029
  229    HG   LEU  36           HG       LEU  36   1.730   6.754  -1.026
  230   HD11  LEU  36          HD11      LEU  36   3.613   7.817   0.088
  231   HD12  LEU  36          HD12      LEU  36   3.773   8.965  -1.245
  232   HD13  LEU  36          HD13      LEU  36   4.068   7.246  -1.516
  233   HD21  LEU  36          HD21      LEU  36   1.408   9.733  -0.752
  234   HD22  LEU  36          HD22      LEU  36   1.348   8.554   0.555
  235   HD23  LEU  36          HD23      LEU  36   0.109   8.540  -0.691
  236    H1   MAN 101           H1       MAN 101  -8.756   6.067   2.719
  237    H2   MAN 101           H2       MAN 101  -6.746   5.178   3.939
  238    H3   MAN 101           H3       MAN 101  -6.922   2.924   2.991
  239    H4   MAN 101           H4       MAN 101  -9.226   2.606   4.947
  240    H5   MAN 101           H5       MAN 101  -9.246   2.470   1.880
  241    H61  MAN 101           H61      MAN 101 -11.023   1.217   3.133
  242    H62  MAN 101           H62      MAN 101 -11.649   2.477   2.043
  243    HO2  MAN 101           HO2      MAN 101  -8.586   5.874   5.172
  244    HO3  MAN 101           HO3      MAN 101  -6.602   1.789   5.000
  245    HO4  MAN 101           HO4      MAN 101  -9.222   0.473   3.956
  246    HO6  MAN 101           HO6      MAN 101 -11.410   3.846   4.088
  Start of MODEL   14
    1    H1   THR   1           H1       THR   1 -10.906  -1.370  -5.981
    2    H2   THR   1           H2       THR   1 -11.455  -0.323  -4.771
    3    H3   THR   1           H3       THR   1 -10.716  -1.770  -4.336
    4    HA   THR   1           HA       THR   1  -8.665  -0.960  -5.359
    5    HB   THR   1           HB       THR   1  -8.621   1.559  -5.654
    6    HG1  THR   1           HG1      THR   1 -10.546   2.239  -4.802
    7   HG21  THR   1          HG21      THR   1  -8.563   0.007  -7.574
    8   HG22  THR   1          HG22      THR   1  -9.454   1.485  -7.949
    9   HG23  THR   1          HG23      THR   1 -10.330   0.002  -7.601
   10    H    GLN   2           H        GLN   2  -7.197   0.281  -4.062
   11    HA   GLN   2           HA       GLN   2  -8.090   0.657  -1.327
   12    HB2  GLN   2           HB2      GLN   2  -6.103  -0.788  -1.883
   13    HB3  GLN   2           HB3      GLN   2  -5.310   0.633  -2.512
   14    HG2  GLN   2           HG2      GLN   2  -4.614  -0.095  -0.208
   15    HG3  GLN   2           HG3      GLN   2  -5.089   1.593  -0.370
   16   HE21  GLN   2          HE21      GLN   2  -6.682   2.320   0.798
   17   HE22  GLN   2          HE22      GLN   2  -7.636   1.379   1.915
   18    H    SER   3           H        SER   3  -8.150   2.610  -0.429
   19    HA   SER   3           HA       SER   3  -8.275   4.879  -2.043
   20    HB2  SER   3           HB2      SER   3  -8.764   6.029   0.090
   21    HB3  SER   3           HB3      SER   3  -9.702   4.545  -0.099
   22    H    HIS   4           H        HIS   4  -7.168   6.809  -1.705
   23    HA   HIS   4           HA       HIS   4  -4.342   6.658  -1.898
   24    HB2  HIS   4           HB2      HIS   4  -5.867   8.413  -2.939
   25    HB3  HIS   4           HB3      HIS   4  -6.054   9.095  -1.339
   26    HD1  HIS   4           HD1      HIS   4  -5.046  11.346  -2.182
   27    HD2  HIS   4           HD2      HIS   4  -2.481   8.107  -2.503
   28    HE1  HIS   4           HE1      HIS   4  -2.812  12.322  -2.689
   29    HE2  HIS   4           HE2      HIS   4  -1.421  10.323  -3.281
   30    H    TYR   5           H        TYR   5  -2.814   6.869  -0.309
   31    HA   TYR   5           HA       TYR   5  -1.845   7.043   1.651
   32    HB2  TYR   5           HB2      TYR   5  -4.286   8.594   2.372
   33    HB3  TYR   5           HB3      TYR   5  -3.107   8.196   3.623
   34    HD1  TYR   5           HD1      TYR   5  -0.787   9.009   3.356
   35    HD2  TYR   5           HD2      TYR   5  -3.914  10.393   0.848
   36    HE1  TYR   5           HE1      TYR   5   0.584  10.930   2.740
   37    HE2  TYR   5           HE2      TYR   5  -2.541  12.338   0.216
   38    HH   TYR   5           HH       TYR   5   0.815  12.541   1.117
   39    H    GLY   6           H        GLY   6  -4.186   5.102   0.953
   40    HA2  GLY   6           HA2      GLY   6  -4.472   3.798   3.525
   41    HA3  GLY   6           HA3      GLY   6  -5.154   3.289   1.984
   42    H    GLN   7           H        GLN   7  -3.684   1.678   3.868
   43    HA   GLN   7           HA       GLN   7  -1.078   1.181   2.837
   44    HB2  GLN   7           HB2      GLN   7  -1.889   0.583   5.145
   45    HB3  GLN   7           HB3      GLN   7  -2.893  -0.658   4.417
   46    HG2  GLN   7           HG2      GLN   7  -0.893  -1.791   3.599
   47    HG3  GLN   7           HG3      GLN   7   0.121  -0.548   4.328
   48   HE21  GLN   7          HE21      GLN   7   0.165  -3.342   4.933
   49   HE22  GLN   7          HE22      GLN   7  -0.319  -3.527   6.574
   50    H    CYS   8           H        CYS   8  -0.618   0.077   1.012
   51    HA   CYS   8           HA       CYS   8  -2.894  -1.166  -0.378
   52    HB2  CYS   8           HB2      CYS   8  -1.592  -0.818  -2.415
   53    HB3  CYS   8           HB3      CYS   8  -1.981   0.661  -1.545
   54    H    GLY   9           H        GLY   9  -0.702  -2.441   1.484
   55    HA2  GLY   9           HA2      GLY   9  -0.861  -4.963   1.149
   56    HA3  GLY   9           HA3      GLY   9  -0.329  -4.610  -0.480
   57    H    GLY  10           H        GLY  10   0.585  -4.460   2.848
   58    HA2  GLY  10           HA2      GLY  10   3.365  -4.830   2.029
   59    HA3  GLY  10           HA3      GLY  10   2.815  -4.436   3.670
   60    H    ILE  11           H        ILE  11   4.401  -6.562   3.621
   61    HA   ILE  11           HA       ILE  11   3.065  -8.995   3.154
   62    HB   ILE  11           HB       ILE  11   5.297  -8.386   5.125
   63   HG12  ILE  11          HG12      ILE  11   5.416  -9.520   2.318
   64   HG13  ILE  11          HG13      ILE  11   5.864  -7.881   2.777
   65   HG21  ILE  11          HG21      ILE  11   5.768 -10.796   5.072
   66   HG22  ILE  11          HG22      ILE  11   4.346 -11.048   4.062
   67   HG23  ILE  11          HG23      ILE  11   4.160 -10.456   5.713
   68   HD11  ILE  11          HD11      ILE  11   7.215 -10.400   3.716
   69   HD12  ILE  11          HD12      ILE  11   7.677  -8.752   4.147
   70   HD13  ILE  11          HD13      ILE  11   7.812  -9.298   2.474
   71    H    GLY  12           H        GLY  12   1.253  -9.611   4.096
   72    HA2  GLY  12           HA2      GLY  12   0.277 -10.455   6.163
   73    HA3  GLY  12           HA3      GLY  12   0.895  -9.023   6.957
   74    H    TYR  13           H        TYR  13  -0.094  -7.830   4.122
   75    HA   TYR  13           HA       TYR  13  -2.653  -7.052   5.326
   76    HB2  TYR  13           HB2      TYR  13  -1.053  -5.257   4.629
   77    HB3  TYR  13           HB3      TYR  13  -1.231  -5.802   2.970
   78    HD1  TYR  13           HD1      TYR  13  -3.349  -4.693   5.837
   79    HD2  TYR  13           HD2      TYR  13  -2.778  -4.630   1.621
   80    HE1  TYR  13           HE1      TYR  13  -5.241  -3.139   5.605
   81    HE2  TYR  13           HE2      TYR  13  -4.684  -3.065   1.394
   82    HH   TYR  13           HH       TYR  13  -6.339  -2.052   2.432
   83    H    SER  14           H        SER  14  -4.286  -8.301   4.768
   84    HA   SER  14           HA       SER  14  -4.398  -9.451   2.095
   85    HB2  SER  14           HB2      SER  14  -6.058  -9.992   4.551
   86    HB3  SER  14           HB3      SER  14  -6.011 -10.965   3.080
   87    HG   SER  14           HG       SER  14  -4.648 -11.472   5.066
   88    H    GLY  15           H        GLY  15  -5.088  -6.617   2.985
   89    HA2  GLY  15           HA2      GLY  15  -7.929  -6.479   2.299
   90    HA3  GLY  15           HA3      GLY  15  -6.940  -5.133   2.869
   91    HA   PRO  16           HA       PRO  16  -7.559  -4.689  -1.751
   92    HB2  PRO  16           HB2      PRO  16  -7.513  -1.848  -0.859
   93    HB3  PRO  16           HB3      PRO  16  -8.591  -2.637  -2.017
   94    HG2  PRO  16           HG2      PRO  16  -9.450  -1.997   0.405
   95    HG3  PRO  16           HG3      PRO  16  -9.933  -3.532  -0.343
   96    HD2  PRO  16           HD2      PRO  16  -7.878  -3.019   1.780
   97    HD3  PRO  16           HD3      PRO  16  -9.053  -4.345   1.639
   98    H    THR  17           H        THR  17  -5.659  -5.024  -2.692
   99    HA   THR  17           HA       THR  17  -3.328  -3.547  -1.806
  100    HB   THR  17           HB       THR  17  -2.169  -5.406  -3.149
  101    HG1  THR  17           HG1      THR  17  -3.428  -7.245  -3.431
  102   HG21  THR  17          HG21      THR  17  -2.319  -6.951  -1.249
  103   HG22  THR  17          HG22      THR  17  -3.791  -6.135  -0.708
  104   HG23  THR  17          HG23      THR  17  -2.256  -5.275  -0.686
  105    H    VAL  18           H        VAL  18  -5.598  -3.381  -4.105
  106    HA   VAL  18           HA       VAL  18  -3.757  -2.367  -6.179
  107    HB   VAL  18           HB       VAL  18  -6.684  -3.152  -6.479
  108   HG11  VAL  18          HG11      VAL  18  -6.081  -1.366  -8.028
  109   HG12  VAL  18          HG12      VAL  18  -6.321  -2.885  -8.894
  110   HG13  VAL  18          HG13      VAL  18  -4.689  -2.298  -8.579
  111   HG21  VAL  18          HG21      VAL  18  -5.237  -5.099  -6.161
  112   HG22  VAL  18          HG22      VAL  18  -4.192  -4.547  -7.465
  113   HG23  VAL  18          HG23      VAL  18  -5.851  -5.035  -7.811
  114    H    CYS  19           H        CYS  19  -3.509  -0.224  -6.103
  115    HA   CYS  19           HA       CYS  19  -5.188   1.436  -4.554
  116    HB2  CYS  19           HB2      CYS  19  -2.964   2.089  -6.471
  117    HB3  CYS  19           HB3      CYS  19  -3.709   3.209  -5.338
  118    H    ALA  20           H        ALA  20  -6.301   3.305  -5.266
  119    HA   ALA  20           HA       ALA  20  -8.048   2.894  -7.438
  120    HB1  ALA  20           HB1      ALA  20  -7.482   5.426  -5.888
  121    HB2  ALA  20           HB2      ALA  20  -8.668   4.195  -5.455
  122    HB3  ALA  20           HB3      ALA  20  -8.878   5.140  -6.928
  123    H    SER  21           H        SER  21  -8.280   4.175  -9.342
  124    HA   SER  21           HA       SER  21  -6.024   4.362 -10.915
  125    HB2  SER  21           HB2      SER  21  -8.621   5.875 -11.252
  126    HB3  SER  21           HB3      SER  21  -7.486   5.425 -12.529
  127    HG   SER  21           HG       SER  21  -7.882   3.196 -11.672
  128    H    GLY  22           H        GLY  22  -4.380   5.746 -10.858
  129    HA2  GLY  22           HA2      GLY  22  -3.605   8.009 -11.149
  130    HA3  GLY  22           HA3      GLY  22  -4.870   8.534 -10.048
  131    H    THR  23           H        THR  23  -4.160   6.041  -8.381
  132    HA   THR  23           HA       THR  23  -1.880   7.312  -7.057
  133    HB   THR  23           HB       THR  23  -2.607   6.180  -4.990
  134    HG1  THR  23           HG1      THR  23  -4.543   5.108  -6.724
  135   HG21  THR  23          HG21      THR  23  -3.352   8.463  -5.406
  136   HG22  THR  23          HG22      THR  23  -4.606   7.559  -4.558
  137   HG23  THR  23          HG23      THR  23  -4.753   7.860  -6.289
  138    H    THR  24           H        THR  24  -0.159   6.049  -6.376
  139    HA   THR  24           HA       THR  24  -0.062   3.414  -7.673
  140    HB   THR  24           HB       THR  24   2.431   3.742  -7.664
  141    HG1  THR  24           HG1      THR  24   1.637   6.212  -6.547
  142   HG21  THR  24          HG21      THR  24   0.819   5.793  -9.182
  143   HG22  THR  24          HG22      THR  24   1.083   4.125  -9.678
  144   HG23  THR  24          HG23      THR  24   2.442   5.249  -9.609
  145    H    CYS  25           H        CYS  25   0.804   1.674  -6.532
  146    HA   CYS  25           HA       CYS  25   0.703   2.001  -3.671
  147    HB2  CYS  25           HB2      CYS  25  -0.374   0.057  -4.614
  148    HB3  CYS  25           HB3      CYS  25   1.135  -0.459  -5.375
  149    H    GLN  26           H        GLN  26   2.423   2.731  -2.705
  150    HA   GLN  26           HA       GLN  26   5.020   1.968  -3.778
  151    HB2  GLN  26           HB2      GLN  26   4.226   4.276  -2.015
  152    HB3  GLN  26           HB3      GLN  26   5.858   3.964  -2.582
  153    HG2  GLN  26           HG2      GLN  26   5.034   4.196  -4.918
  154    HG3  GLN  26           HG3      GLN  26   3.446   4.600  -4.282
  155   HE21  GLN  26          HE21      GLN  26   3.419   6.581  -5.222
  156   HE22  GLN  26          HE22      GLN  26   4.412   7.898  -4.719
  157    H    VAL  27           H        VAL  27   5.851   0.315  -2.763
  158    HA   VAL  27           HA       VAL  27   5.132  -0.354  -0.070
  159    HB   VAL  27           HB       VAL  27   7.316  -1.549  -1.815
  160   HG11  VAL  27          HG11      VAL  27   5.967  -2.667   0.630
  161   HG12  VAL  27          HG12      VAL  27   7.617  -2.059   0.535
  162   HG13  VAL  27          HG13      VAL  27   7.157  -3.508  -0.366
  163   HG21  VAL  27          HG21      VAL  27   5.709  -3.334  -2.347
  164   HG22  VAL  27          HG22      VAL  27   5.150  -1.757  -2.915
  165   HG23  VAL  27          HG23      VAL  27   4.461  -2.461  -1.455
  166    H    LEU  28           H        LEU  28   5.834   0.978   1.372
  167    HA   LEU  28           HA       LEU  28   8.288   2.473   1.075
  168    HB2  LEU  28           HB2      LEU  28   6.205   2.454   3.263
  169    HB3  LEU  28           HB3      LEU  28   7.513   3.613   3.117
  170    HG   LEU  28           HG       LEU  28   5.319   3.280   1.060
  171   HD11  LEU  28          HD11      LEU  28   5.630   5.390   3.190
  172   HD12  LEU  28          HD12      LEU  28   4.381   4.137   3.128
  173   HD13  LEU  28          HD13      LEU  28   4.434   5.387   1.894
  174   HD21  LEU  28          HD21      LEU  28   7.443   5.345   1.444
  175   HD22  LEU  28          HD22      LEU  28   6.153   5.420   0.235
  176   HD23  LEU  28          HD23      LEU  28   7.381   4.145   0.148
  177    H    ASN  29           H        ASN  29   6.950  -0.011   3.111
  178    HA   ASN  29           HA       ASN  29   9.622  -0.725   4.037
  179    HB2  ASN  29           HB2      ASN  29   7.143  -0.552   5.820
  180    HB3  ASN  29           HB3      ASN  29   8.710  -1.181   6.293
  181   HD21  ASN  29          HD21      ASN  29   6.875   1.696   5.631
  182   HD22  ASN  29          HD22      ASN  29   7.990   2.823   6.267
  183    HA   PRO  30           HA       PRO  30   8.314  -4.752   2.777
  184    HB2  PRO  30           HB2      PRO  30   8.695  -5.815   5.534
  185    HB3  PRO  30           HB3      PRO  30   9.359  -6.400   4.006
  186    HG2  PRO  30           HG2      PRO  30  10.898  -5.066   5.691
  187    HG3  PRO  30           HG3      PRO  30  11.016  -4.760   3.950
  188    HD2  PRO  30           HD2      PRO  30   9.680  -3.144   6.080
  189    HD3  PRO  30           HD3      PRO  30  10.630  -2.584   4.689
  190    H    TYR  31           H        TYR  31   6.865  -3.616   5.764
  191    HA   TYR  31           HA       TYR  31   4.525  -5.288   5.138
  192    HB2  TYR  31           HB2      TYR  31   5.166  -4.009   7.811
  193    HB3  TYR  31           HB3      TYR  31   3.924  -5.208   7.473
  194    HD1  TYR  31           HD1      TYR  31   4.554  -7.574   7.084
  195    HD2  TYR  31           HD2      TYR  31   7.451  -4.643   8.064
  196    HE1  TYR  31           HE1      TYR  31   6.182  -9.364   7.596
  197    HE2  TYR  31           HE2      TYR  31   9.069  -6.396   8.580
  198    HH   TYR  31           HH       TYR  31   8.627  -9.639   7.713
  199    H    TYR  32           H        TYR  32   5.640  -2.028   5.597
  200    HA   TYR  32           HA       TYR  32   2.929  -1.016   5.371
  201    HB2  TYR  32           HB2      TYR  32   4.370  -0.018   7.101
  202    HB3  TYR  32           HB3      TYR  32   5.465   0.528   5.837
  203    HD1  TYR  32           HD1      TYR  32   5.315   2.801   5.367
  204    HD2  TYR  32           HD2      TYR  32   1.785   0.645   6.431
  205    HE1  TYR  32           HE1      TYR  32   4.031   4.834   5.187
  206    HE2  TYR  32           HE2      TYR  32   0.475   2.712   6.240
  207    HH   TYR  32           HH       TYR  32   0.757   5.055   6.283
  208    H    SER  33           H        SER  33   2.128  -0.692   3.425
  209    HA   SER  33           HA       SER  33   3.832   0.537   1.377
  210    HB2  SER  33           HB2      SER  33   1.625  -1.492   0.887
  211    HB3  SER  33           HB3      SER  33   2.732  -0.821  -0.311
  212    HG   SER  33           HG       SER  33   3.296  -2.957   0.445
  213    H    GLN  34           H        GLN  34   2.707   2.256   0.299
  214    HA   GLN  34           HA       GLN  34  -0.030   2.687   1.229
  215    HB2  GLN  34           HB2      GLN  34   1.241   4.010   2.754
  216    HB3  GLN  34           HB3      GLN  34   2.251   4.647   1.469
  217    HG2  GLN  34           HG2      GLN  34   0.403   5.950   0.612
  218    HG3  GLN  34           HG3      GLN  34  -0.672   5.203   1.789
  219   HE21  GLN  34          HE21      GLN  34  -0.816   6.063   3.803
  220   HE22  GLN  34          HE22      GLN  34   0.137   7.390   4.349
  221    H    CYS  35           H        CYS  35  -1.407   3.529  -0.202
  222    HA   CYS  35           HA       CYS  35  -0.619   3.805  -2.945
  223    HB2  CYS  35           HB2      CYS  35  -3.240   4.467  -1.592
  224    HB3  CYS  35           HB3      CYS  35  -2.956   4.504  -3.329
  225    H    LEU  36           H        LEU  36   0.383   5.511  -3.642
  226    HA   LEU  36           HA       LEU  36  -0.497   8.138  -2.751
  227    HB2  LEU  36           HB2      LEU  36   2.314   7.208  -3.306
  228    HB3  LEU  36           HB3      LEU  36   1.861   8.894  -3.166
  229    HG   LEU  36           HG       LEU  36   1.564   6.847  -0.965
  230   HD11  LEU  36          HD11      LEU  36   3.409   8.013   0.096
  231   HD12  LEU  36          HD12      LEU  36   3.562   9.060  -1.315
  232   HD13  LEU  36          HD13      LEU  36   3.899   7.334  -1.457
  233   HD21  LEU  36          HD21      LEU  36   1.173   9.838  -0.994
  234   HD22  LEU  36          HD22      LEU  36   1.135   8.817   0.441
  235   HD23  LEU  36          HD23      LEU  36  -0.092   8.619  -0.807
  236    H1   MAN 101           H1       MAN 101  -9.302   5.842   2.327
  237    H2   MAN 101           H2       MAN 101  -7.271   5.220   3.621
  238    H3   MAN 101           H3       MAN 101  -7.202   2.874   3.012
  239    H4   MAN 101           H4       MAN 101  -9.710   2.703   4.744
  240    H5   MAN 101           H5       MAN 101  -9.363   2.233   1.717
  241    H61  MAN 101           H61      MAN 101 -11.731   2.071   3.617
  242    H62  MAN 101           H62      MAN 101 -11.105   0.754   2.600
  243    HO2  MAN 101           HO2      MAN 101  -9.206   5.963   4.670
  244    HO3  MAN 101           HO3      MAN 101  -6.810   2.072   5.119
  245    HO4  MAN 101           HO4      MAN 101  -8.353   0.924   4.953
  246    HO6  MAN 101           HO6      MAN 101 -11.966   3.237   1.512
  Start of MODEL   15
    1    H1   THR   1           H1       THR   1 -11.278  -1.340  -5.857
    2    H2   THR   1           H2       THR   1 -11.713  -0.173  -4.718
    3    H3   THR   1           H3       THR   1 -11.034  -1.633  -4.179
    4    HA   THR   1           HA       THR   1  -9.007  -0.941  -5.349
    5    HB   THR   1           HB       THR   1  -9.115   1.646  -5.730
    6    HG1  THR   1           HG1      THR   1 -11.267   2.227  -6.478
    7   HG21  THR   1          HG21      THR   1 -10.400  -0.293  -7.674
    8   HG22  THR   1          HG22      THR   1  -8.664  -0.019  -7.497
    9   HG23  THR   1          HG23      THR   1  -9.704   1.276  -8.087
   10    H    GLN   2           H        GLN   2  -7.462   0.039  -4.074
   11    HA   GLN   2           HA       GLN   2  -8.257   0.591  -1.375
   12    HB2  GLN   2           HB2      GLN   2  -6.328  -0.892  -1.803
   13    HB3  GLN   2           HB3      GLN   2  -5.516   0.410  -2.656
   14    HG2  GLN   2           HG2      GLN   2  -4.708   0.100  -0.356
   15    HG3  GLN   2           HG3      GLN   2  -5.361   1.705  -0.678
   16   HE21  GLN   2          HE21      GLN   2  -5.961   2.212   1.196
   17   HE22  GLN   2          HE22      GLN   2  -7.167   1.462   2.208
   18    H    SER   3           H        SER   3  -7.994   2.565  -0.343
   19    HA   SER   3           HA       SER   3  -8.300   4.795  -2.051
   20    HB2  SER   3           HB2      SER   3  -8.716   6.005  -0.011
   21    HB3  SER   3           HB3      SER   3  -9.596   4.481   0.031
   22    H    HIS   4           H        HIS   4  -7.199   6.737  -1.679
   23    HA   HIS   4           HA       HIS   4  -4.351   6.615  -1.977
   24    HB2  HIS   4           HB2      HIS   4  -5.884   8.298  -3.061
   25    HB3  HIS   4           HB3      HIS   4  -6.138   9.023  -1.486
   26    HD1  HIS   4           HD1      HIS   4  -5.241  11.248  -2.530
   27    HD2  HIS   4           HD2      HIS   4  -2.458   8.178  -2.438
   28    HE1  HIS   4           HE1      HIS   4  -3.038  12.330  -3.038
   29    HE2  HIS   4           HE2      HIS   4  -1.436  10.408  -3.247
   30    H    TYR   5           H        TYR   5  -2.806   6.887  -0.429
   31    HA   TYR   5           HA       TYR   5  -1.800   7.101   1.499
   32    HB2  TYR   5           HB2      TYR   5  -4.184   8.742   2.177
   33    HB3  TYR   5           HB3      TYR   5  -3.064   8.303   3.459
   34    HD1  TYR   5           HD1      TYR   5  -3.514  10.333   0.417
   35    HD2  TYR   5           HD2      TYR   5  -0.835   9.166   3.493
   36    HE1  TYR   5           HE1      TYR   5  -2.011  12.190  -0.183
   37    HE2  TYR   5           HE2      TYR   5   0.655  10.992   2.922
   38    HH   TYR   5           HH       TYR   5   1.173  12.381   1.050
   39    H    GLY   6           H        GLY   6  -4.085   5.129   0.888
   40    HA2  GLY   6           HA2      GLY   6  -4.295   3.969   3.540
   41    HA3  GLY   6           HA3      GLY   6  -5.130   3.466   2.091
   42    H    GLN   7           H        GLN   7  -3.749   1.672   3.728
   43    HA   GLN   7           HA       GLN   7  -1.143   1.183   2.690
   44    HB2  GLN   7           HB2      GLN   7  -1.964   0.597   5.010
   45    HB3  GLN   7           HB3      GLN   7  -2.928  -0.674   4.277
   46    HG2  GLN   7           HG2      GLN   7  -0.916  -1.780   3.508
   47    HG3  GLN   7           HG3      GLN   7   0.076  -0.475   4.158
   48   HE21  GLN   7          HE21      GLN   7   0.203  -3.257   4.851
   49   HE22  GLN   7          HE22      GLN   7  -0.144  -3.349   6.532
   50    H    CYS   8           H        CYS   8  -0.643  -0.043   0.963
   51    HA   CYS   8           HA       CYS   8  -2.946  -1.179  -0.491
   52    HB2  CYS   8           HB2      CYS   8  -1.589  -0.871  -2.496
   53    HB3  CYS   8           HB3      CYS   8  -2.000   0.617  -1.650
   54    H    GLY   9           H        GLY   9  -0.498  -2.394   1.281
   55    HA2  GLY   9           HA2      GLY   9  -0.783  -4.955   0.890
   56    HA3  GLY   9           HA3      GLY   9  -0.124  -4.551  -0.681
   57    H    GLY  10           H        GLY  10   0.493  -4.599   2.708
   58    HA2  GLY  10           HA2      GLY  10   3.349  -4.828   2.138
   59    HA3  GLY  10           HA3      GLY  10   2.637  -4.555   3.737
   60    H    ILE  11           H        ILE  11   4.324  -6.616   3.616
   61    HA   ILE  11           HA       ILE  11   3.271  -9.104   2.889
   62    HB   ILE  11           HB       ILE  11   5.023  -8.545   5.297
   63   HG12  ILE  11          HG12      ILE  11   5.894  -9.177   2.470
   64   HG13  ILE  11          HG13      ILE  11   5.935  -7.567   3.182
   65   HG21  ILE  11          HG21      ILE  11   4.077 -10.787   5.255
   66   HG22  ILE  11          HG22      ILE  11   5.817 -10.838   4.967
   67   HG23  ILE  11          HG23      ILE  11   4.693 -11.036   3.619
   68   HD11  ILE  11          HD11      ILE  11   7.445  -9.970   4.151
   69   HD12  ILE  11          HD12      ILE  11   7.495  -8.363   4.875
   70   HD13  ILE  11          HD13      ILE  11   8.126  -8.614   3.244
   71    H    GLY  12           H        GLY  12   1.443 -10.024   3.585
   72    HA2  GLY  12           HA2      GLY  12   0.170 -11.075   5.252
   73    HA3  GLY  12           HA3      GLY  12   0.815  -9.941   6.426
   74    H    TYR  13           H        TYR  13  -0.037  -8.094   3.863
   75    HA   TYR  13           HA       TYR  13  -2.346  -7.097   5.264
   76    HB2  TYR  13           HB2      TYR  13  -0.732  -5.581   4.150
   77    HB3  TYR  13           HB3      TYR  13  -1.217  -6.240   2.596
   78    HD1  TYR  13           HD1      TYR  13  -2.817  -5.071   1.372
   79    HD2  TYR  13           HD2      TYR  13  -2.716  -4.576   5.593
   80    HE1  TYR  13           HE1      TYR  13  -4.528  -3.328   1.209
   81    HE2  TYR  13           HE2      TYR  13  -4.432  -2.830   5.434
   82    HH   TYR  13           HH       TYR  13  -6.120  -2.173   2.478
   83    H    SER  14           H        SER  14  -4.237  -8.028   5.127
   84    HA   SER  14           HA       SER  14  -4.914  -9.557   2.760
   85    HB2  SER  14           HB2      SER  14  -6.211  -9.424   5.485
   86    HB3  SER  14           HB3      SER  14  -6.684 -10.518   4.180
   87    HG   SER  14           HG       SER  14  -4.403 -11.158   4.218
   88    H    GLY  15           H        GLY  15  -5.276  -6.465   3.643
   89    HA2  GLY  15           HA2      GLY  15  -7.996  -6.099   2.776
   90    HA3  GLY  15           HA3      GLY  15  -6.841  -4.823   3.159
   91    HA   PRO  16           HA       PRO  16  -7.557  -5.109  -1.503
   92    HB2  PRO  16           HB2      PRO  16  -7.769  -2.168  -1.119
   93    HB3  PRO  16           HB3      PRO  16  -8.804  -3.247  -2.064
   94    HG2  PRO  16           HG2      PRO  16  -9.661  -2.240   0.229
   95    HG3  PRO  16           HG3      PRO  16 -10.001  -3.933  -0.186
   96    HD2  PRO  16           HD2      PRO  16  -7.903  -2.824   1.649
   97    HD3  PRO  16           HD3      PRO  16  -8.993  -4.206   1.900
   98    H    THR  17           H        THR  17  -5.788  -5.152  -2.752
   99    HA   THR  17           HA       THR  17  -3.434  -3.587  -1.960
  100    HB   THR  17           HB       THR  17  -2.275  -5.345  -3.408
  101    HG1  THR  17           HG1      THR  17  -3.611  -6.639  -4.395
  102   HG21  THR  17          HG21      THR  17  -2.159  -5.337  -0.973
  103   HG22  THR  17          HG22      THR  17  -2.298  -6.996  -1.563
  104   HG23  THR  17          HG23      THR  17  -3.705  -6.173  -0.878
  105    H    VAL  18           H        VAL  18  -5.844  -3.510  -4.172
  106    HA   VAL  18           HA       VAL  18  -4.110  -2.523  -6.315
  107    HB   VAL  18           HB       VAL  18  -7.083  -3.162  -6.389
  108   HG11  VAL  18          HG11      VAL  18  -5.231  -2.350  -8.640
  109   HG12  VAL  18          HG12      VAL  18  -6.513  -1.357  -7.943
  110   HG13  VAL  18          HG13      VAL  18  -6.919  -2.838  -8.811
  111   HG21  VAL  18          HG21      VAL  18  -5.650  -5.144  -6.220
  112   HG22  VAL  18          HG22      VAL  18  -4.739  -4.593  -7.626
  113   HG23  VAL  18          HG23      VAL  18  -6.432  -5.044  -7.797
  114    H    CYS  19           H        CYS  19  -3.677  -0.460  -6.124
  115    HA   CYS  19           HA       CYS  19  -5.132   1.339  -4.538
  116    HB2  CYS  19           HB2      CYS  19  -2.987   1.748  -6.600
  117    HB3  CYS  19           HB3      CYS  19  -3.618   3.019  -5.565
  118    H    ALA  20           H        ALA  20  -6.256   3.194  -5.133
  119    HA   ALA  20           HA       ALA  20  -8.057   2.998  -7.267
  120    HB1  ALA  20           HB1      ALA  20  -8.507   4.310  -5.250
  121    HB2  ALA  20           HB2      ALA  20  -8.646   5.316  -6.692
  122    HB3  ALA  20           HB3      ALA  20  -7.210   5.425  -5.675
  123    H    SER  21           H        SER  21  -8.158   4.239  -9.187
  124    HA   SER  21           HA       SER  21  -5.773   4.305 -10.628
  125    HB2  SER  21           HB2      SER  21  -8.380   5.687 -11.254
  126    HB3  SER  21           HB3      SER  21  -7.123   5.225 -12.408
  127    HG   SER  21           HG       SER  21  -7.449   3.043 -11.553
  128    H    GLY  22           H        GLY  22  -4.236   5.713 -10.769
  129    HA2  GLY  22           HA2      GLY  22  -3.523   7.983 -11.067
  130    HA3  GLY  22           HA3      GLY  22  -4.774   8.473  -9.927
  131    H    THR  23           H        THR  23  -3.972   5.929  -8.359
  132    HA   THR  23           HA       THR  23  -1.704   7.229  -7.039
  133    HB   THR  23           HB       THR  23  -2.367   6.079  -4.952
  134    HG1  THR  23           HG1      THR  23  -4.367   4.941  -6.612
  135   HG21  THR  23          HG21      THR  23  -3.273   8.289  -5.344
  136   HG22  THR  23          HG22      THR  23  -4.459   7.291  -4.508
  137   HG23  THR  23          HG23      THR  23  -4.628   7.601  -6.239
  138    H    THR  24           H        THR  24   0.006   5.938  -6.274
  139    HA   THR  24           HA       THR  24   0.227   3.387  -7.691
  140    HB   THR  24           HB       THR  24   2.737   3.842  -7.536
  141    HG1  THR  24           HG1      THR  24   1.724   6.208  -6.420
  142   HG21  THR  24          HG21      THR  24   2.749   5.339  -9.489
  143   HG22  THR  24          HG22      THR  24   1.065   5.759  -9.176
  144   HG23  THR  24          HG23      THR  24   1.490   4.112  -9.639
  145    H    CYS  25           H        CYS  25   0.962   1.623  -6.523
  146    HA   CYS  25           HA       CYS  25   0.786   1.901  -3.653
  147    HB2  CYS  25           HB2      CYS  25  -0.233  -0.067  -4.668
  148    HB3  CYS  25           HB3      CYS  25   1.311  -0.590  -5.327
  149    H    GLN  26           H        GLN  26   2.450   2.791  -2.714
  150    HA   GLN  26           HA       GLN  26   5.092   2.093  -3.685
  151    HB2  GLN  26           HB2      GLN  26   4.129   4.430  -2.060
  152    HB3  GLN  26           HB3      GLN  26   5.818   4.141  -2.455
  153    HG2  GLN  26           HG2      GLN  26   5.277   4.272  -4.837
  154    HG3  GLN  26           HG3      GLN  26   3.586   4.551  -4.435
  155   HE21  GLN  26          HE21      GLN  26   3.545   6.482  -5.467
  156   HE22  GLN  26          HE22      GLN  26   4.320   7.904  -4.848
  157    H    VAL  27           H        VAL  27   6.035   0.590  -2.662
  158    HA   VAL  27           HA       VAL  27   5.450  -0.204   0.002
  159    HB   VAL  27           HB       VAL  27   7.787  -0.948  -1.803
  160   HG11  VAL  27          HG11      VAL  27   6.754  -2.298   0.683
  161   HG12  VAL  27          HG12      VAL  27   8.270  -1.416   0.542
  162   HG13  VAL  27          HG13      VAL  27   8.034  -2.916  -0.362
  163   HG21  VAL  27          HG21      VAL  27   6.522  -2.984  -2.279
  164   HG22  VAL  27          HG22      VAL  27   5.644  -1.540  -2.788
  165   HG23  VAL  27          HG23      VAL  27   5.182  -2.374  -1.305
  166    H    LEU  28           H        LEU  28   5.961   1.102   1.564
  167    HA   LEU  28           HA       LEU  28   8.287   2.847   1.373
  168    HB2  LEU  28           HB2      LEU  28   6.087   2.706   3.439
  169    HB3  LEU  28           HB3      LEU  28   7.312   3.960   3.338
  170    HG   LEU  28           HG       LEU  28   5.170   3.437   1.263
  171   HD11  LEU  28          HD11      LEU  28   5.451   5.662   3.259
  172   HD12  LEU  28          HD12      LEU  28   4.218   4.390   3.258
  173   HD13  LEU  28          HD13      LEU  28   4.264   5.584   1.961
  174   HD21  LEU  28          HD21      LEU  28   5.935   5.524   0.269
  175   HD22  LEU  28          HD22      LEU  28   7.208   4.293   0.283
  176   HD23  LEU  28          HD23      LEU  28   7.218   5.597   1.477
  177    H    ASN  29           H        ASN  29   6.999   0.159   3.102
  178    HA   ASN  29           HA       ASN  29   9.605  -0.511   4.185
  179    HB2  ASN  29           HB2      ASN  29   7.038  -0.517   5.848
  180    HB3  ASN  29           HB3      ASN  29   8.591  -1.155   6.338
  181   HD21  ASN  29          HD21      ASN  29   6.750   1.759   5.800
  182   HD22  ASN  29          HD22      ASN  29   7.806   2.821   6.646
  183    HA   PRO  30           HA       PRO  30   8.303  -4.427   2.571
  184    HB2  PRO  30           HB2      PRO  30   8.674  -5.713   5.231
  185    HB3  PRO  30           HB3      PRO  30   9.362  -6.161   3.666
  186    HG2  PRO  30           HG2      PRO  30  10.878  -4.969   5.479
  187    HG3  PRO  30           HG3      PRO  30  11.005  -4.508   3.773
  188    HD2  PRO  30           HD2      PRO  30   9.615  -3.105   6.018
  189    HD3  PRO  30           HD3      PRO  30  10.592  -2.408   4.713
  190    H    TYR  31           H        TYR  31   6.912  -3.605   5.689
  191    HA   TYR  31           HA       TYR  31   4.553  -5.207   4.984
  192    HB2  TYR  31           HB2      TYR  31   5.330  -4.042   7.670
  193    HB3  TYR  31           HB3      TYR  31   3.943  -5.080   7.359
  194    HD1  TYR  31           HD1      TYR  31   7.639  -4.972   7.448
  195    HD2  TYR  31           HD2      TYR  31   4.196  -7.466   7.246
  196    HE1  TYR  31           HE1      TYR  31   9.046  -6.916   7.840
  197    HE2  TYR  31           HE2      TYR  31   5.601  -9.429   7.645
  198    HH   TYR  31           HH       TYR  31   8.785  -9.232   8.713
  199    H    TYR  32           H        TYR  32   5.635  -1.953   5.555
  200    HA   TYR  32           HA       TYR  32   2.900  -0.993   5.355
  201    HB2  TYR  32           HB2      TYR  32   4.284  -0.022   7.124
  202    HB3  TYR  32           HB3      TYR  32   5.407   0.574   5.909
  203    HD1  TYR  32           HD1      TYR  32   1.739   0.661   6.565
  204    HD2  TYR  32           HD2      TYR  32   5.221   2.838   5.390
  205    HE1  TYR  32           HE1      TYR  32   0.426   2.719   6.462
  206    HE2  TYR  32           HE2      TYR  32   3.931   4.868   5.305
  207    HH   TYR  32           HH       TYR  32   0.759   5.055   6.593
  208    H    SER  33           H        SER  33   2.113  -0.599   3.429
  209    HA   SER  33           HA       SER  33   3.835   0.647   1.416
  210    HB2  SER  33           HB2      SER  33   1.774  -1.518   0.859
  211    HB3  SER  33           HB3      SER  33   2.857  -0.767  -0.313
  212    HG   SER  33           HG       SER  33   3.472  -2.904   0.550
  213    H    GLN  34           H        GLN  34   2.721   2.316   0.366
  214    HA   GLN  34           HA       GLN  34  -0.073   2.682   1.177
  215    HB2  GLN  34           HB2      GLN  34   1.147   4.007   2.745
  216    HB3  GLN  34           HB3      GLN  34   2.195   4.638   1.494
  217    HG2  GLN  34           HG2      GLN  34   0.379   5.953   0.583
  218    HG3  GLN  34           HG3      GLN  34  -0.739   5.234   1.738
  219   HE21  GLN  34          HE21      GLN  34  -0.873   6.071   3.752
  220   HE22  GLN  34          HE22      GLN  34   0.086   7.385   4.321
  221    H    CYS  35           H        CYS  35  -1.409   3.485  -0.329
  222    HA   CYS  35           HA       CYS  35  -0.493   3.776  -3.040
  223    HB2  CYS  35           HB2      CYS  35  -3.200   4.452  -1.862
  224    HB3  CYS  35           HB3      CYS  35  -2.810   4.399  -3.574
  225    H    LEU  36           H        LEU  36   0.624   5.501  -3.564
  226    HA   LEU  36           HA       LEU  36  -0.322   8.107  -2.653
  227    HB2  LEU  36           HB2      LEU  36   2.489   7.193  -3.223
  228    HB3  LEU  36           HB3      LEU  36   2.044   8.879  -3.057
  229    HG   LEU  36           HG       LEU  36   1.738   6.793  -0.899
  230   HD11  LEU  36          HD11      LEU  36   4.080   7.303  -1.335
  231   HD12  LEU  36          HD12      LEU  36   3.554   7.970   0.212
  232   HD13  LEU  36          HD13      LEU  36   3.737   9.031  -1.188
  233   HD21  LEU  36          HD21      LEU  36   1.294   9.774  -0.895
  234   HD22  LEU  36          HD22      LEU  36   1.281   8.741   0.532
  235   HD23  LEU  36          HD23      LEU  36   0.059   8.525  -0.714
  236    H1   MAN 101           H1       MAN 101  -8.881   6.147   2.212
  237    H2   MAN 101           H2       MAN 101  -6.739   5.512   3.365
  238    H3   MAN 101           H3       MAN 101  -6.937   3.080   3.133
  239    H4   MAN 101           H4       MAN 101  -9.232   3.343   5.101
  240    H5   MAN 101           H5       MAN 101  -9.171   2.434   2.165
  241    H61  MAN 101           H61      MAN 101 -10.892   1.342   3.581
  242    H62  MAN 101           H62      MAN 101 -11.601   2.385   2.329
  243    HO2  MAN 101           HO2      MAN 101  -9.162   5.307   4.864
  244    HO3  MAN 101           HO3      MAN 101  -6.636   2.555   5.322
  245    HO4  MAN 101           HO4      MAN 101  -9.222   1.046   4.766
  246    HO6  MAN 101           HO6      MAN 101 -11.634   4.070   4.020
  Start of MODEL   16
    1    H1   THR   1           H1       THR   1 -11.294  -1.087  -4.328
    2    H2   THR   1           H2       THR   1 -11.424  -0.626  -5.963
    3    H3   THR   1           H3       THR   1 -11.634   0.518  -4.730
    4    HA   THR   1           HA       THR   1  -9.153  -0.906  -5.304
    5    HB   THR   1           HB       THR   1  -8.425   1.487  -5.843
    6    HG1  THR   1           HG1      THR   1 -10.300   2.734  -6.736
    7   HG21  THR   1          HG21      THR   1  -9.180   1.344  -8.178
    8   HG22  THR   1          HG22      THR   1 -10.383   0.143  -7.714
    9   HG23  THR   1          HG23      THR   1  -8.665  -0.233  -7.577
   10    H    GLN   2           H        GLN   2  -7.348   0.128  -4.119
   11    HA   GLN   2           HA       GLN   2  -8.169   0.711  -1.427
   12    HB2  GLN   2           HB2      GLN   2  -6.312  -0.880  -1.770
   13    HB3  GLN   2           HB3      GLN   2  -5.396   0.363  -2.610
   14    HG2  GLN   2           HG2      GLN   2  -4.676   0.062  -0.280
   15    HG3  GLN   2           HG3      GLN   2  -5.260   1.686  -0.633
   16   HE21  GLN   2          HE21      GLN   2  -5.933   2.265   1.198
   17   HE22  GLN   2          HE22      GLN   2  -7.194   1.540   2.169
   18    H    SER   3           H        SER   3  -7.875   2.659  -0.400
   19    HA   SER   3           HA       SER   3  -8.049   4.873  -2.126
   20    HB2  SER   3           HB2      SER   3  -8.541   6.111  -0.086
   21    HB3  SER   3           HB3      SER   3  -9.476   4.613  -0.148
   22    H    HIS   4           H        HIS   4  -6.964   6.789  -1.747
   23    HA   HIS   4           HA       HIS   4  -4.130   6.697  -1.934
   24    HB2  HIS   4           HB2      HIS   4  -5.687   8.407  -2.987
   25    HB3  HIS   4           HB3      HIS   4  -5.892   9.113  -1.405
   26    HD1  HIS   4           HD1      HIS   4  -4.911  11.367  -2.223
   27    HD2  HIS   4           HD2      HIS   4  -2.310   8.178  -2.573
   28    HE1  HIS   4           HE1      HIS   4  -2.690  12.388  -2.784
   29    HE2  HIS   4           HE2      HIS   4  -1.211  10.446  -3.265
   30    H    TYR   5           H        TYR   5  -2.641   6.931  -0.311
   31    HA   TYR   5           HA       TYR   5  -1.681   7.208   1.669
   32    HB2  TYR   5           HB2      TYR   5  -4.228   8.591   2.389
   33    HB3  TYR   5           HB3      TYR   5  -2.932   8.401   3.583
   34    HD1  TYR   5           HD1      TYR   5  -4.329  10.423   1.045
   35    HD2  TYR   5           HD2      TYR   5  -0.622   9.380   2.825
   36    HE1  TYR   5           HE1      TYR   5  -3.335  12.486   0.165
   37    HE2  TYR   5           HE2      TYR   5   0.386  11.439   1.953
   38    HH   TYR   5           HH       TYR   5  -1.410  13.973   0.830
   39    H    GLY   6           H        GLY   6  -3.956   5.196   0.962
   40    HA2  GLY   6           HA2      GLY   6  -4.257   3.958   3.584
   41    HA3  GLY   6           HA3      GLY   6  -5.024   3.488   2.082
   42    H    GLN   7           H        GLN   7  -3.793   1.615   3.726
   43    HA   GLN   7           HA       GLN   7  -1.130   1.104   2.792
   44    HB2  GLN   7           HB2      GLN   7  -2.044   0.478   5.080
   45    HB3  GLN   7           HB3      GLN   7  -2.990  -0.764   4.277
   46    HG2  GLN   7           HG2      GLN   7  -0.942  -1.855   3.532
   47    HG3  GLN   7           HG3      GLN   7   0.028  -0.602   4.307
   48   HE21  GLN   7          HE21      GLN   7   0.124  -3.423   4.871
   49   HE22  GLN   7          HE22      GLN   7  -0.383  -3.647   6.489
   50    H    CYS   8           H        CYS   8  -0.648   0.062   0.949
   51    HA   CYS   8           HA       CYS   8  -2.886  -1.157  -0.519
   52    HB2  CYS   8           HB2      CYS   8  -1.481  -0.867  -2.501
   53    HB3  CYS   8           HB3      CYS   8  -1.944   0.625  -1.699
   54    H    GLY   9           H        GLY   9  -0.532  -2.382   1.331
   55    HA2  GLY   9           HA2      GLY   9  -0.759  -4.912   1.033
   56    HA3  GLY   9           HA3      GLY   9  -0.245  -4.580  -0.609
   57    H    GLY  10           H        GLY  10   0.675  -4.555   2.708
   58    HA2  GLY  10           HA2      GLY  10   3.460  -4.806   1.888
   59    HA3  GLY  10           HA3      GLY  10   2.880  -4.557   3.540
   60    H    ILE  11           H        ILE  11   4.457  -6.589   3.525
   61    HA   ILE  11           HA       ILE  11   3.352  -9.068   2.773
   62    HB   ILE  11           HB       ILE  11   5.219  -8.506   5.099
   63   HG12  ILE  11          HG12      ILE  11   5.881  -9.255   2.247
   64   HG13  ILE  11          HG13      ILE  11   6.050  -7.641   2.926
   65   HG21  ILE  11          HG21      ILE  11   5.920 -10.855   4.797
   66   HG22  ILE  11          HG22      ILE  11   4.688 -11.050   3.548
   67   HG23  ILE  11          HG23      ILE  11   4.209 -10.723   5.213
   68   HD11  ILE  11          HD11      ILE  11   7.514 -10.104   3.813
   69   HD12  ILE  11          HD12      ILE  11   7.692  -8.497   4.519
   70   HD13  ILE  11          HD13      ILE  11   8.189  -8.789   2.850
   71    H    GLY  12           H        GLY  12   1.501  -9.939   3.509
   72    HA2  GLY  12           HA2      GLY  12   0.286 -10.975   5.226
   73    HA3  GLY  12           HA3      GLY  12   1.023  -9.866   6.372
   74    H    TYR  13           H        TYR  13  -0.039  -8.191   3.668
   75    HA   TYR  13           HA       TYR  13  -2.140  -7.031   5.262
   76    HB2  TYR  13           HB2      TYR  13  -0.684  -5.580   3.880
   77    HB3  TYR  13           HB3      TYR  13  -1.336  -6.349   2.434
   78    HD1  TYR  13           HD1      TYR  13  -2.767  -4.917   1.284
   79    HD2  TYR  13           HD2      TYR  13  -2.862  -4.907   5.533
   80    HE1  TYR  13           HE1      TYR  13  -4.565  -3.264   1.242
   81    HE2  TYR  13           HE2      TYR  13  -4.658  -3.251   5.499
   82    HH   TYR  13           HH       TYR  13  -6.166  -2.252   2.494
   83    H    SER  14           H        SER  14  -4.064  -7.802   5.363
   84    HA   SER  14           HA       SER  14  -5.034  -9.763   3.526
   85    HB2  SER  14           HB2      SER  14  -6.933  -9.674   5.268
   86    HB3  SER  14           HB3      SER  14  -5.337 -10.240   5.779
   87    HG   SER  14           HG       SER  14  -6.651  -7.833   6.370
   88    H    GLY  15           H        GLY  15  -5.140  -6.469   3.418
   89    HA2  GLY  15           HA2      GLY  15  -7.958  -6.248   2.591
   90    HA3  GLY  15           HA3      GLY  15  -6.883  -4.915   2.950
   91    HA   PRO  16           HA       PRO  16  -7.335  -5.278  -1.681
   92    HB2  PRO  16           HB2      PRO  16  -7.648  -2.360  -1.472
   93    HB3  PRO  16           HB3      PRO  16  -8.685  -3.539  -2.273
   94    HG2  PRO  16           HG2      PRO  16  -9.435  -2.300  -0.016
   95    HG3  PRO  16           HG3      PRO  16  -9.885  -3.978  -0.370
   96    HD2  PRO  16           HD2      PRO  16  -7.729  -2.945   1.439
   97    HD3  PRO  16           HD3      PRO  16  -8.870  -4.279   1.692
   98    H    THR  17           H        THR  17  -5.530  -5.233  -2.849
   99    HA   THR  17           HA       THR  17  -3.311  -3.571  -1.966
  100    HB   THR  17           HB       THR  17  -2.008  -5.185  -3.438
  101    HG1  THR  17           HG1      THR  17  -3.025  -6.952  -4.144
  102   HG21  THR  17          HG21      THR  17  -2.029  -6.942  -1.722
  103   HG22  THR  17          HG22      THR  17  -3.574  -6.324  -1.120
  104   HG23  THR  17          HG23      THR  17  -2.122  -5.336  -0.986
  105    H    VAL  18           H        VAL  18  -5.686  -3.522  -4.194
  106    HA   VAL  18           HA       VAL  18  -4.039  -2.472  -6.381
  107    HB   VAL  18           HB       VAL  18  -7.006  -3.123  -6.362
  108   HG11  VAL  18          HG11      VAL  18  -6.895  -2.892  -8.794
  109   HG12  VAL  18          HG12      VAL  18  -5.202  -2.431  -8.682
  110   HG13  VAL  18          HG13      VAL  18  -6.445  -1.384  -7.998
  111   HG21  VAL  18          HG21      VAL  18  -6.380  -5.053  -7.751
  112   HG22  VAL  18          HG22      VAL  18  -5.670  -5.132  -6.140
  113   HG23  VAL  18          HG23      VAL  18  -4.678  -4.649  -7.513
  114    H    CYS  19           H        CYS  19  -3.633  -0.378  -6.169
  115    HA   CYS  19           HA       CYS  19  -5.129   1.342  -4.538
  116    HB2  CYS  19           HB2      CYS  19  -2.956   1.846  -6.552
  117    HB3  CYS  19           HB3      CYS  19  -3.619   3.070  -5.475
  118    H    ALA  20           H        ALA  20  -6.191   3.245  -5.118
  119    HA   ALA  20           HA       ALA  20  -8.082   3.042  -7.163
  120    HB1  ALA  20           HB1      ALA  20  -7.148   5.506  -5.686
  121    HB2  ALA  20           HB2      ALA  20  -8.416   4.400  -5.155
  122    HB3  ALA  20           HB3      ALA  20  -8.640   5.359  -6.620
  123    H    SER  21           H        SER  21  -8.274   4.120  -9.091
  124    HA   SER  21           HA       SER  21  -6.019   4.260 -10.690
  125    HB2  SER  21           HB2      SER  21  -8.683   5.616 -11.078
  126    HB3  SER  21           HB3      SER  21  -7.561   5.113 -12.345
  127    HG   SER  21           HG       SER  21  -7.878   2.942 -11.165
  128    H    GLY  22           H        GLY  22  -4.488   5.767 -10.773
  129    HA2  GLY  22           HA2      GLY  22  -3.874   8.091 -11.031
  130    HA3  GLY  22           HA3      GLY  22  -5.125   8.489  -9.858
  131    H    THR  23           H        THR  23  -4.075   5.877  -8.416
  132    HA   THR  23           HA       THR  23  -1.796   7.227  -7.173
  133    HB   THR  23           HB       THR  23  -2.389   6.063  -5.047
  134    HG1  THR  23           HG1      THR  23  -4.427   5.009  -6.669
  135   HG21  THR  23          HG21      THR  23  -4.369   7.404  -4.490
  136   HG22  THR  23          HG22      THR  23  -4.634   7.713  -6.207
  137   HG23  THR  23          HG23      THR  23  -3.190   8.338  -5.410
  138    H    THR  24           H        THR  24  -0.030   5.896  -6.492
  139    HA   THR  24           HA       THR  24  -0.032   3.250  -7.761
  140    HB   THR  24           HB       THR  24   2.474   3.533  -7.915
  141    HG1  THR  24           HG1      THR  24   1.841   5.971  -6.710
  142   HG21  THR  24          HG21      THR  24   2.438   5.029  -9.870
  143   HG22  THR  24          HG22      THR  24   0.837   5.594  -9.400
  144   HG23  THR  24          HG23      THR  24   1.070   3.914  -9.888
  145    H    CYS  25           H        CYS  25   0.855   1.508  -6.543
  146    HA   CYS  25           HA       CYS  25   0.773   1.951  -3.726
  147    HB2  CYS  25           HB2      CYS  25  -0.193  -0.070  -4.649
  148    HB3  CYS  25           HB3      CYS  25   1.355  -0.552  -5.332
  149    H    GLN  26           H        GLN  26   2.421   2.752  -2.709
  150    HA   GLN  26           HA       GLN  26   5.081   2.183  -3.739
  151    HB2  GLN  26           HB2      GLN  26   4.086   4.425  -1.998
  152    HB3  GLN  26           HB3      GLN  26   5.768   4.196  -2.442
  153    HG2  GLN  26           HG2      GLN  26   5.114   4.398  -4.824
  154    HG3  GLN  26           HG3      GLN  26   3.464   4.725  -4.306
  155   HE21  GLN  26          HE21      GLN  26   3.398   6.710  -5.205
  156   HE22  GLN  26          HE22      GLN  26   4.316   8.048  -4.626
  157    H    VAL  27           H        VAL  27   6.103   0.698  -2.728
  158    HA   VAL  27           HA       VAL  27   5.422  -0.198  -0.112
  159    HB   VAL  27           HB       VAL  27   7.918  -0.807  -1.743
  160   HG11  VAL  27          HG11      VAL  27   6.682  -2.296   0.570
  161   HG12  VAL  27          HG12      VAL  27   8.192  -1.391   0.601
  162   HG13  VAL  27          HG13      VAL  27   8.058  -2.850  -0.381
  163   HG21  VAL  27          HG21      VAL  27   5.913  -1.411  -2.998
  164   HG22  VAL  27          HG22      VAL  27   5.305  -2.325  -1.618
  165   HG23  VAL  27          HG23      VAL  27   6.762  -2.857  -2.455
  166    H    LEU  28           H        LEU  28   5.859   0.969   1.583
  167    HA   LEU  28           HA       LEU  28   8.099   2.830   1.545
  168    HB2  LEU  28           HB2      LEU  28   5.746   2.591   3.409
  169    HB3  LEU  28           HB3      LEU  28   6.994   3.817   3.530
  170    HG   LEU  28           HG       LEU  28   5.073   3.495   1.219
  171   HD11  LEU  28          HD11      LEU  28   4.172   5.622   1.976
  172   HD12  LEU  28          HD12      LEU  28   5.225   5.556   3.398
  173   HD13  LEU  28          HD13      LEU  28   3.959   4.341   3.166
  174   HD21  LEU  28          HD21      LEU  28   7.198   5.519   1.781
  175   HD22  LEU  28          HD22      LEU  28   5.994   5.636   0.485
  176   HD23  LEU  28          HD23      LEU  28   7.189   4.327   0.472
  177    H    ASN  29           H        ASN  29   6.878   0.019   3.144
  178    HA   ASN  29           HA       ASN  29   9.444  -0.514   4.339
  179    HB2  ASN  29           HB2      ASN  29   6.849  -0.504   5.955
  180    HB3  ASN  29           HB3      ASN  29   8.399  -1.077   6.533
  181   HD21  ASN  29          HD21      ASN  29   6.421   1.664   5.925
  182   HD22  ASN  29          HD22      ASN  29   7.409   2.851   6.675
  183    HA   PRO  30           HA       PRO  30   8.327  -4.601   2.972
  184    HB2  PRO  30           HB2      PRO  30   8.467  -5.661   5.748
  185    HB3  PRO  30           HB3      PRO  30   9.279  -6.233   4.284
  186    HG2  PRO  30           HG2      PRO  30  10.627  -4.881   6.110
  187    HG3  PRO  30           HG3      PRO  30  10.909  -4.572   4.387
  188    HD2  PRO  30           HD2      PRO  30   9.367  -2.968   6.376
  189    HD3  PRO  30           HD3      PRO  30  10.428  -2.411   5.067
  190    H    TYR  31           H        TYR  31   6.619  -3.700   5.987
  191    HA   TYR  31           HA       TYR  31   4.379  -5.344   5.029
  192    HB2  TYR  31           HB2      TYR  31   4.718  -4.151   7.800
  193    HB3  TYR  31           HB3      TYR  31   3.539  -5.345   7.298
  194    HD1  TYR  31           HD1      TYR  31   7.036  -4.788   8.215
  195    HD2  TYR  31           HD2      TYR  31   4.186  -7.687   6.991
  196    HE1  TYR  31           HE1      TYR  31   8.581  -6.554   8.864
  197    HE2  TYR  31           HE2      TYR  31   5.732  -9.482   7.637
  198    HH   TYR  31           HH       TYR  31   8.156  -9.757   7.907
  199    H    TYR  32           H        TYR  32   5.377  -2.108   5.745
  200    HA   TYR  32           HA       TYR  32   2.670  -1.157   5.303
  201    HB2  TYR  32           HB2      TYR  32   3.890  -0.191   7.191
  202    HB3  TYR  32           HB3      TYR  32   5.094   0.452   6.077
  203    HD1  TYR  32           HD1      TYR  32   4.851   2.698   5.395
  204    HD2  TYR  32           HD2      TYR  32   1.412   0.463   6.586
  205    HE1  TYR  32           HE1      TYR  32   3.487   4.675   5.150
  206    HE2  TYR  32           HE2      TYR  32   0.027   2.459   6.318
  207    HH   TYR  32           HH       TYR  32   1.167   5.325   4.807
  208    H    SER  33           H        SER  33   2.016  -0.770   3.349
  209    HA   SER  33           HA       SER  33   3.816   0.610   1.489
  210    HB2  SER  33           HB2      SER  33   1.753  -1.504   0.756
  211    HB3  SER  33           HB3      SER  33   2.834  -0.668  -0.359
  212    HG   SER  33           HG       SER  33   3.441  -2.861   0.391
  213    H    GLN  34           H        GLN  34   2.685   2.271   0.301
  214    HA   GLN  34           HA       GLN  34  -0.072   2.704   1.194
  215    HB2  GLN  34           HB2      GLN  34   1.207   4.031   2.692
  216    HB3  GLN  34           HB3      GLN  34   2.234   4.622   1.401
  217    HG2  GLN  34           HG2      GLN  34   0.413   5.959   0.524
  218    HG3  GLN  34           HG3      GLN  34  -0.680   5.287   1.727
  219   HE21  GLN  34          HE21      GLN  34  -0.703   6.127   3.779
  220   HE22  GLN  34          HE22      GLN  34   0.307   7.434   4.260
  221    H    CYS  35           H        CYS  35  -1.433   3.471  -0.292
  222    HA   CYS  35           HA       CYS  35  -0.598   3.695  -3.026
  223    HB2  CYS  35           HB2      CYS  35  -3.252   4.385  -1.755
  224    HB3  CYS  35           HB3      CYS  35  -2.932   4.369  -3.483
  225    H    LEU  36           H        LEU  36   0.469   5.363  -3.699
  226    HA   LEU  36           HA       LEU  36  -0.482   8.032  -3.046
  227    HB2  LEU  36           HB2      LEU  36   2.380   7.110  -3.250
  228    HB3  LEU  36           HB3      LEU  36   1.882   8.788  -3.171
  229    HG   LEU  36           HG       LEU  36   1.406   6.758  -1.000
  230   HD11  LEU  36          HD11      LEU  36   3.154   7.951   0.216
  231   HD12  LEU  36          HD12      LEU  36   3.450   8.957  -1.204
  232   HD13  LEU  36          HD13      LEU  36   3.776   7.223  -1.263
  233   HD21  LEU  36          HD21      LEU  36  -0.249   8.534  -0.999
  234   HD22  LEU  36          HD22      LEU  36   1.024   9.748  -1.079
  235   HD23  LEU  36          HD23      LEU  36   0.861   8.736   0.357
  236    H1   MAN 101           H1       MAN 101  -8.950   6.158   2.136
  237    H2   MAN 101           H2       MAN 101  -6.850   5.625   3.350
  238    H3   MAN 101           H3       MAN 101  -6.858   3.231   2.947
  239    H4   MAN 101           H4       MAN 101  -9.176   3.218   4.912
  240    H5   MAN 101           H5       MAN 101  -9.122   2.486   1.909
  241    H61  MAN 101           H61      MAN 101 -11.305   2.567   4.029
  242    H62  MAN 101           H62      MAN 101 -10.779   1.153   3.076
  243    HO2  MAN 101           HO2      MAN 101  -9.295   5.116   4.744
  244    HO3  MAN 101           HO3      MAN 101  -7.171   3.865   5.696
  245    HO4  MAN 101           HO4      MAN 101  -7.666   1.476   5.019
  246    HO6  MAN 101           HO6      MAN 101 -11.659   3.464   1.717
  Start of MODEL   17
    1    H1   THR   1           H1       THR   1 -11.494   0.085  -4.921
    2    H2   THR   1           H2       THR   1 -10.969  -1.382  -4.360
    3    H3   THR   1           H3       THR   1 -11.099  -1.115  -6.042
    4    HA   THR   1           HA       THR   1  -8.810  -0.947  -5.348
    5    HB   THR   1           HB       THR   1  -8.513   1.538  -5.919
    6    HG1  THR   1           HG1      THR   1 -10.831   1.991  -7.023
    7   HG21  THR   1          HG21      THR   1 -10.067  -0.237  -7.815
    8   HG22  THR   1          HG22      THR   1  -8.318  -0.263  -7.587
    9   HG23  THR   1          HG23      THR   1  -9.096   1.159  -8.281
   10    H    GLN   2           H        GLN   2  -7.247   0.076  -4.040
   11    HA   GLN   2           HA       GLN   2  -8.212   0.758  -1.410
   12    HB2  GLN   2           HB2      GLN   2  -6.341  -0.808  -1.632
   13    HB3  GLN   2           HB3      GLN   2  -5.401   0.406  -2.489
   14    HG2  GLN   2           HG2      GLN   2  -4.729   0.178  -0.155
   15    HG3  GLN   2           HG3      GLN   2  -5.331   1.790  -0.537
   16   HE21  GLN   2          HE21      GLN   2  -6.000   2.343   1.326
   17   HE22  GLN   2          HE22      GLN   2  -7.271   1.610   2.274
   18    H    SER   3           H        SER   3  -7.891   2.737  -0.365
   19    HA   SER   3           HA       SER   3  -8.134   4.978  -2.061
   20    HB2  SER   3           HB2      SER   3  -8.467   6.215  -0.034
   21    HB3  SER   3           HB3      SER   3  -9.398   4.727   0.065
   22    H    HIS   4           H        HIS   4  -7.033   6.949  -1.509
   23    HA   HIS   4           HA       HIS   4  -4.191   6.776  -1.919
   24    HB2  HIS   4           HB2      HIS   4  -5.701   8.501  -2.963
   25    HB3  HIS   4           HB3      HIS   4  -5.966   9.157  -1.364
   26    HD1  HIS   4           HD1      HIS   4  -4.967  11.416  -1.724
   27    HD2  HIS   4           HD2      HIS   4  -2.395   8.358  -2.813
   28    HE1  HIS   4           HE1      HIS   4  -2.775  12.530  -2.241
   29    HE2  HIS   4           HE2      HIS   4  -1.442  10.705  -3.277
   30    H    TYR   5           H        TYR   5  -2.643   6.993  -0.394
   31    HA   TYR   5           HA       TYR   5  -1.594   7.176   1.533
   32    HB2  TYR   5           HB2      TYR   5  -3.968   8.808   2.291
   33    HB3  TYR   5           HB3      TYR   5  -2.823   8.347   3.551
   34    HD1  TYR   5           HD1      TYR   5  -3.491  10.534   0.741
   35    HD2  TYR   5           HD2      TYR   5  -0.468   9.148   3.377
   36    HE1  TYR   5           HE1      TYR   5  -2.072  12.438   0.113
   37    HE2  TYR   5           HE2      TYR   5   0.956  11.040   2.759
   38    HH   TYR   5           HH       TYR   5  -0.231  13.706   1.034
   39    H    GLY   6           H        GLY   6  -3.981   5.269   0.942
   40    HA2  GLY   6           HA2      GLY   6  -4.232   4.069   3.570
   41    HA3  GLY   6           HA3      GLY   6  -5.043   3.601   2.088
   42    H    GLN   7           H        GLN   7  -3.799   1.738   3.767
   43    HA   GLN   7           HA       GLN   7  -1.170   1.130   2.798
   44    HB2  GLN   7           HB2      GLN   7  -2.116   0.567   5.096
   45    HB3  GLN   7           HB3      GLN   7  -3.058  -0.683   4.296
   46    HG2  GLN   7           HG2      GLN   7  -1.030  -1.786   3.579
   47    HG3  GLN   7           HG3      GLN   7  -0.041  -0.532   4.315
   48   HE21  GLN   7          HE21      GLN   7   0.073  -3.310   4.937
   49   HE22  GLN   7          HE22      GLN   7  -0.389  -3.478   6.575
   50    H    CYS   8           H        CYS   8  -0.742   0.063   0.948
   51    HA   CYS   8           HA       CYS   8  -3.040  -1.137  -0.432
   52    HB2  CYS   8           HB2      CYS   8  -1.661  -0.992  -2.447
   53    HB3  CYS   8           HB3      CYS   8  -2.084   0.548  -1.719
   54    H    GLY   9           H        GLY   9  -0.431  -2.292   1.286
   55    HA2  GLY   9           HA2      GLY   9  -0.832  -4.859   1.115
   56    HA3  GLY   9           HA3      GLY   9  -0.368  -4.586  -0.551
   57    H    GLY  10           H        GLY  10   0.702  -4.453   2.731
   58    HA2  GLY  10           HA2      GLY  10   3.464  -4.805   1.817
   59    HA3  GLY  10           HA3      GLY  10   2.947  -4.443   3.464
   60    H    ILE  11           H        ILE  11   4.493  -6.436   3.588
   61    HA   ILE  11           HA       ILE  11   3.371  -8.987   3.129
   62    HB   ILE  11           HB       ILE  11   5.287  -8.117   5.323
   63   HG12  ILE  11          HG12      ILE  11   5.899  -9.351   2.637
   64   HG13  ILE  11          HG13      ILE  11   6.094  -7.644   3.017
   65   HG21  ILE  11          HG21      ILE  11   4.708 -10.878   4.234
   66   HG22  ILE  11          HG22      ILE  11   4.238 -10.262   5.819
   67   HG23  ILE  11          HG23      ILE  11   5.943 -10.475   5.429
   68   HD11  ILE  11          HD11      ILE  11   7.555  -9.926   4.327
   69   HD12  ILE  11          HD12      ILE  11   7.766  -8.215   4.698
   70   HD13  ILE  11          HD13      ILE  11   8.218  -8.839   3.105
   71    H    GLY  12           H        GLY  12   1.483  -9.680   3.981
   72    HA2  GLY  12           HA2      GLY  12   0.327 -10.438   5.871
   73    HA3  GLY  12           HA3      GLY  12   1.065  -9.151   6.801
   74    H    TYR  13           H        TYR  13  -0.027  -7.900   3.897
   75    HA   TYR  13           HA       TYR  13  -2.332  -6.805   5.285
   76    HB2  TYR  13           HB2      TYR  13  -0.807  -5.248   4.078
   77    HB3  TYR  13           HB3      TYR  13  -1.246  -6.064   2.580
   78    HD1  TYR  13           HD1      TYR  13  -2.853  -4.973   1.263
   79    HD2  TYR  13           HD2      TYR  13  -2.984  -4.480   5.484
   80    HE1  TYR  13           HE1      TYR  13  -4.749  -3.429   1.030
   81    HE2  TYR  13           HE2      TYR  13  -4.888  -2.935   5.233
   82    HH   TYR  13           HH       TYR  13  -6.325  -2.290   2.088
   83    H    SER  14           H        SER  14  -4.100  -7.933   5.166
   84    HA   SER  14           HA       SER  14  -4.540  -9.831   3.049
   85    HB2  SER  14           HB2      SER  14  -6.208  -9.201   5.469
   86    HB3  SER  14           HB3      SER  14  -6.202 -10.690   4.520
   87    HG   SER  14           HG       SER  14  -4.618 -11.364   5.668
   88    H    GLY  15           H        GLY  15  -5.282  -6.616   3.492
   89    HA2  GLY  15           HA2      GLY  15  -7.999  -6.647   2.508
   90    HA3  GLY  15           HA3      GLY  15  -7.028  -5.224   2.849
   91    HA   PRO  16           HA       PRO  16  -7.431  -5.550  -1.759
   92    HB2  PRO  16           HB2      PRO  16  -7.957  -2.900  -2.150
   93    HB3  PRO  16           HB3      PRO  16  -9.201  -4.107  -1.799
   94    HG2  PRO  16           HG2      PRO  16  -7.934  -2.111  -0.004
   95    HG3  PRO  16           HG3      PRO  16  -9.611  -2.671  -0.061
   96    HD2  PRO  16           HD2      PRO  16  -7.759  -3.516   1.769
   97    HD3  PRO  16           HD3      PRO  16  -9.172  -4.466   1.289
   98    H    THR  17           H        THR  17  -5.679  -5.398  -3.059
   99    HA   THR  17           HA       THR  17  -3.476  -3.722  -2.131
  100    HB   THR  17           HB       THR  17  -2.092  -5.326  -3.534
  101    HG1  THR  17           HG1      THR  17  -2.993  -7.099  -4.280
  102   HG21  THR  17          HG21      THR  17  -2.056  -7.025  -1.752
  103   HG22  THR  17          HG22      THR  17  -3.617  -6.437  -1.170
  104   HG23  THR  17          HG23      THR  17  -2.200  -5.397  -1.080
  105    H    VAL  18           H        VAL  18  -5.811  -3.424  -4.318
  106    HA   VAL  18           HA       VAL  18  -4.003  -2.458  -6.416
  107    HB   VAL  18           HB       VAL  18  -6.976  -3.032  -6.633
  108   HG11  VAL  18          HG11      VAL  18  -4.945  -2.348  -8.757
  109   HG12  VAL  18          HG12      VAL  18  -6.241  -1.300  -8.179
  110   HG13  VAL  18          HG13      VAL  18  -6.629  -2.783  -9.053
  111   HG21  VAL  18          HG21      VAL  18  -6.322  -4.985  -7.966
  112   HG22  VAL  18          HG22      VAL  18  -5.689  -5.087  -6.321
  113   HG23  VAL  18          HG23      VAL  18  -4.624  -4.632  -7.647
  114    H    CYS  19           H        CYS  19  -3.575  -0.382  -6.154
  115    HA   CYS  19           HA       CYS  19  -5.143   1.370  -4.627
  116    HB2  CYS  19           HB2      CYS  19  -2.900   1.871  -6.561
  117    HB3  CYS  19           HB3      CYS  19  -3.594   3.083  -5.494
  118    H    ALA  20           H        ALA  20  -6.296   3.160  -5.237
  119    HA   ALA  20           HA       ALA  20  -8.039   2.904  -7.407
  120    HB1  ALA  20           HB1      ALA  20  -8.591   4.097  -5.357
  121    HB2  ALA  20           HB2      ALA  20  -8.792   5.132  -6.773
  122    HB3  ALA  20           HB3      ALA  20  -7.378   5.319  -5.736
  123    H    SER  21           H        SER  21  -8.310   4.313  -9.192
  124    HA   SER  21           HA       SER  21  -6.052   4.599 -10.790
  125    HB2  SER  21           HB2      SER  21  -8.702   6.029 -11.022
  126    HB3  SER  21           HB3      SER  21  -7.554   5.724 -12.329
  127    HG   SER  21           HG       SER  21  -7.874   3.397 -11.485
  128    H    GLY  22           H        GLY  22  -4.462   6.025 -10.672
  129    HA2  GLY  22           HA2      GLY  22  -3.781   8.328 -10.819
  130    HA3  GLY  22           HA3      GLY  22  -5.048   8.716  -9.661
  131    H    THR  23           H        THR  23  -4.053   6.001  -8.379
  132    HA   THR  23           HA       THR  23  -1.851   7.278  -6.916
  133    HB   THR  23           HB       THR  23  -2.552   6.039  -4.903
  134    HG1  THR  23           HG1      THR  23  -4.469   5.028  -6.691
  135   HG21  THR  23          HG21      THR  23  -4.758   7.702  -6.115
  136   HG22  THR  23          HG22      THR  23  -3.374   8.310  -5.205
  137   HG23  THR  23          HG23      THR  23  -4.593   7.316  -4.402
  138    H    THR  24           H        THR  24  -0.115   5.973  -6.306
  139    HA   THR  24           HA       THR  24  -0.058   3.374  -7.672
  140    HB   THR  24           HB       THR  24   2.432   3.684  -7.770
  141    HG1  THR  24           HG1      THR  24   1.740   6.186  -6.604
  142   HG21  THR  24          HG21      THR  24   2.399   5.278  -9.654
  143   HG22  THR  24          HG22      THR  24   0.788   5.803  -9.167
  144   HG23  THR  24          HG23      THR  24   1.043   4.153  -9.730
  145    H    CYS  25           H        CYS  25   0.762   1.578  -6.542
  146    HA   CYS  25           HA       CYS  25   0.678   1.874  -3.686
  147    HB2  CYS  25           HB2      CYS  25  -0.349  -0.093  -4.731
  148    HB3  CYS  25           HB3      CYS  25   1.206  -0.575  -5.397
  149    H    GLN  26           H        GLN  26   2.366   2.578  -2.664
  150    HA   GLN  26           HA       GLN  26   4.959   1.916  -3.770
  151    HB2  GLN  26           HB2      GLN  26   4.127   4.223  -2.032
  152    HB3  GLN  26           HB3      GLN  26   5.766   3.928  -2.596
  153    HG2  GLN  26           HG2      GLN  26   4.925   4.074  -4.930
  154    HG3  GLN  26           HG3      GLN  26   3.349   4.522  -4.287
  155   HE21  GLN  26          HE21      GLN  26   3.401   6.482  -5.338
  156   HE22  GLN  26          HE22      GLN  26   4.394   7.781  -4.807
  157    H    VAL  27           H        VAL  27   5.917   0.381  -2.747
  158    HA   VAL  27           HA       VAL  27   5.213  -0.373  -0.067
  159    HB   VAL  27           HB       VAL  27   7.535  -1.378  -1.751
  160   HG11  VAL  27          HG11      VAL  27   6.087  -2.662   0.567
  161   HG12  VAL  27          HG12      VAL  27   7.698  -1.957   0.614
  162   HG13  VAL  27          HG13      VAL  27   7.396  -3.392  -0.360
  163   HG21  VAL  27          HG21      VAL  27   5.468  -1.674  -3.002
  164   HG22  VAL  27          HG22      VAL  27   4.723  -2.463  -1.611
  165   HG23  VAL  27          HG23      VAL  27   6.075  -3.231  -2.440
  166    H    LEU  28           H        LEU  28   5.850   0.933   1.454
  167    HA   LEU  28           HA       LEU  28   8.247   2.551   1.156
  168    HB2  LEU  28           HB2      LEU  28   6.094   2.555   3.262
  169    HB3  LEU  28           HB3      LEU  28   7.390   3.731   3.143
  170    HG   LEU  28           HG       LEU  28   5.222   3.333   1.067
  171   HD11  LEU  28          HD11      LEU  28   5.596   5.484   3.133
  172   HD12  LEU  28          HD12      LEU  28   4.307   4.275   3.086
  173   HD13  LEU  28          HD13      LEU  28   4.406   5.507   1.832
  174   HD21  LEU  28          HD21      LEU  28   7.294   4.136   0.108
  175   HD22  LEU  28          HD22      LEU  28   7.371   5.391   1.355
  176   HD23  LEU  28          HD23      LEU  28   6.079   5.426   0.151
  177    H    ASN  29           H        ASN  29   6.962  -0.030   3.070
  178    HA   ASN  29           HA       ASN  29   9.578  -0.587   4.194
  179    HB2  ASN  29           HB2      ASN  29   7.010  -0.389   5.835
  180    HB3  ASN  29           HB3      ASN  29   8.532  -1.012   6.422
  181   HD21  ASN  29          HD21      ASN  29   6.750   1.826   5.601
  182   HD22  ASN  29          HD22      ASN  29   7.806   2.974   6.322
  183    HA   PRO  30           HA       PRO  30   8.428  -4.758   3.159
  184    HB2  PRO  30           HB2      PRO  30   8.401  -5.543   6.016
  185    HB3  PRO  30           HB3      PRO  30   9.232  -6.313   4.658
  186    HG2  PRO  30           HG2      PRO  30  10.621  -4.849   6.376
  187    HG3  PRO  30           HG3      PRO  30  10.946  -4.730   4.637
  188    HD2  PRO  30           HD2      PRO  30   9.470  -2.851   6.422
  189    HD3  PRO  30           HD3      PRO  30  10.556  -2.489   5.066
  190    H    TYR  31           H        TYR  31   6.680  -3.677   6.102
  191    HA   TYR  31           HA       TYR  31   4.407  -5.308   5.211
  192    HB2  TYR  31           HB2      TYR  31   4.644  -3.880   7.874
  193    HB3  TYR  31           HB3      TYR  31   3.551  -5.177   7.438
  194    HD1  TYR  31           HD1      TYR  31   6.798  -4.337   8.742
  195    HD2  TYR  31           HD2      TYR  31   4.490  -7.502   7.096
  196    HE1  TYR  31           HE1      TYR  31   8.402  -5.944   9.621
  197    HE2  TYR  31           HE2      TYR  31   6.100  -9.135   7.985
  198    HH   TYR  31           HH       TYR  31   8.614  -9.035   8.608
  199    H    TYR  32           H        TYR  32   5.496  -2.063   5.623
  200    HA   TYR  32           HA       TYR  32   2.810  -1.021   5.304
  201    HB2  TYR  32           HB2      TYR  32   4.280  -0.034   7.027
  202    HB3  TYR  32           HB3      TYR  32   5.345   0.537   5.748
  203    HD1  TYR  32           HD1      TYR  32   1.711   0.618   6.541
  204    HD2  TYR  32           HD2      TYR  32   5.133   2.752   5.173
  205    HE1  TYR  32           HE1      TYR  32   0.380   2.657   6.404
  206    HE2  TYR  32           HE2      TYR  32   3.824   4.787   5.037
  207    HH   TYR  32           HH       TYR  32   1.452   5.463   4.825
  208    H    SER  33           H        SER  33   2.047  -0.710   3.400
  209    HA   SER  33           HA       SER  33   3.750   0.497   1.353
  210    HB2  SER  33           HB2      SER  33   1.628  -1.622   0.858
  211    HB3  SER  33           HB3      SER  33   2.655  -0.868  -0.359
  212    HG   SER  33           HG       SER  33   3.297  -3.008   0.442
  213    H    GLN  34           H        GLN  34   2.632   2.139   0.235
  214    HA   GLN  34           HA       GLN  34  -0.098   2.629   1.170
  215    HB2  GLN  34           HB2      GLN  34   1.177   3.906   2.687
  216    HB3  GLN  34           HB3      GLN  34   2.274   4.450   1.431
  217    HG2  GLN  34           HG2      GLN  34   0.556   5.888   0.521
  218    HG3  GLN  34           HG3      GLN  34  -0.606   5.255   1.684
  219   HE21  GLN  34          HE21      GLN  34  -0.663   6.081   3.724
  220   HE22  GLN  34          HE22      GLN  34   0.383   7.339   4.258
  221    H    CYS  35           H        CYS  35  -1.453   3.476  -0.297
  222    HA   CYS  35           HA       CYS  35  -0.594   3.723  -3.022
  223    HB2  CYS  35           HB2      CYS  35  -3.256   4.404  -1.757
  224    HB3  CYS  35           HB3      CYS  35  -2.935   4.400  -3.483
  225    H    LEU  36           H        LEU  36   0.573   5.399  -3.536
  226    HA   LEU  36           HA       LEU  36  -0.367   8.033  -2.735
  227    HB2  LEU  36           HB2      LEU  36   2.452   7.112  -3.306
  228    HB3  LEU  36           HB3      LEU  36   1.990   8.795  -3.141
  229    HG   LEU  36           HG       LEU  36   1.749   6.714  -0.968
  230   HD11  LEU  36          HD11      LEU  36   3.594   7.909   0.094
  231   HD12  LEU  36          HD12      LEU  36   3.735   8.947  -1.323
  232   HD13  LEU  36          HD13      LEU  36   4.067   7.218  -1.458
  233   HD21  LEU  36          HD21      LEU  36   1.308   8.664   0.477
  234   HD22  LEU  36          HD22      LEU  36   0.063   8.436  -0.740
  235   HD23  LEU  36          HD23      LEU  36   1.277   9.698  -0.952
  236    H1   MAN 101           H1       MAN 101  -8.532   6.410   2.197
  237    H2   MAN 101           H2       MAN 101  -6.452   5.637   3.373
  238    H3   MAN 101           H3       MAN 101  -6.776   3.231   3.155
  239    H4   MAN 101           H4       MAN 101  -9.121   3.640   5.048
  240    H5   MAN 101           H5       MAN 101  -8.998   2.759   2.122
  241    H61  MAN 101           H61      MAN 101 -10.834   1.718   3.435
  242    H62  MAN 101           H62      MAN 101 -11.395   2.771   2.121
  243    HO2  MAN 101           HO2      MAN 101  -8.071   6.834   4.436
  244    HO3  MAN 101           HO3      MAN 101  -6.978   4.147   5.843
  245    HO4  MAN 101           HO4      MAN 101  -7.856   1.745   5.284
  246    HO6  MAN 101           HO6      MAN 101 -11.426   4.478   3.821
  Start of MODEL   18
    1    H1   THR   1           H1       THR   1 -11.771   0.636  -5.272
    2    H2   THR   1           H2       THR   1 -11.504  -0.926  -4.686
    3    H3   THR   1           H3       THR   1 -11.565  -0.652  -6.351
    4    HA   THR   1           HA       THR   1  -9.302  -0.883  -5.560
    5    HB   THR   1           HB       THR   1  -8.495   1.445  -6.234
    6    HG1  THR   1           HG1      THR   1 -10.294   2.580  -7.380
    7   HG21  THR   1          HG21      THR   1 -10.341  -0.056  -8.098
    8   HG22  THR   1          HG22      THR   1  -8.633  -0.410  -7.811
    9   HG23  THR   1          HG23      THR   1  -9.103   1.108  -8.571
   10    H    GLN   2           H        GLN   2  -7.635  -0.159  -4.185
   11    HA   GLN   2           HA       GLN   2  -8.481   0.607  -1.587
   12    HB2  GLN   2           HB2      GLN   2  -6.581  -0.929  -1.947
   13    HB3  GLN   2           HB3      GLN   2  -5.701   0.346  -2.773
   14    HG2  GLN   2           HG2      GLN   2  -4.946   0.007  -0.477
   15    HG3  GLN   2           HG3      GLN   2  -5.566   1.630  -0.766
   16   HE21  GLN   2          HE21      GLN   2  -6.197   2.129   1.082
   17   HE22  GLN   2          HE22      GLN   2  -7.363   1.356   2.124
   18    H    SER   3           H        SER   3  -8.103   2.536  -0.461
   19    HA   SER   3           HA       SER   3  -8.489   4.809  -2.115
   20    HB2  SER   3           HB2      SER   3  -8.998   5.940  -0.059
   21    HB3  SER   3           HB3      SER   3  -9.745   4.351  -0.020
   22    H    HIS   4           H        HIS   4  -7.443   6.827  -1.469
   23    HA   HIS   4           HA       HIS   4  -4.616   6.680  -1.903
   24    HB2  HIS   4           HB2      HIS   4  -6.106   8.479  -2.851
   25    HB3  HIS   4           HB3      HIS   4  -6.367   9.079  -1.232
   26    HD1  HIS   4           HD1      HIS   4  -5.360  11.385  -1.958
   27    HD2  HIS   4           HD2      HIS   4  -2.708   8.209  -2.250
   28    HE1  HIS   4           HE1      HIS   4  -3.113  12.414  -2.393
   29    HE2  HIS   4           HE2      HIS   4  -1.590  10.462  -2.784
   30    H    TYR   5           H        TYR   5  -3.033   6.875  -0.415
   31    HA   TYR   5           HA       TYR   5  -1.956   7.004   1.496
   32    HB2  TYR   5           HB2      TYR   5  -4.407   8.434   2.408
   33    HB3  TYR   5           HB3      TYR   5  -3.128   8.017   3.549
   34    HD1  TYR   5           HD1      TYR   5  -4.313  10.368   1.179
   35    HD2  TYR   5           HD2      TYR   5  -0.791   8.871   2.991
   36    HE1  TYR   5           HE1      TYR   5  -3.152  12.440   0.625
   37    HE2  TYR   5           HE2      TYR   5   0.390  10.939   2.444
   38    HH   TYR   5           HH       TYR   5  -1.202  13.697   1.645
   39    H    GLY   6           H        GLY   6  -4.148   4.936   0.833
   40    HA2  GLY   6           HA2      GLY   6  -4.391   3.723   3.468
   41    HA3  GLY   6           HA3      GLY   6  -5.098   3.165   1.964
   42    H    GLN   7           H        GLN   7  -3.557   1.625   3.903
   43    HA   GLN   7           HA       GLN   7  -1.006   1.102   2.776
   44    HB2  GLN   7           HB2      GLN   7  -1.691   0.612   5.140
   45    HB3  GLN   7           HB3      GLN   7  -2.730  -0.677   4.542
   46    HG2  GLN   7           HG2      GLN   7  -0.799  -1.909   3.777
   47    HG3  GLN   7           HG3      GLN   7   0.274  -0.580   4.212
   48   HE21  GLN   7          HE21      GLN   7   0.473  -3.273   5.210
   49   HE22  GLN   7          HE22      GLN   7   0.199  -3.187   6.892
   50    H    CYS   8           H        CYS   8  -0.597  -0.053   0.987
   51    HA   CYS   8           HA       CYS   8  -2.931  -1.197  -0.377
   52    HB2  CYS   8           HB2      CYS   8  -1.610  -0.963  -2.406
   53    HB3  CYS   8           HB3      CYS   8  -1.853   0.554  -1.545
   54    H    GLY   9           H        GLY   9  -0.791  -2.569   1.510
   55    HA2  GLY   9           HA2      GLY   9  -1.073  -5.090   1.236
   56    HA3  GLY   9           HA3      GLY   9  -0.541  -4.806  -0.402
   57    H    GLY  10           H        GLY  10   0.579  -4.050   2.846
   58    HA2  GLY  10           HA2      GLY  10   3.268  -4.726   2.031
   59    HA3  GLY  10           HA3      GLY  10   2.759  -4.211   3.645
   60    H    ILE  11           H        ILE  11   4.365  -6.355   3.627
   61    HA   ILE  11           HA       ILE  11   3.169  -8.852   3.301
   62    HB   ILE  11           HB       ILE  11   5.239  -8.100   5.394
   63   HG12  ILE  11          HG12      ILE  11   5.609  -9.166   2.581
   64   HG13  ILE  11          HG13      ILE  11   5.926  -7.514   3.094
   65   HG21  ILE  11          HG21      ILE  11   4.531 -10.789   4.210
   66   HG22  ILE  11          HG22      ILE  11   4.186 -10.258   5.856
   67   HG23  ILE  11          HG23      ILE  11   5.856 -10.487   5.334
   68   HD11  ILE  11          HD11      ILE  11   7.984  -8.796   2.912
   69   HD12  ILE  11          HD12      ILE  11   7.358  -9.970   4.074
   70   HD13  ILE  11          HD13      ILE  11   7.684  -8.313   4.584
   71    H    GLY  12           H        GLY  12   1.306  -9.457   4.145
   72    HA2  GLY  12           HA2      GLY  12   0.255 -10.372   6.100
   73    HA3  GLY  12           HA3      GLY  12   0.887  -9.014   7.014
   74    H    TYR  13           H        TYR  13   0.033  -7.405   4.423
   75    HA   TYR  13           HA       TYR  13  -2.581  -6.781   5.542
   76    HB2  TYR  13           HB2      TYR  13  -1.096  -4.911   4.894
   77    HB3  TYR  13           HB3      TYR  13  -1.104  -5.480   3.232
   78    HD1  TYR  13           HD1      TYR  13  -2.976  -4.943   1.755
   79    HD2  TYR  13           HD2      TYR  13  -3.146  -3.941   5.891
   80    HE1  TYR  13           HE1      TYR  13  -4.930  -3.540   1.319
   81    HE2  TYR  13           HE2      TYR  13  -5.111  -2.530   5.463
   82    HH   TYR  13           HH       TYR  13  -6.643  -2.431   2.277
   83    H    SER  14           H        SER  14  -4.167  -7.962   4.961
   84    HA   SER  14           HA       SER  14  -4.150  -9.274   2.342
   85    HB2  SER  14           HB2      SER  14  -5.637  -9.973   4.868
   86    HB3  SER  14           HB3      SER  14  -5.458 -10.984   3.427
   87    HG   SER  14           HG       SER  14  -3.046 -10.348   4.057
   88    H    GLY  15           H        GLY  15  -5.043  -6.550   2.899
   89    HA2  GLY  15           HA2      GLY  15  -7.938  -6.709   2.431
   90    HA3  GLY  15           HA3      GLY  15  -7.027  -5.258   2.829
   91    HA   PRO  16           HA       PRO  16  -7.725  -5.111  -1.770
   92    HB2  PRO  16           HB2      PRO  16  -7.918  -2.239  -1.021
   93    HB3  PRO  16           HB3      PRO  16  -8.960  -3.185  -2.092
   94    HG2  PRO  16           HG2      PRO  16  -9.793  -2.467   0.316
   95    HG3  PRO  16           HG3      PRO  16 -10.177  -4.075  -0.327
   96    HD2  PRO  16           HD2      PRO  16  -8.090  -3.291   1.678
   97    HD3  PRO  16           HD3      PRO  16  -9.169  -4.695   1.672
   98    H    THR  17           H        THR  17  -5.831  -5.214  -2.790
   99    HA   THR  17           HA       THR  17  -3.589  -3.551  -1.878
  100    HB   THR  17           HB       THR  17  -2.202  -5.306  -3.015
  101    HG1  THR  17           HG1      THR  17  -3.201  -7.219  -3.561
  102   HG21  THR  17          HG21      THR  17  -4.058  -6.250  -0.827
  103   HG22  THR  17          HG22      THR  17  -2.595  -5.294  -0.597
  104   HG23  THR  17          HG23      THR  17  -2.481  -6.948  -1.210
  105    H    VAL  18           H        VAL  18  -5.824  -3.480  -4.178
  106    HA   VAL  18           HA       VAL  18  -3.954  -2.493  -6.215
  107    HB   VAL  18           HB       VAL  18  -6.886  -3.205  -6.574
  108   HG11  VAL  18          HG11      VAL  18  -6.184  -1.451  -8.108
  109   HG12  VAL  18          HG12      VAL  18  -6.422  -2.959  -8.990
  110   HG13  VAL  18          HG13      VAL  18  -4.793  -2.414  -8.603
  111   HG21  VAL  18          HG21      VAL  18  -5.516  -5.193  -6.197
  112   HG22  VAL  18          HG22      VAL  18  -4.412  -4.686  -7.475
  113   HG23  VAL  18          HG23      VAL  18  -6.075  -5.128  -7.866
  114    H    CYS  19           H        CYS  19  -3.638  -0.415  -6.014
  115    HA   CYS  19           HA       CYS  19  -5.339   1.317  -4.567
  116    HB2  CYS  19           HB2      CYS  19  -2.999   1.894  -6.361
  117    HB3  CYS  19           HB3      CYS  19  -3.733   3.016  -5.220
  118    H    ALA  20           H        ALA  20  -6.357   3.181  -5.314
  119    HA   ALA  20           HA       ALA  20  -7.914   2.955  -7.626
  120    HB1  ALA  20           HB1      ALA  20  -8.572   5.272  -7.125
  121    HB2  ALA  20           HB2      ALA  20  -7.272   5.381  -5.936
  122    HB3  ALA  20           HB3      ALA  20  -8.605   4.254  -5.688
  123    H    SER  21           H        SER  21  -7.783   4.032  -9.593
  124    HA   SER  21           HA       SER  21  -5.271   4.407 -10.720
  125    HB2  SER  21           HB2      SER  21  -7.926   5.542 -11.630
  126    HB3  SER  21           HB3      SER  21  -6.456   5.489 -12.604
  127    HG   SER  21           HG       SER  21  -7.215   3.634 -13.190
  128    H    GLY  22           H        GLY  22  -3.859   5.956 -10.526
  129    HA2  GLY  22           HA2      GLY  22  -3.328   8.313 -10.651
  130    HA3  GLY  22           HA3      GLY  22  -4.777   8.621  -9.698
  131    H    THR  23           H        THR  23  -3.816   5.977  -8.257
  132    HA   THR  23           HA       THR  23  -1.832   7.350  -6.609
  133    HB   THR  23           HB       THR  23  -2.615   6.107  -4.661
  134    HG1  THR  23           HG1      THR  23  -4.370   4.942  -6.538
  135   HG21  THR  23          HG21      THR  23  -4.831   7.616  -6.039
  136   HG22  THR  23          HG22      THR  23  -3.585   8.292  -4.983
  137   HG23  THR  23          HG23      THR  23  -4.809   7.208  -4.325
  138    H    THR  24           H        THR  24  -0.107   6.181  -5.951
  139    HA   THR  24           HA       THR  24   0.247   3.681  -7.434
  140    HB   THR  24           HB       THR  24   2.746   4.197  -7.065
  141    HG1  THR  24           HG1      THR  24   1.606   6.515  -6.022
  142   HG21  THR  24          HG21      THR  24   1.679   4.278  -9.252
  143   HG22  THR  24          HG22      THR  24   2.809   5.622  -9.083
  144   HG23  THR  24          HG23      THR  24   1.074   5.899  -8.922
  145    H    CYS  25           H        CYS  25   0.561   1.853  -6.346
  146    HA   CYS  25           HA       CYS  25   0.691   1.882  -3.491
  147    HB2  CYS  25           HB2      CYS  25  -0.489   0.038  -4.562
  148    HB3  CYS  25           HB3      CYS  25   0.935  -0.451  -5.455
  149    H    GLN  26           H        GLN  26   2.468   2.760  -2.757
  150    HA   GLN  26           HA       GLN  26   4.998   1.958  -3.916
  151    HB2  GLN  26           HB2      GLN  26   4.324   4.195  -2.014
  152    HB3  GLN  26           HB3      GLN  26   5.936   3.843  -2.629
  153    HG2  GLN  26           HG2      GLN  26   5.169   4.254  -4.899
  154    HG3  GLN  26           HG3      GLN  26   3.548   4.577  -4.297
  155   HE21  GLN  26          HE21      GLN  26   3.520   6.594  -5.107
  156   HE22  GLN  26          HE22      GLN  26   4.436   7.904  -4.469
  157    H    VAL  27           H        VAL  27   5.986   0.382  -3.022
  158    HA   VAL  27           HA       VAL  27   5.403  -0.438  -0.335
  159    HB   VAL  27           HB       VAL  27   7.615  -1.463  -2.148
  160   HG11  VAL  27          HG11      VAL  27   7.930  -1.980   0.210
  161   HG12  VAL  27          HG12      VAL  27   7.555  -3.450  -0.702
  162   HG13  VAL  27          HG13      VAL  27   6.315  -2.672   0.287
  163   HG21  VAL  27          HG21      VAL  27   4.813  -2.538  -1.767
  164   HG22  VAL  27          HG22      VAL  27   6.090  -3.309  -2.710
  165   HG23  VAL  27          HG23      VAL  27   5.432  -1.754  -3.220
  166    H    LEU  28           H        LEU  28   5.980   1.085   0.970
  167    HA   LEU  28           HA       LEU  28   8.432   2.565   0.795
  168    HB2  LEU  28           HB2      LEU  28   6.288   2.481   2.934
  169    HB3  LEU  28           HB3      LEU  28   7.588   3.649   2.851
  170    HG   LEU  28           HG       LEU  28   5.504   3.360   0.681
  171   HD11  LEU  28          HD11      LEU  28   5.599   5.357   2.939
  172   HD12  LEU  28          HD12      LEU  28   4.417   4.059   2.755
  173   HD13  LEU  28          HD13      LEU  28   4.468   5.369   1.589
  174   HD21  LEU  28          HD21      LEU  28   7.592   4.361  -0.043
  175   HD22  LEU  28          HD22      LEU  28   7.517   5.480   1.322
  176   HD23  LEU  28          HD23      LEU  28   6.313   5.582   0.032
  177    H    ASN  29           H        ASN  29   7.099   0.031   2.794
  178    HA   ASN  29           HA       ASN  29   9.751  -0.697   3.716
  179    HB2  ASN  29           HB2      ASN  29   7.323  -0.367   5.536
  180    HB3  ASN  29           HB3      ASN  29   8.851  -1.066   6.011
  181   HD21  ASN  29          HD21      ASN  29   7.154   1.875   5.330
  182   HD22  ASN  29          HD22      ASN  29   8.334   2.955   5.964
  183    HA   PRO  30           HA       PRO  30   8.313  -4.782   2.748
  184    HB2  PRO  30           HB2      PRO  30   8.565  -5.610   5.603
  185    HB3  PRO  30           HB3      PRO  30   9.216  -6.380   4.152
  186    HG2  PRO  30           HG2      PRO  30  10.826  -4.989   5.713
  187    HG3  PRO  30           HG3      PRO  30  10.942  -4.836   3.950
  188    HD2  PRO  30           HD2      PRO  30   9.692  -2.977   5.924
  189    HD3  PRO  30           HD3      PRO  30  10.680  -2.594   4.498
  190    H    TYR  31           H        TYR  31   6.949  -3.701   5.880
  191    HA   TYR  31           HA       TYR  31   4.505  -5.172   5.196
  192    HB2  TYR  31           HB2      TYR  31   5.144  -3.779   7.817
  193    HB3  TYR  31           HB3      TYR  31   3.872  -4.948   7.508
  194    HD1  TYR  31           HD1      TYR  31   4.393  -7.330   7.307
  195    HD2  TYR  31           HD2      TYR  31   7.444  -4.502   8.173
  196    HE1  TYR  31           HE1      TYR  31   5.894  -9.151   7.982
  197    HE2  TYR  31           HE2      TYR  31   8.941  -6.292   8.842
  198    HH   TYR  31           HH       TYR  31   8.752  -8.625   9.664
  199    H    TYR  32           H        TYR  32   5.792  -1.956   5.573
  200    HA   TYR  32           HA       TYR  32   3.113  -0.864   5.336
  201    HB2  TYR  32           HB2      TYR  32   4.649   0.154   6.994
  202    HB3  TYR  32           HB3      TYR  32   5.706   0.649   5.681
  203    HD1  TYR  32           HD1      TYR  32   5.600   2.915   5.237
  204    HD2  TYR  32           HD2      TYR  32   2.036   0.844   6.340
  205    HE1  TYR  32           HE1      TYR  32   4.354   4.975   5.045
  206    HE2  TYR  32           HE2      TYR  32   0.765   2.921   6.133
  207    HH   TYR  32           HH       TYR  32   2.046   5.700   4.658
  208    H    SER  33           H        SER  33   2.305  -0.618   3.427
  209    HA   SER  33           HA       SER  33   3.944   0.513   1.295
  210    HB2  SER  33           HB2      SER  33   1.944  -1.762   0.952
  211    HB3  SER  33           HB3      SER  33   2.937  -1.043  -0.319
  212    HG   SER  33           HG       SER  33   4.572  -1.812   1.617
  213    H    GLN  34           H        GLN  34   2.702   2.090   0.139
  214    HA   GLN  34           HA       GLN  34  -0.023   2.437   1.171
  215    HB2  GLN  34           HB2      GLN  34   1.524   3.680   2.621
  216    HB3  GLN  34           HB3      GLN  34   2.124   4.559   1.229
  217    HG2  GLN  34           HG2      GLN  34  -0.029   5.594   0.919
  218    HG3  GLN  34           HG3      GLN  34  -0.706   4.650   2.240
  219   HE21  GLN  34          HE21      GLN  34  -1.227   6.311   3.582
  220   HE22  GLN  34          HE22      GLN  34  -0.075   7.383   4.277
  221    H    CYS  35           H        CYS  35  -1.443   3.320  -0.263
  222    HA   CYS  35           HA       CYS  35  -0.607   3.741  -2.989
  223    HB2  CYS  35           HB2      CYS  35  -3.269   4.428  -1.736
  224    HB3  CYS  35           HB3      CYS  35  -2.893   4.277  -3.447
  225    H    LEU  36           H        LEU  36   0.515   5.509  -3.349
  226    HA   LEU  36           HA       LEU  36  -0.447   7.988  -2.168
  227    HB2  LEU  36           HB2      LEU  36   2.316   7.204  -3.086
  228    HB3  LEU  36           HB3      LEU  36   1.880   8.841  -2.635
  229    HG   LEU  36           HG       LEU  36   1.698   6.472  -0.763
  230   HD11  LEU  36          HD11      LEU  36   3.797   8.611  -0.986
  231   HD12  LEU  36          HD12      LEU  36   4.017   6.895  -1.337
  232   HD13  LEU  36          HD13      LEU  36   3.682   7.427   0.314
  233   HD21  LEU  36          HD21      LEU  36   1.489   8.202   0.962
  234   HD22  LEU  36          HD22      LEU  36   0.166   8.266  -0.195
  235   HD23  LEU  36          HD23      LEU  36   1.474   9.443  -0.290
  236    H1   MAN 101           H1       MAN 101  -9.275   5.945   2.252
  237    H2   MAN 101           H2       MAN 101  -7.172   5.537   3.495
  238    H3   MAN 101           H3       MAN 101  -6.876   3.213   2.911
  239    H4   MAN 101           H4       MAN 101  -9.255   2.660   4.746
  240    H5   MAN 101           H5       MAN 101  -9.001   2.356   1.705
  241    H61  MAN 101           H61      MAN 101 -10.474   0.748   2.785
  242    H62  MAN 101           H62      MAN 101 -11.370   1.875   1.732
  243    HO2  MAN 101           HO2      MAN 101  -9.103   6.123   4.619
  244    HO3  MAN 101           HO3      MAN 101  -6.082   3.996   5.016
  245    HO4  MAN 101           HO4      MAN 101  -7.623   1.109   4.696
  246    HO6  MAN 101           HO6      MAN 101 -11.256   2.983   4.133
  Start of MODEL   19
    1    H1   THR   1           H1       THR   1 -11.441  -0.545  -6.244
    2    H2   THR   1           H2       THR   1 -11.690   0.656  -5.060
    3    H3   THR   1           H3       THR   1 -11.322  -0.920  -4.606
    4    HA   THR   1           HA       THR   1  -9.163  -0.778  -5.454
    5    HB   THR   1           HB       THR   1  -8.355   1.478  -6.196
    6    HG1  THR   1           HG1      THR   1 -10.945   2.137  -6.989
    7   HG21  THR   1          HG21      THR   1 -10.414   0.136  -7.956
    8   HG22  THR   1          HG22      THR   1  -8.705  -0.300  -7.822
    9   HG23  THR   1          HG23      THR   1  -9.173   1.266  -8.497
   10    H    GLN   2           H        GLN   2  -7.532  -0.099  -4.105
   11    HA   GLN   2           HA       GLN   2  -8.320   0.669  -1.512
   12    HB2  GLN   2           HB2      GLN   2  -6.416  -0.860  -1.954
   13    HB3  GLN   2           HB3      GLN   2  -5.552   0.451  -2.736
   14    HG2  GLN   2           HG2      GLN   2  -4.785   0.052  -0.444
   15    HG3  GLN   2           HG3      GLN   2  -5.430   1.671  -0.695
   16   HE21  GLN   2          HE21      GLN   2  -6.009   2.066   1.246
   17   HE22  GLN   2          HE22      GLN   2  -7.220   1.230   2.185
   18    H    SER   3           H        SER   3  -7.924   2.593  -0.422
   19    HA   SER   3           HA       SER   3  -8.238   4.859  -2.114
   20    HB2  SER   3           HB2      SER   3  -8.783   6.001  -0.036
   21    HB3  SER   3           HB3      SER   3  -9.663   4.477  -0.156
   22    H    HIS   4           H        HIS   4  -7.237   6.864  -1.171
   23    HA   HIS   4           HA       HIS   4  -4.408   6.699  -1.743
   24    HB2  HIS   4           HB2      HIS   4  -5.922   8.439  -2.723
   25    HB3  HIS   4           HB3      HIS   4  -6.152   9.120  -1.135
   26    HD1  HIS   4           HD1      HIS   4  -5.146  11.396  -1.772
   27    HD2  HIS   4           HD2      HIS   4  -2.586   8.220  -2.469
   28    HE1  HIS   4           HE1      HIS   4  -2.948  12.440  -2.349
   29    HE2  HIS   4           HE2      HIS   4  -1.603  10.487  -3.174
   30    H    TYR   5           H        TYR   5  -2.808   6.920  -0.223
   31    HA   TYR   5           HA       TYR   5  -1.745   7.008   1.705
   32    HB2  TYR   5           HB2      TYR   5  -4.111   8.626   2.518
   33    HB3  TYR   5           HB3      TYR   5  -2.969   8.119   3.767
   34    HD1  TYR   5           HD1      TYR   5  -3.526  10.285   0.872
   35    HD2  TYR   5           HD2      TYR   5  -0.688   9.004   3.760
   36    HE1  TYR   5           HE1      TYR   5  -2.080  12.177   0.287
   37    HE2  TYR   5           HE2      TYR   5   0.768  10.887   3.189
   38    HH   TYR   5           HH       TYR   5   1.165  12.375   1.276
   39    H    GLY   6           H        GLY   6  -4.066   5.088   1.013
   40    HA2  GLY   6           HA2      GLY   6  -4.324   3.777   3.586
   41    HA3  GLY   6           HA3      GLY   6  -5.119   3.344   2.083
   42    H    GLN   7           H        GLN   7  -3.791   1.448   3.683
   43    HA   GLN   7           HA       GLN   7  -1.183   1.020   2.575
   44    HB2  GLN   7           HB2      GLN   7  -1.662   0.437   4.926
   45    HB3  GLN   7           HB3      GLN   7  -2.877  -0.710   4.398
   46    HG2  GLN   7           HG2      GLN   7  -1.235  -2.164   3.482
   47    HG3  GLN   7           HG3      GLN   7   0.027  -0.948   3.665
   48   HE21  GLN   7          HE21      GLN   7  -0.103  -3.672   4.748
   49   HE22  GLN   7          HE22      GLN   7   0.024  -3.501   6.439
   50    H    CYS   8           H        CYS   8  -0.707  -0.155   0.857
   51    HA   CYS   8           HA       CYS   8  -2.983  -1.382  -0.545
   52    HB2  CYS   8           HB2      CYS   8  -1.647  -1.107  -2.572
   53    HB3  CYS   8           HB3      CYS   8  -2.004   0.405  -1.752
   54    H    GLY   9           H        GLY   9  -0.674  -2.582   1.336
   55    HA2  GLY   9           HA2      GLY   9  -0.820  -5.117   1.183
   56    HA3  GLY   9           HA3      GLY   9  -0.421  -4.885  -0.503
   57    H    GLY  10           H        GLY  10   0.774  -4.482   2.738
   58    HA2  GLY  10           HA2      GLY  10   3.495  -4.982   1.754
   59    HA3  GLY  10           HA3      GLY  10   3.049  -4.454   3.381
   60    H    ILE  11           H        ILE  11   4.592  -6.563   3.468
   61    HA   ILE  11           HA       ILE  11   3.299  -9.059   3.299
   62    HB   ILE  11           HB       ILE  11   5.479  -8.184   5.230
   63   HG12  ILE  11          HG12      ILE  11   5.721  -9.559   2.540
   64   HG13  ILE  11          HG13      ILE  11   6.086  -7.868   2.854
   65   HG21  ILE  11          HG21      ILE  11   4.416 -10.231   5.984
   66   HG22  ILE  11          HG22      ILE  11   6.038 -10.581   5.379
   67   HG23  ILE  11          HG23      ILE  11   4.628 -10.952   4.389
   68   HD11  ILE  11          HD11      ILE  11   8.105  -9.219   2.737
   69   HD12  ILE  11          HD12      ILE  11   7.504 -10.230   4.058
   70   HD13  ILE  11          HD13      ILE  11   7.888  -8.534   4.350
   71    H    GLY  12           H        GLY  12   1.455  -9.572   4.347
   72    HA2  GLY  12           HA2      GLY  12   0.522 -10.236   6.480
   73    HA3  GLY  12           HA3      GLY  12   1.249  -8.799   7.178
   74    H    TYR  13           H        TYR  13  -0.018  -7.883   4.266
   75    HA   TYR  13           HA       TYR  13  -2.426  -6.886   5.595
   76    HB2  TYR  13           HB2      TYR  13  -0.925  -5.257   4.463
   77    HB3  TYR  13           HB3      TYR  13  -1.230  -6.075   2.941
   78    HD1  TYR  13           HD1      TYR  13  -3.229  -4.572   5.733
   79    HD2  TYR  13           HD2      TYR  13  -2.767  -5.030   1.531
   80    HE1  TYR  13           HE1      TYR  13  -5.130  -3.055   5.360
   81    HE2  TYR  13           HE2      TYR  13  -4.655  -3.534   1.147
   82    HH   TYR  13           HH       TYR  13  -6.366  -2.426   2.102
   83    H    SER  14           H        SER  14  -4.444  -7.541   4.993
   84    HA   SER  14           HA       SER  14  -4.556  -9.525   2.822
   85    HB2  SER  14           HB2      SER  14  -6.325  -9.366   5.257
   86    HB3  SER  14           HB3      SER  14  -6.175 -10.704   4.118
   87    HG   SER  14           HG       SER  14  -3.975 -10.918   4.816
   88    H    GLY  15           H        GLY  15  -5.216  -6.463   3.182
   89    HA2  GLY  15           HA2      GLY  15  -8.046  -6.473   2.400
   90    HA3  GLY  15           HA3      GLY  15  -7.097  -5.063   2.849
   91    HA   PRO  16           HA       PRO  16  -7.616  -5.071  -1.782
   92    HB2  PRO  16           HB2      PRO  16  -7.791  -2.162  -1.187
   93    HB3  PRO  16           HB3      PRO  16  -8.801  -3.148  -2.250
   94    HG2  PRO  16           HG2      PRO  16  -9.731  -2.319   0.091
   95    HG3  PRO  16           HG3      PRO  16 -10.081  -3.959  -0.493
   96    HD2  PRO  16           HD2      PRO  16  -8.062  -3.074   1.545
   97    HD3  PRO  16           HD3      PRO  16  -9.160  -4.466   1.586
   98    H    THR  17           H        THR  17  -5.831  -5.125  -2.908
   99    HA   THR  17           HA       THR  17  -3.442  -3.661  -2.030
  100    HB   THR  17           HB       THR  17  -2.352  -5.452  -3.476
  101    HG1  THR  17           HG1      THR  17  -3.579  -7.192  -4.007
  102   HG21  THR  17          HG21      THR  17  -2.464  -7.131  -1.683
  103   HG22  THR  17          HG22      THR  17  -3.894  -6.337  -1.028
  104   HG23  THR  17          HG23      THR  17  -2.342  -5.506  -1.004
  105    H    VAL  18           H        VAL  18  -5.816  -3.566  -4.300
  106    HA   VAL  18           HA       VAL  18  -4.076  -2.469  -6.398
  107    HB   VAL  18           HB       VAL  18  -7.037  -3.155  -6.507
  108   HG11  VAL  18          HG11      VAL  18  -5.175  -2.277  -8.716
  109   HG12  VAL  18          HG12      VAL  18  -6.478  -1.314  -8.020
  110   HG13  VAL  18          HG13      VAL  18  -6.852  -2.784  -8.925
  111   HG21  VAL  18          HG21      VAL  18  -5.630  -5.135  -6.370
  112   HG22  VAL  18          HG22      VAL  18  -4.656  -4.548  -7.713
  113   HG23  VAL  18          HG23      VAL  18  -6.346  -4.987  -7.976
  114    H    CYS  19           H        CYS  19  -3.721  -0.368  -6.210
  115    HA   CYS  19           HA       CYS  19  -5.309   1.324  -4.585
  116    HB2  CYS  19           HB2      CYS  19  -3.066   1.920  -6.502
  117    HB3  CYS  19           HB3      CYS  19  -3.746   3.044  -5.335
  118    H    ALA  20           H        ALA  20  -6.291   3.287  -5.290
  119    HA   ALA  20           HA       ALA  20  -7.996   3.069  -7.507
  120    HB1  ALA  20           HB1      ALA  20  -7.197   5.532  -5.935
  121    HB2  ALA  20           HB2      ALA  20  -8.518   4.427  -5.548
  122    HB3  ALA  20           HB3      ALA  20  -8.584   5.390  -7.022
  123    H    SER  21           H        SER  21  -7.997   4.250  -9.457
  124    HA   SER  21           HA       SER  21  -5.552   4.356 -10.785
  125    HB2  SER  21           HB2      SER  21  -8.149   5.726 -11.500
  126    HB3  SER  21           HB3      SER  21  -6.835   5.316 -12.612
  127    HG   SER  21           HG       SER  21  -7.238   3.083 -11.616
  128    H    GLY  22           H        GLY  22  -4.002   5.805 -10.715
  129    HA2  GLY  22           HA2      GLY  22  -3.303   8.084 -10.922
  130    HA3  GLY  22           HA3      GLY  22  -4.664   8.532  -9.895
  131    H    THR  23           H        THR  23  -3.984   6.016  -8.241
  132    HA   THR  23           HA       THR  23  -1.835   7.332  -6.759
  133    HB   THR  23           HB       THR  23  -2.612   6.116  -4.787
  134    HG1  THR  23           HG1      THR  23  -4.396   4.986  -6.652
  135   HG21  THR  23          HG21      THR  23  -3.516   8.343  -5.169
  136   HG22  THR  23          HG22      THR  23  -4.741   7.314  -4.423
  137   HG23  THR  23          HG23      THR  23  -4.815   7.666  -6.150
  138    H    THR  24           H        THR  24  -0.107   6.165  -6.105
  139    HA   THR  24           HA       THR  24   0.237   3.650  -7.569
  140    HB   THR  24           HB       THR  24   2.717   4.120  -7.302
  141    HG1  THR  24           HG1      THR  24   1.659   6.533  -6.216
  142   HG21  THR  24          HG21      THR  24   1.078   6.138  -8.831
  143   HG22  THR  24          HG22      THR  24   1.523   4.528  -9.396
  144   HG23  THR  24          HG23      THR  24   2.771   5.749  -9.132
  145    H    CYS  25           H        CYS  25   0.823   1.804  -6.532
  146    HA   CYS  25           HA       CYS  25   0.707   1.856  -3.654
  147    HB2  CYS  25           HB2      CYS  25  -0.386  -0.006  -4.777
  148    HB3  CYS  25           HB3      CYS  25   1.095  -0.512  -5.564
  149    H    GLN  26           H        GLN  26   2.398   2.751  -2.803
  150    HA   GLN  26           HA       GLN  26   5.038   2.072  -3.805
  151    HB2  GLN  26           HB2      GLN  26   4.101   4.241  -1.929
  152    HB3  GLN  26           HB3      GLN  26   5.775   3.997  -2.402
  153    HG2  GLN  26           HG2      GLN  26   5.173   4.410  -4.733
  154    HG3  GLN  26           HG3      GLN  26   3.494   4.628  -4.255
  155   HE21  GLN  26          HE21      GLN  26   3.434   6.645  -5.059
  156   HE22  GLN  26          HE22      GLN  26   4.212   8.002  -4.331
  157    H    VAL  27           H        VAL  27   6.027   0.508  -2.840
  158    HA   VAL  27           HA       VAL  27   5.223  -0.367  -0.220
  159    HB   VAL  27           HB       VAL  27   7.585  -1.334  -1.884
  160   HG11  VAL  27          HG11      VAL  27   7.410  -3.382  -0.551
  161   HG12  VAL  27          HG12      VAL  27   6.098  -2.660   0.377
  162   HG13  VAL  27          HG13      VAL  27   7.716  -1.973   0.467
  163   HG21  VAL  27          HG21      VAL  27   6.131  -3.170  -2.631
  164   HG22  VAL  27          HG22      VAL  27   5.522  -1.600  -3.160
  165   HG23  VAL  27          HG23      VAL  27   4.769  -2.424  -1.793
  166    H    LEU  28           H        LEU  28   5.687   1.183   1.152
  167    HA   LEU  28           HA       LEU  28   8.061   2.789   1.096
  168    HB2  LEU  28           HB2      LEU  28   5.887   2.522   3.160
  169    HB3  LEU  28           HB3      LEU  28   7.131   3.753   3.170
  170    HG   LEU  28           HG       LEU  28   5.035   3.455   1.008
  171   HD11  LEU  28          HD11      LEU  28   4.052   5.458   2.001
  172   HD12  LEU  28          HD12      LEU  28   5.209   5.361   3.334
  173   HD13  LEU  28          HD13      LEU  28   4.016   4.076   3.092
  174   HD21  LEU  28          HD21      LEU  28   5.752   5.673   0.369
  175   HD22  LEU  28          HD22      LEU  28   7.099   4.519   0.260
  176   HD23  LEU  28          HD23      LEU  28   6.979   5.633   1.637
  177    H    ASN  29           H        ASN  29   6.903   0.028   2.828
  178    HA   ASN  29           HA       ASN  29   9.491  -0.377   4.100
  179    HB2  ASN  29           HB2      ASN  29   6.809  -0.503   5.539
  180    HB3  ASN  29           HB3      ASN  29   8.373  -0.908   6.223
  181   HD21  ASN  29          HD21      ASN  29   6.273   1.672   5.217
  182   HD22  ASN  29          HD22      ASN  29   7.069   2.954   6.016
  183    HA   PRO  30           HA       PRO  30   8.544  -4.522   2.754
  184    HB2  PRO  30           HB2      PRO  30   8.821  -5.614   5.483
  185    HB3  PRO  30           HB3      PRO  30   9.690  -6.063   4.013
  186    HG2  PRO  30           HG2      PRO  30  10.914  -4.649   5.918
  187    HG3  PRO  30           HG3      PRO  30  11.204  -4.306   4.203
  188    HD2  PRO  30           HD2      PRO  30   9.501  -2.832   6.171
  189    HD3  PRO  30           HD3      PRO  30  10.552  -2.186   4.895
  190    H    TYR  31           H        TYR  31   6.954  -3.579   5.779
  191    HA   TYR  31           HA       TYR  31   4.755  -5.391   5.048
  192    HB2  TYR  31           HB2      TYR  31   5.207  -4.041   7.721
  193    HB3  TYR  31           HB3      TYR  31   4.047  -5.302   7.350
  194    HD1  TYR  31           HD1      TYR  31   7.611  -4.570   7.933
  195    HD2  TYR  31           HD2      TYR  31   4.732  -7.614   7.247
  196    HE1  TYR  31           HE1      TYR  31   9.253  -6.262   8.601
  197    HE2  TYR  31           HE2      TYR  31   6.367  -9.313   7.910
  198    HH   TYR  31           HH       TYR  31   9.186  -8.556   9.508
  199    H    TYR  32           H        TYR  32   5.606  -2.048   5.620
  200    HA   TYR  32           HA       TYR  32   2.829  -1.342   5.221
  201    HB2  TYR  32           HB2      TYR  32   3.984  -0.222   7.078
  202    HB3  TYR  32           HB3      TYR  32   5.087   0.528   5.928
  203    HD1  TYR  32           HD1      TYR  32   4.545   2.654   5.053
  204    HD2  TYR  32           HD2      TYR  32   1.464   0.159   6.629
  205    HE1  TYR  32           HE1      TYR  32   2.941   4.439   4.727
  206    HE2  TYR  32           HE2      TYR  32  -0.158   1.949   6.310
  207    HH   TYR  32           HH       TYR  32  -0.154   4.386   6.136
  208    H    SER  33           H        SER  33   2.089  -1.035   3.285
  209    HA   SER  33           HA       SER  33   3.772   0.374   1.329
  210    HB2  SER  33           HB2      SER  33   1.660  -1.733   0.738
  211    HB3  SER  33           HB3      SER  33   2.715  -0.948  -0.435
  212    HG   SER  33           HG       SER  33   3.367  -3.101   0.284
  213    H    GLN  34           H        GLN  34   2.605   2.033   0.186
  214    HA   GLN  34           HA       GLN  34  -0.132   2.483   1.128
  215    HB2  GLN  34           HB2      GLN  34   1.113   3.772   2.671
  216    HB3  GLN  34           HB3      GLN  34   2.190   4.369   1.423
  217    HG2  GLN  34           HG2      GLN  34   0.432   5.748   0.511
  218    HG3  GLN  34           HG3      GLN  34  -0.724   5.065   1.648
  219   HE21  GLN  34          HE21      GLN  34  -0.779   5.811   3.703
  220   HE22  GLN  34          HE22      GLN  34   0.137   7.133   4.276
  221    H    CYS  35           H        CYS  35  -1.484   3.431  -0.290
  222    HA   CYS  35           HA       CYS  35  -0.605   3.767  -3.024
  223    HB2  CYS  35           HB2      CYS  35  -3.310   4.356  -1.807
  224    HB3  CYS  35           HB3      CYS  35  -2.935   4.273  -3.520
  225    H    LEU  36           H        LEU  36   0.517   5.545  -3.416
  226    HA   LEU  36           HA       LEU  36  -0.588   8.088  -2.496
  227    HB2  LEU  36           HB2      LEU  36   2.250   7.370  -3.190
  228    HB3  LEU  36           HB3      LEU  36   1.703   9.021  -2.993
  229    HG   LEU  36           HG       LEU  36   1.621   6.910  -0.839
  230   HD11  LEU  36          HD11      LEU  36   3.464   9.264  -1.214
  231   HD12  LEU  36          HD12      LEU  36   3.901   7.561  -1.387
  232   HD13  LEU  36          HD13      LEU  36   3.421   8.192   0.189
  233   HD21  LEU  36          HD21      LEU  36   1.116   8.820   0.630
  234   HD22  LEU  36          HD22      LEU  36  -0.146   8.544  -0.559
  235   HD23  LEU  36          HD23      LEU  36   1.005   9.864  -0.786
  236    H1   MAN 101           H1       MAN 101  -9.258   5.851   2.263
  237    H2   MAN 101           H2       MAN 101  -7.229   5.228   3.571
  238    H3   MAN 101           H3       MAN 101  -7.028   2.932   2.804
  239    H4   MAN 101           H4       MAN 101  -9.489   2.450   4.532
  240    H5   MAN 101           H5       MAN 101  -9.187   2.255   1.482
  241    H61  MAN 101           H61      MAN 101 -10.852   0.688   2.384
  242    H62  MAN 101           H62      MAN 101 -11.630   2.005   1.476
  243    HO2  MAN 101           HO2      MAN 101  -9.090   5.821   4.681
  244    HO3  MAN 101           HO3      MAN 101  -7.640   3.264   5.542
  245    HO4  MAN 101           HO4      MAN 101  -9.210   0.304   3.676
  246    HO6  MAN 101           HO6      MAN 101 -11.607   3.016   3.790
  Start of MODEL   20
    1    H1   THR   1           H1       THR   1 -10.614  -2.022  -5.881
    2    H2   THR   1           H2       THR   1 -11.340  -1.163  -4.653
    3    H3   THR   1           H3       THR   1 -10.236  -2.381  -4.258
    4    HA   THR   1           HA       THR   1  -8.542  -0.971  -5.363
    5    HB   THR   1           HB       THR   1  -9.381   1.473  -5.420
    6    HG1  THR   1           HG1      THR   1 -11.721   1.274  -6.257
    7   HG21  THR   1          HG21      THR   1 -10.180  -0.509  -7.573
    8   HG22  THR   1          HG22      THR   1  -8.596   0.260  -7.404
    9   HG23  THR   1          HG23      THR   1 -10.003   1.232  -7.799
   10    H    GLN   2           H        GLN   2  -7.275   0.089  -3.985
   11    HA   GLN   2           HA       GLN   2  -8.238   0.518  -1.293
   12    HB2  GLN   2           HB2      GLN   2  -6.181  -0.831  -1.582
   13    HB3  GLN   2           HB3      GLN   2  -5.435   0.503  -2.449
   14    HG2  GLN   2           HG2      GLN   2  -4.674   0.371  -0.148
   15    HG3  GLN   2           HG3      GLN   2  -5.517   1.880  -0.497
   16   HE21  GLN   2          HE21      GLN   2  -6.285   2.365   1.333
   17   HE22  GLN   2          HE22      GLN   2  -7.342   1.457   2.370
   18    H    SER   3           H        SER   3  -8.000   2.566  -0.315
   19    HA   SER   3           HA       SER   3  -8.410   4.709  -2.138
   20    HB2  SER   3           HB2      SER   3  -8.930   5.973  -0.151
   21    HB3  SER   3           HB3      SER   3  -9.742   4.407  -0.068
   22    H    HIS   4           H        HIS   4  -7.418   6.776  -1.466
   23    HA   HIS   4           HA       HIS   4  -4.586   6.705  -1.916
   24    HB2  HIS   4           HB2      HIS   4  -6.215   8.411  -2.831
   25    HB3  HIS   4           HB3      HIS   4  -6.355   9.053  -1.211
   26    HD1  HIS   4           HD1      HIS   4  -5.498  11.312  -2.085
   27    HD2  HIS   4           HD2      HIS   4  -2.776   8.229  -2.505
   28    HE1  HIS   4           HE1      HIS   4  -3.342  12.412  -2.692
   29    HE2  HIS   4           HE2      HIS   4  -1.757  10.523  -3.130
   30    H    TYR   5           H        TYR   5  -2.978   6.958  -0.431
   31    HA   TYR   5           HA       TYR   5  -1.877   7.152   1.461
   32    HB2  TYR   5           HB2      TYR   5  -4.323   8.600   2.376
   33    HB3  TYR   5           HB3      TYR   5  -3.015   8.267   3.512
   34    HD1  TYR   5           HD1      TYR   5  -4.191  10.391   0.845
   35    HD2  TYR   5           HD2      TYR   5  -0.750   9.223   3.033
   36    HE1  TYR   5           HE1      TYR   5  -3.020  12.406   0.082
   37    HE2  TYR   5           HE2      TYR   5   0.429  11.237   2.285
   38    HH   TYR   5           HH       TYR   5  -1.162  13.823   0.798
   39    H    GLY   6           H        GLY   6  -4.121   5.106   0.896
   40    HA2  GLY   6           HA2      GLY   6  -4.299   3.930   3.535
   41    HA3  GLY   6           HA3      GLY   6  -5.063   3.380   2.064
   42    H    GLN   7           H        GLN   7  -3.789   1.562   3.641
   43    HA   GLN   7           HA       GLN   7  -1.112   1.121   2.682
   44    HB2  GLN   7           HB2      GLN   7  -1.970   0.523   4.987
   45    HB3  GLN   7           HB3      GLN   7  -2.922  -0.740   4.229
   46    HG2  GLN   7           HG2      GLN   7  -0.906  -1.848   3.478
   47    HG3  GLN   7           HG3      GLN   7   0.086  -0.563   4.165
   48   HE21  GLN   7          HE21      GLN   7   0.221  -3.356   4.874
   49   HE22  GLN   7          HE22      GLN   7  -0.223  -3.444   6.519
   50    H    CYS   8           H        CYS   8  -0.628  -0.076   0.898
   51    HA   CYS   8           HA       CYS   8  -2.931  -1.282  -0.496
   52    HB2  CYS   8           HB2      CYS   8  -1.585  -0.989  -2.528
   53    HB3  CYS   8           HB3      CYS   8  -2.056   0.502  -1.733
   54    H    GLY   9           H        GLY   9  -0.749  -2.529   1.374
   55    HA2  GLY   9           HA2      GLY   9  -0.877  -5.059   1.046
   56    HA3  GLY   9           HA3      GLY   9  -0.270  -4.707  -0.556
   57    H    GLY  10           H        GLY  10   0.463  -4.641   2.826
   58    HA2  GLY  10           HA2      GLY  10   3.291  -4.868   2.143
   59    HA3  GLY  10           HA3      GLY  10   2.637  -4.567   3.765
   60    H    ILE  11           H        ILE  11   4.286  -6.590   3.785
   61    HA   ILE  11           HA       ILE  11   3.177  -9.108   3.173
   62    HB   ILE  11           HB       ILE  11   5.084  -8.401   5.425
   63   HG12  ILE  11          HG12      ILE  11   5.705  -9.373   2.626
   64   HG13  ILE  11          HG13      ILE  11   5.880  -7.709   3.174
   65   HG21  ILE  11          HG21      ILE  11   5.770 -10.763   5.318
   66   HG22  ILE  11          HG22      ILE  11   4.550 -11.065   4.087
   67   HG23  ILE  11          HG23      ILE  11   4.056 -10.609   5.717
   68   HD11  ILE  11          HD11      ILE  11   7.363 -10.092   4.230
   69   HD12  ILE  11          HD12      ILE  11   7.541  -8.435   4.804
   70   HD13  ILE  11          HD13      ILE  11   8.012  -8.853   3.152
   71    H    GLY  12           H        GLY  12   1.207  -9.682   3.889
   72    HA2  GLY  12           HA2      GLY  12   0.109 -10.736   5.755
   73    HA3  GLY  12           HA3      GLY  12   0.725  -9.450   6.778
   74    H    TYR  13           H        TYR  13  -0.073  -7.725   4.242
   75    HA   TYR  13           HA       TYR  13  -2.582  -6.924   5.415
   76    HB2  TYR  13           HB2      TYR  13  -0.979  -5.243   4.563
   77    HB3  TYR  13           HB3      TYR  13  -1.189  -5.887   2.943
   78    HD1  TYR  13           HD1      TYR  13  -2.776  -4.890   1.542
   79    HD2  TYR  13           HD2      TYR  13  -3.136  -4.379   5.744
   80    HE1  TYR  13           HE1      TYR  13  -4.569  -3.275   1.185
   81    HE2  TYR  13           HE2      TYR  13  -4.952  -2.751   5.385
   82    HH   TYR  13           HH       TYR  13  -6.203  -2.099   2.148
   83    H    SER  14           H        SER  14  -4.325  -8.017   5.046
   84    HA   SER  14           HA       SER  14  -4.640  -9.521   2.616
   85    HB2  SER  14           HB2      SER  14  -6.639 -10.368   3.993
   86    HB3  SER  14           HB3      SER  14  -5.016 -10.779   4.552
   87    HG   SER  14           HG       SER  14  -6.826  -8.861   5.546
   88    H    GLY  15           H        GLY  15  -5.280  -6.464   3.473
   89    HA2  GLY  15           HA2      GLY  15  -8.032  -6.219   2.608
   90    HA3  GLY  15           HA3      GLY  15  -6.956  -4.902   3.055
   91    HA   PRO  16           HA       PRO  16  -7.617  -4.862  -1.572
   92    HB2  PRO  16           HB2      PRO  16  -7.800  -1.956  -0.961
   93    HB3  PRO  16           HB3      PRO  16  -8.829  -2.939  -2.002
   94    HG2  PRO  16           HG2      PRO  16  -9.728  -2.136   0.353
   95    HG3  PRO  16           HG3      PRO  16 -10.050  -3.789  -0.205
   96    HD2  PRO  16           HD2      PRO  16  -7.966  -2.829   1.727
   97    HD3  PRO  16           HD3      PRO  16  -9.061  -4.219   1.874
   98    H    THR  17           H        THR  17  -5.780  -5.002  -2.690
   99    HA   THR  17           HA       THR  17  -3.412  -3.460  -1.886
  100    HB   THR  17           HB       THR  17  -2.272  -5.170  -3.331
  101    HG1  THR  17           HG1      THR  17  -3.444  -6.591  -4.367
  102   HG21  THR  17          HG21      THR  17  -2.445  -6.984  -1.675
  103   HG22  THR  17          HG22      THR  17  -3.918  -6.256  -1.032
  104   HG23  THR  17          HG23      THR  17  -2.380  -5.413  -0.878
  105    H    VAL  18           H        VAL  18  -5.822  -3.513  -4.208
  106    HA   VAL  18           HA       VAL  18  -4.086  -2.523  -6.343
  107    HB   VAL  18           HB       VAL  18  -7.092  -2.945  -6.398
  108   HG11  VAL  18          HG11      VAL  18  -5.137  -2.555  -8.656
  109   HG12  VAL  18          HG12      VAL  18  -6.332  -1.385  -8.095
  110   HG13  VAL  18          HG13      VAL  18  -6.856  -2.896  -8.839
  111   HG21  VAL  18          HG21      VAL  18  -6.645  -5.026  -7.626
  112   HG22  VAL  18          HG22      VAL  18  -5.968  -5.073  -5.999
  113   HG23  VAL  18          HG23      VAL  18  -4.916  -4.788  -7.386
  114    H    CYS  19           H        CYS  19  -3.604  -0.428  -6.114
  115    HA   CYS  19           HA       CYS  19  -5.137   1.376  -4.608
  116    HB2  CYS  19           HB2      CYS  19  -2.901   1.794  -6.571
  117    HB3  CYS  19           HB3      CYS  19  -3.574   3.045  -5.535
  118    H    ALA  20           H        ALA  20  -6.246   3.201  -5.288
  119    HA   ALA  20           HA       ALA  20  -7.956   2.984  -7.483
  120    HB1  ALA  20           HB1      ALA  20  -7.111   5.418  -5.910
  121    HB2  ALA  20           HB2      ALA  20  -8.443   4.332  -5.508
  122    HB3  ALA  20           HB3      ALA  20  -8.522   5.321  -6.965
  123    H    SER  21           H        SER  21  -7.906   4.053  -9.476
  124    HA   SER  21           HA       SER  21  -5.404   4.257 -10.723
  125    HB2  SER  21           HB2      SER  21  -8.068   5.369 -11.604
  126    HB3  SER  21           HB3      SER  21  -6.665   5.086 -12.643
  127    HG   SER  21           HG       SER  21  -6.918   2.848 -11.539
  128    H    GLY  22           H        GLY  22  -3.947   5.800 -10.667
  129    HA2  GLY  22           HA2      GLY  22  -3.379   8.126 -10.881
  130    HA3  GLY  22           HA3      GLY  22  -4.825   8.501  -9.940
  131    H    THR  23           H        THR  23  -3.934   5.933  -8.342
  132    HA   THR  23           HA       THR  23  -1.906   7.370  -6.801
  133    HB   THR  23           HB       THR  23  -2.625   6.155  -4.794
  134    HG1  THR  23           HG1      THR  23  -4.410   4.934  -6.616
  135   HG21  THR  23          HG21      THR  23  -3.659   8.306  -5.210
  136   HG22  THR  23          HG22      THR  23  -4.817   7.218  -4.449
  137   HG23  THR  23          HG23      THR  23  -4.917   7.542  -6.182
  138    H    THR  24           H        THR  24  -0.123   6.231  -6.085
  139    HA   THR  24           HA       THR  24   0.329   3.757  -7.589
  140    HB   THR  24           HB       THR  24   2.782   4.359  -7.393
  141    HG1  THR  24           HG1      THR  24   1.656   6.722  -6.222
  142   HG21  THR  24          HG21      THR  24   1.032   6.428  -8.734
  143   HG22  THR  24          HG22      THR  24   1.493   4.881  -9.431
  144   HG23  THR  24          HG23      THR  24   2.722   6.106  -9.117
  145    H    CYS  25           H        CYS  25   0.853   1.908  -6.490
  146    HA   CYS  25           HA       CYS  25   0.798   2.018  -3.621
  147    HB2  CYS  25           HB2      CYS  25  -0.301   0.107  -4.695
  148    HB3  CYS  25           HB3      CYS  25   1.196  -0.417  -5.442
  149    H    GLN  26           H        GLN  26   2.485   2.883  -2.758
  150    HA   GLN  26           HA       GLN  26   5.094   2.142  -3.780
  151    HB2  GLN  26           HB2      GLN  26   4.272   4.372  -1.932
  152    HB3  GLN  26           HB3      GLN  26   5.914   4.066  -2.482
  153    HG2  GLN  26           HG2      GLN  26   5.240   4.453  -4.780
  154    HG3  GLN  26           HG3      GLN  26   3.576   4.704  -4.262
  155   HE21  GLN  26          HE21      GLN  26   3.479   6.703  -5.065
  156   HE22  GLN  26          HE22      GLN  26   4.314   8.064  -4.387
  157    H    VAL  27           H        VAL  27   5.873   0.422  -2.872
  158    HA   VAL  27           HA       VAL  27   5.343  -0.321  -0.182
  159    HB   VAL  27           HB       VAL  27   7.528  -1.269  -2.084
  160   HG11  VAL  27          HG11      VAL  27   7.699  -3.233  -0.615
  161   HG12  VAL  27          HG12      VAL  27   6.538  -2.495   0.494
  162   HG13  VAL  27          HG13      VAL  27   8.111  -1.742   0.236
  163   HG21  VAL  27          HG21      VAL  27   6.082  -3.212  -2.462
  164   HG22  VAL  27          HG22      VAL  27   5.274  -1.717  -2.936
  165   HG23  VAL  27          HG23      VAL  27   4.854  -2.506  -1.417
  166    H    LEU  28           H        LEU  28   5.947   1.013   1.289
  167    HA   LEU  28           HA       LEU  28   8.339   2.647   1.087
  168    HB2  LEU  28           HB2      LEU  28   6.204   2.470   3.222
  169    HB3  LEU  28           HB3      LEU  28   7.471   3.682   3.157
  170    HG   LEU  28           HG       LEU  28   5.328   3.360   1.042
  171   HD11  LEU  28          HD11      LEU  28   4.335   4.078   3.147
  172   HD12  LEU  28          HD12      LEU  28   4.337   5.382   1.968
  173   HD13  LEU  28          HD13      LEU  28   5.526   5.375   3.273
  174   HD21  LEU  28          HD21      LEU  28   7.372   4.342   0.216
  175   HD22  LEU  28          HD22      LEU  28   7.362   5.489   1.561
  176   HD23  LEU  28          HD23      LEU  28   6.097   5.567   0.326
  177    H    ASN  29           H        ASN  29   7.016   0.039   2.975
  178    HA   ASN  29           HA       ASN  29   9.660  -0.685   3.953
  179    HB2  ASN  29           HB2      ASN  29   7.147  -0.573   5.683
  180    HB3  ASN  29           HB3      ASN  29   8.705  -1.211   6.157
  181   HD21  ASN  29          HD21      ASN  29   6.879   1.695   5.553
  182   HD22  ASN  29          HD22      ASN  29   7.954   2.806   6.280
  183    HA   PRO  30           HA       PRO  30   8.319  -4.690   2.595
  184    HB2  PRO  30           HB2      PRO  30   8.709  -5.761   5.355
  185    HB3  PRO  30           HB3      PRO  30   9.346  -6.367   3.819
  186    HG2  PRO  30           HG2      PRO  30  10.938  -5.051   5.468
  187    HG3  PRO  30           HG3      PRO  30  11.009  -4.727   3.725
  188    HD2  PRO  30           HD2      PRO  30   9.727  -3.129   5.900
  189    HD3  PRO  30           HD3      PRO  30  10.653  -2.552   4.512
  190    H    TYR  31           H        TYR  31   6.942  -3.692   5.696
  191    HA   TYR  31           HA       TYR  31   4.541  -5.268   5.044
  192    HB2  TYR  31           HB2      TYR  31   5.308  -4.001   7.692
  193    HB3  TYR  31           HB3      TYR  31   3.920  -5.039   7.407
  194    HD1  TYR  31           HD1      TYR  31   7.624  -5.008   7.291
  195    HD2  TYR  31           HD2      TYR  31   4.136  -7.379   7.719
  196    HE1  TYR  31           HE1      TYR  31   9.025  -6.909   7.858
  197    HE2  TYR  31           HE2      TYR  31   5.533  -9.324   8.285
  198    HH   TYR  31           HH       TYR  31   8.893  -9.017   8.964
  199    H    TYR  32           H        TYR  32   5.720  -2.026   5.500
  200    HA   TYR  32           HA       TYR  32   3.002  -1.032   5.311
  201    HB2  TYR  32           HB2      TYR  32   4.436  -0.076   7.064
  202    HB3  TYR  32           HB3      TYR  32   5.517   0.542   5.821
  203    HD1  TYR  32           HD1      TYR  32   5.303   2.804   5.387
  204    HD2  TYR  32           HD2      TYR  32   1.845   0.568   6.483
  205    HE1  TYR  32           HE1      TYR  32   3.978   4.811   5.275
  206    HE2  TYR  32           HE2      TYR  32   0.492   2.602   6.359
  207    HH   TYR  32           HH       TYR  32   1.727   5.491   4.992
  208    H    SER  33           H        SER  33   2.181  -0.681   3.385
  209    HA   SER  33           HA       SER  33   3.849   0.581   1.327
  210    HB2  SER  33           HB2      SER  33   1.747  -1.565   0.846
  211    HB3  SER  33           HB3      SER  33   2.783  -0.820  -0.371
  212    HG   SER  33           HG       SER  33   3.438  -2.948   0.451
  213    H    GLN  34           H        GLN  34   2.693   2.239   0.221
  214    HA   GLN  34           HA       GLN  34  -0.060   2.639   1.126
  215    HB2  GLN  34           HB2      GLN  34   1.171   3.924   2.714
  216    HB3  GLN  34           HB3      GLN  34   2.213   4.584   1.472
  217    HG2  GLN  34           HG2      GLN  34   0.430   5.957   0.614
  218    HG3  GLN  34           HG3      GLN  34  -0.718   5.186   1.707
  219   HE21  GLN  34          HE21      GLN  34  -0.924   5.955   3.756
  220   HE22  GLN  34          HE22      GLN  34  -0.017   7.259   4.395
  221    H    CYS  35           H        CYS  35  -1.431   3.511  -0.308
  222    HA   CYS  35           HA       CYS  35  -0.573   3.871  -3.048
  223    HB2  CYS  35           HB2      CYS  35  -3.288   4.430  -1.825
  224    HB3  CYS  35           HB3      CYS  35  -2.914   4.383  -3.537
  225    H    LEU  36           H        LEU  36   0.499   5.663  -3.479
  226    HA   LEU  36           HA       LEU  36  -0.602   8.201  -2.509
  227    HB2  LEU  36           HB2      LEU  36   2.246   7.502  -3.229
  228    HB3  LEU  36           HB3      LEU  36   1.683   9.130  -2.911
  229    HG   LEU  36           HG       LEU  36   1.617   6.877  -0.907
  230   HD11  LEU  36          HD11      LEU  36   3.472   9.251  -1.110
  231   HD12  LEU  36          HD12      LEU  36   3.907   7.564  -1.405
  232   HD13  LEU  36          HD13      LEU  36   3.410   8.079   0.207
  233   HD21  LEU  36          HD21      LEU  36   1.117   8.685   0.679
  234   HD22  LEU  36          HD22      LEU  36  -0.141   8.494  -0.531
  235   HD23  LEU  36          HD23      LEU  36   1.014   9.822  -0.664
  236    H1   MAN 101           H1       MAN 101  -9.197   6.099   2.118
  237    H2   MAN 101           H2       MAN 101  -7.074   5.766   3.285
  238    H3   MAN 101           H3       MAN 101  -6.909   3.327   2.921
  239    H4   MAN 101           H4       MAN 101  -9.163   3.165   4.952
  240    H5   MAN 101           H5       MAN 101  -9.080   2.392   1.994
  241    H61  MAN 101           H61      MAN 101 -10.567   1.044   3.436
  242    H62  MAN 101           H62      MAN 101 -11.464   1.996   2.222
  243    HO2  MAN 101           HO2      MAN 101  -9.013   6.455   4.366
  244    HO3  MAN 101           HO3      MAN 101  -7.081   4.071   5.663
  245    HO4  MAN 101           HO4      MAN 101  -7.553   1.540   5.005
  246    HO6  MAN 101           HO6      MAN 101 -11.861   3.555   3.875


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