NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type
3674 1e0q cing 1-original 7 MR format nomenclature mapping


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H1       MET   1 -14.044   0.236  -0.523
    2    H2   MET   1           H2       MET   1 -15.186   1.479  -0.639
    3    H3   MET   1           H3       MET   1 -14.434   0.885  -2.035
    4    HA   MET   1           HA       MET   1 -13.359   2.861  -1.656
    5   1HB   MET   1          1HB       MET   1 -12.351   3.466   0.631
    6   2HB   MET   1          2HB       MET   1 -14.085   3.617   0.462
    7   1HG   MET   1          1HG       MET   1 -12.996   1.125   1.719
    8   2HG   MET   1          2HG       MET   1 -12.956   2.624   2.645
    9   1HE   MET   1          1HE       MET   1 -14.978   4.084   3.111
   10   2HE   MET   1          2HE       MET   1 -16.478   3.328   3.652
   11   3HE   MET   1          3HE       MET   1 -14.947   2.899   4.419
   12    H    GLN   2           H        GLN   2 -11.297   3.174  -2.226
   13    HA   GLN   2           HA       GLN   2  -9.266   1.110  -1.685
   14   1HB   GLN   2          1HB       GLN   2 -10.140   2.226  -4.317
   15   2HB   GLN   2          2HB       GLN   2  -8.418   1.951  -4.098
   16   1HG   GLN   2          1HG       GLN   2  -8.664  -0.339  -3.923
   17   2HG   GLN   2          2HG       GLN   2 -10.364  -0.226  -3.468
   18   2HE2  GLN   2          2HE2      GLN   2  -8.081  -0.258  -6.141
   19   1HE2  GLN   2          1HE2      GLN   2  -9.265  -0.428  -7.388
   20    H    ILE   3           H        ILE   3  -7.400   1.766  -0.903
   21    HA   ILE   3           HA       ILE   3  -6.309   4.433  -1.248
   22    HB   ILE   3           HB       ILE   3  -5.768   4.631   1.298
   23   1HG1  ILE   3          2HG1      ILE   3  -8.355   3.705   2.277
   24   2HG1  ILE   3          1HG1      ILE   3  -7.537   2.353   1.514
   25   1HG2  ILE   3          1HG2      ILE   3  -8.457   5.297   0.130
   26   2HG2  ILE   3          2HG2      ILE   3  -7.883   5.936   1.670
   27   3HG2  ILE   3          3HG2      ILE   3  -7.005   6.298   0.182
   28   1HD1  ILE   3          1HD1      ILE   3  -6.054   4.008   3.494
   29   2HD1  ILE   3          2HD1      ILE   3  -7.248   2.834   4.050
   30   3HD1  ILE   3          3HD1      ILE   3  -5.872   2.302   3.083
   31    H    PHE   4           H        PHE   4  -4.296   4.352  -1.743
   32    HA   PHE   4           HA       PHE   4  -2.717   1.907  -1.504
   33   1HB   PHE   4          1HB       PHE   4  -2.762   4.292  -3.259
   34   2HB   PHE   4          2HB       PHE   4  -1.165   3.651  -2.942
   35    HD1  PHE   4           HD1      PHE   4  -4.623   2.774  -4.508
   36    HD2  PHE   4           HD2      PHE   4  -0.265   1.683  -4.122
   37    HE1  PHE   4           HE1      PHE   4  -4.861   1.124  -6.483
   38    HE2  PHE   4           HE2      PHE   4  -0.517   0.026  -6.097
   39    HZ   PHE   4           HZ       PHE   4  -2.807  -0.248  -7.288
   40    H    VAL   5           H        VAL   5  -0.694   1.661  -0.617
   41    HA   VAL   5           HA       VAL   5   0.627   3.806   0.863
   42    HB   VAL   5           HB       VAL   5   1.100   2.217   2.861
   43   1HG1  VAL   5          1HG1      VAL   5  -0.135   4.253   3.096
   44   2HG1  VAL   5          2HG1      VAL   5  -1.615   3.466   2.550
   45   3HG1  VAL   5          3HG1      VAL   5  -0.879   2.994   4.083
   46   1HG2  VAL   5          1HG2      VAL   5  -1.491   0.874   2.003
   47   2HG2  VAL   5          2HG2      VAL   5   0.092   0.103   2.104
   48   3HG2  VAL   5          3HG2      VAL   5  -0.706   0.679   3.570
   49    H    LYS   6           H        LYS   6   2.779   3.831   0.771
   50    HA   LYS   6           HA       LYS   6   4.286   1.512  -0.272
   51   1HB   LYS   6          1HB       LYS   6   3.758   3.757  -1.752
   52   2HB   LYS   6          2HB       LYS   6   5.299   4.193  -1.033
   53   1HG   LYS   6          1HG       LYS   6   6.399   2.348  -2.048
   54   2HG   LYS   6          2HG       LYS   6   4.870   1.618  -2.539
   55   1HD   LYS   6          1HD       LYS   6   4.541   3.132  -4.266
   56   2HD   LYS   6          2HD       LYS   6   5.587   4.356  -3.542
   57   1HE   LYS   6          1HE       LYS   6   7.547   3.173  -4.162
   58   2HE   LYS   6          2HE       LYS   6   6.624   1.736  -4.601
   59   1HZ   LYS   6          1HZ       LYS   6   6.460   4.351  -5.999
   60   2HZ   LYS   6          2HZ       LYS   6   7.349   3.016  -6.541
   61   3HZ   LYS   6          3HZ       LYS   6   5.662   2.927  -6.445
   62    H    THR   7           H        THR   7   6.355   1.149   0.456
   63    HA   THR   7           HA       THR   7   7.398   2.686   2.772
   64    HB   THR   7           HB       THR   7   8.597   0.482   3.383
   65    HG1  THR   7           HG1      THR   7   6.552  -0.568   1.708
   66   1HG2  THR   7          1HG2      THR   7   5.638   0.868   3.751
   67   2HG2  THR   7          2HG2      THR   7   6.504  -0.477   4.496
   68   3HG2  THR   7          3HG2      THR   7   6.943   1.186   4.894
   69    H    LEU   8           H        LEU   8   9.615   3.082   2.965
   70    HA   LEU   8           HA       LEU   8  11.166   3.506   0.594
   71   1HB   LEU   8          1HB       LEU   8  11.540   3.985   3.513
   72   2HB   LEU   8          2HB       LEU   8  12.966   4.032   2.499
   73    HG   LEU   8           HG       LEU   8  10.920   5.638   1.232
   74   1HD1  LEU   8          1HD1      LEU   8   9.955   5.804   3.510
   75   2HD1  LEU   8          2HD1      LEU   8  11.466   6.536   4.052
   76   3HD1  LEU   8          3HD1      LEU   8  10.479   7.346   2.836
   77   1HD2  LEU   8          1HD2      LEU   8  13.540   6.376   2.530
   78   2HD2  LEU   8          2HD2      LEU   8  13.258   6.003   0.830
   79   3HD2  LEU   8          3HD2      LEU   8  12.567   7.463   1.539
   80    H    ASP   9           H        ASP   9  10.965   0.725   2.658
   81    HA   ASP   9           HA       ASP   9  13.575  -0.447   2.370
   82   1HB   ASP   9          1HB       ASP   9  11.004  -1.251   3.593
   83   2HB   ASP   9          2HB       ASP   9  12.012  -2.580   3.034
   84    H    GLY  10           H        GLY  10  10.496  -0.855   0.566
   85   1HA   GLY  10          2HA       GLY  10  11.819  -2.591  -1.454
   86   2HA   GLY  10          1HA       GLY  10  10.760  -1.265  -1.892
   87    H    LYS  11           H        LYS  11   8.510  -1.433  -0.593
   88    HA   LYS  11           HA       LYS  11   7.278  -4.012  -1.310
   89   1HB   LYS  11          1HB       LYS  11   7.163  -2.718   1.399
   90   2HB   LYS  11          2HB       LYS  11   5.756  -3.588   0.819
   91   1HG   LYS  11          1HG       LYS  11   7.025  -5.628   0.665
   92   2HG   LYS  11          2HG       LYS  11   8.511  -4.772   1.089
   93   1HD   LYS  11          1HD       LYS  11   7.329  -4.103   3.246
   94   2HD   LYS  11          2HD       LYS  11   6.100  -5.297   2.820
   95   1HE   LYS  11          1HE       LYS  11   8.016  -6.960   2.637
   96   2HE   LYS  11          2HE       LYS  11   9.006  -5.733   3.431
   97   1HZ   LYS  11          1HZ       LYS  11   7.423  -5.753   5.284
   98   2HZ   LYS  11          2HZ       LYS  11   6.553  -6.993   4.531
   99   3HZ   LYS  11          3HZ       LYS  11   8.140  -7.267   5.049
  100    H    THR  12           H        THR  12   5.196  -3.935  -2.111
  101    HA   THR  12           HA       THR  12   3.621  -1.471  -2.135
  102    HB   THR  12           HB       THR  12   3.073  -1.876  -4.650
  103    HG1  THR  12           HG1      THR  12   4.181  -3.436  -5.532
  104   1HG2  THR  12          1HG2      THR  12   4.396   0.060  -3.622
  105   2HG2  THR  12          2HG2      THR  12   5.836  -0.782  -4.194
  106   3HG2  THR  12          3HG2      THR  12   4.612  -0.245  -5.345
  107    H    ILE  13           H        ILE  13   1.707  -1.918  -1.389
  108    HA   ILE  13           HA       ILE  13   0.031  -4.132  -2.223
  109    HB   ILE  13           HB       ILE  13  -0.586  -4.752   0.237
  110   1HG1  ILE  13          1HG1      ILE  13   2.177  -4.738   1.242
  111   2HG1  ILE  13          2HG1      ILE  13   1.652  -3.094   0.924
  112   1HG2  ILE  13          1HG2      ILE  13   1.881  -5.842  -1.096
  113   2HG2  ILE  13          2HG2      ILE  13   1.015  -6.637   0.221
  114   3HG2  ILE  13          3HG2      ILE  13   0.211  -6.361  -1.326
  115   1HD1  ILE  13          1HD1      ILE  13   0.063  -5.011   2.605
  116   2HD1  ILE  13          2HD1      ILE  13   1.307  -3.948   3.265
  117   3HD1  ILE  13          3HD1      ILE  13  -0.119  -3.259   2.484
  118    H    THR  14           H        THR  14  -2.149  -3.808  -2.044
  119    HA   THR  14           HA       THR  14  -3.102  -1.109  -1.505
  120    HB   THR  14           HB       THR  14  -5.375  -2.051  -2.240
  121    HG1  THR  14           HG1      THR  14  -5.411  -4.155  -2.430
  122   1HG2  THR  14          1HG2      THR  14  -3.550  -0.858  -3.707
  123   2HG2  THR  14          2HG2      THR  14  -3.505  -2.433  -4.503
  124   3HG2  THR  14          3HG2      THR  14  -5.023  -1.536  -4.405
  125    H    LEU  15           H        LEU  15  -4.595  -0.415  -0.029
  126    HA   LEU  15           HA       LEU  15  -5.328  -2.196   2.197
  127   1HB   LEU  15          1HB       LEU  15  -3.871   0.162   2.338
  128   2HB   LEU  15          2HB       LEU  15  -5.488   0.707   2.724
  129    HG   LEU  15           HG       LEU  15  -4.925  -1.685   4.271
  130   1HD1  LEU  15          1HD1      LEU  15  -2.871   0.492   4.615
  131   2HD1  LEU  15          2HD1      LEU  15  -3.114  -0.882   5.693
  132   3HD1  LEU  15          3HD1      LEU  15  -2.570  -1.148   4.038
  133   1HD2  LEU  15          1HD2      LEU  15  -5.350   1.186   5.101
  134   2HD2  LEU  15          2HD2      LEU  15  -6.584  -0.064   4.943
  135   3HD2  LEU  15          3HD2      LEU  15  -5.350  -0.199   6.195
  136    H    GLU  16           H        GLU  16  -7.258  -2.969   1.836
  137    HA   GLU  16           HA       GLU  16  -9.513  -1.254   0.995
  138   1HB   GLU  16          1HB       GLU  16  -8.559  -3.853  -0.127
  139   2HB   GLU  16          2HB       GLU  16 -10.297  -3.602  -0.050
  140   1HG   GLU  16          1HG       GLU  16  -9.781  -1.358  -1.247
  141   2HG   GLU  16          2HG       GLU  16  -8.236  -2.109  -1.639
  142    H    VAL  17           H        VAL  17 -11.534  -1.593   1.884
  143    HA   VAL  17           HA       VAL  17 -11.943  -3.661   3.936
  144    HB   VAL  17           HB       VAL  17 -13.275  -1.969   5.371
  145   1HG1  VAL  17          1HG1      VAL  17 -11.201  -3.069   6.048
  146   2HG1  VAL  17          2HG1      VAL  17 -10.280  -1.724   5.375
  147   3HG1  VAL  17          3HG1      VAL  17 -11.369  -1.454   6.735
  148   1HG2  VAL  17          1HG2      VAL  17 -13.089   0.015   3.758
  149   2HG2  VAL  17          2HG2      VAL  17 -12.707   0.345   5.449
  150   3HG2  VAL  17          3HG2      VAL  17 -11.408   0.152   4.274

  No H/Q in entry =         150
  Start of MODEL    2
    1    H1   MET   1           H1       MET   1 -14.146   0.229  -1.913
    2    H2   MET   1           H2       MET   1 -13.942  -0.098  -0.266
    3    H3   MET   1           H3       MET   1 -15.098   1.032  -0.766
    4    HA   MET   1           HA       MET   1 -13.393   2.494  -1.592
    5   1HB   MET   1          1HB       MET   1 -14.100   2.026   1.028
    6   2HB   MET   1          2HB       MET   1 -12.349   1.956   1.126
    7   1HG   MET   1          1HG       MET   1 -12.088   4.175   0.637
    8   2HG   MET   1          2HG       MET   1 -13.593   4.268  -0.279
    9   1HE   MET   1          1HE       MET   1 -11.834   4.092   3.021
   10   2HE   MET   1          2HE       MET   1 -12.127   5.826   2.886
   11   3HE   MET   1          3HE       MET   1 -12.908   4.899   4.168
   12    H    GLN   2           H        GLN   2 -11.297   3.012  -2.109
   13    HA   GLN   2           HA       GLN   2  -9.134   1.048  -1.771
   14   1HB   GLN   2          1HB       GLN   2 -10.146   2.203  -4.341
   15   2HB   GLN   2          2HB       GLN   2  -8.408   2.016  -4.168
   16   1HG   GLN   2          1HG       GLN   2  -8.542  -0.303  -4.020
   17   2HG   GLN   2          2HG       GLN   2 -10.259  -0.273  -3.624
   18   2HE2  GLN   2          2HE2      GLN   2  -7.885  -0.134  -6.211
   19   1HE2  GLN   2          1HE2      GLN   2  -9.015  -0.305  -7.505
   20    H    ILE   3           H        ILE   3  -7.311   1.808  -0.994
   21    HA   ILE   3           HA       ILE   3  -6.354   4.519  -1.315
   22    HB   ILE   3           HB       ILE   3  -5.839   4.753   1.240
   23   1HG1  ILE   3          2HG1      ILE   3  -8.410   3.785   2.206
   24   2HG1  ILE   3          1HG1      ILE   3  -7.574   2.442   1.447
   25   1HG2  ILE   3          1HG2      ILE   3  -7.268   6.208  -0.199
   26   2HG2  ILE   3          2HG2      ILE   3  -8.669   5.309   0.384
   27   3HG2  ILE   3          3HG2      ILE   3  -7.674   6.226   1.517
   28   1HD1  ILE   3          1HD1      ILE   3  -6.137   4.125   3.444
   29   2HD1  ILE   3          2HD1      ILE   3  -7.293   2.904   3.975
   30   3HD1  ILE   3          3HD1      ILE   3  -5.894   2.433   3.012
   31    H    PHE   4           H        PHE   4  -4.325   4.526  -1.761
   32    HA   PHE   4           HA       PHE   4  -2.669   2.139  -1.505
   33   1HB   PHE   4          1HB       PHE   4  -2.744   4.540  -3.238
   34   2HB   PHE   4          2HB       PHE   4  -1.138   3.938  -2.893
   35    HD1  PHE   4           HD1      PHE   4  -4.539   2.987  -4.538
   36    HD2  PHE   4           HD2      PHE   4  -0.164   2.001  -4.070
   37    HE1  PHE   4           HE1      PHE   4  -4.697   1.338  -6.522
   38    HE2  PHE   4           HE2      PHE   4  -0.335   0.347  -6.055
   39    HZ   PHE   4           HZ       PHE   4  -2.594   0.022  -7.292
   40    H    VAL   5           H        VAL   5  -0.697   1.921  -0.548
   41    HA   VAL   5           HA       VAL   5   0.642   4.062   0.895
   42    HB   VAL   5           HB       VAL   5   0.942   2.597   3.021
   43   1HG1  VAL   5          1HG1      VAL   5  -0.310   4.753   2.806
   44   2HG1  VAL   5          2HG1      VAL   5  -1.789   3.795   2.708
   45   3HG1  VAL   5          3HG1      VAL   5  -0.782   3.719   4.154
   46   1HG2  VAL   5          1HG2      VAL   5  -0.280   0.527   2.178
   47   2HG2  VAL   5          2HG2      VAL   5  -0.784   1.109   3.766
   48   3HG2  VAL   5          3HG2      VAL   5  -1.780   1.437   2.349
   49    H    LYS   6           H        LYS   6   2.801   3.935   0.928
   50    HA   LYS   6           HA       LYS   6   4.155   1.490  -0.042
   51   1HB   LYS   6          1HB       LYS   6   4.014   3.908  -1.349
   52   2HB   LYS   6          2HB       LYS   6   5.547   4.055  -0.507
   53   1HG   LYS   6          1HG       LYS   6   6.504   2.265  -1.666
   54   2HG   LYS   6          2HG       LYS   6   4.938   1.627  -2.166
   55   1HD   LYS   6          1HD       LYS   6   4.660   3.266  -3.818
   56   2HD   LYS   6          2HD       LYS   6   5.882   4.325  -3.107
   57   1HE   LYS   6          1HE       LYS   6   7.648   2.930  -3.852
   58   2HE   LYS   6          2HE       LYS   6   6.537   1.627  -4.272
   59   1HZ   LYS   6          1HZ       LYS   6   6.582   4.278  -5.609
   60   2HZ   LYS   6          2HZ       LYS   6   7.358   2.898  -6.205
   61   3HZ   LYS   6          3HZ       LYS   6   5.673   2.926  -6.066
   62    H    THR   7           H        THR   7   6.044   0.813   0.860
   63    HA   THR   7           HA       THR   7   6.717   1.611   3.584
   64    HB   THR   7           HB       THR   7   8.401  -0.339   3.373
   65    HG1  THR   7           HG1      THR   7   8.580  -1.003   1.384
   66   1HG2  THR   7          1HG2      THR   7   6.257  -0.511   4.602
   67   2HG2  THR   7          2HG2      THR   7   5.470  -1.028   3.110
   68   3HG2  THR   7          3HG2      THR   7   6.726  -2.030   3.838
   69    H    LEU   8           H        LEU   8   8.235   1.747   0.361
   70    HA   LEU   8           HA       LEU   8   9.889   2.920  -0.636
   71   1HB   LEU   8          1HB       LEU   8  10.333   4.245   2.054
   72   2HB   LEU   8          2HB       LEU   8  11.411   4.542   0.707
   73    HG   LEU   8           HG       LEU   8   8.653   4.930  -0.154
   74   1HD1  LEU   8          1HD1      LEU   8   8.353   5.433   2.294
   75   2HD1  LEU   8          2HD1      LEU   8   9.443   6.799   2.064
   76   3HD1  LEU   8          3HD1      LEU   8   7.919   6.730   1.180
   77   1HD2  LEU   8          1HD2      LEU   8  10.972   6.850   0.078
   78   2HD2  LEU   8          2HD2      LEU   8  10.539   5.887  -1.335
   79   3HD2  LEU   8          3HD2      LEU   8   9.464   7.169  -0.778
   80    H    ASP   9           H        ASP   9  10.521   0.739   1.951
   81    HA   ASP   9           HA       ASP   9  13.366   0.365   1.708
   82   1HB   ASP   9          1HB       ASP   9  11.487  -0.361   3.595
   83   2HB   ASP   9          2HB       ASP   9  11.881  -1.902   2.842
   84    H    GLY  10           H        GLY  10  10.504  -1.290   0.297
   85   1HA   GLY  10          2HA       GLY  10  12.101  -3.288  -1.156
   86   2HA   GLY  10          1HA       GLY  10  11.261  -2.090  -2.118
   87    H    LYS  11           H        LYS  11   8.814  -1.893  -0.657
   88    HA   LYS  11           HA       LYS  11   7.410  -4.348  -1.451
   89   1HB   LYS  11          1HB       LYS  11   7.461  -3.275   1.357
   90   2HB   LYS  11          2HB       LYS  11   5.973  -3.988   0.757
   91   1HG   LYS  11          1HG       LYS  11   7.050  -6.096   0.404
   92   2HG   LYS  11          2HG       LYS  11   8.630  -5.401   0.785
   93   1HD   LYS  11          1HD       LYS  11   7.740  -4.844   3.057
   94   2HD   LYS  11          2HD       LYS  11   6.290  -5.763   2.652
   95   1HE   LYS  11          1HE       LYS  11   7.736  -7.735   2.231
   96   2HE   LYS  11          2HE       LYS  11   9.112  -6.795   2.806
   97   1HZ   LYS  11          1HZ       LYS  11   6.689  -7.429   4.401
   98   2HZ   LYS  11          2HZ       LYS  11   8.178  -8.220   4.537
   99   3HZ   LYS  11          3HZ       LYS  11   8.050  -6.585   4.949
  100    H    THR  12           H        THR  12   5.307  -4.089  -2.161
  101    HA   THR  12           HA       THR  12   3.874  -1.545  -1.954
  102    HB   THR  12           HB       THR  12   3.243  -1.727  -4.476
  103    HG1  THR  12           HG1      THR  12   4.326  -3.103  -5.645
  104   1HG2  THR  12          1HG2      THR  12   4.668   0.067  -3.367
  105   2HG2  THR  12          2HG2      THR  12   6.067  -0.814  -3.982
  106   3HG2  THR  12          3HG2      THR  12   4.880  -0.148  -5.105
  107    H    ILE  13           H        ILE  13   1.890  -1.917  -1.305
  108    HA   ILE  13           HA       ILE  13   0.154  -4.037  -2.250
  109    HB   ILE  13           HB       ILE  13  -0.528  -4.722   0.183
  110   1HG1  ILE  13          1HG1      ILE  13   2.240  -4.856   1.190
  111   2HG1  ILE  13          2HG1      ILE  13   1.757  -3.185   0.959
  112   1HG2  ILE  13          1HG2      ILE  13   1.895  -5.869  -1.187
  113   2HG2  ILE  13          2HG2      ILE  13   0.997  -6.676   0.100
  114   3HG2  ILE  13          3HG2      ILE  13   0.203  -6.308  -1.431
  115   1HD1  ILE  13          1HD1      ILE  13   0.098  -5.132   2.530
  116   2HD1  ILE  13          2HD1      ILE  13   1.394  -4.179   3.254
  117   3HD1  ILE  13          3HD1      ILE  13   0.003  -3.370   2.524
  118    H    THR  14           H        THR  14  -2.011  -3.655  -2.099
  119    HA   THR  14           HA       THR  14  -2.904  -0.951  -1.495
  120    HB   THR  14           HB       THR  14  -5.196  -1.832  -2.268
  121    HG1  THR  14           HG1      THR  14  -5.212  -3.951  -2.422
  122   1HG2  THR  14          1HG2      THR  14  -3.395  -0.597  -3.676
  123   2HG2  THR  14          2HG2      THR  14  -3.254  -2.156  -4.492
  124   3HG2  THR  14          3HG2      THR  14  -4.809  -1.321  -4.445
  125    H    LEU  15           H        LEU  15  -4.395  -0.252  -0.014
  126    HA   LEU  15           HA       LEU  15  -5.184  -2.070   2.162
  127   1HB   LEU  15          1HB       LEU  15  -3.676   0.218   2.409
  128   2HB   LEU  15          2HB       LEU  15  -5.284   0.844   2.704
  129    HG   LEU  15           HG       LEU  15  -5.007  -1.546   4.286
  130   1HD1  LEU  15          1HD1      LEU  15  -2.683   0.340   4.624
  131   2HD1  LEU  15          2HD1      LEU  15  -3.160  -0.898   5.787
  132   3HD1  LEU  15          3HD1      LEU  15  -2.617  -1.364   4.174
  133   1HD2  LEU  15          1HD2      LEU  15  -6.449   0.370   4.825
  134   2HD2  LEU  15          2HD2      LEU  15  -5.400  -0.077   6.170
  135   3HD2  LEU  15          3HD2      LEU  15  -5.016   1.334   5.185
  136    H    GLU  16           H        GLU  16  -7.118  -2.809   1.783
  137    HA   GLU  16           HA       GLU  16  -9.323  -1.070   0.863
  138   1HB   GLU  16          1HB       GLU  16  -8.391  -3.730  -0.111
  139   2HB   GLU  16          2HB       GLU  16 -10.126  -3.457  -0.082
  140   1HG   GLU  16          1HG       GLU  16  -9.638  -1.324  -1.410
  141   2HG   GLU  16          2HG       GLU  16  -8.024  -1.986  -1.656
  142    H    VAL  17           H        VAL  17 -11.365  -1.311   1.720
  143    HA   VAL  17           HA       VAL  17 -11.742  -3.096   4.046
  144    HB   VAL  17           HB       VAL  17 -13.457  -1.376   4.941
  145   1HG1  VAL  17          1HG1      VAL  17 -11.240  -1.943   5.920
  146   2HG1  VAL  17          2HG1      VAL  17 -10.586  -0.519   5.112
  147   3HG1  VAL  17          3HG1      VAL  17 -11.852  -0.340   6.326
  148   1HG2  VAL  17          1HG2      VAL  17 -13.423   0.200   2.933
  149   2HG2  VAL  17          2HG2      VAL  17 -13.230   0.968   4.511
  150   3HG2  VAL  17          3HG2      VAL  17 -11.826   0.719   3.472

  No H/Q in entry =         150
  Start of MODEL    3
    1    H1   MET   1           H1       MET   1 -14.000   0.675  -1.416
    2    H2   MET   1           H2       MET   1 -13.775   0.555   0.255
    3    H3   MET   1           H3       MET   1 -14.883   1.670  -0.372
    4    HA   MET   1           HA       MET   1 -13.111   2.903  -1.424
    5   1HB   MET   1          1HB       MET   1 -13.838   2.875   1.228
    6   2HB   MET   1          2HB       MET   1 -12.090   2.720   1.350
    7   1HG   MET   1          1HG       MET   1 -11.712   4.819   0.466
    8   2HG   MET   1          2HG       MET   1 -13.271   4.871  -0.358
    9   1HE   MET   1          1HE       MET   1 -15.537   5.103   0.849
   10   2HE   MET   1          2HE       MET   1 -15.678   6.364   2.075
   11   3HE   MET   1          3HE       MET   1 -14.937   6.729   0.516
   12    H    GLN   2           H        GLN   2 -10.999   3.219  -2.019
   13    HA   GLN   2           HA       GLN   2  -8.942   1.226  -1.372
   14   1HB   GLN   2          1HB       GLN   2 -10.080   1.730  -4.009
   15   2HB   GLN   2          2HB       GLN   2  -8.357   2.067  -3.999
   16   1HG   GLN   2          1HG       GLN   2  -7.813  -0.144  -3.416
   17   2HG   GLN   2          2HG       GLN   2  -9.476  -0.519  -2.967
   18   2HE2  GLN   2          2HE2      GLN   2  -7.210  -0.151  -5.629
   19   1HE2  GLN   2          1HE2      GLN   2  -8.239  -0.833  -6.838
   20    H    ILE   3           H        ILE   3  -7.087   1.998  -0.701
   21    HA   ILE   3           HA       ILE   3  -6.003   4.580  -1.428
   22    HB   ILE   3           HB       ILE   3  -5.464   5.191   1.047
   23   1HG1  ILE   3          1HG1      ILE   3  -8.072   4.376   2.129
   24   2HG1  ILE   3          2HG1      ILE   3  -7.153   2.954   1.668
   25   1HG2  ILE   3          1HG2      ILE   3  -6.860   6.467  -0.556
   26   2HG2  ILE   3          2HG2      ILE   3  -8.287   5.658   0.095
   27   3HG2  ILE   3          3HG2      ILE   3  -7.317   6.706   1.130
   28   1HD1  ILE   3          1HD1      ILE   3  -5.801   5.022   3.320
   29   2HD1  ILE   3          2HD1      ILE   3  -7.007   3.980   4.077
   30   3HD1  ILE   3          3HD1      ILE   3  -5.591   3.270   3.299
   31    H    PHE   4           H        PHE   4  -4.006   4.403  -1.918
   32    HA   PHE   4           HA       PHE   4  -2.451   2.009  -1.392
   33   1HB   PHE   4          1HB       PHE   4  -2.376   4.265  -3.311
   34   2HB   PHE   4          2HB       PHE   4  -0.808   3.617  -2.885
   35    HD1  PHE   4           HD1      PHE   4  -4.225   2.683  -4.522
   36    HD2  PHE   4           HD2      PHE   4   0.097   1.561  -3.891
   37    HE1  PHE   4           HE1      PHE   4  -4.406   0.918  -6.400
   38    HE2  PHE   4           HE2      PHE   4  -0.100  -0.210  -5.772
   39    HZ   PHE   4           HZ       PHE   4  -2.345  -0.529  -7.036
   40    H    VAL   5           H        VAL   5  -0.513   1.775  -0.374
   41    HA   VAL   5           HA       VAL   5   0.831   3.986   0.978
   42    HB   VAL   5           HB       VAL   5   1.137   2.546   3.127
   43   1HG1  VAL   5          1HG1      VAL   5   0.005   4.664   3.111
   44   2HG1  VAL   5          2HG1      VAL   5  -1.496   3.895   2.598
   45   3HG1  VAL   5          3HG1      VAL   5  -0.825   3.543   4.190
   46   1HG2  VAL   5          1HG2      VAL   5  -0.092   0.470   2.274
   47   2HG2  VAL   5          2HG2      VAL   5  -0.555   1.045   3.878
   48   3HG2  VAL   5          3HG2      VAL   5  -1.586   1.382   2.488
   49    H    LYS   6           H        LYS   6   2.972   3.932   0.899
   50    HA   LYS   6           HA       LYS   6   4.391   1.459   0.128
   51   1HB   LYS   6          1HB       LYS   6   4.023   3.682  -1.492
   52   2HB   LYS   6          2HB       LYS   6   5.633   3.943  -0.838
   53   1HG   LYS   6          1HG       LYS   6   6.487   2.004  -1.824
   54   2HG   LYS   6          2HG       LYS   6   4.885   1.312  -2.073
   55   1HD   LYS   6          1HD       LYS   6   4.429   2.744  -3.886
   56   2HD   LYS   6          2HD       LYS   6   5.746   3.839  -3.467
   57   1HE   LYS   6          1HE       LYS   6   6.426   1.012  -4.169
   58   2HE   LYS   6          2HE       LYS   6   5.942   2.107  -5.462
   59   1HZ   LYS   6          1HZ       LYS   6   7.689   3.655  -4.663
   60   2HZ   LYS   6          2HZ       LYS   6   8.214   2.460  -3.587
   61   3HZ   LYS   6          3HZ       LYS   6   8.295   2.192  -5.254
   62    H    THR   7           H        THR   7   6.382   1.027   0.941
   63    HA   THR   7           HA       THR   7   7.273   2.364   3.399
   64    HB   THR   7           HB       THR   7   8.921   0.342   3.426
   65    HG1  THR   7           HG1      THR   7   8.765  -0.855   1.698
   66   1HG2  THR   7          1HG2      THR   7   6.961   0.623   4.940
   67   2HG2  THR   7          2HG2      THR   7   5.984  -0.266   3.771
   68   3HG2  THR   7          3HG2      THR   7   7.338  -1.062   4.574
   69    H    LEU   8           H        LEU   8   8.374   1.805   0.089
   70    HA   LEU   8           HA       LEU   8  10.031   2.310  -1.260
   71   1HB   LEU   8          1HB       LEU   8  10.986   4.566  -1.296
   72   2HB   LEU   8          2HB       LEU   8   9.261   4.585  -1.052
   73    HG   LEU   8           HG       LEU   8  10.793   4.783   1.479
   74   1HD1  LEU   8          1HD1      LEU   8  12.283   6.034  -0.104
   75   2HD1  LEU   8          2HD1      LEU   8  10.947   7.155  -0.366
   76   3HD1  LEU   8          3HD1      LEU   8  11.649   6.980   1.243
   77   1HD2  LEU   8          1HD2      LEU   8   8.372   5.169   1.355
   78   2HD2  LEU   8          2HD2      LEU   8   9.229   6.589   1.958
   79   3HD2  LEU   8          3HD2      LEU   8   8.648   6.549   0.293
   80    H    ASP   9           H        ASP   9  10.745   0.304  -0.082
   81    HA   ASP   9           HA       ASP   9  13.647   0.334   0.315
   82   1HB   ASP   9          1HB       ASP   9  11.975  -0.020   2.515
   83   2HB   ASP   9          2HB       ASP   9  12.365  -1.670   2.045
   84    H    GLY  10           H        GLY  10  10.662  -1.589  -0.272
   85   1HA   GLY  10          2HA       GLY  10  11.985  -3.885  -1.489
   86   2HA   GLY  10          1HA       GLY  10  11.111  -2.851  -2.605
   87    H    LYS  11           H        LYS  11   8.922  -2.128  -0.827
   88    HA   LYS  11           HA       LYS  11   7.227  -4.532  -0.916
   89   1HB   LYS  11          1HB       LYS  11   7.836  -2.941   1.570
   90   2HB   LYS  11          2HB       LYS  11   6.256  -3.682   1.392
   91   1HG   LYS  11          1HG       LYS  11   7.018  -5.757   1.821
   92   2HG   LYS  11          2HG       LYS  11   8.485  -5.535   0.877
   93   1HD   LYS  11          1HD       LYS  11   9.659  -5.375   2.774
   94   2HD   LYS  11          2HD       LYS  11   8.806  -3.890   3.172
   95   1HE   LYS  11          1HE       LYS  11   7.539  -6.522   3.820
   96   2HE   LYS  11          2HE       LYS  11   8.847  -5.920   4.833
   97   1HZ   LYS  11          1HZ       LYS  11   7.569  -3.878   5.172
   98   2HZ   LYS  11          2HZ       LYS  11   6.300  -4.510   4.247
   99   3HZ   LYS  11          3HZ       LYS  11   6.722  -5.240   5.713
  100    H    THR  12           H        THR  12   5.020  -4.193  -1.219
  101    HA   THR  12           HA       THR  12   3.838  -1.518  -1.299
  102    HB   THR  12           HB       THR  12   2.653  -2.140  -3.530
  103    HG1  THR  12           HG1      THR  12   4.982  -3.773  -3.746
  104   1HG2  THR  12          1HG2      THR  12   4.459  -0.345  -3.114
  105   2HG2  THR  12          2HG2      THR  12   5.556  -1.474  -3.910
  106   3HG2  THR  12          3HG2      THR  12   4.152  -0.852  -4.776
  107    H    ILE  13           H        ILE  13   1.913  -1.460  -0.367
  108    HA   ILE  13           HA       ILE  13   0.146  -3.793  -0.237
  109    HB   ILE  13           HB       ILE  13   1.629  -3.834   1.790
  110   1HG1  ILE  13          2HG1      ILE  13  -0.801  -3.631   3.351
  111   2HG1  ILE  13          1HG1      ILE  13  -1.203  -4.256   1.761
  112   1HG2  ILE  13          1HG2      ILE  13   1.979  -1.526   2.361
  113   2HG2  ILE  13          2HG2      ILE  13   0.278  -1.331   2.797
  114   3HG2  ILE  13          3HG2      ILE  13   1.318  -2.396   3.746
  115   1HD1  ILE  13          1HD1      ILE  13   0.909  -5.422   3.560
  116   2HD1  ILE  13          2HD1      ILE  13  -0.751  -6.007   3.445
  117   3HD1  ILE  13          3HD1      ILE  13   0.316  -6.098   2.043
  118    H    THR  14           H        THR  14  -1.997  -3.430  -0.398
  119    HA   THR  14           HA       THR  14  -3.056  -0.678  -0.684
  120    HB   THR  14           HB       THR  14  -4.990  -1.865  -1.943
  121    HG1  THR  14           HG1      THR  14  -2.976  -3.877  -2.154
  122   1HG2  THR  14          1HG2      THR  14  -3.025  -0.470  -2.910
  123   2HG2  THR  14          2HG2      THR  14  -2.486  -2.029  -3.537
  124   3HG2  THR  14          3HG2      THR  14  -4.079  -1.404  -3.972
  125    H    LEU  15           H        LEU  15  -5.034  -0.056   0.194
  126    HA   LEU  15           HA       LEU  15  -6.132  -1.717   2.363
  127   1HB   LEU  15          1HB       LEU  15  -5.622   1.177   2.088
  128   2HB   LEU  15          2HB       LEU  15  -7.219   0.817   2.706
  129    HG   LEU  15           HG       LEU  15  -5.307  -0.799   4.162
  130   1HD1  LEU  15          1HD1      LEU  15  -4.625   2.135   4.128
  131   2HD1  LEU  15          2HD1      LEU  15  -4.025   0.961   5.300
  132   3HD1  LEU  15          3HD1      LEU  15  -3.598   0.804   3.595
  133   1HD2  LEU  15          1HD2      LEU  15  -7.031   1.520   5.028
  134   2HD2  LEU  15          2HD2      LEU  15  -7.462  -0.189   5.065
  135   3HD2  LEU  15          3HD2      LEU  15  -6.184   0.421   6.118
  136    H    GLU  16           H        GLU  16  -7.675  -2.960   1.633
  137    HA   GLU  16           HA       GLU  16  -9.809  -1.943  -0.143
  138   1HB   GLU  16          1HB       GLU  16  -8.116  -4.390  -0.328
  139   2HB   GLU  16          2HB       GLU  16  -9.800  -4.555  -0.796
  140   1HG   GLU  16          1HG       GLU  16  -9.450  -2.636  -2.381
  141   2HG   GLU  16          2HG       GLU  16  -7.733  -2.712  -1.997
  142    H    VAL  17           H        VAL  17 -11.919  -2.561   0.181
  143    HA   VAL  17           HA       VAL  17 -12.626  -3.698   2.779
  144    HB   VAL  17           HB       VAL  17 -13.439  -1.398   2.123
  145   1HG1  VAL  17          1HG1      VAL  17 -14.085  -1.647  -0.206
  146   2HG1  VAL  17          2HG1      VAL  17 -15.424  -2.697   0.263
  147   3HG1  VAL  17          3HG1      VAL  17 -15.413  -1.006   0.761
  148   1HG2  VAL  17          1HG2      VAL  17 -14.515  -2.831   3.903
  149   2HG2  VAL  17          2HG2      VAL  17 -15.454  -1.469   3.297
  150   3HG2  VAL  17          3HG2      VAL  17 -15.822  -3.105   2.750

  No H/Q in entry =         150
  Start of MODEL    4
    1    H1   MET   1           H1       MET   1 -14.039  -0.121  -1.610
    2    H2   MET   1           H2       MET   1 -13.829  -0.217   0.066
    3    H3   MET   1           H3       MET   1 -15.006   0.811  -0.580
    4    HA   MET   1           HA       MET   1 -13.322   2.175  -1.608
    5   1HB   MET   1          1HB       MET   1 -14.041   2.070   1.054
    6   2HB   MET   1          2HB       MET   1 -12.288   2.056   1.162
    7   1HG   MET   1          1HG       MET   1 -12.614   4.291   1.235
    8   2HG   MET   1          2HG       MET   1 -12.554   4.107  -0.516
    9   1HE   MET   1          1HE       MET   1 -14.751   4.377   2.620
   10   2HE   MET   1          2HE       MET   1 -14.421   6.032   2.104
   11   3HE   MET   1          3HE       MET   1 -16.070   5.407   2.062
   12    H    GLN   2           H        GLN   2 -11.229   2.657  -2.176
   13    HA   GLN   2           HA       GLN   2  -9.045   0.793  -1.548
   14   1HB   GLN   2          1HB       GLN   2 -10.197   0.718  -4.003
   15   2HB   GLN   2          2HB       GLN   2  -9.017   1.986  -4.285
   16   1HG   GLN   2          1HG       GLN   2  -7.278   0.350  -3.376
   17   2HG   GLN   2          2HG       GLN   2  -8.524  -0.885  -3.530
   18   2HE2  GLN   2          2HE2      GLN   2  -9.029  -1.697  -5.571
   19   1HE2  GLN   2          1HE2      GLN   2  -8.152  -1.256  -6.990
   20    H    ILE   3           H        ILE   3  -7.243   1.663  -0.862
   21    HA   ILE   3           HA       ILE   3  -6.352   4.360  -1.435
   22    HB   ILE   3           HB       ILE   3  -5.806   4.787   1.090
   23   1HG2  ILE   3          1HG2      ILE   3  -8.574   5.199  -0.027
   24   2HG2  ILE   3          2HG2      ILE   3  -7.914   6.058   1.365
   25   3HG2  ILE   3          3HG2      ILE   3  -7.169   6.247  -0.223
   26   1HD1  ILE   3          1HD1      ILE   3  -6.023   4.317   3.306
   27   2HD1  ILE   3          2HD1      ILE   3  -7.209   3.208   3.995
   28   3HD1  ILE   3          3HD1      ILE   3  -5.827   2.576   3.099
   29    H    PHE   4           H        PHE   4  -4.336   4.353  -1.950
   30    HA   PHE   4           HA       PHE   4  -2.634   2.022  -1.558
   31   1HB   PHE   4          1HB       PHE   4  -2.790   4.285  -3.450
   32   2HB   PHE   4          2HB       PHE   4  -1.159   3.774  -3.080
   33    HD1  PHE   4           HD1      PHE   4  -4.518   2.625  -4.655
   34    HD2  PHE   4           HD2      PHE   4  -0.132   1.742  -4.083
   35    HE1  PHE   4           HE1      PHE   4  -4.636   0.829  -6.511
   36    HE2  PHE   4           HE2      PHE   4  -0.259  -0.044  -5.956
   37    HZ   PHE   4           HZ       PHE   4  -2.505  -0.501  -7.172
   38    H    VAL   5           H        VAL   5  -0.647   1.886  -0.626
   39    HA   VAL   5           HA       VAL   5   0.670   4.132   0.677
   40    HB   VAL   5           HB       VAL   5   1.064   2.766   2.852
   41   1HG1  VAL   5          1HG1      VAL   5  -0.252   4.872   2.595
   42   2HG1  VAL   5          2HG1      VAL   5  -1.707   3.876   2.545
   43   3HG1  VAL   5          3HG1      VAL   5  -0.681   3.869   3.981
   44   1HG2  VAL   5          1HG2      VAL   5  -0.009   0.610   2.292
   45   2HG2  VAL   5          2HG2      VAL   5  -0.773   1.353   3.697
   46   3HG2  VAL   5          3HG2      VAL   5  -1.566   1.420   2.122
   47    H    LYS   6           H        LYS   6   2.828   4.081   0.616
   48    HA   LYS   6           HA       LYS   6   4.227   1.638  -0.283
   49   1HB   LYS   6          1HB       LYS   6   3.931   3.925  -1.745
   50   2HB   LYS   6          2HB       LYS   6   5.457   4.255  -0.944
   51   1HG   LYS   6          1HG       LYS   6   6.495   2.367  -1.934
   52   2HG   LYS   6          2HG       LYS   6   4.954   1.722  -2.496
   53   1HD   LYS   6          1HD       LYS   6   4.841   3.135  -4.289
   54   2HD   LYS   6          2HD       LYS   6   5.714   4.437  -3.478
   55   1HE   LYS   6          1HE       LYS   6   7.813   3.321  -3.823
   56   2HE   LYS   6          2HE       LYS   6   7.000   1.888  -4.454
   57   1HZ   LYS   6          1HZ       LYS   6   6.171   3.272  -6.299
   58   2HZ   LYS   6          2HZ       LYS   6   7.081   4.574  -5.716
   59   3HZ   LYS   6          3HZ       LYS   6   7.860   3.176  -6.264
   60    H    THR   7           H        THR   7   6.227   1.104   0.503
   61    HA   THR   7           HA       THR   7   7.240   2.432   2.952
   62    HB   THR   7           HB       THR   7   8.368   0.120   3.363
   63    HG1  THR   7           HG1      THR   7   7.877  -0.915   1.445
   64   1HG2  THR   7          1HG2      THR   7   5.475   0.755   3.798
   65   2HG2  THR   7          2HG2      THR   7   6.119  -0.808   4.301
   66   3HG2  THR   7          3HG2      THR   7   6.795   0.681   4.966
   67    H    LEU   8           H        LEU   8   9.436   2.780   3.270
   68    HA   LEU   8           HA       LEU   8  11.094   3.435   1.046
   69   1HB   LEU   8          1HB       LEU   8  11.018   3.966   3.830
   70   2HB   LEU   8          2HB       LEU   8  12.605   3.305   3.505
   71    HG   LEU   8           HG       LEU   8  12.190   5.244   1.470
   72   1HD1  LEU   8          1HD1      LEU   8  11.294   6.313   4.142
   73   2HD1  LEU   8          2HD1      LEU   8  11.803   7.321   2.789
   74   3HD1  LEU   8          3HD1      LEU   8  10.383   6.288   2.632
   75   1HD2  LEU   8          1HD2      LEU   8  13.831   5.395   3.996
   76   2HD2  LEU   8          2HD2      LEU   8  14.348   4.786   2.422
   77   3HD2  LEU   8          3HD2      LEU   8  13.982   6.499   2.628
   78    H    ASP   9           H        ASP   9  10.772   0.398   2.676
   79    HA   ASP   9           HA       ASP   9  13.373  -0.778   2.350
   80   1HB   ASP   9          1HB       ASP   9  11.096  -1.472   3.749
   81   2HB   ASP   9          2HB       ASP   9  11.145  -2.688   2.479
   82    H    GLY  10           H        GLY  10  10.435  -0.772   0.307
   83   1HA   GLY  10          2HA       GLY  10  11.888  -2.068  -1.936
   84   2HA   GLY  10          1HA       GLY  10  10.672  -0.820  -2.128
   85    H    LYS  11           H        LYS  11   8.544  -1.634  -0.645
   86    HA   LYS  11           HA       LYS  11   7.491  -3.919  -2.116
   87   1HB   LYS  11          1HB       LYS  11   6.363  -4.914  -0.041
   88   2HB   LYS  11          2HB       LYS  11   8.070  -5.226  -0.233
   89   1HG   LYS  11          1HG       LYS  11   8.188  -3.110   1.462
   90   2HG   LYS  11          2HG       LYS  11   6.604  -3.745   1.902
   91   1HD   LYS  11          1HD       LYS  11   7.821  -6.021   2.091
   92   2HD   LYS  11          2HD       LYS  11   9.300  -5.060   2.111
   93   1HE   LYS  11          1HE       LYS  11   8.621  -3.919   4.093
   94   2HE   LYS  11          2HE       LYS  11   7.002  -4.611   4.005
   95   1HZ   LYS  11          1HZ       LYS  11   9.476  -6.204   4.404
   96   2HZ   LYS  11          2HZ       LYS  11   8.462  -5.693   5.659
   97   3HZ   LYS  11          3HZ       LYS  11   7.882  -6.766   4.487
   98    H    THR  12           H        THR  12   5.435  -3.737  -2.790
   99    HA   THR  12           HA       THR  12   3.780  -1.459  -1.860
  100    HB   THR  12           HB       THR  12   2.693  -1.598  -4.212
  101    HG1  THR  12           HG1      THR  12   3.859  -2.523  -5.818
  102   1HG2  THR  12          1HG2      THR  12   4.226   0.235  -3.321
  103   2HG2  THR  12          2HG2      THR  12   5.514  -0.551  -4.236
  104   3HG2  THR  12          3HG2      THR  12   4.098   0.085  -5.074
  105    H    ILE  13           H        ILE  13   1.753  -1.765  -1.203
  106    HA   ILE  13           HA       ILE  13   0.119  -4.083  -1.827
  107    HB   ILE  13           HB       ILE  13  -0.490  -4.512   0.647
  108   1HG1  ILE  13          1HG1      ILE  13   2.200  -4.219   1.768
  109   2HG1  ILE  13          2HG1      ILE  13   1.633  -2.647   1.228
  110   1HG2  ILE  13          1HG2      ILE  13   2.088  -5.527  -0.519
  111   2HG2  ILE  13          2HG2      ILE  13   1.274  -6.246   0.873
  112   3HG2  ILE  13          3HG2      ILE  13   0.469  -6.207  -0.698
  113   1HD1  ILE  13          1HD1      ILE  13   0.112  -4.454   3.094
  114   2HD1  ILE  13          2HD1      ILE  13   1.155  -3.125   3.605
  115   3HD1  ILE  13          3HD1      ILE  13  -0.296  -2.794   2.657
  116    H    THR  14           H        THR  14  -2.062  -3.784  -1.724
  117    HA   THR  14           HA       THR  14  -3.079  -1.061  -1.406
  118    HB   THR  14           HB       THR  14  -5.301  -2.065  -2.194
  119    HG1  THR  14           HG1      THR  14  -5.334  -4.179  -2.268
  120   1HG2  THR  14          1HG2      THR  14  -3.500  -0.928  -3.656
  121   2HG2  THR  14          2HG2      THR  14  -3.239  -2.554  -4.289
  122   3HG2  THR  14          3HG2      THR  14  -4.832  -1.801  -4.416
  123    H    LEU  15           H        LEU  15  -4.634  -0.328  -0.006
  124    HA   LEU  15           HA       LEU  15  -5.423  -2.037   2.259
  125   1HB   LEU  15          1HB       LEU  15  -3.977   0.329   2.378
  126   2HB   LEU  15          2HB       LEU  15  -5.608   0.879   2.696
  127    HG   LEU  15           HG       LEU  15  -5.092  -1.462   4.330
  128   1HD1  LEU  15          1HD1      LEU  15  -3.031   0.715   4.637
  129   2HD1  LEU  15          2HD1      LEU  15  -3.326  -0.587   5.790
  130   3HD1  LEU  15          3HD1      LEU  15  -2.735  -0.960   4.170
  131   1HD2  LEU  15          1HD2      LEU  15  -6.724   0.429   4.729
  132   2HD2  LEU  15          2HD2      LEU  15  -5.799  -0.110   6.130
  133   3HD2  LEU  15          3HD2      LEU  15  -5.347   1.377   5.296
  134    H    GLU  16           H        GLU  16  -7.326  -2.837   1.824
  135    HA   GLU  16           HA       GLU  16  -9.525  -1.176   0.763
  136   1HB   GLU  16          1HB       GLU  16  -8.537  -3.878  -0.005
  137   2HB   GLU  16          2HB       GLU  16 -10.278  -3.641  -0.024
  138   1HG   GLU  16          1HG       GLU  16  -9.642  -1.503  -1.430
  139   2HG   GLU  16          2HG       GLU  16  -8.166  -2.413  -1.741
  140    H    VAL  17           H        VAL  17 -11.584  -1.363   1.580
  141    HA   VAL  17           HA       VAL  17 -12.169  -3.177   3.817
  142    HB   VAL  17           HB       VAL  17 -13.484  -1.292   5.008
  143   1HG1  VAL  17          1HG1      VAL  17 -11.551  -2.375   5.957
  144   2HG1  VAL  17          2HG1      VAL  17 -10.480  -1.257   5.111
  145   3HG1  VAL  17          3HG1      VAL  17 -11.566  -0.659   6.365
  146   1HG2  VAL  17          1HG2      VAL  17 -13.127   0.505   3.209
  147   2HG2  VAL  17          2HG2      VAL  17 -12.822   0.992   4.878
  148   3HG2  VAL  17          3HG2      VAL  17 -11.472   0.630   3.804

  No H/Q in entry =         148
  Start of MODEL    5
    1    H1   MET   1           H1       MET   1 -14.102   0.882  -1.176
    2    H2   MET   1           H2       MET   1 -13.942   0.854   0.507
    3    H3   MET   1           H3       MET   1 -15.000   1.953  -0.224
    4    HA   MET   1           HA       MET   1 -13.193   3.124  -1.241
    5   1HB   MET   1          1HB       MET   1 -13.906   3.145   1.424
    6   2HB   MET   1          2HB       MET   1 -12.162   2.961   1.528
    7   1HG   MET   1          2HG       MET   1 -12.270   5.218   1.558
    8   2HG   MET   1          1HG       MET   1 -12.233   4.994  -0.189
    9   1HE   MET   1          1HE       MET   1 -14.360   5.560   2.942
   10   2HE   MET   1          2HE       MET   1 -13.887   7.163   2.372
   11   3HE   MET   1          3HE       MET   1 -15.587   6.691   2.363
   12    H    GLN   2           H        GLN   2 -11.060   3.394  -1.819
   13    HA   GLN   2           HA       GLN   2  -9.072   1.343  -1.150
   14   1HB   GLN   2          1HB       GLN   2 -10.230   1.533  -3.687
   15   2HB   GLN   2          2HB       GLN   2  -8.708   2.390  -3.864
   16   1HG   GLN   2          1HG       GLN   2  -7.470   0.454  -3.170
   17   2HG   GLN   2          2HG       GLN   2  -8.957  -0.412  -2.797
   18   2HE2  GLN   2          2HE2      GLN   2  -6.827   0.701  -5.366
   19   1HE2  GLN   2          1HE2      GLN   2  -7.564  -0.224  -6.625
   20    H    ILE   3           H        ILE   3  -7.214   2.059  -0.437
   21    HA   ILE   3           HA       ILE   3  -6.107   4.665  -1.091
   22    HB   ILE   3           HB       ILE   3  -5.514   5.109   1.409
   23   1HG1  ILE   3          1HG1      ILE   3  -8.107   4.260   2.488
   24   2HG1  ILE   3          2HG1      ILE   3  -7.230   2.855   1.906
   25   1HG2  ILE   3          1HG2      ILE   3  -6.923   6.500  -0.084
   26   2HG2  ILE   3          2HG2      ILE   3  -8.346   5.663   0.537
   27   3HG2  ILE   3          3HG2      ILE   3  -7.349   6.632   1.622
   28   1HD1  ILE   3          1HD1      ILE   3  -5.776   4.763   3.653
   29   2HD1  ILE   3          2HD1      ILE   3  -7.010   3.732   4.378
   30   3HD1  ILE   3          3HD1      ILE   3  -5.645   3.008   3.527
   31    H    PHE   4           H        PHE   4  -4.096   4.568  -1.574
   32    HA   PHE   4           HA       PHE   4  -2.536   2.141  -1.240
   33   1HB   PHE   4          1HB       PHE   4  -2.551   4.460  -3.051
   34   2HB   PHE   4          2HB       PHE   4  -0.937   3.943  -2.621
   35    HD1  PHE   4           HD1      PHE   4  -4.197   2.870  -4.415
   36    HD2  PHE   4           HD2      PHE   4   0.133   1.909  -3.604
   37    HE1  PHE   4           HE1      PHE   4  -4.213   1.157  -6.349
   38    HE2  PHE   4           HE2      PHE   4   0.114   0.208  -5.556
   39    HZ   PHE   4           HZ       PHE   4  -2.055  -0.170  -6.934
   40    H    VAL   5           H        VAL   5  -0.585   1.850  -0.278
   41    HA   VAL   5           HA       VAL   5   0.802   3.958   1.169
   42    HB   VAL   5           HB       VAL   5   1.147   2.396   3.232
   43   1HG1  VAL   5          1HG1      VAL   5  -0.025   4.565   3.218
   44   2HG1  VAL   5          2HG1      VAL   5  -1.544   3.706   2.960
   45   3HG1  VAL   5          3HG1      VAL   5  -0.621   3.441   4.439
   46   1HG2  VAL   5          1HG2      VAL   5  -0.144   0.394   2.299
   47   2HG2  VAL   5          2HG2      VAL   5  -0.547   0.885   3.947
   48   3HG2  VAL   5          3HG2      VAL   5  -1.614   1.318   2.610
   49    H    LYS   6           H        LYS   6   2.849   3.955   0.669
   50    HA   LYS   6           HA       LYS   6   4.271   1.481  -0.113
   51   1HB   LYS   6          1HB       LYS   6   3.553   3.663  -1.787
   52   2HB   LYS   6          2HB       LYS   6   5.287   3.793  -1.540
   53   1HG   LYS   6          1HG       LYS   6   5.032   1.133  -2.127
   54   2HG   LYS   6          2HG       LYS   6   3.718   1.817  -3.078
   55   1HD   LYS   6          1HD       LYS   6   6.204   3.335  -3.406
   56   2HD   LYS   6          2HD       LYS   6   6.426   1.630  -3.772
   57   1HE   LYS   6          2HE       LYS   6   5.848   2.457  -5.835
   58   2HE   LYS   6          1HE       LYS   6   4.273   1.949  -5.227
   59   1HZ   LYS   6          1HZ       LYS   6   5.314   4.723  -5.024
   60   2HZ   LYS   6          2HZ       LYS   6   4.296   4.186  -6.263
   61   3HZ   LYS   6          3HZ       LYS   6   3.749   4.194  -4.662
   62    H    THR   7           H        THR   7   6.456   1.287   0.295
   63    HA   THR   7           HA       THR   7   7.859   3.351   1.832
   64    HB   THR   7           HB       THR   7   7.230   1.813   3.572
   65    HG1  THR   7           HG1      THR   7   9.976   1.498   2.964
   66   1HG2  THR   7          1HG2      THR   7   7.980  -0.393   1.773
   67   2HG2  THR   7          2HG2      THR   7   8.558  -0.575   3.429
   68   3HG2  THR   7          3HG2      THR   7   6.835  -0.363   3.114
   69    H    LEU   8           H        LEU   8  10.059   3.563   1.589
   70    HA   LEU   8           HA       LEU   8  11.130   3.007  -1.026
   71   1HB   LEU   8          1HB       LEU   8  11.669   4.817   1.176
   72   2HB   LEU   8          2HB       LEU   8  13.170   4.149   0.571
   73    HG   LEU   8           HG       LEU   8  11.782   4.920  -1.762
   74   1HD1  LEU   8          1HD1      LEU   8  11.442   7.058   0.342
   75   2HD1  LEU   8          2HD1      LEU   8  11.288   7.325  -1.395
   76   3HD1  LEU   8          3HD1      LEU   8  10.169   6.239  -0.567
   77   1HD2  LEU   8          1HD2      LEU   8  14.216   5.114  -1.299
   78   2HD2  LEU   8          2HD2      LEU   8  13.516   6.538  -2.070
   79   3HD2  LEU   8          3HD2      LEU   8  13.877   6.557  -0.344
   80    H    ASP   9           H        ASP   9  11.203   1.078   1.754
   81    HA   ASP   9           HA       ASP   9  13.804  -0.151   1.702
   82   1HB   ASP   9          1HB       ASP   9  11.714  -0.134   3.500
   83   2HB   ASP   9          2HB       ASP   9  11.654  -1.777   2.878
   84    H    GLY  10           H        GLY  10  10.677  -0.975   0.172
   85   1HA   GLY  10          2HA       GLY  10  11.862  -3.288  -1.272
   86   2HA   GLY  10          1HA       GLY  10  10.868  -2.086  -2.074
   87    H    LYS  11           H        LYS  11   8.698  -1.719  -0.528
   88    HA   LYS  11           HA       LYS  11   7.216  -4.265  -0.621
   89   1HB   LYS  11          1HB       LYS  11   7.330  -2.450   1.799
   90   2HB   LYS  11          2HB       LYS  11   5.989  -3.535   1.533
   91   1HG   LYS  11          1HG       LYS  11   7.095  -5.263   2.420
   92   2HG   LYS  11          2HG       LYS  11   8.481  -5.001   1.371
   93   1HD   LYS  11          1HD       LYS  11   9.648  -4.454   3.213
   94   2HD   LYS  11          2HD       LYS  11   8.726  -2.960   3.273
   95   1HE   LYS  11          1HE       LYS  11   7.660  -5.449   4.580
   96   2HE   LYS  11          2HE       LYS  11   8.888  -4.476   5.387
   97   1HZ   LYS  11          1HZ       LYS  11   7.406  -2.561   5.227
   98   2HZ   LYS  11          2HZ       LYS  11   6.223  -3.517   4.486
   99   3HZ   LYS  11          3HZ       LYS  11   6.681  -3.824   6.085
  100    H    THR  12           H        THR  12   5.018  -4.115  -1.125
  101    HA   THR  12           HA       THR  12   3.702  -1.518  -1.474
  102    HB   THR  12           HB       THR  12   2.706  -2.350  -3.710
  103    HG1  THR  12           HG1      THR  12   3.421  -4.225  -4.348
  104   1HG2  THR  12          1HG2      THR  12   4.498  -0.515  -3.335
  105   2HG2  THR  12          2HG2      THR  12   5.616  -1.703  -4.008
  106   3HG2  THR  12          3HG2      THR  12   4.244  -1.144  -4.965
  107    H    ILE  13           H        ILE  13   1.812  -1.505  -0.496
  108    HA   ILE  13           HA       ILE  13   0.057  -3.842  -0.361
  109    HB   ILE  13           HB       ILE  13   1.561  -3.921   1.658
  110   1HG1  ILE  13          1HG1      ILE  13  -0.859  -3.764   3.235
  111   2HG1  ILE  13          2HG1      ILE  13  -1.269  -4.352   1.633
  112   1HG2  ILE  13          1HG2      ILE  13   0.227  -1.417   2.675
  113   2HG2  ILE  13          2HG2      ILE  13   1.193  -2.517   3.658
  114   3HG2  ILE  13          3HG2      ILE  13   1.937  -1.662   2.307
  115   1HD1  ILE  13          1HD1      ILE  13   0.866  -5.554   3.381
  116   2HD1  ILE  13          2HD1      ILE  13  -0.796  -6.137   3.283
  117   3HD1  ILE  13          3HD1      ILE  13   0.247  -6.199   1.860
  118    H    THR  14           H        THR  14  -2.069  -3.450  -0.568
  119    HA   THR  14           HA       THR  14  -3.116  -0.681  -0.728
  120    HB   THR  14           HB       THR  14  -5.029  -1.756  -2.093
  121    HG1  THR  14           HG1      THR  14  -4.877  -3.849  -2.319
  122   1HG2  THR  14          1HG2      THR  14  -2.254  -1.358  -3.116
  123   2HG2  THR  14          2HG2      THR  14  -3.541  -1.898  -4.195
  124   3HG2  THR  14          3HG2      THR  14  -3.698  -0.367  -3.336
  125    H    LEU  15           H        LEU  15  -5.084  -0.092   0.191
  126    HA   LEU  15           HA       LEU  15  -6.190  -1.874   2.258
  127   1HB   LEU  15          1HB       LEU  15  -5.382   0.806   2.415
  128   2HB   LEU  15          2HB       LEU  15  -7.127   0.907   2.342
  129    HG   LEU  15           HG       LEU  15  -6.498  -1.126   4.272
  130   1HD1  LEU  15          1HD1      LEU  15  -4.269  -0.158   4.467
  131   2HD1  LEU  15          2HD1      LEU  15  -4.978   1.422   4.802
  132   3HD1  LEU  15          3HD1      LEU  15  -5.212   0.092   5.936
  133   1HD2  LEU  15          1HD2      LEU  15  -7.557   1.675   4.646
  134   2HD2  LEU  15          2HD2      LEU  15  -8.508   0.218   4.354
  135   3HD2  LEU  15          3HD2      LEU  15  -7.605   0.395   5.858
  136    H    GLU  16           H        GLU  16  -7.656  -3.131   1.389
  137    HA   GLU  16           HA       GLU  16  -9.842  -2.057  -0.284
  138   1HB   GLU  16          1HB       GLU  16  -8.055  -4.409  -0.685
  139   2HB   GLU  16          2HB       GLU  16  -9.737  -4.606  -1.149
  140   1HG   GLU  16          1HG       GLU  16  -9.399  -2.423  -2.487
  141   2HG   GLU  16          2HG       GLU  16  -7.678  -2.728  -2.271
  142    H    VAL  17           H        VAL  17 -11.925  -2.789   0.007
  143    HA   VAL  17           HA       VAL  17 -12.592  -4.053   2.553
  144    HB   VAL  17           HB       VAL  17 -15.047  -3.518   1.940
  145   1HG1  VAL  17          1HG1      VAL  17 -13.769  -2.341   3.634
  146   2HG1  VAL  17          2HG1      VAL  17 -13.174  -1.215   2.414
  147   3HG1  VAL  17          3HG1      VAL  17 -14.893  -1.265   2.804
  148   1HG2  VAL  17          1HG2      VAL  17 -14.631  -2.923  -0.519
  149   2HG2  VAL  17          2HG2      VAL  17 -15.620  -1.788   0.401
  150   3HG2  VAL  17          3HG2      VAL  17 -13.931  -1.414   0.064

  No H/Q in entry =         150
  Start of MODEL    6
    1    H1   MET   1           H1       MET   1 -13.894   1.229  -3.196
    2    H2   MET   1           H2       MET   1 -14.254   1.058  -1.552
    3    H3   MET   1           H3       MET   1 -14.874   2.370  -2.420
    4    HA   MET   1           HA       MET   1 -12.715   3.302  -2.720
    5   1HB   MET   1          1HB       MET   1 -14.144   3.169  -0.356
    6   2HB   MET   1          2HB       MET   1 -12.528   2.719   0.166
    7   1HG   MET   1          2HG       MET   1 -12.373   4.953   0.466
    8   2HG   MET   1          1HG       MET   1 -11.888   4.894  -1.226
    9   1HE   MET   1          1HE       MET   1 -14.751   5.449   1.285
   10   2HE   MET   1          2HE       MET   1 -13.911   6.991   1.113
   11   3HE   MET   1          3HE       MET   1 -15.584   6.834   0.576
   12    H    GLN   2           H        GLN   2 -10.473   3.280  -2.602
   13    HA   GLN   2           HA       GLN   2  -9.026   0.880  -1.731
   14   1HB   GLN   2          1HB       GLN   2  -9.099   2.006  -4.499
   15   2HB   GLN   2          2HB       GLN   2  -7.521   1.521  -3.896
   16   1HG   GLN   2          1HG       GLN   2  -8.089  -0.710  -3.801
   17   2HG   GLN   2          2HG       GLN   2  -9.815  -0.377  -3.679
   18   2HE2  GLN   2          2HE2      GLN   2  -7.090  -0.754  -5.871
   19   1HE2  GLN   2          1HE2      GLN   2  -8.030  -0.810  -7.319
   20    H    ILE   3           H        ILE   3  -7.304   1.279  -0.520
   21    HA   ILE   3           HA       ILE   3  -6.099   3.946  -0.471
   22    HB   ILE   3           HB       ILE   3  -7.778   3.549   1.384
   23   1HG1  ILE   3          1HG1      ILE   3  -5.622   4.333   3.111
   24   2HG1  ILE   3          2HG1      ILE   3  -5.254   4.903   1.493
   25   1HG2  ILE   3          1HG2      ILE   3  -6.767   1.174   1.995
   26   2HG2  ILE   3          2HG2      ILE   3  -5.891   2.146   3.177
   27   3HG2  ILE   3          3HG2      ILE   3  -7.655   2.170   3.150
   28   1HD1  ILE   3          1HD1      ILE   3  -7.809   5.707   1.670
   29   2HD1  ILE   3          2HD1      ILE   3  -7.353   5.761   3.374
   30   3HD1  ILE   3          3HD1      ILE   3  -6.436   6.687   2.185
   31    H    PHE   4           H        PHE   4  -4.072   3.977  -1.044
   32    HA   PHE   4           HA       PHE   4  -2.344   1.596  -0.866
   33   1HB   PHE   4          1HB       PHE   4  -2.774   3.683  -2.916
   34   2HB   PHE   4          2HB       PHE   4  -1.089   3.289  -2.645
   35    HD1  PHE   4           HD1      PHE   4  -4.462   1.938  -3.943
   36    HD2  PHE   4           HD2      PHE   4  -0.055   1.110  -3.440
   37    HE1  PHE   4           HE1      PHE   4  -4.635  -0.025  -5.611
   38    HE2  PHE   4           HE2      PHE   4  -0.246  -0.864  -5.102
   39    HZ   PHE   4           HZ       PHE   4  -2.531  -1.430  -6.196
   40    H    VAL   5           H        VAL   5  -0.280   1.625  -0.097
   41    HA   VAL   5           HA       VAL   5   0.973   4.045   0.955
   42    HB   VAL   5           HB       VAL   5   1.688   2.805   3.123
   43   1HG1  VAL   5          1HG1      VAL   5   0.252   4.781   3.035
   44   2HG1  VAL   5          2HG1      VAL   5  -1.165   3.736   2.939
   45   3HG1  VAL   5          3HG1      VAL   5  -0.146   3.712   4.378
   46   1HG2  VAL   5          1HG2      VAL   5   0.775   0.543   2.744
   47   2HG2  VAL   5          2HG2      VAL   5   0.064   1.275   4.180
   48   3HG2  VAL   5          3HG2      VAL   5  -0.861   1.202   2.681
   49    H    LYS   6           H        LYS   6   3.106   4.188   0.692
   50    HA   LYS   6           HA       LYS   6   4.621   1.864  -0.321
   51   1HB   LYS   6          1HB       LYS   6   4.035   4.148  -1.698
   52   2HB   LYS   6          2HB       LYS   6   5.599   4.574  -1.020
   53   1HG   LYS   6          1HG       LYS   6   6.720   2.921  -2.207
   54   2HG   LYS   6          2HG       LYS   6   5.261   1.968  -2.466
   55   1HD   LYS   6          1HD       LYS   6   4.612   3.176  -4.291
   56   2HD   LYS   6          2HD       LYS   6   5.311   4.684  -3.697
   57   1HE   LYS   6          1HE       LYS   6   7.507   4.010  -4.349
   58   2HE   LYS   6          2HE       LYS   6   6.963   2.370  -4.703
   59   1HZ   LYS   6          1HZ       LYS   6   5.551   3.327  -6.476
   60   2HZ   LYS   6          2HZ       LYS   6   6.251   4.840  -6.187
   61   3HZ   LYS   6          3HZ       LYS   6   7.205   3.559  -6.743
   62    H    THR   7           H        THR   7   6.706   1.466   0.290
   63    HA   THR   7           HA       THR   7   7.896   2.917   2.586
   64    HB   THR   7           HB       THR   7   8.993   0.611   3.124
   65    HG1  THR   7           HG1      THR   7   8.365  -0.696   1.507
   66   1HG2  THR   7          1HG2      THR   7   6.161   1.372   3.738
   67   2HG2  THR   7          2HG2      THR   7   6.836  -0.134   4.358
   68   3HG2  THR   7          3HG2      THR   7   7.579   1.408   4.786
   69    H    LEU   8           H        LEU   8  10.126   3.199   2.683
   70    HA   LEU   8           HA       LEU   8  11.601   3.613   0.285
   71   1HB   LEU   8          1HB       LEU   8  12.161   3.865   3.202
   72   2HB   LEU   8          2HB       LEU   8  13.534   3.877   2.115
   73    HG   LEU   8           HG       LEU   8  11.555   5.706   1.063
   74   1HD1  LEU   8          1HD1      LEU   8  10.707   5.792   3.386
   75   2HD1  LEU   8          2HD1      LEU   8  12.293   6.365   3.905
   76   3HD1  LEU   8          3HD1      LEU   8  11.326   7.333   2.792
   77   1HD2  LEU   8          1HD2      LEU   8  13.954   5.856   0.627
   78   2HD2  LEU   8          2HD2      LEU   8  13.323   7.364   1.288
   79   3HD2  LEU   8          3HD2      LEU   8  14.241   6.265   2.318
   80    H    ASP   9           H        ASP   9  11.325   0.711   2.165
   81    HA   ASP   9           HA       ASP   9  13.829  -0.608   1.646
   82   1HB   ASP   9          1HB       ASP   9  11.282  -1.308   2.957
   83   2HB   ASP   9          2HB       ASP   9  12.106  -2.669   2.207
   84    H    GLY  10           H        GLY  10  10.674  -0.605  -0.044
   85   1HA   GLY  10          2HA       GLY  10  11.803  -2.125  -2.331
   86   2HA   GLY  10          1HA       GLY  10  10.622  -0.838  -2.478
   87    H    LYS  11           H        LYS  11   8.649  -1.452  -0.704
   88    HA   LYS  11           HA       LYS  11   7.357  -3.785  -1.882
   89   1HB   LYS  11          1HB       LYS  11   6.441  -4.603   0.362
   90   2HB   LYS  11          2HB       LYS  11   8.112  -4.977   0.024
   91   1HG   LYS  11          1HG       LYS  11   8.543  -2.834   1.543
   92   2HG   LYS  11          2HG       LYS  11   6.925  -3.210   2.133
   93   1HD   LYS  11          1HD       LYS  11   7.963  -5.650   2.358
   94   2HD   LYS  11          2HD       LYS  11   9.474  -4.746   2.410
   95   1HE   LYS  11          1HE       LYS  11   9.002  -4.819   4.639
   96   2HE   LYS  11          2HE       LYS  11   8.147  -3.334   4.229
   97   1HZ   LYS  11          1HZ       LYS  11   6.850  -6.005   4.286
   98   2HZ   LYS  11          2HZ       LYS  11   6.870  -4.952   5.610
   99   3HZ   LYS  11          3HZ       LYS  11   6.094  -4.495   4.178
  100    H    THR  12           H        THR  12   5.243  -3.582  -2.324
  101    HA   THR  12           HA       THR  12   3.754  -1.193  -1.386
  102    HB   THR  12           HB       THR  12   2.420  -1.457  -3.597
  103    HG1  THR  12           HG1      THR  12   3.131  -2.878  -4.970
  104   1HG2  THR  12          1HG2      THR  12   5.176  -0.295  -3.379
  105   2HG2  THR  12          2HG2      THR  12   4.276  -0.190  -4.892
  106   3HG2  THR  12          3HG2      THR  12   3.616   0.529  -3.423
  107    H    ILE  13           H        ILE  13   1.727  -1.393  -0.592
  108    HA   ILE  13           HA       ILE  13   0.116  -3.808  -0.859
  109    HB   ILE  13           HB       ILE  13  -0.393  -3.940   1.649
  110   1HG1  ILE  13          1HG1      ILE  13   2.301  -3.294   2.635
  111   2HG1  ILE  13          2HG1      ILE  13   1.560  -1.859   1.945
  112   1HG2  ILE  13          1HG2      ILE  13   2.233  -4.939   0.573
  113   2HG2  ILE  13          2HG2      ILE  13   1.491  -5.511   2.068
  114   3HG2  ILE  13          3HG2      ILE  13   0.660  -5.740   0.528
  115   1HD1  ILE  13          1HD1      ILE  13   0.271  -3.570   4.060
  116   2HD1  ILE  13          2HD1      ILE  13   1.212  -2.112   4.386
  117   3HD1  ILE  13          3HD1      ILE  13  -0.289  -2.007   3.465
  118    H    THR  14           H        THR  14  -2.061  -3.591  -0.686
  119    HA   THR  14           HA       THR  14  -3.211  -1.001   0.075
  120    HB   THR  14           HB       THR  14  -3.144  -0.881  -2.344
  121    HG1  THR  14           HG1      THR  14  -4.909   0.169  -1.980
  122   1HG2  THR  14          1HG2      THR  14  -3.253  -3.333  -2.954
  123   2HG2  THR  14          2HG2      THR  14  -4.992  -3.266  -2.650
  124   3HG2  THR  14          3HG2      THR  14  -4.279  -2.277  -3.926
  125    H    LEU  15           H        LEU  15  -5.272  -0.914   0.936
  126    HA   LEU  15           HA       LEU  15  -6.512  -3.422   1.871
  127   1HB   LEU  15          1HB       LEU  15  -5.172  -1.668   3.475
  128   2HB   LEU  15          2HB       LEU  15  -6.801  -1.036   3.596
  129    HG   LEU  15           HG       LEU  15  -6.931  -3.903   3.975
  130   1HD1  LEU  15          1HD1      LEU  15  -4.540  -3.691   4.616
  131   2HD1  LEU  15          2HD1      LEU  15  -5.031  -2.602   5.913
  132   3HD1  LEU  15          3HD1      LEU  15  -5.588  -4.275   5.909
  133   1HD2  LEU  15          1HD2      LEU  15  -8.497  -2.140   4.846
  134   2HD2  LEU  15          2HD2      LEU  15  -8.028  -3.379   6.011
  135   3HD2  LEU  15          3HD2      LEU  15  -7.289  -1.780   6.080
  136    H    GLU  16           H        GLU  16  -8.669  -3.658   1.718
  137    HA   GLU  16           HA       GLU  16 -10.375  -1.445   0.755
  138   1HB   GLU  16          1HB       GLU  16  -9.973  -4.180  -0.378
  139   2HB   GLU  16          2HB       GLU  16 -11.594  -3.505  -0.445
  140   1HG   GLU  16          1HG       GLU  16 -10.448  -1.444  -1.510
  141   2HG   GLU  16          2HG       GLU  16  -9.090  -2.532  -1.779
  142    H    VAL  17           H        VAL  17 -12.477  -1.295   1.462
  143    HA   VAL  17           HA       VAL  17 -13.202  -2.701   3.913
  144    HB   VAL  17           HB       VAL  17 -15.235  -1.102   3.982
  145   1HG1  VAL  17          1HG1      VAL  17 -13.278  -0.948   5.431
  146   2HG1  VAL  17          2HG1      VAL  17 -12.503   0.118   4.259
  147   3HG1  VAL  17          3HG1      VAL  17 -13.980   0.631   5.075
  148   1HG2  VAL  17          1HG2      VAL  17 -15.179  -0.172   1.673
  149   2HG2  VAL  17          2HG2      VAL  17 -15.072   1.090   2.901
  150   3HG2  VAL  17          3HG2      VAL  17 -13.627   0.584   2.028

  No H/Q in entry =         150
  Start of MODEL    7
    1    H1   MET   1           H1       MET   1 -13.708   0.181  -1.169
    2    H2   MET   1           H2       MET   1 -13.992   0.743   0.402
    3    H3   MET   1           H3       MET   1 -14.939   1.304  -0.882
    4    HA   MET   1           HA       MET   1 -13.316   2.619  -1.747
    5   1HB   MET   1          1HB       MET   1 -12.262   3.926   0.168
    6   2HB   MET   1          2HB       MET   1 -14.000   3.772   0.219
    7   1HG   MET   1          1HG       MET   1 -13.402   3.546   2.450
    8   2HG   MET   1          2HG       MET   1 -13.516   1.861   1.951
    9   1HE   MET   1          1HE       MET   1 -11.216   4.885   2.559
   10   2HE   MET   1          2HE       MET   1 -11.451   4.102   4.123
   11   3HE   MET   1          3HE       MET   1  -9.848   4.135   3.384
   12    H    GLN   2           H        GLN   2 -11.321   3.011  -2.557
   13    HA   GLN   2           HA       GLN   2  -9.135   1.141  -1.907
   14   1HB   GLN   2          1HB       GLN   2 -10.098   2.237  -4.513
   15   2HB   GLN   2          2HB       GLN   2  -8.360   2.064  -4.325
   16   1HG   GLN   2          1HG       GLN   2  -8.482  -0.251  -4.117
   17   2HG   GLN   2          2HG       GLN   2 -10.203  -0.221  -3.732
   18   2HE2  GLN   2          2HE2      GLN   2  -7.811  -0.128  -6.307
   19   1HE2  GLN   2          1HE2      GLN   2  -8.931  -0.342  -7.605
   20    H    ILE   3           H        ILE   3  -7.349   1.865  -1.044
   21    HA   ILE   3           HA       ILE   3  -6.308   4.551  -1.393
   22    HB   ILE   3           HB       ILE   3  -5.863   4.793   1.173
   23   1HG1  ILE   3          1HG1      ILE   3  -8.496   3.825   2.022
   24   2HG1  ILE   3          2HG1      ILE   3  -7.574   2.485   1.365
   25   1HG2  ILE   3          1HG2      ILE   3  -7.164   6.326  -0.221
   26   2HG2  ILE   3          2HG2      ILE   3  -8.618   5.380   0.094
   27   3HG2  ILE   3          3HG2      ILE   3  -7.807   6.219   1.418
   28   1HD1  ILE   3          1HD1      ILE   3  -6.191   4.210   3.325
   29   2HD1  ILE   3          2HD1      ILE   3  -7.502   3.191   3.920
   30   3HD1  ILE   3          3HD1      ILE   3  -6.123   2.463   3.094
   31    H    PHE   4           H        PHE   4  -4.282   4.508  -1.812
   32    HA   PHE   4           HA       PHE   4  -2.667   2.101  -1.506
   33   1HB   PHE   4          1HB       PHE   4  -2.668   4.500  -3.245
   34   2HB   PHE   4          2HB       PHE   4  -1.081   3.865  -2.873
   35    HD1  PHE   4           HD1      PHE   4  -4.478   2.971  -4.565
   36    HD2  PHE   4           HD2      PHE   4  -0.125   1.918  -4.039
   37    HE1  PHE   4           HE1      PHE   4  -4.637   1.326  -6.552
   38    HE2  PHE   4           HE2      PHE   4  -0.297   0.268  -6.030
   39    HZ   PHE   4           HZ       PHE   4  -2.543  -0.023  -7.295
   40    H    VAL   5           H        VAL   5  -0.703   1.866  -0.525
   41    HA   VAL   5           HA       VAL   5   0.607   3.999   0.961
   42    HB   VAL   5           HB       VAL   5   0.906   2.493   3.056
   43   1HG1  VAL   5          1HG1      VAL   5  -0.278   4.608   3.053
   44   2HG1  VAL   5          2HG1      VAL   5  -1.771   3.785   2.600
   45   3HG1  VAL   5          3HG1      VAL   5  -1.021   3.455   4.162
   46   1HG2  VAL   5          1HG2      VAL   5  -0.209   0.403   2.258
   47   2HG2  VAL   5          2HG2      VAL   5  -0.911   1.022   3.752
   48   3HG2  VAL   5          3HG2      VAL   5  -1.748   1.266   2.219
   49    H    LYS   6           H        LYS   6   2.763   3.914   0.970
   50    HA   LYS   6           HA       LYS   6   4.162   1.498  -0.008
   51   1HB   LYS   6          1HB       LYS   6   3.940   3.904  -1.334
   52   2HB   LYS   6          2HB       LYS   6   5.491   4.081  -0.529
   53   1HG   LYS   6          1HG       LYS   6   6.449   2.304  -1.700
   54   2HG   LYS   6          2HG       LYS   6   4.883   1.626  -2.146
   55   1HD   LYS   6          1HD       LYS   6   4.517   3.256  -3.798
   56   2HD   LYS   6          2HD       LYS   6   5.762   4.325  -3.148
   57   1HE   LYS   6          1HE       LYS   6   7.502   2.935  -3.952
   58   2HE   LYS   6          2HE       LYS   6   6.386   1.615  -4.300
   59   1HZ   LYS   6          1HZ       LYS   6   6.314   4.240  -5.682
   60   2HZ   LYS   6          2HZ       LYS   6   7.129   2.885  -6.281
   61   3HZ   LYS   6          3HZ       LYS   6   5.449   2.845  -6.089
   62    H    THR   7           H        THR   7   6.091   0.886   0.858
   63    HA   THR   7           HA       THR   7   6.810   1.767   3.553
   64    HB   THR   7           HB       THR   7   8.481  -0.199   3.375
   65    HG1  THR   7           HG1      THR   7   8.557  -1.203   1.548
   66   1HG2  THR   7          1HG2      THR   7   5.510  -0.750   3.287
   67   2HG2  THR   7          2HG2      THR   7   6.733  -1.902   3.824
   68   3HG2  THR   7          3HG2      THR   7   6.479  -0.404   4.721
   69    H    LEU   8           H        LEU   8   8.246   1.759   0.287
   70    HA   LEU   8           HA       LEU   8   9.878   2.876  -0.801
   71   1HB   LEU   8          1HB       LEU   8  10.354   4.334   1.812
   72   2HB   LEU   8          2HB       LEU   8  11.448   4.536   0.460
   73    HG   LEU   8           HG       LEU   8   8.834   4.944  -0.604
   74   1HD1  LEU   8          1HD1      LEU   8   7.973   5.280   1.647
   75   2HD1  LEU   8          2HD1      LEU   8   9.196   6.514   1.945
   76   3HD1  LEU   8          3HD1      LEU   8   7.949   6.787   0.728
   77   1HD2  LEU   8          1HD2      LEU   8  10.964   6.964   0.097
   78   2HD2  LEU   8          2HD2      LEU   8  10.827   6.066  -1.414
   79   3HD2  LEU   8          3HD2      LEU   8   9.594   7.248  -0.977
   80    H    ASP   9           H        ASP   9  10.568   0.813   1.868
   81    HA   ASP   9           HA       ASP   9  13.406   0.421   1.571
   82   1HB   ASP   9          1HB       ASP   9  11.596  -0.195   3.548
   83   2HB   ASP   9          2HB       ASP   9  11.921  -1.777   2.851
   84    H    GLY  10           H        GLY  10  10.509  -1.297   0.315
   85   1HA   GLY  10          2HA       GLY  10  12.061  -3.376  -1.066
   86   2HA   GLY  10          1HA       GLY  10  11.231  -2.215  -2.079
   87    H    LYS  11           H        LYS  11   8.800  -1.912  -0.598
   88    HA   LYS  11           HA       LYS  11   7.355  -4.378  -1.273
   89   1HB   LYS  11          1HB       LYS  11   7.443  -3.193   1.489
   90   2HB   LYS  11          2HB       LYS  11   5.945  -3.920   0.932
   91   1HG   LYS  11          1HG       LYS  11   7.001  -6.048   0.664
   92   2HG   LYS  11          2HG       LYS  11   8.592  -5.352   0.986
   93   1HD   LYS  11          1HD       LYS  11   7.744  -4.685   3.248
   94   2HD   LYS  11          2HD       LYS  11   6.283  -5.615   2.908
   95   1HE   LYS  11          1HE       LYS  11   7.628  -7.627   2.627
   96   2HE   LYS  11          2HE       LYS  11   9.091  -6.697   2.950
   97   1HZ   LYS  11          1HZ       LYS  11   6.851  -7.019   4.870
   98   2HZ   LYS  11          2HZ       LYS  11   8.269  -7.939   4.895
   99   3HZ   LYS  11          3HZ       LYS  11   8.340  -6.272   5.168
  100    H    THR  12           H        THR  12   5.260  -4.118  -1.987
  101    HA   THR  12           HA       THR  12   3.839  -1.564  -1.851
  102    HB   THR  12           HB       THR  12   3.219  -1.786  -4.369
  103    HG1  THR  12           HG1      THR  12   4.642  -2.846  -5.675
  104   1HG2  THR  12          1HG2      THR  12   4.673   0.008  -3.283
  105   2HG2  THR  12          2HG2      THR  12   6.054  -0.895  -3.903
  106   3HG2  THR  12          3HG2      THR  12   4.862  -0.230  -5.020
  107    H    ILE  13           H        ILE  13   1.839  -1.911  -1.225
  108    HA   ILE  13           HA       ILE  13   0.112  -4.054  -2.137
  109    HB   ILE  13           HB       ILE  13  -0.601  -4.677   0.303
  110   1HG1  ILE  13          1HG1      ILE  13   2.158  -4.780   1.344
  111   2HG1  ILE  13          2HG1      ILE  13   1.663  -3.118   1.076
  112   1HG2  ILE  13          1HG2      ILE  13   1.839  -5.860  -1.005
  113   2HG2  ILE  13          2HG2      ILE  13   0.923  -6.635   0.289
  114   3HG2  ILE  13          3HG2      ILE  13   0.149  -6.304  -1.263
  115   1HD1  ILE  13          1HD1      ILE  13   0.010  -5.052   2.673
  116   2HD1  ILE  13          2HD1      ILE  13   1.285  -4.062   3.386
  117   3HD1  ILE  13          3HD1      ILE  13  -0.110  -3.292   2.624
  118    H    THR  14           H        THR  14  -2.054  -3.665  -2.025
  119    HA   THR  14           HA       THR  14  -2.951  -0.947  -1.474
  120    HB   THR  14           HB       THR  14  -5.226  -1.826  -2.297
  121    HG1  THR  14           HG1      THR  14  -5.332  -3.805  -3.176
  122   1HG2  THR  14          1HG2      THR  14  -3.369  -0.619  -3.672
  123   2HG2  THR  14          2HG2      THR  14  -3.246  -2.184  -4.479
  124   3HG2  THR  14          3HG2      THR  14  -4.785  -1.316  -4.459
  125    H    LEU  15           H        LEU  15  -4.482  -0.240  -0.033
  126    HA   LEU  15           HA       LEU  15  -5.289  -2.039   2.150
  127   1HB   LEU  15          1HB       LEU  15  -3.832   0.278   2.381
  128   2HB   LEU  15          2HB       LEU  15  -5.455   0.883   2.636
  129    HG   LEU  15           HG       LEU  15  -5.161  -1.474   4.267
  130   1HD1  LEU  15          1HD1      LEU  15  -2.717  -1.052   4.062
  131   2HD1  LEU  15          2HD1      LEU  15  -2.973   0.514   4.834
  132   3HD1  LEU  15          3HD1      LEU  15  -3.336  -0.973   5.711
  133   1HD2  LEU  15          1HD2      LEU  15  -6.670   0.373   4.770
  134   2HD2  LEU  15          2HD2      LEU  15  -5.588   0.048   6.124
  135   3HD2  LEU  15          3HD2      LEU  15  -5.291   1.430   5.071
  136    H    GLU  16           H        GLU  16  -7.179  -2.848   1.694
  137    HA   GLU  16           HA       GLU  16  -9.446  -1.173   0.809
  138   1HB   GLU  16          1HB       GLU  16  -8.385  -3.734  -0.288
  139   2HB   GLU  16          2HB       GLU  16 -10.132  -3.556  -0.244
  140   1HG   GLU  16          1HG       GLU  16  -9.637  -1.268  -1.421
  141   2HG   GLU  16          2HG       GLU  16  -8.103  -2.032  -1.830
  142    H    VAL  17           H        VAL  17 -11.498  -1.586   1.628
  143    HA   VAL  17           HA       VAL  17 -11.684  -2.980   4.179
  144    HB   VAL  17           HB       VAL  17 -14.096  -2.060   4.280
  145   1HG1  VAL  17          1HG1      VAL  17 -12.304  -1.196   5.629
  146   2HG1  VAL  17          2HG1      VAL  17 -11.794  -0.128   4.322
  147   3HG1  VAL  17          3HG1      VAL  17 -13.357   0.114   5.101
  148   1HG2  VAL  17          1HG2      VAL  17 -14.472  -1.342   1.946
  149   2HG2  VAL  17          2HG2      VAL  17 -14.619   0.019   3.057
  150   3HG2  VAL  17          3HG2      VAL  17 -13.158  -0.175   2.084

  No H/Q in entry =         150
  Start of MODEL    8
    1    H1   MET   1           H1       MET   1 -13.974   1.402  -3.127
    2    H2   MET   1           H2       MET   1 -14.252   1.096  -1.488
    3    H3   MET   1           H3       MET   1 -14.922   2.468  -2.218
    4    HA   MET   1           HA       MET   1 -12.746   3.398  -2.586
    5   1HB   MET   1          1HB       MET   1 -14.154   3.232  -0.219
    6   2HB   MET   1          2HB       MET   1 -12.543   2.745   0.287
    7   1HG   MET   1          1HG       MET   1 -11.617   4.813  -0.234
    8   2HG   MET   1          2HG       MET   1 -12.950   5.251  -1.303
    9   1HE   MET   1          1HE       MET   1 -15.395   5.754  -0.430
   10   2HE   MET   1          2HE       MET   1 -15.465   6.964   0.853
   11   3HE   MET   1          3HE       MET   1 -14.415   7.217  -0.542
   12    H    GLN   2           H        GLN   2 -10.504   3.359  -2.490
   13    HA   GLN   2           HA       GLN   2  -9.062   0.931  -1.695
   14   1HB   GLN   2          1HB       GLN   2  -9.156   2.125  -4.433
   15   2HB   GLN   2          2HB       GLN   2  -7.577   1.610  -3.858
   16   1HG   GLN   2          1HG       GLN   2  -8.153  -0.613  -3.838
   17   2HG   GLN   2          2HG       GLN   2  -9.873  -0.282  -3.649
   18   2HE2  GLN   2          2HE2      GLN   2  -7.223  -0.595  -5.939
   19   1HE2  GLN   2          1HE2      GLN   2  -8.208  -0.601  -7.357
   20    H    ILE   3           H        ILE   3  -7.330   1.291  -0.490
   21    HA   ILE   3           HA       ILE   3  -6.094   3.943  -0.401
   22    HB   ILE   3           HB       ILE   3  -7.772   3.539   1.456
   23   1HG1  ILE   3          1HG1      ILE   3  -5.595   4.265   3.185
   24   2HG1  ILE   3          2HG1      ILE   3  -5.230   4.858   1.575
   25   1HG2  ILE   3          1HG2      ILE   3  -5.863   1.487   2.487
   26   2HG2  ILE   3          2HG2      ILE   3  -6.861   2.428   3.600
   27   3HG2  ILE   3          3HG2      ILE   3  -7.621   1.439   2.353
   28   1HD1  ILE   3          1HD1      ILE   3  -7.748   5.714   1.746
   29   2HD1  ILE   3          2HD1      ILE   3  -7.348   5.684   3.464
   30   3HD1  ILE   3          3HD1      ILE   3  -6.375   6.644   2.349
   31    H    PHE   4           H        PHE   4  -4.063   3.951  -0.979
   32    HA   PHE   4           HA       PHE   4  -2.389   1.530  -0.869
   33   1HB   PHE   4          1HB       PHE   4  -2.770   3.689  -2.849
   34   2HB   PHE   4          2HB       PHE   4  -1.093   3.255  -2.590
   35    HD1  PHE   4           HD1      PHE   4  -4.493   1.999  -3.922
   36    HD2  PHE   4           HD2      PHE   4  -0.097   1.089  -3.458
   37    HE1  PHE   4           HE1      PHE   4  -4.702   0.089  -5.646
   38    HE2  PHE   4           HE2      PHE   4  -0.327  -0.834  -5.177
   39    HZ   PHE   4           HZ       PHE   4  -2.622  -1.332  -6.278
   40    H    VAL   5           H        VAL   5  -0.327   1.475  -0.104
   41    HA   VAL   5           HA       VAL   5   0.954   3.826   1.083
   42    HB   VAL   5           HB       VAL   5   1.711   2.415   3.128
   43   1HG1  VAL   5          1HG1      VAL   5   0.253   4.380   3.218
   44   2HG1  VAL   5          2HG1      VAL   5  -1.153   3.325   3.077
   45   3HG1  VAL   5          3HG1      VAL   5  -0.098   3.205   4.485
   46   1HG2  VAL   5          1HG2      VAL   5  -0.804   0.808   2.540
   47   2HG2  VAL   5          2HG2      VAL   5   0.843   0.184   2.630
   48   3HG2  VAL   5          3HG2      VAL   5   0.055   0.811   4.080
   49    H    LYS   6           H        LYS   6   3.087   4.000   0.813
   50    HA   LYS   6           HA       LYS   6   4.619   1.760  -0.355
   51   1HB   LYS   6          1HB       LYS   6   3.947   4.072  -1.647
   52   2HB   LYS   6          2HB       LYS   6   5.516   4.512  -0.991
   53   1HG   LYS   6          1HG       LYS   6   6.647   2.929  -2.257
   54   2HG   LYS   6          2HG       LYS   6   5.207   1.946  -2.509
   55   1HD   LYS   6          1HD       LYS   6   4.441   3.243  -4.244
   56   2HD   LYS   6          2HD       LYS   6   5.228   4.708  -3.657
   57   1HE   LYS   6          1HE       LYS   6   7.354   3.977  -4.449
   58   2HE   LYS   6          2HE       LYS   6   6.738   2.360  -4.793
   59   1HZ   LYS   6          1HZ       LYS   6   5.892   4.849  -6.177
   60   2HZ   LYS   6          2HZ       LYS   6   6.958   3.694  -6.803
   61   3HZ   LYS   6          3HZ       LYS   6   5.341   3.286  -6.522
   62    H    THR   7           H        THR   7   6.722   1.392   0.212
   63    HA   THR   7           HA       THR   7   7.907   2.806   2.535
   64    HB   THR   7           HB       THR   7   9.099   0.551   2.985
   65    HG1  THR   7           HG1      THR   7   8.583  -0.779   1.373
   66   1HG2  THR   7          1HG2      THR   7   6.238   1.146   3.624
   67   2HG2  THR   7          2HG2      THR   7   6.953  -0.380   4.147
   68   3HG2  THR   7          3HG2      THR   7   7.650   1.152   4.681
   69    H    LEU   8           H        LEU   8  10.127   3.180   2.600
   70    HA   LEU   8           HA       LEU   8  11.539   3.682   0.165
   71   1HB   LEU   8          1HB       LEU   8  11.962   4.139   3.045
   72   2HB   LEU   8          2HB       LEU   8  13.444   3.944   2.135
   73    HG   LEU   8           HG       LEU   8  11.850   5.772   0.628
   74   1HD1  LEU   8          1HD1      LEU   8  11.849   6.486   3.556
   75   2HD1  LEU   8          2HD1      LEU   8  11.526   7.622   2.245
   76   3HD1  LEU   8          3HD1      LEU   8  10.448   6.250   2.510
   77   1HD2  LEU   8          1HD2      LEU   8  14.307   5.759   0.779
   78   2HD2  LEU   8          2HD2      LEU   8  13.619   7.358   1.058
   79   3HD2  LEU   8          3HD2      LEU   8  14.195   6.395   2.420
   80    H    ASP   9           H        ASP   9  11.468   0.820   2.148
   81    HA   ASP   9           HA       ASP   9  14.026  -0.364   1.558
   82   1HB   ASP   9          1HB       ASP   9  11.543  -1.255   2.948
   83   2HB   ASP   9          2HB       ASP   9  12.622  -2.510   2.354
   84    H    GLY  10           H        GLY  10  10.777  -0.655   0.071
   85   1HA   GLY  10          2HA       GLY  10  11.842  -2.330  -2.142
   86   2HA   GLY  10          1HA       GLY  10  10.735  -0.995  -2.398
   87    H    LYS  11           H        LYS  11   8.734  -1.305  -0.614
   88    HA   LYS  11           HA       LYS  11   7.369  -3.790  -1.411
   89   1HB   LYS  11          1HB       LYS  11   8.039  -2.998   1.350
   90   2HB   LYS  11          2HB       LYS  11   6.339  -3.361   1.131
   91   1HG   LYS  11          1HG       LYS  11   6.756  -5.528   1.303
   92   2HG   LYS  11          2HG       LYS  11   7.768  -5.465  -0.132
   93   1HD   LYS  11          1HD       LYS  11   9.553  -5.974   1.115
   94   2HD   LYS  11          2HD       LYS  11   9.371  -4.468   2.004
   95   1HE   LYS  11          1HE       LYS  11   9.292  -5.953   3.739
   96   2HE   LYS  11          2HE       LYS  11   7.574  -5.896   3.346
   97   1HZ   LYS  11          1HZ       LYS  11   9.468  -7.938   2.306
   98   2HZ   LYS  11          2HZ       LYS  11   8.451  -8.170   3.639
   99   3HZ   LYS  11          3HZ       LYS  11   7.788  -7.918   2.103
  100    H    THR  12           H        THR  12   5.187  -3.671  -1.797
  101    HA   THR  12           HA       THR  12   3.666  -1.194  -1.344
  102    HB   THR  12           HB       THR  12   2.621  -1.524  -3.705
  103    HG1  THR  12           HG1      THR  12   3.593  -3.357  -4.445
  104   1HG2  THR  12          1HG2      THR  12   3.912   0.461  -3.098
  105   2HG2  THR  12          2HG2      THR  12   5.412  -0.386  -3.474
  106   3HG2  THR  12          3HG2      THR  12   4.256  -0.028  -4.757
  107    H    ILE  13           H        ILE  13   1.684  -1.510  -0.576
  108    HA   ILE  13           HA       ILE  13   0.063  -3.874  -1.081
  109    HB   ILE  13           HB       ILE  13  -0.490  -4.219   1.412
  110   1HG1  ILE  13          1HG1      ILE  13   2.236  -3.751   2.432
  111   2HG1  ILE  13          2HG1      ILE  13   1.511  -2.240   1.911
  112   1HG2  ILE  13          1HG2      ILE  13   2.115  -5.209   0.275
  113   2HG2  ILE  13          2HG2      ILE  13   1.305  -5.906   1.678
  114   3HG2  ILE  13          3HG2      ILE  13   0.515  -5.931   0.101
  115   1HD1  ILE  13          1HD1      ILE  13   0.154  -4.128   3.814
  116   2HD1  ILE  13          2HD1      ILE  13   1.221  -2.824   4.336
  117   3HD1  ILE  13          3HD1      ILE  13  -0.267  -2.450   3.464
  118    H    THR  14           H        THR  14  -2.114  -3.637  -0.926
  119    HA   THR  14           HA       THR  14  -3.216  -1.074   0.003
  120    HB   THR  14           HB       THR  14  -3.194  -0.878  -2.413
  121    HG1  THR  14           HG1      THR  14  -5.195  -0.119  -2.607
  122   1HG2  THR  14          1HG2      THR  14  -3.349  -3.316  -3.086
  123   2HG2  THR  14          2HG2      THR  14  -5.081  -3.227  -2.762
  124   3HG2  THR  14          3HG2      THR  14  -4.367  -2.213  -4.018
  125    H    LEU  15           H        LEU  15  -5.275  -0.976   0.884
  126    HA   LEU  15           HA       LEU  15  -6.540  -3.483   1.785
  127   1HB   LEU  15          1HB       LEU  15  -5.163  -1.776   3.405
  128   2HB   LEU  15          2HB       LEU  15  -6.781  -1.121   3.549
  129    HG   LEU  15           HG       LEU  15  -6.951  -3.990   3.887
  130   1HD1  LEU  15          1HD1      LEU  15  -4.907  -2.699   5.685
  131   2HD1  LEU  15          2HD1      LEU  15  -5.636  -4.285   5.933
  132   3HD1  LEU  15          3HD1      LEU  15  -4.620  -3.993   4.522
  133   1HD2  LEU  15          1HD2      LEU  15  -8.492  -2.236   4.796
  134   2HD2  LEU  15          2HD2      LEU  15  -8.008  -3.474   5.956
  135   3HD2  LEU  15          3HD2      LEU  15  -7.265  -1.876   6.010
  136    H    GLU  16           H        GLU  16  -8.707  -3.683   1.648
  137    HA   GLU  16           HA       GLU  16 -10.383  -1.425   0.733
  138   1HB   GLU  16          1HB       GLU  16 -10.033  -4.148  -0.442
  139   2HB   GLU  16          2HB       GLU  16 -11.647  -3.456  -0.478
  140   1HG   GLU  16          1HG       GLU  16 -10.501  -1.393  -1.532
  141   2HG   GLU  16          2HG       GLU  16  -9.151  -2.483  -1.829
  142    H    VAL  17           H        VAL  17 -12.473  -1.246   1.461
  143    HA   VAL  17           HA       VAL  17 -13.320  -2.948   3.718
  144    HB   VAL  17           HB       VAL  17 -14.917  -1.014   4.354
  145   1HG1  VAL  17          1HG1      VAL  17 -11.954  -0.702   4.734
  146   2HG1  VAL  17          2HG1      VAL  17 -13.192   0.115   5.687
  147   3HG1  VAL  17          3HG1      VAL  17 -13.068  -1.643   5.725
  148   1HG2  VAL  17          1HG2      VAL  17 -14.583   0.436   2.304
  149   2HG2  VAL  17          2HG2      VAL  17 -14.362   1.275   3.841
  150   3HG2  VAL  17          3HG2      VAL  17 -12.958   0.787   2.892

  No H/Q in entry =         150
  Start of MODEL    9
    1    H1   MET   1           H1       MET   1 -13.939   1.250  -2.860
    2    H2   MET   1           H2       MET   1 -14.209   0.944  -1.218
    3    H3   MET   1           H3       MET   1 -14.893   2.307  -1.948
    4    HA   MET   1           HA       MET   1 -12.752   3.282  -2.302
    5   1HB   MET   1          1HB       MET   1 -14.088   3.005   0.101
    6   2HB   MET   1          2HB       MET   1 -12.450   2.550   0.542
    7   1HG   MET   1          1HG       MET   1 -11.612   4.649   0.158
    8   2HG   MET   1          2HG       MET   1 -12.879   5.068  -0.994
    9   1HE   MET   1          1HE       MET   1 -11.872   4.479   2.618
   10   2HE   MET   1          2HE       MET   1 -11.616   6.208   2.373
   11   3HE   MET   1          3HE       MET   1 -12.841   5.653   3.514
   12    H    GLN   2           H        GLN   2 -10.513   3.282  -2.272
   13    HA   GLN   2           HA       GLN   2  -9.001   0.862  -1.588
   14   1HB   GLN   2          1HB       GLN   2  -9.203   2.129  -4.287
   15   2HB   GLN   2          2HB       GLN   2  -7.594   1.642  -3.773
   16   1HG   GLN   2          1HG       GLN   2  -8.123  -0.600  -3.771
   17   2HG   GLN   2          2HG       GLN   2  -9.848  -0.304  -3.571
   18   2HE2  GLN   2          2HE2      GLN   2  -7.197  -0.516  -5.874
   19   1HE2  GLN   2          1HE2      GLN   2  -8.188  -0.514  -7.289
   20    H    ILE   3           H        ILE   3  -7.243   1.226  -0.422
   21    HA   ILE   3           HA       ILE   3  -6.065   3.902  -0.292
   22    HB   ILE   3           HB       ILE   3  -7.673   3.404   1.603
   23   1HG1  ILE   3          1HG1      ILE   3  -5.454   4.135   3.279
   24   2HG1  ILE   3          2HG1      ILE   3  -5.164   4.786   1.675
   25   1HG2  ILE   3          1HG2      ILE   3  -5.682   1.373   2.513
   26   2HG2  ILE   3          2HG2      ILE   3  -6.665   2.256   3.684
   27   3HG2  ILE   3          3HG2      ILE   3  -7.441   1.283   2.435
   28   1HD1  ILE   3          1HD1      ILE   3  -7.715   5.550   1.993
   29   2HD1  ILE   3          2HD1      ILE   3  -7.198   5.518   3.680
   30   3HD1  ILE   3          3HD1      ILE   3  -6.334   6.518   2.511
   31    H    PHE   4           H        PHE   4  -4.058   3.979  -0.933
   32    HA   PHE   4           HA       PHE   4  -2.304   1.609  -0.908
   33   1HB   PHE   4          1HB       PHE   4  -2.816   3.773  -2.866
   34   2HB   PHE   4          2HB       PHE   4  -1.127   3.350  -2.681
   35    HD1  PHE   4           HD1      PHE   4  -4.582   2.046  -3.843
   36    HD2  PHE   4           HD2      PHE   4  -0.148   1.232  -3.640
   37    HE1  PHE   4           HE1      PHE   4  -4.846   0.150  -5.576
   38    HE2  PHE   4           HE2      PHE   4  -0.431  -0.675  -5.366
   39    HZ   PHE   4           HZ       PHE   4  -2.775  -1.215  -6.342
   40    H    VAL   5           H        VAL   5  -0.248   1.618  -0.153
   41    HA   VAL   5           HA       VAL   5   1.048   4.014   0.897
   42    HB   VAL   5           HB       VAL   5   1.767   2.759   3.056
   43   1HG1  VAL   5          1HG1      VAL   5   0.358   4.762   2.973
   44   2HG1  VAL   5          2HG1      VAL   5  -1.073   3.733   2.917
   45   3HG1  VAL   5          3HG1      VAL   5  -0.023   3.707   4.333
   46   1HG2  VAL   5          1HG2      VAL   5   0.726   0.514   2.568
   47   2HG2  VAL   5          2HG2      VAL   5   0.260   1.199   4.126
   48   3HG2  VAL   5          3HG2      VAL   5  -0.862   1.262   2.767
   49    H    LYS   6           H        LYS   6   3.179   4.123   0.615
   50    HA   LYS   6           HA       LYS   6   4.661   1.766  -0.376
   51   1HB   LYS   6          1HB       LYS   6   4.060   4.015  -1.813
   52   2HB   LYS   6          2HB       LYS   6   5.642   4.442  -1.183
   53   1HG   LYS   6          1HG       LYS   6   6.710   2.703  -2.319
   54   2HG   LYS   6          2HG       LYS   6   5.209   1.815  -2.572
   55   1HD   LYS   6          1HD       LYS   6   4.581   3.092  -4.377
   56   2HD   LYS   6          2HD       LYS   6   5.450   4.523  -3.821
   57   1HE   LYS   6          1HE       LYS   6   7.537   3.638  -4.535
   58   2HE   LYS   6          2HE       LYS   6   6.840   2.042  -4.815
   59   1HZ   LYS   6          1HZ       LYS   6   5.499   3.004  -6.601
   60   2HZ   LYS   6          2HZ       LYS   6   6.227   4.510  -6.350
   61   3HZ   LYS   6          3HZ       LYS   6   7.153   3.203  -6.892
   62    H    THR   7           H        THR   7   6.746   1.375   0.230
   63    HA   THR   7           HA       THR   7   7.948   2.884   2.484
   64    HB   THR   7           HB       THR   7   9.120   0.638   3.026
   65    HG1  THR   7           HG1      THR   7   8.448  -0.511   1.179
   66   1HG2  THR   7          1HG2      THR   7   6.257   1.269   3.624
   67   2HG2  THR   7          2HG2      THR   7   6.967  -0.233   4.215
   68   3HG2  THR   7          3HG2      THR   7   7.662   1.318   4.688
   69    H    LEU   8           H        LEU   8  10.171   3.241   2.543
   70    HA   LEU   8           HA       LEU   8  11.588   3.648   0.098
   71   1HB   LEU   8          1HB       LEU   8  12.164   4.058   2.994
   72   2HB   LEU   8          2HB       LEU   8  13.524   4.083   1.890
   73    HG   LEU   8           HG       LEU   8  11.452   5.768   0.780
   74   1HD1  LEU   8          1HD1      LEU   8  10.594   5.948   3.073
   75   2HD1  LEU   8          2HD1      LEU   8  12.167   6.547   3.599
   76   3HD1  LEU   8          3HD1      LEU   8  11.207   7.480   2.451
   77   1HD2  LEU   8          1HD2      LEU   8  13.827   6.017   0.302
   78   2HD2  LEU   8          2HD2      LEU   8  13.143   7.519   0.920
   79   3HD2  LEU   8          3HD2      LEU   8  14.125   6.499   1.972
   80    H    ASP   9           H        ASP   9  11.475   0.830   2.128
   81    HA   ASP   9           HA       ASP   9  14.027  -0.388   1.575
   82   1HB   ASP   9          1HB       ASP   9  11.546  -1.214   2.998
   83   2HB   ASP   9          2HB       ASP   9  12.586  -2.503   2.409
   84    H    GLY  10           H        GLY  10  10.758  -0.722   0.120
   85   1HA   GLY  10          2HA       GLY  10  11.814  -2.439  -2.066
   86   2HA   GLY  10          1HA       GLY  10  10.724  -1.096  -2.355
   87    H    LYS  11           H        LYS  11   8.701  -1.309  -0.630
   88    HA   LYS  11           HA       LYS  11   7.322  -3.826  -1.307
   89   1HB   LYS  11          1HB       LYS  11   7.658  -2.691   1.463
   90   2HB   LYS  11          2HB       LYS  11   6.206  -3.591   1.068
   91   1HG   LYS  11          1HG       LYS  11   7.236  -5.551   1.310
   92   2HG   LYS  11          2HG       LYS  11   8.550  -5.084   0.243
   93   1HD   LYS  11          1HD       LYS  11   9.929  -5.051   2.004
   94   2HD   LYS  11          2HD       LYS  11   9.031  -3.694   2.668
   95   1HE   LYS  11          1HE       LYS  11   7.447  -5.581   3.579
   96   2HE   LYS  11          2HE       LYS  11   8.861  -6.605   3.338
   97   1HZ   LYS  11          1HZ       LYS  11  10.116  -4.968   4.711
   98   2HZ   LYS  11          2HZ       LYS  11   8.649  -4.203   5.063
   99   3HZ   LYS  11          3HZ       LYS  11   8.909  -5.800   5.554
  100    H    THR  12           H        THR  12   5.129  -3.707  -1.703
  101    HA   THR  12           HA       THR  12   3.638  -1.194  -1.391
  102    HB   THR  12           HB       THR  12   2.586  -1.627  -3.729
  103    HG1  THR  12           HG1      THR  12   3.593  -2.941  -5.064
  104   1HG2  THR  12          1HG2      THR  12   5.330  -0.443  -3.354
  105   2HG2  THR  12          2HG2      THR  12   4.452  -0.338  -4.881
  106   3HG2  THR  12          3HG2      THR  12   3.778   0.391  -3.423
  107    H    ILE  13           H        ILE  13   1.664  -1.453  -0.584
  108    HA   ILE  13           HA       ILE  13   0.040  -3.847  -0.949
  109    HB   ILE  13           HB       ILE  13  -0.509  -4.044   1.553
  110   1HG1  ILE  13          1HG1      ILE  13   2.196  -3.442   2.562
  111   2HG1  ILE  13          2HG1      ILE  13   1.437  -1.987   1.939
  112   1HG2  ILE  13          1HG2      ILE  13   2.111  -5.048   0.466
  113   2HG2  ILE  13          2HG2      ILE  13   1.367  -5.644   1.950
  114   3HG2  ILE  13          3HG2      ILE  13   0.532  -5.832   0.406
  115   1HD1  ILE  13          1HD1      ILE  13   0.135  -3.788   3.964
  116   2HD1  ILE  13          2HD1      ILE  13   1.132  -2.395   4.387
  117   3HD1  ILE  13          3HD1      ILE  13  -0.365  -2.166   3.481
  118    H    THR  14           H        THR  14  -2.141  -3.611  -0.799
  119    HA   THR  14           HA       THR  14  -3.272  -1.032   0.025
  120    HB   THR  14           HB       THR  14  -3.170  -0.837  -2.389
  121    HG1  THR  14           HG1      THR  14  -5.848  -1.241  -1.539
  122   1HG2  THR  14          1HG2      THR  14  -3.270  -3.225  -3.128
  123   2HG2  THR  14          2HG2      THR  14  -4.996  -3.237  -2.752
  124   3HG2  THR  14          3HG2      THR  14  -4.373  -2.171  -4.013
  125    H    LEU  15           H        LEU  15  -5.330  -0.944   0.877
  126    HA   LEU  15           HA       LEU  15  -6.592  -3.467   1.746
  127   1HB   LEU  15          1HB       LEU  15  -5.303  -1.715   3.383
  128   2HB   LEU  15          2HB       LEU  15  -6.933  -1.080   3.461
  129    HG   LEU  15           HG       LEU  15  -7.101  -3.936   3.842
  130   1HD1  LEU  15          1HD1      LEU  15  -4.723  -3.805   4.504
  131   2HD1  LEU  15          2HD1      LEU  15  -5.171  -2.666   5.774
  132   3HD1  LEU  15          3HD1      LEU  15  -5.790  -4.317   5.812
  133   1HD2  LEU  15          1HD2      LEU  15  -8.674  -2.222   4.707
  134   2HD2  LEU  15          2HD2      LEU  15  -8.149  -3.381   5.927
  135   3HD2  LEU  15          3HD2      LEU  15  -7.457  -1.759   5.898
  136    H    GLU  16           H        GLU  16  -8.750  -3.716   1.575
  137    HA   GLU  16           HA       GLU  16 -10.452  -1.527   0.553
  138   1HB   GLU  16          1HB       GLU  16 -10.018  -4.279  -0.516
  139   2HB   GLU  16          2HB       GLU  16 -11.647  -3.631  -0.604
  140   1HG   GLU  16          1HG       GLU  16 -10.650  -1.618  -1.770
  141   2HG   GLU  16          2HG       GLU  16  -9.147  -2.530  -1.876
  142    H    VAL  17           H        VAL  17 -12.554  -1.360   1.245
  143    HA   VAL  17           HA       VAL  17 -13.502  -3.143   3.403
  144    HB   VAL  17           HB       VAL  17 -14.870  -1.142   4.304
  145   1HG1  VAL  17          1HG1      VAL  17 -12.953  -2.221   5.424
  146   2HG1  VAL  17          2HG1      VAL  17 -11.897  -1.000   4.713
  147   3HG1  VAL  17          3HG1      VAL  17 -13.164  -0.521   5.843
  148   1HG2  VAL  17          1HG2      VAL  17 -14.439   0.540   2.504
  149   2HG2  VAL  17          2HG2      VAL  17 -13.984   1.121   4.106
  150   3HG2  VAL  17          3HG2      VAL  17 -12.741   0.576   2.977

  No H/Q in entry =         150
  Start of MODEL   10
    1    H1   MET   1           H1       MET   1 -13.687   0.520   0.732
    2    H2   MET   1           H2       MET   1 -14.822   1.660   0.205
    3    H3   MET   1           H3       MET   1 -14.052   0.653  -0.913
    4    HA   MET   1           HA       MET   1 -13.112   2.851  -1.002
    5   1HB   MET   1          1HB       MET   1 -13.628   2.840   1.707
    6   2HB   MET   1          2HB       MET   1 -11.881   2.680   1.681
    7   1HG   MET   1          1HG       MET   1 -11.555   4.787   0.907
    8   2HG   MET   1          2HG       MET   1 -13.058   4.810  -0.016
    9   1HE   MET   1          1HE       MET   1 -11.287   5.074   3.261
   10   2HE   MET   1          2HE       MET   1 -11.510   6.784   2.887
   11   3HE   MET   1          3HE       MET   1 -12.319   6.075   4.285
   12    H    GLN   2           H        GLN   2 -11.044   3.121  -1.755
   13    HA   GLN   2           HA       GLN   2  -8.993   1.073  -1.266
   14   1HB   GLN   2          1HB       GLN   2 -10.390   1.164  -3.636
   15   2HB   GLN   2          2HB       GLN   2  -9.009   2.175  -4.015
   16   1HG   GLN   2          1HG       GLN   2  -8.345  -0.393  -2.736
   17   2HG   GLN   2          2HG       GLN   2  -9.093  -0.516  -4.324
   18   2HE2  GLN   2          2HE2      GLN   2  -7.963   0.277  -6.167
   19   1HE2  GLN   2          1HE2      GLN   2  -6.279   0.650  -6.085
   20    H    ILE   3           H        ILE   3  -7.077   1.808  -0.704
   21    HA   ILE   3           HA       ILE   3  -5.975   4.362  -1.511
   22    HB   ILE   3           HB       ILE   3  -5.268   4.972   0.916
   23   1HG1  ILE   3          1HG1      ILE   3  -7.810   4.234   2.184
   24   2HG1  ILE   3          2HG1      ILE   3  -6.976   2.782   1.660
   25   1HG2  ILE   3          1HG2      ILE   3  -6.755   6.254  -0.614
   26   2HG2  ILE   3          2HG2      ILE   3  -8.140   5.504   0.178
   27   3HG2  ILE   3          3HG2      ILE   3  -7.052   6.540   1.102
   28   1HD1  ILE   3          1HD1      ILE   3  -5.542   4.852   3.273
   29   2HD1  ILE   3          2HD1      ILE   3  -6.593   3.662   4.040
   30   3HD1  ILE   3          3HD1      ILE   3  -5.197   3.131   3.102
   31    H    PHE   4           H        PHE   4  -3.965   4.215  -2.028
   32    HA   PHE   4           HA       PHE   4  -2.418   1.784  -1.594
   33   1HB   PHE   4          1HB       PHE   4  -2.414   4.047  -3.507
   34   2HB   PHE   4          2HB       PHE   4  -0.832   3.389  -3.152
   35    HD1  PHE   4           HD1      PHE   4  -4.311   2.523  -4.665
   36    HD2  PHE   4           HD2      PHE   4   0.002   1.297  -4.184
   37    HE1  PHE   4           HE1      PHE   4  -4.607   0.752  -6.520
   38    HE2  PHE   4           HE2      PHE   4  -0.302  -0.467  -6.057
   39    HZ   PHE   4           HZ       PHE   4  -2.602  -0.739  -7.230
   40    H    VAL   5           H        VAL   5  -0.398   1.561  -0.678
   41    HA   VAL   5           HA       VAL   5   0.967   3.786   0.632
   42    HB   VAL   5           HB       VAL   5   1.386   2.363   2.763
   43   1HG1  VAL   5          1HG1      VAL   5   0.133   4.464   2.683
   44   2HG1  VAL   5          2HG1      VAL   5  -1.353   3.552   2.422
   45   3HG1  VAL   5          3HG1      VAL   5  -0.456   3.362   3.928
   46   1HG2  VAL   5          1HG2      VAL   5   0.195   0.245   1.970
   47   2HG2  VAL   5          2HG2      VAL   5  -0.242   0.816   3.580
   48   3HG2  VAL   5          3HG2      VAL   5  -1.321   1.110   2.214
   49    H    LYS   6           H        LYS   6   3.108   3.769   0.519
   50    HA   LYS   6           HA       LYS   6   4.618   1.333  -0.197
   51   1HB   LYS   6          1HB       LYS   6   4.044   3.333  -2.025
   52   2HB   LYS   6          2HB       LYS   6   5.631   3.808  -1.449
   53   1HG   LYS   6          1HG       LYS   6   6.489   1.567  -2.050
   54   2HG   LYS   6          2HG       LYS   6   4.900   1.153  -2.684
   55   1HD   LYS   6          1HD       LYS   6   5.418   2.053  -4.661
   56   2HD   LYS   6          2HD       LYS   6   5.688   3.624  -3.917
   57   1HE   LYS   6          1HE       LYS   6   8.013   3.094  -3.534
   58   2HE   LYS   6          2HE       LYS   6   7.768   1.439  -4.093
   59   1HZ   LYS   6          1HZ       LYS   6   7.436   3.872  -5.765
   60   2HZ   LYS   6          2HZ       LYS   6   8.784   2.850  -5.790
   61   3HZ   LYS   6          3HZ       LYS   6   7.275   2.272  -6.292
   62    H    THR   7           H        THR   7   6.706   1.131   0.573
   63    HA   THR   7           HA       THR   7   7.714   3.145   2.477
   64    HB   THR   7           HB       THR   7   6.957   1.216   3.764
   65    HG1  THR   7           HG1      THR   7   9.782   1.416   3.748
   66   1HG2  THR   7          1HG2      THR   7   8.786  -0.497   2.088
   67   2HG2  THR   7          2HG2      THR   7   8.355  -0.959   3.734
   68   3HG2  THR   7          3HG2      THR   7   7.096  -0.773   2.513
   69    H    LEU   8           H        LEU   8  10.094   3.146   2.920
   70    HA   LEU   8           HA       LEU   8  11.670   3.655   0.588
   71   1HB   LEU   8          1HB       LEU   8  12.124   3.753   3.536
   72   2HB   LEU   8          2HB       LEU   8  13.531   3.787   2.493
   73    HG   LEU   8           HG       LEU   8  11.645   5.717   1.469
   74   1HD1  LEU   8          1HD1      LEU   8  10.633   5.776   3.679
   75   2HD1  LEU   8          2HD1      LEU   8  12.209   6.094   4.405
   76   3HD1  LEU   8          3HD1      LEU   8  11.480   7.283   3.325
   77   1HD2  LEU   8          1HD2      LEU   8  14.130   5.747   1.244
   78   2HD2  LEU   8          2HD2      LEU   8  13.424   7.285   1.738
   79   3HD2  LEU   8          3HD2      LEU   8  14.226   6.260   2.928
   80    H    ASP   9           H        ASP   9  11.353   0.740   2.521
   81    HA   ASP   9           HA       ASP   9  13.829  -0.593   1.915
   82   1HB   ASP   9          1HB       ASP   9  11.240  -1.502   3.162
   83   2HB   ASP   9          2HB       ASP   9  12.508  -2.659   2.776
   84    H    GLY  10           H        GLY  10  10.561  -0.706   0.438
   85   1HA   GLY  10          2HA       GLY  10  11.563  -2.351  -1.826
   86   2HA   GLY  10          1HA       GLY  10  10.423  -1.030  -2.007
   87    H    LYS  11           H        LYS  11   8.361  -1.292  -0.574
   88    HA   LYS  11           HA       LYS  11   7.152  -3.941  -1.081
   89   1HB   LYS  11          1HB       LYS  11   7.130  -2.454   1.540
   90   2HB   LYS  11          2HB       LYS  11   5.797  -3.504   1.118
   91   1HG   LYS  11          1HG       LYS  11   7.267  -5.415   1.045
   92   2HG   LYS  11          2HG       LYS  11   8.673  -4.378   1.314
   93   1HD   LYS  11          1HD       LYS  11   7.423  -3.652   3.478
   94   2HD   LYS  11          2HD       LYS  11   6.470  -5.114   3.223
   95   1HE   LYS  11          1HE       LYS  11   8.779  -6.288   3.061
   96   2HE   LYS  11          2HE       LYS  11   9.383  -4.824   3.840
   97   1HZ   LYS  11          1HZ       LYS  11   7.168  -6.462   4.938
   98   2HZ   LYS  11          2HZ       LYS  11   8.787  -6.667   5.384
   99   3HZ   LYS  11          3HZ       LYS  11   7.997  -5.205   5.708
  100    H    THR  12           H        THR  12   4.975  -3.966  -1.662
  101    HA   THR  12           HA       THR  12   3.428  -1.478  -1.798
  102    HB   THR  12           HB       THR  12   2.547  -2.254  -4.119
  103    HG1  THR  12           HG1      THR  12   5.078  -3.564  -4.096
  104   1HG2  THR  12          1HG2      THR  12   4.089  -0.242  -3.542
  105   2HG2  THR  12          2HG2      THR  12   5.355  -1.221  -4.284
  106   3HG2  THR  12          3HG2      THR  12   3.938  -0.755  -5.223
  107    H    ILE  13           H        ILE  13   1.511  -1.663  -0.938
  108    HA   ILE  13           HA       ILE  13  -0.135  -4.059  -1.081
  109    HB   ILE  13           HB       ILE  13  -0.702  -3.992   1.383
  110   1HG1  ILE  13          1HG1      ILE  13   0.347  -1.995   2.317
  111   2HG1  ILE  13          2HG1      ILE  13   0.990  -3.394   3.125
  112   1HG2  ILE  13          1HG2      ILE  13   0.562  -5.764   0.154
  113   2HG2  ILE  13          2HG2      ILE  13   2.022  -5.139   0.926
  114   3HG2  ILE  13          3HG2      ILE  13   0.697  -5.760   1.911
  115   1HD1  ILE  13          1HD1      ILE  13   3.054  -2.898   1.444
  116   2HD1  ILE  13          2HD1      ILE  13   2.383  -1.270   1.554
  117   3HD1  ILE  13          3HD1      ILE  13   2.894  -2.118   3.017
  118    H    THR  14           H        THR  14  -2.293  -3.742  -1.116
  119    HA   THR  14           HA       THR  14  -3.334  -0.982  -1.120
  120    HB   THR  14           HB       THR  14  -5.423  -2.037  -2.169
  121    HG1  THR  14           HG1      THR  14  -5.387  -4.157  -2.173
  122   1HG2  THR  14          1HG2      THR  14  -3.446  -0.878  -3.393
  123   2HG2  THR  14          2HG2      THR  14  -3.118  -2.505  -3.994
  124   3HG2  THR  14          3HG2      THR  14  -4.681  -1.749  -4.303
  125    H    LEU  15           H        LEU  15  -5.122  -0.278   0.018
  126    HA   LEU  15           HA       LEU  15  -6.045  -1.920   2.281
  127   1HB   LEU  15          1HB       LEU  15  -5.354   0.944   2.021
  128   2HB   LEU  15          2HB       LEU  15  -6.863   0.662   2.860
  129    HG   LEU  15           HG       LEU  15  -4.945  -1.146   3.995
  130   1HD1  LEU  15          1HD1      LEU  15  -3.879   1.665   3.806
  131   2HD1  LEU  15          2HD1      LEU  15  -3.277   0.427   4.909
  132   3HD1  LEU  15          3HD1      LEU  15  -3.136   0.200   3.165
  133   1HD2  LEU  15          1HD2      LEU  15  -6.897  -0.131   5.138
  134   2HD2  LEU  15          2HD2      LEU  15  -5.400  -0.006   6.060
  135   3HD2  LEU  15          3HD2      LEU  15  -6.025   1.400   5.197
  136    H    GLU  16           H        GLU  16  -7.719  -3.040   1.630
  137    HA   GLU  16           HA       GLU  16  -9.996  -1.779   0.232
  138   1HB   GLU  16          1HB       GLU  16  -8.513  -4.306  -0.328
  139   2HB   GLU  16          2HB       GLU  16 -10.250  -4.324  -0.590
  140   1HG   GLU  16          1HG       GLU  16  -9.745  -2.129  -1.955
  141   2HG   GLU  16          2HG       GLU  16  -8.119  -2.802  -2.033
  142    H    VAL  17           H        VAL  17 -12.084  -2.303   0.798
  143    HA   VAL  17           HA       VAL  17 -12.625  -4.158   3.014
  144    HB   VAL  17           HB       VAL  17 -14.398  -2.521   3.948
  145   1HG1  VAL  17          1HG1      VAL  17 -12.277  -3.239   5.042
  146   2HG1  VAL  17          2HG1      VAL  17 -11.551  -1.736   4.473
  147   3HG1  VAL  17          3HG1      VAL  17 -12.921  -1.688   5.582
  148   1HG2  VAL  17          1HG2      VAL  17 -14.178  -0.725   2.153
  149   2HG2  VAL  17          2HG2      VAL  17 -14.104  -0.146   3.819
  150   3HG2  VAL  17          3HG2      VAL  17 -12.625  -0.305   2.873

  No H/Q in entry =         150
  Start of MODEL   11
    1    H1   MET   1           H1       MET   1 -13.991   1.018  -1.248
    2    H2   MET   1           H2       MET   1 -13.797   0.762   0.413
    3    H3   MET   1           H3       MET   1 -14.807   2.001  -0.141
    4    HA   MET   1           HA       MET   1 -12.950   3.187  -1.063
    5   1HB   MET   1          1HB       MET   1 -13.621   2.917   1.609
    6   2HB   MET   1          2HB       MET   1 -11.883   2.665   1.642
    7   1HG   MET   1          1HG       MET   1 -11.912   4.906   1.936
    8   2HG   MET   1          2HG       MET   1 -11.916   4.883   0.174
    9   1HE   MET   1          1HE       MET   1 -13.991   5.141   3.395
   10   2HE   MET   1          2HE       MET   1 -13.443   6.776   3.020
   11   3HE   MET   1          3HE       MET   1 -15.164   6.391   2.977
   12    H    GLN   2           H        GLN   2 -10.804   3.417  -1.624
   13    HA   GLN   2           HA       GLN   2  -8.892   1.227  -1.213
   14   1HB   GLN   2          1HB       GLN   2 -10.007   2.056  -3.788
   15   2HB   GLN   2          2HB       GLN   2  -8.258   2.212  -3.764
   16   1HG   GLN   2          1HG       GLN   2  -7.971  -0.100  -3.283
   17   2HG   GLN   2          2HG       GLN   2  -9.698  -0.315  -2.999
   18   2HE2  GLN   2          2HE2      GLN   2  -7.188   0.015  -5.436
   19   1HE2  GLN   2          1HE2      GLN   2  -8.178  -0.432  -6.780
   20    H    ILE   3           H        ILE   3  -6.944   1.803  -0.573
   21    HA   ILE   3           HA       ILE   3  -5.759   4.408  -1.056
   22    HB   ILE   3           HB       ILE   3  -5.065   4.647   1.452
   23   1HG1  ILE   3          1HG1      ILE   3  -7.669   3.865   2.550
   24   2HG1  ILE   3          2HG1      ILE   3  -6.893   2.459   1.843
   25   1HG2  ILE   3          1HG2      ILE   3  -6.344   6.283   0.212
   26   2HG2  ILE   3          2HG2      ILE   3  -7.839   5.408   0.544
   27   3HG2  ILE   3          3HG2      ILE   3  -6.947   6.165   1.865
   28   1HD1  ILE   3          1HD1      ILE   3  -5.296   4.157   3.682
   29   2HD1  ILE   3          2HD1      ILE   3  -6.553   3.120   4.356
   30   3HD1  ILE   3          3HD1      ILE   3  -5.243   2.415   3.409
   31    H    PHE   4           H        PHE   4  -3.728   4.326  -1.514
   32    HA   PHE   4           HA       PHE   4  -2.183   1.844  -1.223
   33   1HB   PHE   4          1HB       PHE   4  -2.221   4.135  -3.152
   34   2HB   PHE   4          2HB       PHE   4  -0.701   3.295  -2.933
   35    HD1  PHE   4           HD1      PHE   4  -4.389   2.800  -4.120
   36    HD2  PHE   4           HD2      PHE   4  -0.180   1.182  -4.081
   37    HE1  PHE   4           HE1      PHE   4  -5.026   1.098  -5.955
   38    HE2  PHE   4           HE2      PHE   4  -0.832  -0.526  -5.919
   39    HZ   PHE   4           HZ       PHE   4  -3.250  -0.566  -6.864
   40    H    VAL   5           H        VAL   5  -0.119   1.702  -0.398
   41    HA   VAL   5           HA       VAL   5   1.246   4.009   0.797
   42    HB   VAL   5           HB       VAL   5   1.572   1.688   2.624
   43   1HG1  VAL   5          1HG1      VAL   5   2.470   3.961   3.016
   44   2HG1  VAL   5          2HG1      VAL   5   0.823   4.530   3.293
   45   3HG1  VAL   5          3HG1      VAL   5   1.534   3.328   4.369
   46   1HG2  VAL   5          1HG2      VAL   5  -0.938   1.502   2.256
   47   2HG2  VAL   5          2HG2      VAL   5  -0.422   1.752   3.923
   48   3HG2  VAL   5          3HG2      VAL   5  -1.080   3.099   2.991
   49    H    LYS   6           H        LYS   6   3.385   4.035   0.490
   50    HA   LYS   6           HA       LYS   6   4.841   1.630  -0.411
   51   1HB   LYS   6          1HB       LYS   6   4.103   3.642  -2.122
   52   2HB   LYS   6          2HB       LYS   6   5.700   4.188  -1.638
   53   1HG   LYS   6          1HG       LYS   6   6.753   2.299  -2.551
   54   2HG   LYS   6          2HG       LYS   6   5.245   1.392  -2.650
   55   1HD   LYS   6          1HD       LYS   6   4.544   2.485  -4.559
   56   2HD   LYS   6          2HD       LYS   6   5.504   3.927  -4.229
   57   1HE   LYS   6          1HE       LYS   6   7.510   2.852  -4.914
   58   2HE   LYS   6          2HE       LYS   6   6.730   1.271  -4.951
   59   1HZ   LYS   6          1HZ       LYS   6   5.964   3.521  -6.730
   60   2HZ   LYS   6          2HZ       LYS   6   7.070   2.317  -7.167
   61   3HZ   LYS   6          3HZ       LYS   6   5.461   1.909  -6.839
   62    H    THR   7           H        THR   7   6.975   1.394   0.128
   63    HA   THR   7           HA       THR   7   8.304   3.316   1.948
   64    HB   THR   7           HB       THR   7   9.400   1.227   3.027
   65    HG1  THR   7           HG1      THR   7   8.710  -0.615   2.336
   66   1HG2  THR   7          1HG2      THR   7   6.610   2.174   3.553
   67   2HG2  THR   7          2HG2      THR   7   7.283   0.846   4.499
   68   3HG2  THR   7          3HG2      THR   7   8.075   2.423   4.503
   69    H    LEU   8           H        LEU   8  10.543   3.539   1.816
   70    HA   LEU   8           HA       LEU   8  11.844   3.346  -0.680
   71   1HB   LEU   8          1HB       LEU   8  12.344   4.506   1.874
   72   2HB   LEU   8          2HB       LEU   8  13.790   3.634   1.418
   73    HG   LEU   8           HG       LEU   8  13.062   5.104  -0.902
   74   1HD1  LEU   8          1HD1      LEU   8  12.825   6.840   1.553
   75   2HD1  LEU   8          2HD1      LEU   8  13.051   7.444  -0.088
   76   3HD1  LEU   8          3HD1      LEU   8  11.591   6.547   0.327
   77   1HD2  LEU   8          1HD2      LEU   8  15.351   4.608  -0.166
   78   2HD2  LEU   8          2HD2      LEU   8  15.130   6.315  -0.551
   79   3HD2  LEU   8          3HD2      LEU   8  15.181   5.791   1.133
   80    H    ASP   9           H        ASP   9  11.636   0.863   1.742
   81    HA   ASP   9           HA       ASP   9  14.030  -0.651   1.204
   82   1HB   ASP   9          1HB       ASP   9  12.136  -0.664   3.234
   83   2HB   ASP   9          2HB       ASP   9  11.863  -2.197   2.415
   84    H    GLY  10           H        GLY  10  10.623  -0.908   0.080
   85   1HA   GLY  10          2HA       GLY  10  11.346  -3.007  -1.901
   86   2HA   GLY  10          1HA       GLY  10  10.335  -1.631  -2.304
   87    H    LYS  11           H        LYS  11   8.468  -1.386  -0.461
   88    HA   LYS  11           HA       LYS  11   6.878  -3.872  -0.503
   89   1HB   LYS  11          1HB       LYS  11   7.948  -2.589   1.839
   90   2HB   LYS  11          2HB       LYS  11   6.204  -2.423   1.877
   91   1HG   LYS  11          1HG       LYS  11   5.876  -4.576   2.404
   92   2HG   LYS  11          2HG       LYS  11   7.057  -5.152   1.237
   93   1HD   LYS  11          1HD       LYS  11   8.359  -5.714   2.985
   94   2HD   LYS  11          2HD       LYS  11   8.643  -3.995   3.234
   95   1HE   LYS  11          1HE       LYS  11   7.965  -4.670   5.339
   96   2HE   LYS  11          2HE       LYS  11   6.442  -4.121   4.648
   97   1HZ   LYS  11          1HZ       LYS  11   7.337  -6.956   4.705
   98   2HZ   LYS  11          2HZ       LYS  11   6.265  -6.267   5.818
   99   3HZ   LYS  11          3HZ       LYS  11   5.830  -6.384   4.187
  100    H    THR  12           H        THR  12   4.659  -3.674  -0.735
  101    HA   THR  12           HA       THR  12   3.339  -1.060  -0.894
  102    HB   THR  12           HB       THR  12   2.078  -1.887  -3.011
  103    HG1  THR  12           HG1      THR  12   2.813  -3.908  -3.374
  104   1HG2  THR  12          1HG2      THR  12   4.885  -0.816  -3.040
  105   2HG2  THR  12          2HG2      THR  12   3.970  -1.043  -4.531
  106   3HG2  THR  12          3HG2      THR  12   3.366   0.048  -3.284
  107    H    ILE  13           H        ILE  13   1.465  -1.024   0.141
  108    HA   ILE  13           HA       ILE  13  -0.139  -3.443   0.551
  109    HB   ILE  13           HB       ILE  13   1.430  -3.104   2.503
  110   1HG1  ILE  13          1HG1      ILE  13  -0.980  -3.049   4.105
  111   2HG1  ILE  13          2HG1      ILE  13  -1.323  -3.874   2.597
  112   1HG2  ILE  13          1HG2      ILE  13   1.518  -0.735   2.854
  113   2HG2  ILE  13          2HG2      ILE  13  -0.190  -0.685   3.290
  114   3HG2  ILE  13          3HG2      ILE  13   0.959  -1.528   4.330
  115   1HD1  ILE  13          1HD1      ILE  13   0.942  -4.581   4.447
  116   2HD1  ILE  13          2HD1      ILE  13  -0.631  -5.380   4.425
  117   3HD1  ILE  13          3HD1      ILE  13   0.425  -5.473   3.016
  118    H    THR  14           H        THR  14  -2.237  -3.239   0.153
  119    HA   THR  14           HA       THR  14  -3.538  -0.587  -0.093
  120    HB   THR  14           HB       THR  14  -5.175  -1.861  -1.677
  121    HG1  THR  14           HG1      THR  14  -2.877  -3.539  -1.873
  122   1HG2  THR  14          1HG2      THR  14  -3.379  -0.093  -2.248
  123   2HG2  THR  14          2HG2      THR  14  -2.517  -1.464  -2.953
  124   3HG2  THR  14          3HG2      THR  14  -4.131  -1.044  -3.529
  125    H    LEU  15           H        LEU  15  -5.655  -0.261   0.570
  126    HA   LEU  15           HA       LEU  15  -6.830  -2.261   2.392
  127   1HB   LEU  15          1HB       LEU  15  -6.214   0.451   2.851
  128   2HB   LEU  15          2HB       LEU  15  -7.950   0.430   2.636
  129    HG   LEU  15           HG       LEU  15  -7.317  -1.721   4.431
  130   1HD1  LEU  15          1HD1      LEU  15  -5.193  -0.616   4.899
  131   2HD1  LEU  15          2HD1      LEU  15  -6.050   0.868   5.312
  132   3HD1  LEU  15          3HD1      LEU  15  -6.265  -0.577   6.299
  133   1HD2  LEU  15          1HD2      LEU  15  -8.631   0.949   4.930
  134   2HD2  LEU  15          2HD2      LEU  15  -9.428  -0.556   4.470
  135   3HD2  LEU  15          3HD2      LEU  15  -8.653  -0.415   6.048
  136    H    GLU  16           H        GLU  16  -8.295  -3.440   1.422
  137    HA   GLU  16           HA       GLU  16 -10.263  -2.287  -0.455
  138   1HB   GLU  16          1HB       GLU  16  -8.416  -4.599  -0.816
  139   2HB   GLU  16          2HB       GLU  16 -10.043  -4.783  -1.457
  140   1HG   GLU  16          1HG       GLU  16  -9.674  -2.616  -2.698
  141   2HG   GLU  16          2HG       GLU  16  -7.986  -2.709  -2.201
  142    H    VAL  17           H        VAL  17 -12.356  -3.032  -0.433
  143    HA   VAL  17           HA       VAL  17 -13.238  -4.605   1.888
  144    HB   VAL  17           HB       VAL  17 -15.619  -3.788   1.283
  145   1HG1  VAL  17          1HG1      VAL  17 -14.205  -3.043   3.193
  146   2HG1  VAL  17          2HG1      VAL  17 -13.743  -1.645   2.224
  147   3HG1  VAL  17          3HG1      VAL  17 -15.432  -1.891   2.667
  148   1HG2  VAL  17          1HG2      VAL  17 -15.010  -2.759  -0.993
  149   2HG2  VAL  17          2HG2      VAL  17 -16.001  -1.771   0.078
  150   3HG2  VAL  17          3HG2      VAL  17 -14.275  -1.440  -0.084

  No H/Q in entry =         150
  Start of MODEL   12
    1    H1   MET   1           H1       MET   1 -13.462   0.125   0.065
    2    H2   MET   1           H2       MET   1 -14.644   1.294  -0.243
    3    H3   MET   1           H3       MET   1 -13.897   0.490  -1.530
    4    HA   MET   1           HA       MET   1 -12.869   2.524  -1.529
    5   1HB   MET   1          1HB       MET   1 -11.875   3.571   0.595
    6   2HB   MET   1          2HB       MET   1 -13.616   3.617   0.437
    7   1HG   MET   1          1HG       MET   1 -13.681   1.655   2.075
    8   2HG   MET   1          2HG       MET   1 -11.961   1.936   2.336
    9   1HE   MET   1          1HE       MET   1 -15.513   3.445   2.444
   10   2HE   MET   1          2HE       MET   1 -15.284   2.549   3.946
   11   3HE   MET   1          3HE       MET   1 -15.480   4.302   3.986
   12    H    GLN   2           H        GLN   2 -10.802   2.804  -2.146
   13    HA   GLN   2           HA       GLN   2  -8.722   0.926  -1.250
   14   1HB   GLN   2          1HB       GLN   2  -9.558   1.543  -4.058
   15   2HB   GLN   2          2HB       GLN   2  -7.843   1.301  -3.745
   16   1HG   GLN   2          1HG       GLN   2  -8.143  -0.917  -3.101
   17   2HG   GLN   2          2HG       GLN   2  -9.871  -0.706  -2.829
   18   2HE2  GLN   2          2HE2      GLN   2  -7.370  -1.277  -5.228
   19   1HE2  GLN   2          1HE2      GLN   2  -8.444  -1.669  -6.523
   20    H    ILE   3           H        ILE   3  -6.885   1.741  -0.605
   21    HA   ILE   3           HA       ILE   3  -5.884   4.356  -1.384
   22    HB   ILE   3           HB       ILE   3  -5.302   4.903   1.116
   23   1HG1  ILE   3          2HG1      ILE   3  -7.878   4.111   2.226
   24   2HG1  ILE   3          1HG1      ILE   3  -7.066   2.669   1.641
   25   1HG2  ILE   3          1HG2      ILE   3  -6.742   6.180  -0.488
   26   2HG2  ILE   3          2HG2      ILE   3  -8.140   5.407   0.261
   27   3HG2  ILE   3          3HG2      ILE   3  -7.088   6.446   1.221
   28   1HD1  ILE   3          1HD1      ILE   3  -5.613   4.585   3.406
   29   2HD1  ILE   3          2HD1      ILE   3  -6.758   3.426   4.082
   30   3HD1  ILE   3          3HD1      ILE   3  -5.359   2.854   3.173
   31    H    PHE   4           H        PHE   4  -3.865   4.288  -1.884
   32    HA   PHE   4           HA       PHE   4  -2.187   1.993  -1.173
   33   1HB   PHE   4          1HB       PHE   4  -2.495   3.737  -3.542
   34   2HB   PHE   4          2HB       PHE   4  -0.834   3.329  -3.164
   35    HD1  PHE   4           HD1      PHE   4  -4.257   1.849  -4.245
   36    HD2  PHE   4           HD2      PHE   4   0.146   1.066  -3.645
   37    HE1  PHE   4           HE1      PHE   4  -4.465  -0.356  -5.569
   38    HE2  PHE   4           HE2      PHE   4  -0.076  -1.138  -4.985
   39    HZ   PHE   4           HZ       PHE   4  -2.376  -1.851  -5.949
   40    H    VAL   5           H        VAL   5  -0.169   2.075  -0.347
   41    HA   VAL   5           HA       VAL   5   1.239   4.534   0.283
   42    HB   VAL   5           HB       VAL   5   1.738   3.699   2.718
   43   1HG1  VAL   5          1HG1      VAL   5   0.640   5.789   2.177
   44   2HG1  VAL   5          2HG1      VAL   5  -0.919   4.969   2.107
   45   3HG1  VAL   5          3HG1      VAL   5  -0.043   5.067   3.634
   46   1HG2  VAL   5          1HG2      VAL   5   0.414   1.542   2.610
   47   2HG2  VAL   5          2HG2      VAL   5   0.034   2.580   3.984
   48   3HG2  VAL   5          3HG2      VAL   5  -1.055   2.521   2.600
   49    H    LYS   6           H        LYS   6   3.352   4.393  -0.019
   50    HA   LYS   6           HA       LYS   6   4.611   1.762  -0.457
   51   1HB   LYS   6          1HB       LYS   6   4.380   3.901  -2.190
   52   2HB   LYS   6          2HB       LYS   6   6.003   4.115  -1.556
   53   1HG   LYS   6          1HG       LYS   6   6.730   2.044  -2.403
   54   2HG   LYS   6          2HG       LYS   6   5.085   1.478  -2.666
   55   1HD   LYS   6          1HD       LYS   6   5.121   2.224  -4.769
   56   2HD   LYS   6          2HD       LYS   6   5.427   3.869  -4.222
   57   1HE   LYS   6          1HE       LYS   6   7.817   3.482  -4.276
   58   2HE   LYS   6          2HE       LYS   6   7.567   1.779  -4.661
   59   1HZ   LYS   6          1HZ       LYS   6   6.764   4.059  -6.389
   60   2HZ   LYS   6          2HZ       LYS   6   8.132   3.093  -6.623
   61   3HZ   LYS   6          3HZ       LYS   6   6.588   2.418  -6.762
   62    H    THR   7           H        THR   7   6.618   1.222   0.293
   63    HA   THR   7           HA       THR   7   7.851   2.828   2.460
   64    HB   THR   7           HB       THR   7   8.849   0.525   3.165
   65    HG1  THR   7           HG1      THR   7   6.601  -0.355   1.660
   66   1HG2  THR   7          1HG2      THR   7   6.042   1.439   3.649
   67   2HG2  THR   7          2HG2      THR   7   6.605  -0.080   4.348
   68   3HG2  THR   7          3HG2      THR   7   7.424   1.431   4.745
   69    H    LEU   8           H        LEU   8  10.097   3.022   2.628
   70    HA   LEU   8           HA       LEU   8  11.673   3.307   0.293
   71   1HB   LEU   8          1HB       LEU   8  11.916   3.857   3.115
   72   2HB   LEU   8          2HB       LEU   8  13.427   3.207   2.523
   73    HG   LEU   8           HG       LEU   8  12.635   5.187   0.621
   74   1HD1  LEU   8          1HD1      LEU   8  11.111   6.127   2.279
   75   2HD1  LEU   8          2HD1      LEU   8  12.443   6.277   3.426
   76   3HD1  LEU   8          3HD1      LEU   8  12.452   7.221   1.937
   77   1HD2  LEU   8          1HD2      LEU   8  14.752   5.321   2.767
   78   2HD2  LEU   8          2HD2      LEU   8  14.940   4.642   1.150
   79   3HD2  LEU   8          3HD2      LEU   8  14.651   6.370   1.352
   80    H    ASP   9           H        ASP   9  11.199   0.431   2.183
   81    HA   ASP   9           HA       ASP   9  13.635  -1.022   1.693
   82   1HB   ASP   9          1HB       ASP   9  10.929  -1.812   2.760
   83   2HB   ASP   9          2HB       ASP   9  12.155  -3.029   2.425
   84    H    GLY  10           H        GLY  10  10.476  -0.891   0.011
   85   1HA   GLY  10          2HA       GLY  10  11.528  -2.486  -2.262
   86   2HA   GLY  10          1HA       GLY  10  10.394  -1.159  -2.417
   87    H    LYS  11           H        LYS  11   8.411  -1.665  -0.633
   88    HA   LYS  11           HA       LYS  11   7.018  -3.967  -1.754
   89   1HB   LYS  11          1HB       LYS  11   6.079  -4.677   0.527
   90   2HB   LYS  11          2HB       LYS  11   7.715  -5.165   0.159
   91   1HG   LYS  11          1HG       LYS  11   8.147  -2.877   1.624
   92   2HG   LYS  11          2HG       LYS  11   6.655  -3.474   2.347
   93   1HD   LYS  11          1HD       LYS  11   7.964  -5.757   2.424
   94   2HD   LYS  11          2HD       LYS  11   9.382  -4.721   2.285
   95   1HE   LYS  11          1HE       LYS  11   9.223  -4.827   4.554
   96   2HE   LYS  11          2HE       LYS  11   8.183  -3.432   4.278
   97   1HZ   LYS  11          1HZ       LYS  11   6.268  -4.960   4.311
   98   2HZ   LYS  11          2HZ       LYS  11   7.305  -6.241   4.692
   99   3HZ   LYS  11          3HZ       LYS  11   7.117  -4.954   5.775
  100    H    THR  12           H        THR  12   4.903  -3.689  -2.174
  101    HA   THR  12           HA       THR  12   3.632  -1.105  -1.507
  102    HB   THR  12           HB       THR  12   1.974  -1.764  -3.382
  103    HG1  THR  12           HG1      THR  12   2.364  -3.555  -4.413
  104   1HG2  THR  12          1HG2      THR  12   3.793  -0.003  -3.518
  105   2HG2  THR  12          2HG2      THR  12   4.778  -1.213  -4.340
  106   3HG2  THR  12          3HG2      THR  12   3.256  -0.682  -5.054
  107    H    ILE  13           H        ILE  13   1.765  -0.888  -0.426
  108    HA   ILE  13           HA       ILE  13   0.111  -3.194   0.310
  109    HB   ILE  13           HB       ILE  13   1.824  -2.874   2.112
  110   1HG1  ILE  13          2HG1      ILE  13  -0.387  -2.385   3.915
  111   2HG1  ILE  13          1HG1      ILE  13  -0.982  -3.280   2.527
  112   1HG2  ILE  13          1HG2      ILE  13   2.191  -0.498   2.213
  113   2HG2  ILE  13          2HG2      ILE  13   0.556  -0.231   2.827
  114   3HG2  ILE  13          3HG2      ILE  13   1.734  -1.107   3.804
  115   1HD1  ILE  13          1HD1      ILE  13   1.356  -4.117   4.232
  116   2HD1  ILE  13          2HD1      ILE  13  -0.294  -4.721   4.402
  117   3HD1  ILE  13          3HD1      ILE  13   0.616  -5.046   2.927
  118    H    THR  14           H        THR  14  -2.040  -2.895   0.248
  119    HA   THR  14           HA       THR  14  -3.280  -0.244   0.271
  120    HB   THR  14           HB       THR  14  -3.036  -0.549  -2.120
  121    HG1  THR  14           HG1      THR  14  -4.958   0.162  -2.517
  122   1HG2  THR  14          1HG2      THR  14  -3.523  -3.329  -1.800
  123   2HG2  THR  14          2HG2      THR  14  -4.835  -2.693  -2.793
  124   3HG2  THR  14          3HG2      THR  14  -3.157  -2.454  -3.288
  125    H    LEU  15           H        LEU  15  -5.481  -0.101   0.851
  126    HA   LEU  15           HA       LEU  15  -6.529  -2.326   2.469
  127   1HB   LEU  15          1HB       LEU  15  -6.531   0.608   2.736
  128   2HB   LEU  15          2HB       LEU  15  -8.080  -0.127   3.086
  129    HG   LEU  15           HG       LEU  15  -6.058  -1.644   4.483
  130   1HD1  LEU  15          1HD1      LEU  15  -5.862   1.324   4.959
  131   2HD1  LEU  15          2HD1      LEU  15  -5.223   0.084   6.039
  132   3HD1  LEU  15          3HD1      LEU  15  -4.583   0.243   4.403
  133   1HD2  LEU  15          1HD2      LEU  15  -8.400  -1.474   5.165
  134   2HD2  LEU  15          2HD2      LEU  15  -7.310  -1.015   6.474
  135   3HD2  LEU  15          3HD2      LEU  15  -8.165   0.228   5.560
  136    H    GLU  16           H        GLU  16  -8.335  -3.395   1.989
  137    HA   GLU  16           HA       GLU  16 -10.277  -2.413  -0.007
  138   1HB   GLU  16          1HB       GLU  16  -8.678  -4.948  -0.127
  139   2HB   GLU  16          2HB       GLU  16 -10.333  -4.983  -0.717
  140   1HG   GLU  16          1HG       GLU  16  -9.718  -3.019  -2.195
  141   2HG   GLU  16          2HG       GLU  16  -8.041  -3.310  -1.738
  142    H    VAL  17           H        VAL  17 -12.406  -2.983   0.237
  143    HA   VAL  17           HA       VAL  17 -13.255  -4.717   2.457
  144    HB   VAL  17           HB       VAL  17 -15.217  -3.106   2.955
  145   1HG1  VAL  17          1HG1      VAL  17 -13.276  -3.650   4.433
  146   2HG1  VAL  17          2HG1      VAL  17 -12.541  -2.138   3.898
  147   3HG1  VAL  17          3HG1      VAL  17 -14.081  -2.114   4.756
  148   1HG2  VAL  17          1HG2      VAL  17 -14.714  -1.427   1.081
  149   2HG2  VAL  17          2HG2      VAL  17 -15.024  -0.748   2.680
  150   3HG2  VAL  17          3HG2      VAL  17 -13.372  -0.868   2.078

  No H/Q in entry =         150
  Start of MODEL   13
    1    H1   MET   1           H1       MET   1 -13.651   0.224  -0.197
    2    H2   MET   1           H2       MET   1 -14.701   1.481  -0.625
    3    H3   MET   1           H3       MET   1 -13.819   0.672  -1.821
    4    HA   MET   1           HA       MET   1 -12.845   2.813  -1.391
    5   1HB   MET   1          1HB       MET   1 -13.686   2.342   1.188
    6   2HB   MET   1          2HB       MET   1 -11.950   2.098   1.341
    7   1HG   MET   1          1HG       MET   1 -11.466   4.303   0.888
    8   2HG   MET   1          2HG       MET   1 -12.963   4.563  -0.008
    9   1HE   MET   1          1HE       MET   1 -15.331   4.651   1.138
   10   2HE   MET   1          2HE       MET   1 -15.455   5.771   2.497
   11   3HE   MET   1          3HE       MET   1 -14.622   6.264   1.022
   12    H    GLN   2           H        GLN   2 -10.701   3.144  -1.841
   13    HA   GLN   2           HA       GLN   2  -8.723   1.006  -1.453
   14   1HB   GLN   2          1HB       GLN   2  -9.516   2.233  -4.076
   15   2HB   GLN   2          2HB       GLN   2  -7.823   1.825  -3.823
   16   1HG   GLN   2          1HG       GLN   2  -8.331  -0.476  -3.524
   17   2HG   GLN   2          2HG       GLN   2 -10.062  -0.152  -3.450
   18   2HE2  GLN   2          2HE2      GLN   2  -7.277  -0.519  -5.563
   19   1HE2  GLN   2          1HE2      GLN   2  -8.173  -0.570  -7.038
   20    H    ILE   3           H        ILE   3  -6.871   1.625  -0.636
   21    HA   ILE   3           HA       ILE   3  -5.737   4.280  -0.916
   22    HB   ILE   3           HB       ILE   3  -5.226   4.399   1.652
   23   1HG1  ILE   3          1HG1      ILE   3  -7.866   3.552   2.554
   24   2HG1  ILE   3          2HG1      ILE   3  -7.092   2.188   1.768
   25   1HG2  ILE   3          1HG2      ILE   3  -6.524   6.006   0.282
   26   2HG2  ILE   3          2HG2      ILE   3  -7.997   5.155   0.748
   27   3HG2  ILE   3          3HG2      ILE   3  -7.010   5.948   1.977
   28   1HD1  ILE   3          1HD1      ILE   3  -5.603   3.729   3.839
   29   2HD1  ILE   3          2HD1      ILE   3  -6.835   2.559   4.314
   30   3HD1  ILE   3          3HD1      ILE   3  -5.445   2.039   3.360
   31    H    PHE   4           H        PHE   4  -3.720   4.158  -1.405
   32    HA   PHE   4           HA       PHE   4  -2.159   1.710  -0.947
   33   1HB   PHE   4          1HB       PHE   4  -2.370   3.707  -3.127
   34   2HB   PHE   4          2HB       PHE   4  -0.740   3.153  -2.802
   35    HD1  PHE   4           HD1      PHE   4  -4.242   2.050  -4.043
   36    HD2  PHE   4           HD2      PHE   4   0.080   0.875  -3.500
   37    HE1  PHE   4           HE1      PHE   4  -4.594   0.020  -5.597
   38    HE2  PHE   4           HE2      PHE   4  -0.285  -1.149  -5.071
   39    HZ   PHE   4           HZ       PHE   4  -2.618  -1.581  -6.121
   40    H    VAL   5           H        VAL   5  -0.099   1.647  -0.150
   41    HA   VAL   5           HA       VAL   5   1.284   4.044   0.794
   42    HB   VAL   5           HB       VAL   5   1.926   2.854   3.014
   43   1HG1  VAL   5          1HG1      VAL   5   0.501   4.893   2.716
   44   2HG1  VAL   5          2HG1      VAL   5  -0.903   3.843   2.908
   45   3HG1  VAL   5          3HG1      VAL   5   0.269   3.997   4.217
   46   1HG2  VAL   5          1HG2      VAL   5  -0.684   1.352   2.589
   47   2HG2  VAL   5          2HG2      VAL   5   0.918   0.633   2.753
   48   3HG2  VAL   5          3HG2      VAL   5   0.181   1.474   4.120
   49    H    LYS   6           H        LYS   6   3.411   4.069   0.492
   50    HA   LYS   6           HA       LYS   6   4.851   1.601  -0.264
   51   1HB   LYS   6          1HB       LYS   6   4.196   3.613  -2.004
   52   2HB   LYS   6          2HB       LYS   6   5.792   4.131  -1.487
   53   1HG   LYS   6          1HG       LYS   6   6.798   2.131  -2.300
   54   2HG   LYS   6          2HG       LYS   6   5.228   1.377  -2.577
   55   1HD   LYS   6          1HD       LYS   6   4.830   2.562  -4.504
   56   2HD   LYS   6          2HD       LYS   6   5.805   3.944  -4.002
   57   1HE   LYS   6          1HE       LYS   6   7.831   2.801  -4.515
   58   2HE   LYS   6          2HE       LYS   6   6.985   1.270  -4.742
   59   1HZ   LYS   6          1HZ       LYS   6   5.822   2.313  -6.645
   60   2HZ   LYS   6          2HZ       LYS   6   6.808   3.677  -6.469
   61   3HZ   LYS   6          3HZ       LYS   6   7.493   2.183  -6.869
   62    H    THR   7           H        THR   7   6.956   1.308   0.333
   63    HA   THR   7           HA       THR   7   8.236   3.162   2.267
   64    HB   THR   7           HB       THR   7   9.414   1.049   3.164
   65    HG1  THR   7           HG1      THR   7   8.792  -0.818   2.444
   66   1HG2  THR   7          1HG2      THR   7   6.561   1.757   3.709
   67   2HG2  THR   7          2HG2      THR   7   7.296   0.377   4.529
   68   3HG2  THR   7          3HG2      THR   7   7.988   1.991   4.719
   69    H    LEU   8           H        LEU   8  10.486   3.464   2.195
   70    HA   LEU   8           HA       LEU   8  11.819   3.536  -0.302
   71   1HB   LEU   8          1HB       LEU   8  12.157   4.714   2.160
   72   2HB   LEU   8          2HB       LEU   8  13.564   3.678   2.069
   73    HG   LEU   8           HG       LEU   8  13.462   5.008  -0.444
   74   1HD1  LEU   8          1HD1      LEU   8  12.963   6.960   1.801
   75   2HD1  LEU   8          2HD1      LEU   8  13.545   7.396   0.195
   76   3HD1  LEU   8          3HD1      LEU   8  11.946   6.678   0.388
   77   1HD2  LEU   8          1HD2      LEU   8  15.465   4.335   0.932
   78   2HD2  LEU   8          2HD2      LEU   8  15.570   5.905   0.136
   79   3HD2  LEU   8          3HD2      LEU   8  15.221   5.812   1.862
   80    H    ASP   9           H        ASP   9  11.669   0.890   1.949
   81    HA   ASP   9           HA       ASP   9  14.109  -0.521   1.337
   82   1HB   ASP   9          1HB       ASP   9  11.645  -1.166   2.923
   83   2HB   ASP   9          2HB       ASP   9  12.743  -2.469   2.486
   84    H    GLY  10           H        GLY  10  10.735  -0.755   0.126
   85   1HA   GLY  10          2HA       GLY  10  11.537  -2.709  -1.965
   86   2HA   GLY  10          1HA       GLY  10  10.482  -1.344  -2.283
   87    H    LYS  11           H        LYS  11   8.519  -1.288  -0.588
   88    HA   LYS  11           HA       LYS  11   7.063  -3.843  -0.823
   89   1HB   LYS  11          1HB       LYS  11   7.539  -2.299   1.701
   90   2HB   LYS  11          2HB       LYS  11   5.981  -3.075   1.490
   91   1HG   LYS  11          1HG       LYS  11   7.028  -5.233   1.311
   92   2HG   LYS  11          2HG       LYS  11   8.631  -4.492   1.355
   93   1HD   LYS  11          1HD       LYS  11   8.003  -3.545   3.611
   94   2HD   LYS  11          2HD       LYS  11   6.573  -4.572   3.558
   95   1HE   LYS  11          1HE       LYS  11   9.236  -5.846   3.116
   96   2HE   LYS  11          2HE       LYS  11   8.812  -5.330   4.745
   97   1HZ   LYS  11          1HZ       LYS  11   6.714  -6.632   4.473
   98   2HZ   LYS  11          2HZ       LYS  11   7.352  -7.267   3.041
   99   3HZ   LYS  11          3HZ       LYS  11   8.125  -7.566   4.515
  100    H    THR  12           H        THR  12   4.862  -3.727  -1.215
  101    HA   THR  12           HA       THR  12   3.450  -1.156  -1.331
  102    HB   THR  12           HB       THR  12   2.365  -1.936  -3.561
  103    HG1  THR  12           HG1      THR  12   3.186  -3.672  -4.415
  104   1HG2  THR  12          1HG2      THR  12   3.837   0.053  -3.323
  105   2HG2  THR  12          2HG2      THR  12   5.223  -0.971  -3.696
  106   3HG2  THR  12          3HG2      THR  12   3.960  -0.722  -4.902
  107    H    ILE  13           H        ILE  13   1.502  -1.216  -0.449
  108    HA   ILE  13           HA       ILE  13  -0.187  -3.589  -0.383
  109    HB   ILE  13           HB       ILE  13  -0.694  -3.330   2.081
  110   1HG1  ILE  13          1HG1      ILE  13   0.411  -1.285   2.834
  111   2HG1  ILE  13          2HG1      ILE  13   1.043  -2.631   3.733
  112   1HG2  ILE  13          1HG2      ILE  13   0.505  -5.212   0.959
  113   2HG2  ILE  13          2HG2      ILE  13   1.997  -4.557   1.632
  114   3HG2  ILE  13          3HG2      ILE  13   0.700  -5.075   2.707
  115   1HD1  ILE  13          1HD1      ILE  13   3.151  -2.393   2.225
  116   2HD1  ILE  13          2HD1      ILE  13   2.477  -0.830   1.764
  117   3HD1  ILE  13          3HD1      ILE  13   2.867  -1.156   3.452
  118    H    THR  14           H        THR  14  -2.354  -3.282  -0.274
  119    HA   THR  14           HA       THR  14  -3.469  -0.606   0.172
  120    HB   THR  14           HB       THR  14  -3.315  -0.646  -2.243
  121    HG1  THR  14           HG1      THR  14  -6.008  -1.023  -1.439
  122   1HG2  THR  14          1HG2      THR  14  -3.877  -3.402  -2.251
  123   2HG2  THR  14          2HG2      THR  14  -5.272  -2.642  -3.020
  124   3HG2  THR  14          3HG2      THR  14  -3.648  -2.354  -3.653
  125    H    LEU  15           H        LEU  15  -5.624  -0.421   0.859
  126    HA   LEU  15           HA       LEU  15  -6.791  -2.801   2.155
  127   1HB   LEU  15          1HB       LEU  15  -6.006  -0.451   3.323
  128   2HB   LEU  15          2HB       LEU  15  -7.705  -0.136   3.043
  129    HG   LEU  15           HG       LEU  15  -7.497  -2.758   4.230
  130   1HD1  LEU  15          1HD1      LEU  15  -5.276  -1.888   5.039
  131   2HD1  LEU  15          2HD1      LEU  15  -6.179  -0.699   5.977
  132   3HD1  LEU  15          3HD1      LEU  15  -6.403  -2.421   6.287
  133   1HD2  LEU  15          1HD2      LEU  15  -8.556  -0.152   5.317
  134   2HD2  LEU  15          2HD2      LEU  15  -9.465  -1.388   4.448
  135   3HD2  LEU  15          3HD2      LEU  15  -8.818  -1.733   6.052
  136    H    GLU  16           H        GLU  16  -8.763  -3.514   1.661
  137    HA   GLU  16           HA       GLU  16 -10.671  -1.920   0.072
  138   1HB   GLU  16          1HB       GLU  16  -9.451  -4.555  -0.664
  139   2HB   GLU  16          2HB       GLU  16 -11.134  -4.282  -1.087
  140   1HG   GLU  16          1HG       GLU  16 -10.257  -2.079  -2.145
  141   2HG   GLU  16          2HG       GLU  16  -8.682  -2.862  -2.073
  142    H    VAL  17           H        VAL  17 -12.836  -2.246   0.406
  143    HA   VAL  17           HA       VAL  17 -13.684  -4.054   2.588
  144    HB   VAL  17           HB       VAL  17 -15.682  -2.453   2.960
  145   1HG1  VAL  17          1HG1      VAL  17 -13.957  -2.799   4.595
  146   2HG1  VAL  17          2HG1      VAL  17 -12.931  -1.596   3.813
  147   3HG1  VAL  17          3HG1      VAL  17 -14.443  -1.104   4.575
  148   1HG2  VAL  17          1HG2      VAL  17 -15.282  -0.906   0.989
  149   2HG2  VAL  17          2HG2      VAL  17 -15.480  -0.092   2.541
  150   3HG2  VAL  17          3HG2      VAL  17 -13.870  -0.285   1.848

  No H/Q in entry =         150
  Start of MODEL   14
    1    H1   MET   1           H1       MET   1 -14.139   0.088  -2.029
    2    H2   MET   1           H2       MET   1 -14.027  -0.078  -0.348
    3    H3   MET   1           H3       MET   1 -15.145   0.999  -1.020
    4    HA   MET   1           HA       MET   1 -13.402   2.386  -1.870
    5   1HB   MET   1          1HB       MET   1 -14.209   2.132   0.749
    6   2HB   MET   1          2HB       MET   1 -12.465   2.064   0.920
    7   1HG   MET   1          1HG       MET   1 -12.265   4.259   0.648
    8   2HG   MET   1          2HG       MET   1 -13.273   4.264  -0.798
    9   1HE   MET   1          1HE       MET   1 -12.986   4.362   2.929
   10   2HE   MET   1          2HE       MET   1 -13.176   6.082   2.575
   11   3HE   MET   1          3HE       MET   1 -14.418   5.227   3.493
   12    H    GLN   2           H        GLN   2 -11.286   2.857  -2.347
   13    HA   GLN   2           HA       GLN   2  -9.160   0.904  -1.788
   14   1HB   GLN   2          1HB       GLN   2 -10.054   1.916  -4.455
   15   2HB   GLN   2          2HB       GLN   2  -8.323   1.756  -4.201
   16   1HG   GLN   2          1HG       GLN   2  -8.443  -0.552  -3.932
   17   2HG   GLN   2          2HG       GLN   2 -10.177  -0.520  -3.610
   18   2HE2  GLN   2          2HE2      GLN   2  -7.695  -0.494  -6.098
   19   1HE2  GLN   2          1HE2      GLN   2  -8.768  -0.747  -7.428
   20    H    ILE   3           H        ILE   3  -7.352   1.676  -0.994
   21    HA   ILE   3           HA       ILE   3  -6.372   4.373  -1.387
   22    HB   ILE   3           HB       ILE   3  -5.906   4.668   1.173
   23   1HG1  ILE   3          2HG1      ILE   3  -8.503   3.721   2.099
   24   2HG1  ILE   3          1HG1      ILE   3  -7.638   2.361   1.403
   25   1HG2  ILE   3          1HG2      ILE   3  -7.253   6.141  -0.264
   26   2HG2  ILE   3          2HG2      ILE   3  -8.691   5.209   0.157
   27   3HG2  ILE   3          3HG2      ILE   3  -7.821   6.101   1.405
   28   1HD1  ILE   3          1HD1      ILE   3  -6.237   4.097   3.371
   29   2HD1  ILE   3          2HD1      ILE   3  -7.439   2.935   3.933
   30   3HD1  ILE   3          3HD1      ILE   3  -6.030   2.380   3.027
   31    H    PHE   4           H        PHE   4  -4.355   4.321  -1.858
   32    HA   PHE   4           HA       PHE   4  -2.712   1.940  -1.477
   33   1HB   PHE   4          1HB       PHE   4  -2.809   4.223  -3.350
   34   2HB   PHE   4          2HB       PHE   4  -1.190   3.685  -2.964
   35    HD1  PHE   4           HD1      PHE   4  -4.549   2.579  -4.579
   36    HD2  PHE   4           HD2      PHE   4  -0.171   1.674  -3.991
   37    HE1  PHE   4           HE1      PHE   4  -4.660   0.816  -6.466
   38    HE2  PHE   4           HE2      PHE   4  -0.296  -0.099  -5.877
   39    HZ   PHE   4           HZ       PHE   4  -2.531  -0.522  -7.124
   40    H    VAL   5           H        VAL   5  -0.705   1.782  -0.553
   41    HA   VAL   5           HA       VAL   5   0.595   4.008   0.808
   42    HB   VAL   5           HB       VAL   5   1.011   2.579   2.937
   43   1HG1  VAL   5          1HG1      VAL   5  -0.294   4.670   2.809
   44   2HG1  VAL   5          2HG1      VAL   5  -1.757   3.704   2.615
   45   3HG1  VAL   5          3HG1      VAL   5  -0.807   3.580   4.096
   46   1HG2  VAL   5          1HG2      VAL   5  -0.165   0.456   2.102
   47   2HG2  VAL   5          2HG2      VAL   5  -0.583   0.996   3.728
   48   3HG2  VAL   5          3HG2      VAL   5  -1.685   1.307   2.387
   49    H    LYS   6           H        LYS   6   2.750   3.992   0.727
   50    HA   LYS   6           HA       LYS   6   4.183   1.596  -0.246
   51   1HB   LYS   6          1HB       LYS   6   3.838   3.922  -1.642
   52   2HB   LYS   6          2HB       LYS   6   5.371   4.245  -0.850
   53   1HG   LYS   6          1HG       LYS   6   6.419   2.406  -1.911
   54   2HG   LYS   6          2HG       LYS   6   4.878   1.745  -2.458
   55   1HD   LYS   6          1HD       LYS   6   4.693   3.218  -4.205
   56   2HD   LYS   6          2HD       LYS   6   5.598   4.493  -3.388
   57   1HE   LYS   6          1HE       LYS   6   7.671   3.479  -3.895
   58   2HE   LYS   6          2HE       LYS   6   6.902   1.963  -4.366
   59   1HZ   LYS   6          1HZ       LYS   6   5.863   3.204  -6.232
   60   2HZ   LYS   6          2HZ       LYS   6   6.805   4.548  -5.823
   61   3HZ   LYS   6          3HZ       LYS   6   7.549   3.114  -6.329
   62    H    THR   7           H        THR   7   6.196   1.074   0.513
   63    HA   THR   7           HA       THR   7   7.213   2.368   2.979
   64    HB   THR   7           HB       THR   7   8.369   0.062   3.344
   65    HG1  THR   7           HG1      THR   7   7.929  -1.352   1.861
   66   1HG2  THR   7          1HG2      THR   7   5.475   0.659   3.813
   67   2HG2  THR   7          2HG2      THR   7   6.138  -0.906   4.282
   68   3HG2  THR   7          3HG2      THR   7   6.806   0.575   4.969
   69    H    LEU   8           H        LEU   8   9.404   2.743   3.280
   70    HA   LEU   8           HA       LEU   8  11.032   3.437   1.042
   71   1HB   LEU   8          1HB       LEU   8  10.898   4.161   3.691
   72   2HB   LEU   8          2HB       LEU   8  12.399   3.261   3.649
   73    HG   LEU   8           HG       LEU   8  12.537   5.017   1.418
   74   1HD1  LEU   8          1HD1      LEU   8  11.498   6.481   3.842
   75   2HD1  LEU   8          2HD1      LEU   8  12.287   7.251   2.465
   76   3HD1  LEU   8          3HD1      LEU   8  10.758   6.401   2.242
   77   1HD2  LEU   8          1HD2      LEU   8  14.375   4.260   2.955
   78   2HD2  LEU   8          2HD2      LEU   8  14.426   5.961   2.491
   79   3HD2  LEU   8          3HD2      LEU   8  13.839   5.500   4.089
   80    H    ASP   9           H        ASP   9  10.767   0.390   2.655
   81    HA   ASP   9           HA       ASP   9  13.385  -0.745   2.332
   82   1HB   ASP   9          1HB       ASP   9  10.685  -1.871   3.018
   83   2HB   ASP   9          2HB       ASP   9  12.006  -2.966   2.629
   84    H    GLY  10           H        GLY  10  10.465  -0.754   0.264
   85   1HA   GLY  10          2HA       GLY  10  11.948  -2.019  -1.978
   86   2HA   GLY  10          1HA       GLY  10  10.729  -0.774  -2.171
   87    H    LYS  11           H        LYS  11   8.597  -1.620  -0.698
   88    HA   LYS  11           HA       LYS  11   7.557  -3.887  -2.206
   89   1HB   LYS  11          1HB       LYS  11   6.432  -4.916  -0.143
   90   2HB   LYS  11          2HB       LYS  11   8.139  -5.224  -0.346
   91   1HG   LYS  11          1HG       LYS  11   8.259  -3.133   1.383
   92   2HG   LYS  11          2HG       LYS  11   6.680  -3.784   1.820
   93   1HD   LYS  11          1HD       LYS  11   7.907  -6.055   1.966
   94   2HD   LYS  11          2HD       LYS  11   9.383  -5.090   1.988
   95   1HE   LYS  11          1HE       LYS  11   8.710  -3.976   3.991
   96   2HE   LYS  11          2HE       LYS  11   7.099  -4.687   3.910
   97   1HZ   LYS  11          1HZ       LYS  11   9.626  -6.191   4.335
   98   2HZ   LYS  11          2HZ       LYS  11   8.493  -5.812   5.534
   99   3HZ   LYS  11          3HZ       LYS  11   8.075  -6.863   4.276
  100    H    THR  12           H        THR  12   5.484  -3.725  -2.854
  101    HA   THR  12           HA       THR  12   3.830  -1.458  -1.898
  102    HB   THR  12           HB       THR  12   2.708  -1.602  -4.233
  103    HG1  THR  12           HG1      THR  12   3.549  -3.197  -5.366
  104   1HG2  THR  12          1HG2      THR  12   5.430  -0.424  -3.746
  105   2HG2  THR  12          2HG2      THR  12   4.581  -0.186  -5.273
  106   3HG2  THR  12          3HG2      THR  12   3.862   0.383  -3.767
  107    H    ILE  13           H        ILE  13   1.817  -1.770  -1.209
  108    HA   ILE  13           HA       ILE  13   0.189  -4.102  -1.797
  109    HB   ILE  13           HB       ILE  13  -0.380  -4.522   0.686
  110   1HG1  ILE  13          1HG1      ILE  13   2.317  -4.202   1.775
  111   2HG1  ILE  13          2HG1      ILE  13   1.743  -2.636   1.222
  112   1HG2  ILE  13          1HG2      ILE  13   2.198  -5.520  -0.495
  113   2HG2  ILE  13          2HG2      ILE  13   1.390  -6.242   0.899
  114   3HG2  ILE  13          3HG2      ILE  13   0.584  -6.210  -0.672
  115   1HD1  ILE  13          1HD1      ILE  13   0.228  -4.420   3.112
  116   2HD1  ILE  13          2HD1      ILE  13   1.289  -3.102   3.612
  117   3HD1  ILE  13          3HD1      ILE  13  -0.164  -2.757   2.672
  118    H    THR  14           H        THR  14  -1.989  -3.815  -1.676
  119    HA   THR  14           HA       THR  14  -3.023  -1.101  -1.357
  120    HB   THR  14           HB       THR  14  -5.247  -2.152  -2.098
  121    HG1  THR  14           HG1      THR  14  -5.041  -4.301  -1.919
  122   1HG2  THR  14          1HG2      THR  14  -2.880  -1.703  -3.782
  123   2HG2  THR  14          2HG2      THR  14  -4.198  -2.618  -4.515
  124   3HG2  THR  14          3HG2      THR  14  -4.507  -1.015  -3.856
  125    H    LEU  15           H        LEU  15  -4.573  -0.373   0.042
  126    HA   LEU  15           HA       LEU  15  -5.351  -2.063   2.322
  127   1HB   LEU  15          1HB       LEU  15  -3.901   0.311   2.416
  128   2HB   LEU  15          2HB       LEU  15  -5.531   0.850   2.753
  129    HG   LEU  15           HG       LEU  15  -4.969  -1.491   4.380
  130   1HD1  LEU  15          1HD1      LEU  15  -2.605  -0.817   4.108
  131   2HD1  LEU  15          2HD1      LEU  15  -3.002   0.746   4.823
  132   3HD1  LEU  15          3HD1      LEU  15  -3.178  -0.728   5.774
  133   1HD2  LEU  15          1HD2      LEU  15  -6.658   0.265   4.860
  134   2HD2  LEU  15          2HD2      LEU  15  -5.594  -0.083   6.223
  135   3HD2  LEU  15          3HD2      LEU  15  -5.344   1.371   5.259
  136    H    GLU  16           H        GLU  16  -7.288  -2.825   1.985
  137    HA   GLU  16           HA       GLU  16  -9.482  -1.147   0.938
  138   1HB   GLU  16          1HB       GLU  16  -8.527  -3.839   0.084
  139   2HB   GLU  16          2HB       GLU  16 -10.265  -3.584   0.095
  140   1HG   GLU  16          1HG       GLU  16  -9.638  -1.419  -1.265
  141   2HG   GLU  16          2HG       GLU  16  -8.163  -2.319  -1.610
  142    H    VAL  17           H        VAL  17 -11.532  -1.355   1.785
  143    HA   VAL  17           HA       VAL  17 -12.161  -3.287   3.886
  144    HB   VAL  17           HB       VAL  17 -13.254  -1.453   5.349
  145   1HG1  VAL  17          1HG1      VAL  17 -11.372  -2.823   6.039
  146   2HG1  VAL  17          2HG1      VAL  17 -10.256  -1.650   5.340
  147   3HG1  VAL  17          3HG1      VAL  17 -11.274  -1.193   6.705
  148   1HG2  VAL  17          1HG2      VAL  17 -11.223   0.380   4.021
  149   2HG2  VAL  17          2HG2      VAL  17 -12.975   0.572   3.988
  150   3HG2  VAL  17          3HG2      VAL  17 -12.101   0.738   5.509

  No H/Q in entry =         150
  Start of MODEL   15
    1    H1   MET   1           H1       MET   1 -14.221   1.245  -1.531
    2    H2   MET   1           H2       MET   1 -14.914   2.639  -2.196
    3    H3   MET   1           H3       MET   1 -13.991   1.605  -3.166
    4    HA   MET   1           HA       MET   1 -12.693   3.497  -2.679
    5   1HB   MET   1          1HB       MET   1 -12.076   4.099  -0.300
    6   2HB   MET   1          2HB       MET   1 -13.720   4.457  -0.761
    7   1HG   MET   1          1HG       MET   1 -13.159   1.944   0.784
    8   2HG   MET   1          2HG       MET   1 -13.141   3.494   1.620
    9   1HE   MET   1          1HE       MET   1 -15.086   5.162   1.602
   10   2HE   MET   1          2HE       MET   1 -16.705   4.545   1.940
   11   3HE   MET   1          3HE       MET   1 -15.350   4.072   2.965
   12    H    GLN   2           H        GLN   2 -10.472   3.460  -2.591
   13    HA   GLN   2           HA       GLN   2  -9.066   1.044  -1.689
   14   1HB   GLN   2          1HB       GLN   2  -9.135   2.161  -4.459
   15   2HB   GLN   2          2HB       GLN   2  -7.566   1.636  -3.867
   16   1HG   GLN   2          1HG       GLN   2  -8.174  -0.575  -3.793
   17   2HG   GLN   2          2HG       GLN   2  -9.889  -0.215  -3.601
   18   2HE2  GLN   2          2HE2      GLN   2  -7.259  -0.624  -5.900
   19   1HE2  GLN   2          1HE2      GLN   2  -8.255  -0.654  -7.311
   20    H    ILE   3           H        ILE   3  -7.316   1.399  -0.511
   21    HA   ILE   3           HA       ILE   3  -6.029   4.028  -0.487
   22    HB   ILE   3           HB       ILE   3  -7.706   3.724   1.388
   23   1HG1  ILE   3          1HG1      ILE   3  -5.491   4.411   3.090
   24   2HG1  ILE   3          2HG1      ILE   3  -5.126   4.965   1.465
   25   1HG2  ILE   3          1HG2      ILE   3  -5.861   1.632   2.460
   26   2HG2  ILE   3          2HG2      ILE   3  -6.825   2.628   3.553
   27   3HG2  ILE   3          3HG2      ILE   3  -7.620   1.637   2.330
   28   1HD1  ILE   3          1HD1      ILE   3  -7.821   5.598   2.519
   29   2HD1  ILE   3          2HD1      ILE   3  -6.445   6.445   3.230
   30   3HD1  ILE   3          3HD1      ILE   3  -6.743   6.548   1.494
   31    H    PHE   4           H        PHE   4  -3.991   3.982  -1.043
   32    HA   PHE   4           HA       PHE   4  -2.374   1.526  -0.878
   33   1HB   PHE   4          1HB       PHE   4  -2.695   3.652  -2.904
   34   2HB   PHE   4          2HB       PHE   4  -1.029   3.188  -2.624
   35    HD1  PHE   4           HD1      PHE   4  -4.448   1.974  -3.952
   36    HD2  PHE   4           HD2      PHE   4  -0.074   0.987  -3.445
   37    HE1  PHE   4           HE1      PHE   4  -4.685   0.034  -5.638
   38    HE2  PHE   4           HE2      PHE   4  -0.331  -0.964  -5.127
   39    HZ   PHE   4           HZ       PHE   4  -2.631  -1.439  -6.230
   40    H    VAL   5           H        VAL   5  -0.325   1.442  -0.085
   41    HA   VAL   5           HA       VAL   5   0.960   3.798   1.104
   42    HB   VAL   5           HB       VAL   5   1.738   2.357   3.119
   43   1HG1  VAL   5          1HG1      VAL   5   0.298   4.297   3.307
   44   2HG1  VAL   5          2HG1      VAL   5  -1.122   3.285   3.045
   45   3HG1  VAL   5          3HG1      VAL   5  -0.133   3.060   4.487
   46   1HG2  VAL   5          1HG2      VAL   5  -0.771   0.742   2.519
   47   2HG2  VAL   5          2HG2      VAL   5   0.881   0.126   2.564
   48   3HG2  VAL   5          3HG2      VAL   5   0.120   0.710   4.044
   49    H    LYS   6           H        LYS   6   3.084   4.007   0.823
   50    HA   LYS   6           HA       LYS   6   4.641   1.808  -0.389
   51   1HB   LYS   6          1HB       LYS   6   3.929   4.143  -1.628
   52   2HB   LYS   6          2HB       LYS   6   5.506   4.575  -0.987
   53   1HG   LYS   6          1HG       LYS   6   6.632   3.077  -2.330
   54   2HG   LYS   6          2HG       LYS   6   5.236   2.017  -2.510
   55   1HD   LYS   6          1HD       LYS   6   4.322   3.264  -4.217
   56   2HD   LYS   6          2HD       LYS   6   5.082   4.767  -3.687
   57   1HE   LYS   6          1HE       LYS   6   7.211   4.056  -4.542
   58   2HE   LYS   6          2HE       LYS   6   6.581   2.450  -4.906
   59   1HZ   LYS   6          1HZ       LYS   6   5.075   3.471  -6.523
   60   2HZ   LYS   6          2HZ       LYS   6   5.747   4.990  -6.200
   61   3HZ   LYS   6          3HZ       LYS   6   6.695   3.777  -6.900
   62    H    THR   7           H        THR   7   6.746   1.453   0.169
   63    HA   THR   7           HA       THR   7   7.943   2.875   2.479
   64    HB   THR   7           HB       THR   7   9.108   0.613   2.967
   65    HG1  THR   7           HG1      THR   7   6.885  -0.324   1.458
   66   1HG2  THR   7          1HG2      THR   7   6.273   1.289   3.624
   67   2HG2  THR   7          2HG2      THR   7   6.930  -0.265   4.140
   68   3HG2  THR   7          3HG2      THR   7   7.690   1.235   4.672
   69    H    LEU   8           H        LEU   8  10.169   3.215   2.532
   70    HA   LEU   8           HA       LEU   8  11.572   3.650   0.080
   71   1HB   LEU   8          1HB       LEU   8  11.786   4.473   2.784
   72   2HB   LEU   8          2HB       LEU   8  13.331   3.765   2.369
   73    HG   LEU   8           HG       LEU   8  12.727   5.476   0.192
   74   1HD1  LEU   8          1HD1      LEU   8  12.069   6.852   2.795
   75   2HD1  LEU   8          2HD1      LEU   8  12.428   7.688   1.282
   76   3HD1  LEU   8          3HD1      LEU   8  11.012   6.642   1.397
   77   1HD2  LEU   8          1HD2      LEU   8  14.955   5.043   1.163
   78   2HD2  LEU   8          2HD2      LEU   8  14.640   6.759   0.900
   79   3HD2  LEU   8          3HD2      LEU   8  14.539   6.083   2.525
   80    H    ASP   9           H        ASP   9  11.478   0.827   2.114
   81    HA   ASP   9           HA       ASP   9  14.029  -0.381   1.541
   82   1HB   ASP   9          1HB       ASP   9  11.544  -1.256   2.948
   83   2HB   ASP   9          2HB       ASP   9  12.650  -2.506   2.396
   84    H    GLY  10           H        GLY  10  10.755  -0.730   0.101
   85   1HA   GLY  10          2HA       GLY  10  11.810  -2.451  -2.083
   86   2HA   GLY  10          1HA       GLY  10  10.722  -1.107  -2.377
   87    H    LYS  11           H        LYS  11   8.697  -1.311  -0.651
   88    HA   LYS  11           HA       LYS  11   7.307  -3.819  -1.336
   89   1HB   LYS  11          1HB       LYS  11   7.651  -2.711   1.445
   90   2HB   LYS  11          2HB       LYS  11   6.202  -3.611   1.041
   91   1HG   LYS  11          1HG       LYS  11   7.237  -5.569   1.283
   92   2HG   LYS  11          2HG       LYS  11   8.534  -5.100   0.196
   93   1HD   LYS  11          1HD       LYS  11   9.938  -5.086   1.938
   94   2HD   LYS  11          2HD       LYS  11   9.067  -3.711   2.605
   95   1HE   LYS  11          1HE       LYS  11   7.473  -5.615   3.532
   96   2HE   LYS  11          2HE       LYS  11   8.918  -6.604   3.328
   97   1HZ   LYS  11          1HZ       LYS  11   8.749  -4.098   4.912
   98   2HZ   LYS  11          2HZ       LYS  11   8.781  -5.664   5.550
   99   3HZ   LYS  11          3HZ       LYS  11  10.131  -5.059   4.730
  100    H    THR  12           H        THR  12   5.118  -3.687  -1.727
  101    HA   THR  12           HA       THR  12   3.635  -1.172  -1.381
  102    HB   THR  12           HB       THR  12   2.579  -1.575  -3.724
  103    HG1  THR  12           HG1      THR  12   3.897  -2.593  -5.229
  104   1HG2  THR  12          1HG2      THR  12   4.125   0.333  -3.020
  105   2HG2  THR  12          2HG2      THR  12   5.412  -0.564  -3.827
  106   3HG2  THR  12          3HG2      THR  12   4.014  -0.010  -4.747
  107    H    ILE  13           H        ILE  13   1.673  -1.444  -0.556
  108    HA   ILE  13           HA       ILE  13   0.040  -3.827  -0.950
  109    HB   ILE  13           HB       ILE  13  -0.490  -4.065   1.552
  110   1HG1  ILE  13          1HG1      ILE  13   2.216  -3.488   2.563
  111   2HG1  ILE  13          2HG1      ILE  13   1.474  -2.019   1.953
  112   1HG2  ILE  13          1HG2      ILE  13   2.154  -5.045   0.491
  113   2HG2  ILE  13          2HG2      ILE  13   1.329  -5.699   1.906
  114   3HG2  ILE  13          3HG2      ILE  13   0.572  -5.810   0.315
  115   1HD1  ILE  13          1HD1      ILE  13   0.171  -3.830   3.971
  116   2HD1  ILE  13          2HD1      ILE  13   1.152  -2.423   4.389
  117   3HD1  ILE  13          3HD1      ILE  13  -0.349  -2.216   3.484
  118    H    THR  14           H        THR  14  -2.137  -3.591  -0.789
  119    HA   THR  14           HA       THR  14  -3.251  -1.003   0.042
  120    HB   THR  14           HB       THR  14  -3.219  -0.875  -2.379
  121    HG1  THR  14           HG1      THR  14  -5.224  -0.128  -2.602
  122   1HG2  THR  14          1HG2      THR  14  -3.328  -3.257  -3.081
  123   2HG2  THR  14          2HG2      THR  14  -5.027  -3.306  -2.604
  124   3HG2  THR  14          3HG2      THR  14  -4.512  -2.249  -3.920
  125    H    LEU  15           H        LEU  15  -5.304  -0.895   0.929
  126    HA   LEU  15           HA       LEU  15  -6.519  -3.398   1.911
  127   1HB   LEU  15          1HB       LEU  15  -5.210  -1.564   3.455
  128   2HB   LEU  15          2HB       LEU  15  -6.855  -0.976   3.570
  129    HG   LEU  15           HG       LEU  15  -6.925  -3.825   4.029
  130   1HD1  LEU  15          1HD1      LEU  15  -4.868  -2.413   5.719
  131   2HD1  LEU  15          2HD1      LEU  15  -5.573  -3.989   6.080
  132   3HD1  LEU  15          3HD1      LEU  15  -4.595  -3.771   4.628
  133   1HD2  LEU  15          1HD2      LEU  15  -8.510  -2.116   4.904
  134   2HD2  LEU  15          2HD2      LEU  15  -7.930  -3.249   6.124
  135   3HD2  LEU  15          3HD2      LEU  15  -7.269  -1.616   6.052
  136    H    GLU  16           H        GLU  16  -8.655  -3.700   1.720
  137    HA   GLU  16           HA       GLU  16 -10.449  -1.540   0.800
  138   1HB   GLU  16          1HB       GLU  16  -9.897  -4.184  -0.481
  139   2HB   GLU  16          2HB       GLU  16 -11.549  -3.589  -0.528
  140   1HG   GLU  16          1HG       GLU  16 -10.639  -1.462  -1.536
  141   2HG   GLU  16          2HG       GLU  16  -9.088  -2.284  -1.683
  142    H    VAL  17           H        VAL  17 -12.564  -1.542   1.490
  143    HA   VAL  17           HA       VAL  17 -13.300  -3.348   3.699
  144    HB   VAL  17           HB       VAL  17 -15.140  -1.614   4.256
  145   1HG1  VAL  17          1HG1      VAL  17 -13.070  -2.076   5.551
  146   2HG1  VAL  17          2HG1      VAL  17 -12.324  -0.699   4.740
  147   3HG1  VAL  17          3HG1      VAL  17 -13.739  -0.458   5.765
  148   1HG2  VAL  17          1HG2      VAL  17 -15.010  -0.127   2.268
  149   2HG2  VAL  17          2HG2      VAL  17 -14.732   0.754   3.769
  150   3HG2  VAL  17          3HG2      VAL  17 -13.369   0.333   2.731

  No H/Q in entry =         150
  Start of MODEL   16
    1    H1   MET   1           H1       MET   1 -13.909   0.652  -1.995
    2    H2   MET   1           H2       MET   1 -13.891   0.377  -0.325
    3    H3   MET   1           H3       MET   1 -14.862   1.601  -0.970
    4    HA   MET   1           HA       MET   1 -12.974   2.869  -1.634
    5   1HB   MET   1          1HB       MET   1 -13.854   2.470   0.943
    6   2HB   MET   1          2HB       MET   1 -12.128   2.202   1.127
    7   1HG   MET   1          1HG       MET   1 -11.612   4.378   0.803
    8   2HG   MET   1          2HG       MET   1 -12.921   4.644  -0.348
    9   1HE   MET   1          1HE       MET   1 -11.758   4.284   3.180
   10   2HE   MET   1          2HE       MET   1 -11.851   6.043   3.066
   11   3HE   MET   1          3HE       MET   1 -12.922   5.172   4.164
   12    H    GLN   2           H        GLN   2 -10.830   3.141  -2.102
   13    HA   GLN   2           HA       GLN   2  -8.901   0.967  -1.656
   14   1HB   GLN   2          1HB       GLN   2  -9.643   2.221  -4.278
   15   2HB   GLN   2          2HB       GLN   2  -7.956   1.794  -4.013
   16   1HG   GLN   2          1HG       GLN   2  -8.445  -0.491  -3.816
   17   2HG   GLN   2          2HG       GLN   2 -10.168  -0.193  -3.598
   18   2HE2  GLN   2          2HE2      GLN   2  -7.554  -0.472  -5.930
   19   1HE2  GLN   2          1HE2      GLN   2  -8.563  -0.500  -7.332
   20    H    ILE   3           H        ILE   3  -7.044   1.532  -0.812
   21    HA   ILE   3           HA       ILE   3  -5.844   4.163  -1.059
   22    HB   ILE   3           HB       ILE   3  -5.361   4.258   1.511
   23   1HG1  ILE   3          2HG1      ILE   3  -8.024   3.435   2.379
   24   2HG1  ILE   3          1HG1      ILE   3  -7.246   2.067   1.604
   25   1HG2  ILE   3          1HG2      ILE   3  -6.565   5.940   0.228
   26   2HG2  ILE   3          2HG2      ILE   3  -8.076   5.063   0.477
   27   3HG2  ILE   3          3HG2      ILE   3  -7.230   5.772   1.852
   28   1HD1  ILE   3          1HD1      ILE   3  -5.932   3.637   3.796
   29   2HD1  ILE   3          2HD1      ILE   3  -6.991   2.259   4.095
   30   3HD1  ILE   3          3HD1      ILE   3  -5.499   2.042   3.179
   31    H    PHE   4           H        PHE   4  -3.805   4.030  -1.474
   32    HA   PHE   4           HA       PHE   4  -2.319   1.532  -1.079
   33   1HB   PHE   4          1HB       PHE   4  -2.403   3.632  -3.154
   34   2HB   PHE   4          2HB       PHE   4  -0.785   3.088  -2.768
   35    HD1  PHE   4           HD1      PHE   4  -4.187   2.014  -4.266
   36    HD2  PHE   4           HD2      PHE   4   0.104   0.840  -3.506
   37    HE1  PHE   4           HE1      PHE   4  -4.425   0.050  -5.922
   38    HE2  PHE   4           HE2      PHE   4  -0.147  -1.117  -5.180
   39    HZ   PHE   4           HZ       PHE   4  -2.408  -1.516  -6.391
   40    H    VAL   5           H        VAL   5  -0.320   1.353  -0.169
   41    HA   VAL   5           HA       VAL   5   1.004   3.663   1.062
   42    HB   VAL   5           HB       VAL   5   1.619   2.211   3.126
   43   1HG1  VAL   5          1HG1      VAL   5   0.240   4.209   3.212
   44   2HG1  VAL   5          2HG1      VAL   5  -1.199   3.237   2.907
   45   3HG1  VAL   5          3HG1      VAL   5  -0.278   3.006   4.393
   46   1HG2  VAL   5          1HG2      VAL   5   0.563   0.033   2.326
   47   2HG2  VAL   5          2HG2      VAL   5   0.129   0.530   3.961
   48   3HG2  VAL   5          3HG2      VAL   5  -1.008   0.772   2.632
   49    H    LYS   6           H        LYS   6   3.111   3.818   0.767
   50    HA   LYS   6           HA       LYS   6   4.724   1.512  -0.131
   51   1HB   LYS   6          1HB       LYS   6   3.903   3.514  -1.819
   52   2HB   LYS   6          2HB       LYS   6   5.451   4.146  -1.285
   53   1HG   LYS   6          1HG       LYS   6   6.570   2.130  -2.076
   54   2HG   LYS   6          2HG       LYS   6   5.020   1.447  -2.570
   55   1HD   LYS   6          1HD       LYS   6   4.811   2.851  -4.387
   56   2HD   LYS   6          2HD       LYS   6   5.803   4.122  -3.668
   57   1HE   LYS   6          1HE       LYS   6   7.806   2.987  -4.179
   58   2HE   LYS   6          2HE       LYS   6   6.959   1.479  -4.527
   59   1HZ   LYS   6          1HZ       LYS   6   6.648   3.956  -6.133
   60   2HZ   LYS   6          2HZ       LYS   6   7.723   2.708  -6.523
   61   3HZ   LYS   6          3HZ       LYS   6   6.058   2.415  -6.506
   62    H    THR   7           H        THR   7   6.846   1.380   0.495
   63    HA   THR   7           HA       THR   7   7.977   3.412   2.300
   64    HB   THR   7           HB       THR   7   7.211   1.652   3.789
   65    HG1  THR   7           HG1      THR   7   8.990   1.576   4.988
   66   1HG2  THR   7          1HG2      THR   7   8.508  -0.289   1.974
   67   2HG2  THR   7          2HG2      THR   7   8.761  -0.579   3.695
   68   3HG2  THR   7          3HG2      THR   7   7.122  -0.493   3.046
   69    H    LEU   8           H        LEU   8  10.325   3.455   2.556
   70    HA   LEU   8           HA       LEU   8  11.773   3.596   0.097
   71   1HB   LEU   8          1HB       LEU   8  12.062   4.544   2.769
   72   2HB   LEU   8          2HB       LEU   8  13.556   3.736   2.350
   73    HG   LEU   8           HG       LEU   8  12.958   5.390   0.115
   74   1HD1  LEU   8          1HD1      LEU   8  12.530   6.900   2.688
   75   2HD1  LEU   8          2HD1      LEU   8  12.854   7.650   1.125
   76   3HD1  LEU   8          3HD1      LEU   8  11.385   6.702   1.361
   77   1HD2  LEU   8          1HD2      LEU   8  15.197   4.822   1.054
   78   2HD2  LEU   8          2HD2      LEU   8  14.995   6.521   0.631
   79   3HD2  LEU   8          3HD2      LEU   8  14.914   6.018   2.319
   80    H    ASP   9           H        ASP   9  11.443   0.933   2.306
   81    HA   ASP   9           HA       ASP   9  13.890  -0.515   1.860
   82   1HB   ASP   9          1HB       ASP   9  11.272  -1.185   3.176
   83   2HB   ASP   9          2HB       ASP   9  12.434  -2.465   2.847
   84    H    GLY  10           H        GLY  10  10.648  -0.643   0.336
   85   1HA   GLY  10          2HA       GLY  10  11.605  -2.550  -1.734
   86   2HA   GLY  10          1HA       GLY  10  10.575  -1.175  -2.086
   87    H    LYS  11           H        LYS  11   8.460  -1.143  -0.682
   88    HA   LYS  11           HA       LYS  11   7.075  -3.733  -0.981
   89   1HB   LYS  11          1HB       LYS  11   7.142  -2.024   1.490
   90   2HB   LYS  11          2HB       LYS  11   5.704  -2.955   1.131
   91   1HG   LYS  11          1HG       LYS  11   6.976  -5.014   1.228
   92   2HG   LYS  11          2HG       LYS  11   8.468  -4.102   1.483
   93   1HD   LYS  11          1HD       LYS  11   7.271  -3.108   3.541
   94   2HD   LYS  11          2HD       LYS  11   6.121  -4.433   3.338
   95   1HE   LYS  11          1HE       LYS  11   8.165  -5.967   3.370
   96   2HE   LYS  11          2HE       LYS  11   9.051  -4.563   3.970
   97   1HZ   LYS  11          1HZ       LYS  11   7.461  -4.436   5.813
   98   2HZ   LYS  11          2HZ       LYS  11   6.696  -5.837   5.254
   99   3HZ   LYS  11          3HZ       LYS  11   8.295  -5.908   5.799
  100    H    THR  12           H        THR  12   4.955  -3.681  -1.669
  101    HA   THR  12           HA       THR  12   3.444  -1.204  -1.945
  102    HB   THR  12           HB       THR  12   2.770  -1.887  -4.371
  103    HG1  THR  12           HG1      THR  12   5.308  -3.174  -4.186
  104   1HG2  THR  12          1HG2      THR  12   4.237   0.108  -3.577
  105   2HG2  THR  12          2HG2      THR  12   5.571  -0.827  -4.252
  106   3HG2  THR  12          3HG2      THR  12   4.234  -0.328  -5.287
  107    H    ILE  13           H        ILE  13   1.628  -1.549  -0.947
  108    HA   ILE  13           HA       ILE  13  -0.114  -3.830  -1.456
  109    HB   ILE  13           HB       ILE  13  -0.597  -4.193   1.058
  110   1HG1  ILE  13          1HG1      ILE  13   2.205  -3.859   1.945
  111   2HG1  ILE  13          2HG1      ILE  13   1.490  -2.313   1.520
  112   1HG2  ILE  13          1HG2      ILE  13   1.908  -5.292  -0.203
  113   2HG2  ILE  13          2HG2      ILE  13   1.117  -5.976   1.217
  114   3HG2  ILE  13          3HG2      ILE  13   0.268  -5.928  -0.329
  115   1HD1  ILE  13          1HD1      ILE  13   0.157  -4.220   3.418
  116   2HD1  ILE  13          2HD1      ILE  13   1.343  -3.026   3.945
  117   3HD1  ILE  13          3HD1      ILE  13  -0.162  -2.500   3.187
  118    H    THR  14           H        THR  14  -2.268  -3.509  -1.229
  119    HA   THR  14           HA       THR  14  -3.223  -0.893  -0.275
  120    HB   THR  14           HB       THR  14  -3.418  -0.751  -2.672
  121    HG1  THR  14           HG1      THR  14  -5.110   0.279  -1.837
  122   1HG2  THR  14          1HG2      THR  14  -3.617  -3.262  -3.201
  123   2HG2  THR  14          2HG2      THR  14  -5.345  -3.065  -2.906
  124   3HG2  THR  14          3HG2      THR  14  -4.559  -2.142  -4.188
  125    H    LEU  15           H        LEU  15  -5.146  -0.686   0.793
  126    HA   LEU  15           HA       LEU  15  -6.328  -3.111   1.987
  127   1HB   LEU  15          1HB       LEU  15  -5.022  -1.114   3.296
  128   2HB   LEU  15          2HB       LEU  15  -6.664  -0.509   3.372
  129    HG   LEU  15           HG       LEU  15  -6.704  -3.296   4.154
  130   1HD1  LEU  15          1HD1      LEU  15  -4.687  -1.658   5.680
  131   2HD1  LEU  15          2HD1      LEU  15  -5.344  -3.213   6.193
  132   3HD1  LEU  15          3HD1      LEU  15  -4.366  -3.108   4.729
  133   1HD2  LEU  15          1HD2      LEU  15  -8.297  -1.469   4.815
  134   2HD2  LEU  15          2HD2      LEU  15  -7.761  -2.516   6.129
  135   3HD2  LEU  15          3HD2      LEU  15  -7.068  -0.904   5.948
  136    H    GLU  16           H        GLU  16  -8.416  -3.539   1.721
  137    HA   GLU  16           HA       GLU  16 -10.289  -1.524   0.632
  138   1HB   GLU  16          1HB       GLU  16  -9.633  -4.261  -0.387
  139   2HB   GLU  16          2HB       GLU  16 -11.289  -3.697  -0.544
  140   1HG   GLU  16          1HG       GLU  16 -10.260  -1.611  -1.655
  141   2HG   GLU  16          2HG       GLU  16  -8.796  -2.581  -1.802
  142    H    VAL  17           H        VAL  17 -12.407  -1.538   1.280
  143    HA   VAL  17           HA       VAL  17 -13.338  -3.481   3.290
  144    HB   VAL  17           HB       VAL  17 -14.619  -1.581   4.491
  145   1HG1  VAL  17          1HG1      VAL  17 -12.752  -2.896   5.421
  146   2HG1  VAL  17          2HG1      VAL  17 -11.644  -1.631   4.893
  147   3HG1  VAL  17          3HG1      VAL  17 -12.887  -1.270   6.090
  148   1HG2  VAL  17          1HG2      VAL  17 -12.455   0.206   3.317
  149   2HG2  VAL  17          2HG2      VAL  17 -14.189   0.358   3.036
  150   3HG2  VAL  17          3HG2      VAL  17 -13.531   0.639   4.648

  No H/Q in entry =         150
  Start of MODEL   17
    1    H1   MET   1           H1       MET   1 -14.290   1.161  -2.900
    2    H2   MET   1           H2       MET   1 -15.038   1.506  -1.424
    3    H3   MET   1           H3       MET   1 -15.360   2.465  -2.781
    4    HA   MET   1           HA       MET   1 -13.324   3.476  -2.768
    5   1HB   MET   1          1HB       MET   1 -12.949   4.317  -0.413
    6   2HB   MET   1          2HB       MET   1 -14.580   4.484  -1.011
    7   1HG   MET   1          1HG       MET   1 -13.869   2.189   0.805
    8   2HG   MET   1          2HG       MET   1 -14.158   3.795   1.468
    9   1HE   MET   1          1HE       MET   1 -16.287   5.142   1.106
   10   2HE   MET   1          2HE       MET   1 -17.844   4.339   1.320
   11   3HE   MET   1          3HE       MET   1 -16.579   4.147   2.534
   12    H    GLN   2           H        GLN   2 -11.148   3.490  -2.756
   13    HA   GLN   2           HA       GLN   2  -9.607   1.335  -1.472
   14   1HB   GLN   2          1HB       GLN   2  -9.833   1.914  -4.367
   15   2HB   GLN   2          2HB       GLN   2  -8.185   1.739  -3.790
   16   1HG   GLN   2          1HG       GLN   2  -8.380  -0.482  -3.480
   17   2HG   GLN   2          2HG       GLN   2 -10.050  -0.376  -2.925
   18   2HE2  GLN   2          2HE2      GLN   2  -7.946  -0.738  -5.716
   19   1HE2  GLN   2          1HE2      GLN   2  -9.197  -1.155  -6.834
   20    H    ILE   3           H        ILE   3  -7.611   1.814  -0.700
   21    HA   ILE   3           HA       ILE   3  -6.371   4.422  -1.115
   22    HB   ILE   3           HB       ILE   3  -5.741   4.519   1.369
   23   1HG1  ILE   3          1HG1      ILE   3  -6.635   2.420   2.319
   24   2HG1  ILE   3          2HG1      ILE   3  -7.300   3.797   3.146
   25   1HG2  ILE   3          1HG2      ILE   3  -7.122   6.127   0.074
   26   2HG2  ILE   3          2HG2      ILE   3  -8.548   5.396   0.814
   27   3HG2  ILE   3          3HG2      ILE   3  -7.324   6.163   1.826
   28   1HD1  ILE   3          1HD1      ILE   3  -9.370   3.140   1.447
   29   2HD1  ILE   3          2HD1      ILE   3  -8.654   1.561   1.764
   30   3HD1  ILE   3          3HD1      ILE   3  -9.209   2.565   3.105
   31    H    PHE   4           H        PHE   4  -4.327   4.324  -1.564
   32    HA   PHE   4           HA       PHE   4  -2.824   1.812  -1.377
   33   1HB   PHE   4          1HB       PHE   4  -2.942   4.098  -3.215
   34   2HB   PHE   4          2HB       PHE   4  -1.302   3.605  -2.863
   35    HD1  PHE   4           HD1      PHE   4  -4.655   2.424  -4.428
   36    HD2  PHE   4           HD2      PHE   4  -0.249   1.617  -3.915
   37    HE1  PHE   4           HE1      PHE   4  -4.757   0.661  -6.318
   38    HE2  PHE   4           HE2      PHE   4  -0.358  -0.135  -5.820
   39    HZ   PHE   4           HZ       PHE   4  -2.605  -0.612  -7.026
   40    H    VAL   5           H        VAL   5  -0.781   1.552  -0.523
   41    HA   VAL   5           HA       VAL   5   0.596   3.709   0.893
   42    HB   VAL   5           HB       VAL   5   1.097   2.141   2.902
   43   1HG1  VAL   5          1HG1      VAL   5  -0.131   4.202   3.101
   44   2HG1  VAL   5          2HG1      VAL   5  -1.629   3.385   2.655
   45   3HG1  VAL   5          3HG1      VAL   5  -0.815   2.971   4.163
   46   1HG2  VAL   5          1HG2      VAL   5  -0.005   0.042   2.102
   47   2HG2  VAL   5          2HG2      VAL   5  -0.612   0.580   3.667
   48   3HG2  VAL   5          3HG2      VAL   5  -1.569   0.851   2.212
   49    H    LYS   6           H        LYS   6   2.759   3.697   0.811
   50    HA   LYS   6           HA       LYS   6   4.200   1.368  -0.298
   51   1HB   LYS   6          1HB       LYS   6   3.746   3.739  -1.638
   52   2HB   LYS   6          2HB       LYS   6   5.344   4.004  -0.959
   53   1HG   LYS   6          1HG       LYS   6   6.298   2.257  -2.173
   54   2HG   LYS   6          2HG       LYS   6   4.739   1.494  -2.488
   55   1HD   LYS   6          1HD       LYS   6   4.167   3.074  -4.129
   56   2HD   LYS   6          2HD       LYS   6   5.408   4.211  -3.596
   57   1HE   LYS   6          1HE       LYS   6   7.145   2.868  -4.496
   58   2HE   LYS   6          2HE       LYS   6   6.052   1.510  -4.758
   59   1HZ   LYS   6          1HZ       LYS   6   5.892   4.120  -6.166
   60   2HZ   LYS   6          2HZ       LYS   6   6.562   2.706  -6.812
   61   3HZ   LYS   6          3HZ       LYS   6   4.911   2.772  -6.449
   62    H    THR   7           H        THR   7   6.251   0.897   0.407
   63    HA   THR   7           HA       THR   7   7.251   2.188   2.880
   64    HB   THR   7           HB       THR   7   8.584  -0.017   3.137
   65    HG1  THR   7           HG1      THR   7   8.084  -1.666   1.896
   66   1HG2  THR   7          1HG2      THR   7   5.650   0.305   3.617
   67   2HG2  THR   7          2HG2      THR   7   6.424  -1.237   3.981
   68   3HG2  THR   7          3HG2      THR   7   6.980   0.237   4.775
   69    H    LEU   8           H        LEU   8   9.427   2.682   3.197
   70    HA   LEU   8           HA       LEU   8  10.985   3.638   1.006
   71   1HB   LEU   8          1HB       LEU   8  11.356   3.519   3.995
   72   2HB   LEU   8          2HB       LEU   8  12.749   3.884   3.030
   73    HG   LEU   8           HG       LEU   8  11.879   5.892   4.068
   74   1HD1  LEU   8          1HD1      LEU   8  11.418   6.092   1.107
   75   2HD1  LEU   8          2HD1      LEU   8  11.538   7.462   2.210
   76   3HD1  LEU   8          3HD1      LEU   8  12.917   6.383   1.989
   77   1HD2  LEU   8          1HD2      LEU   8   9.219   5.465   2.714
   78   2HD2  LEU   8          2HD2      LEU   8   9.560   5.417   4.445
   79   3HD2  LEU   8          3HD2      LEU   8   9.702   6.935   3.561
   80    H    ASP   9           H        ASP   9  11.011   0.512   2.577
   81    HA   ASP   9           HA       ASP   9  13.700  -0.363   2.040
   82   1HB   ASP   9          1HB       ASP   9  11.625  -1.295   3.627
   83   2HB   ASP   9          2HB       ASP   9  11.763  -2.529   2.381
   84    H    GLY  10           H        GLY  10  10.597  -0.756   0.287
   85   1HA   GLY  10          2HA       GLY  10  11.964  -2.042  -2.020
   86   2HA   GLY  10          1HA       GLY  10  10.754  -0.785  -2.204
   87    H    LYS  11           H        LYS  11   8.688  -1.487  -0.617
   88    HA   LYS  11           HA       LYS  11   7.614  -3.971  -1.784
   89   1HB   LYS  11          1HB       LYS  11   8.031  -3.432   1.081
   90   2HB   LYS  11          2HB       LYS  11   6.380  -3.883   0.710
   91   1HG   LYS  11          1HG       LYS  11   6.946  -6.025   0.690
   92   2HG   LYS  11          2HG       LYS  11   8.040  -5.742  -0.655
   93   1HD   LYS  11          1HD       LYS  11   9.773  -6.263   0.660
   94   2HD   LYS  11          2HD       LYS  11   9.427  -4.869   1.674
   95   1HE   LYS  11          1HE       LYS  11   9.353  -6.529   3.247
   96   2HE   LYS  11          2HE       LYS  11   7.661  -6.535   2.750
   97   1HZ   LYS  11          1HZ       LYS  11   8.210  -8.358   1.207
   98   2HZ   LYS  11          2HZ       LYS  11   9.789  -8.387   1.815
   99   3HZ   LYS  11          3HZ       LYS  11   8.487  -8.772   2.823
  100    H    THR  12           H        THR  12   5.436  -3.992  -2.304
  101    HA   THR  12           HA       THR  12   3.779  -1.601  -1.809
  102    HB   THR  12           HB       THR  12   2.778  -1.971  -4.175
  103    HG1  THR  12           HG1      THR  12   5.323  -3.204  -4.534
  104   1HG2  THR  12          1HG2      THR  12   4.158   0.001  -3.448
  105   2HG2  THR  12          2HG2      THR  12   5.568  -0.825  -4.114
  106   3HG2  THR  12          3HG2      THR  12   4.233  -0.366  -5.171
  107    H    ILE  13           H        ILE  13   1.822  -1.945  -1.060
  108    HA   ILE  13           HA       ILE  13   0.206  -4.300  -1.557
  109    HB   ILE  13           HB       ILE  13  -0.328  -4.650   0.953
  110   1HG1  ILE  13          1HG1      ILE  13   2.410  -4.316   1.954
  111   2HG1  ILE  13          2HG1      ILE  13   1.802  -2.763   1.403
  112   1HG2  ILE  13          1HG2      ILE  13   2.219  -5.705  -0.251
  113   2HG2  ILE  13          2HG2      ILE  13   1.420  -6.388   1.166
  114   3HG2  ILE  13          3HG2      ILE  13   0.595  -6.377  -0.394
  115   1HD1  ILE  13          1HD1      ILE  13   0.362  -4.535   3.363
  116   2HD1  ILE  13          2HD1      ILE  13   1.443  -3.217   3.818
  117   3HD1  ILE  13          3HD1      ILE  13  -0.042  -2.873   2.929
  118    H    THR  14           H        THR  14  -1.952  -3.973  -1.497
  119    HA   THR  14           HA       THR  14  -2.968  -1.254  -1.193
  120    HB   THR  14           HB       THR  14  -5.192  -2.301  -1.962
  121    HG1  THR  14           HG1      THR  14  -5.162  -4.408  -2.069
  122   1HG2  THR  14          1HG2      THR  14  -3.342  -1.117  -3.408
  123   2HG2  THR  14          2HG2      THR  14  -3.221  -2.723  -4.129
  124   3HG2  THR  14          3HG2      THR  14  -4.766  -1.868  -4.128
  125    H    LEU  15           H        LEU  15  -4.551  -0.508   0.159
  126    HA   LEU  15           HA       LEU  15  -5.345  -2.155   2.465
  127   1HB   LEU  15          1HB       LEU  15  -3.946   0.167   2.600
  128   2HB   LEU  15          2HB       LEU  15  -5.570   0.820   2.616
  129    HG   LEU  15           HG       LEU  15  -5.442  -1.345   4.540
  130   1HD1  LEU  15          1HD1      LEU  15  -3.280   0.723   4.884
  131   2HD1  LEU  15          2HD1      LEU  15  -3.847  -0.366   6.150
  132   3HD1  LEU  15          3HD1      LEU  15  -3.071  -1.020   4.707
  133   1HD2  LEU  15          1HD2      LEU  15  -7.034   0.535   4.600
  134   2HD2  LEU  15          2HD2      LEU  15  -6.166   0.333   6.124
  135   3HD2  LEU  15          3HD2      LEU  15  -5.710   1.623   5.012
  136    H    GLU  16           H        GLU  16  -7.274  -2.985   2.187
  137    HA   GLU  16           HA       GLU  16  -9.493  -1.455   0.978
  138   1HB   GLU  16          1HB       GLU  16  -8.420  -4.143   0.260
  139   2HB   GLU  16          2HB       GLU  16 -10.168  -3.956   0.225
  140   1HG   GLU  16          1HG       GLU  16  -9.597  -1.830  -1.213
  141   2HG   GLU  16          2HG       GLU  16  -8.077  -2.676  -1.485
  142    H    VAL  17           H        VAL  17 -11.552  -1.699   1.782
  143    HA   VAL  17           HA       VAL  17 -11.873  -3.035   4.389
  144    HB   VAL  17           HB       VAL  17 -14.021  -1.613   4.642
  145   1HG1  VAL  17          1HG1      VAL  17 -12.020  -1.293   5.963
  146   2HG1  VAL  17          2HG1      VAL  17 -11.360  -0.215   4.732
  147   3HG1  VAL  17          3HG1      VAL  17 -12.812   0.245   5.621
  148   1HG2  VAL  17          1HG2      VAL  17 -14.151  -0.680   2.299
  149   2HG2  VAL  17          2HG2      VAL  17 -14.205   0.545   3.569
  150   3HG2  VAL  17          3HG2      VAL  17 -12.718   0.284   2.657

  No H/Q in entry =         150
  Start of MODEL   18
    1    H1   MET   1           H1       MET   1 -14.143   0.185  -2.029
    2    H2   MET   1           H2       MET   1 -14.043  -0.016  -0.352
    3    H3   MET   1           H3       MET   1 -15.144   1.087  -1.008
    4    HA   MET   1           HA       MET   1 -13.384   2.474  -1.815
    5   1HB   MET   1          1HB       MET   1 -14.207   2.178   0.787
    6   2HB   MET   1          2HB       MET   1 -12.463   2.055   0.972
    7   1HG   MET   1          1HG       MET   1 -12.110   4.241   0.388
    8   2HG   MET   1          2HG       MET   1 -13.559   4.328  -0.614
    9   1HE   MET   1          1HE       MET   1 -15.981   4.366   0.359
   10   2HE   MET   1          2HE       MET   1 -16.286   5.556   1.627
   11   3HE   MET   1          3HE       MET   1 -15.388   6.020   0.180
   12    H    GLN   2           H        GLN   2 -11.268   2.923  -2.300
   13    HA   GLN   2           HA       GLN   2  -9.156   0.945  -1.775
   14   1HB   GLN   2          1HB       GLN   2 -10.062   1.969  -4.433
   15   2HB   GLN   2          2HB       GLN   2  -8.330   1.801  -4.192
   16   1HG   GLN   2          1HG       GLN   2  -8.462  -0.509  -3.918
   17   2HG   GLN   2          2HG       GLN   2 -10.196  -0.466  -3.602
   18   2HE2  GLN   2          2HE2      GLN   2  -7.705  -0.449  -6.081
   19   1HE2  GLN   2          1HE2      GLN   2  -8.775  -0.694  -7.416
   20    H    ILE   3           H        ILE   3  -7.341   1.704  -0.987
   21    HA   ILE   3           HA       ILE   3  -6.353   4.399  -1.376
   22    HB   ILE   3           HB       ILE   3  -5.869   4.678   1.182
   23   1HG1  ILE   3          1HG1      ILE   3  -8.474   3.716   2.098
   24   2HG1  ILE   3          2HG1      ILE   3  -7.581   2.368   1.418
   25   1HG2  ILE   3          1HG2      ILE   3  -7.275   6.110  -0.309
   26   2HG2  ILE   3          2HG2      ILE   3  -8.686   5.230   0.279
   27   3HG2  ILE   3          3HG2      ILE   3  -7.700   6.166   1.403
   28   1HD1  ILE   3          1HD1      ILE   3  -6.378   4.172   3.486
   29   2HD1  ILE   3          2HD1      ILE   3  -7.385   2.787   3.907
   30   3HD1  ILE   3          3HD1      ILE   3  -5.882   2.546   3.014
   31    H    PHE   4           H        PHE   4  -4.336   4.352  -1.852
   32    HA   PHE   4           HA       PHE   4  -2.691   1.965  -1.483
   33   1HB   PHE   4          1HB       PHE   4  -2.808   4.238  -3.367
   34   2HB   PHE   4          2HB       PHE   4  -1.186   3.701  -2.995
   35    HD1  PHE   4           HD1      PHE   4  -4.562   2.597  -4.572
   36    HD2  PHE   4           HD2      PHE   4  -0.181   1.681  -4.025
   37    HE1  PHE   4           HE1      PHE   4  -4.698   0.821  -6.447
   38    HE2  PHE   4           HE2      PHE   4  -0.324  -0.085  -5.916
   39    HZ   PHE   4           HZ       PHE   4  -2.577  -0.514  -7.131
   40    H    VAL   5           H        VAL   5  -0.681   1.819  -0.563
   41    HA   VAL   5           HA       VAL   5   0.629   4.060   0.760
   42    HB   VAL   5           HB       VAL   5   1.049   2.662   2.911
   43   1HG1  VAL   5          1HG1      VAL   5  -0.181   4.744   2.869
   44   2HG1  VAL   5          2HG1      VAL   5  -1.668   3.877   2.488
   45   3HG1  VAL   5          3HG1      VAL   5  -0.872   3.621   4.041
   46   1HG2  VAL   5          1HG2      VAL   5  -0.031   0.509   2.272
   47   2HG2  VAL   5          2HG2      VAL   5  -0.722   1.194   3.745
   48   3HG2  VAL   5          3HG2      VAL   5  -1.593   1.324   2.217
   49    H    LYS   6           H        LYS   6   2.785   4.035   0.679
   50    HA   LYS   6           HA       LYS   6   4.207   1.622  -0.269
   51   1HB   LYS   6          1HB       LYS   6   3.875   3.926  -1.694
   52   2HB   LYS   6          2HB       LYS   6   5.399   4.267  -0.893
   53   1HG   LYS   6          1HG       LYS   6   6.468   2.425  -1.923
   54   2HG   LYS   6          2HG       LYS   6   4.937   1.742  -2.470
   55   1HD   LYS   6          1HD       LYS   6   4.763   3.169  -4.249
   56   2HD   LYS   6          2HD       LYS   6   5.617   4.483  -3.441
   57   1HE   LYS   6          1HE       LYS   6   7.730   3.491  -3.874
   58   2HE   LYS   6          2HE       LYS   6   6.991   1.971  -4.377
   59   1HZ   LYS   6          1HZ       LYS   6   6.014   3.167  -6.276
   60   2HZ   LYS   6          2HZ       LYS   6   6.843   4.566  -5.813
   61   3HZ   LYS   6          3HZ       LYS   6   7.707   3.195  -6.297
   62    H    THR   7           H        THR   7   6.219   1.100   0.497
   63    HA   THR   7           HA       THR   7   7.238   2.407   2.954
   64    HB   THR   7           HB       THR   7   8.375   0.093   3.340
   65    HG1  THR   7           HG1      THR   7   7.948  -1.190   1.700
   66   1HG2  THR   7          1HG2      THR   7   5.479   0.707   3.794
   67   2HG2  THR   7          2HG2      THR   7   6.149  -0.844   4.301
   68   3HG2  THR   7          3HG2      THR   7   6.806   0.657   4.954
   69    H    LEU   8           H        LEU   8   9.432   2.764   3.260
   70    HA   LEU   8           HA       LEU   8  11.078   3.432   1.027
   71   1HB   LEU   8          1HB       LEU   8  11.366   3.512   3.994
   72   2HB   LEU   8          2HB       LEU   8  12.824   3.670   3.036
   73    HG   LEU   8           HG       LEU   8  10.839   5.462   1.933
   74   1HD1  LEU   8          1HD1      LEU   8   9.823   5.318   4.206
   75   2HD1  LEU   8          2HD1      LEU   8  11.313   6.004   4.853
   76   3HD1  LEU   8          3HD1      LEU   8  10.333   6.935   3.720
   77   1HD2  LEU   8          1HD2      LEU   8  13.421   5.981   3.403
   78   2HD2  LEU   8          2HD2      LEU   8  13.194   5.840   1.659
   79   3HD2  LEU   8          3HD2      LEU   8  12.495   7.204   2.531
   80    H    ASP   9           H        ASP   9  10.778   0.397   2.670
   81    HA   ASP   9           HA       ASP   9  13.378  -0.776   2.345
   82   1HB   ASP   9          1HB       ASP   9  11.210  -1.467   3.814
   83   2HB   ASP   9          2HB       ASP   9  11.040  -2.603   2.482
   84    H    GLY  10           H        GLY  10  10.452  -0.766   0.286
   85   1HA   GLY  10          2HA       GLY  10  11.915  -2.059  -1.951
   86   2HA   GLY  10          1HA       GLY  10  10.701  -0.811  -2.147
   87    H    LYS  11           H        LYS  11   8.567  -1.630  -0.673
   88    HA   LYS  11           HA       LYS  11   7.519  -3.912  -2.153
   89   1HB   LYS  11          1HB       LYS  11   6.393  -4.919  -0.081
   90   2HB   LYS  11          2HB       LYS  11   8.101  -5.223  -0.266
   91   1HG   LYS  11          1HG       LYS  11   8.292  -3.182   1.437
   92   2HG   LYS  11          2HG       LYS  11   6.640  -3.657   1.829
   93   1HD   LYS  11          1HD       LYS  11   7.703  -6.060   2.015
   94   2HD   LYS  11          2HD       LYS  11   9.205  -5.161   2.209
   95   1HE   LYS  11          1HE       LYS  11   8.598  -5.351   4.395
   96   2HE   LYS  11          2HE       LYS  11   7.765  -3.847   4.014
   97   1HZ   LYS  11          1HZ       LYS  11   5.763  -5.236   3.537
   98   2HZ   LYS  11          2HZ       LYS  11   6.593  -6.571   4.163
   99   3HZ   LYS  11          3HZ       LYS  11   6.251  -5.246   5.158
  100    H    THR  12           H        THR  12   5.455  -3.739  -2.818
  101    HA   THR  12           HA       THR  12   3.802  -1.461  -1.886
  102    HB   THR  12           HB       THR  12   2.698  -1.615  -4.230
  103    HG1  THR  12           HG1      THR  12   3.631  -2.817  -5.694
  104   1HG2  THR  12          1HG2      THR  12   4.106   0.280  -3.447
  105   2HG2  THR  12          2HG2      THR  12   5.517  -0.539  -4.116
  106   3HG2  THR  12          3HG2      THR  12   4.218  -0.006  -5.184
  107    H    ILE  13           H        ILE  13   1.788  -1.772  -1.200
  108    HA   ILE  13           HA       ILE  13   0.159  -4.105  -1.793
  109    HB   ILE  13           HB       ILE  13  -0.420  -4.519   0.688
  110   1HG1  ILE  13          1HG1      ILE  13   2.277  -4.189   1.783
  111   2HG1  ILE  13          2HG1      ILE  13   1.690  -2.628   1.233
  112   1HG2  ILE  13          1HG2      ILE  13   2.176  -5.520  -0.457
  113   2HG2  ILE  13          2HG2      ILE  13   1.327  -6.248   0.908
  114   3HG2  ILE  13          3HG2      ILE  13   0.564  -6.200  -0.682
  115   1HD1  ILE  13          1HD1      ILE  13   0.235  -4.436   3.149
  116   2HD1  ILE  13          2HD1      ILE  13   1.226  -3.050   3.607
  117   3HD1  ILE  13          3HD1      ILE  13  -0.248  -2.809   2.668
  118    H    THR  14           H        THR  14  -2.022  -3.818  -1.679
  119    HA   THR  14           HA       THR  14  -3.054  -1.103  -1.374
  120    HB   THR  14           HB       THR  14  -5.276  -2.150  -2.116
  121    HG1  THR  14           HG1      THR  14  -3.547  -4.340  -2.718
  122   1HG2  THR  14          1HG2      THR  14  -2.906  -1.707  -3.793
  123   2HG2  THR  14          2HG2      THR  14  -4.210  -2.641  -4.528
  124   3HG2  THR  14          3HG2      THR  14  -4.536  -1.032  -3.884
  125    H    LEU  15           H        LEU  15  -4.604  -0.369   0.021
  126    HA   LEU  15           HA       LEU  15  -5.390  -2.050   2.305
  127   1HB   LEU  15          1HB       LEU  15  -3.943   0.339   2.371
  128   2HB   LEU  15          2HB       LEU  15  -5.572   0.853   2.749
  129    HG   LEU  15           HG       LEU  15  -4.966  -1.483   4.351
  130   1HD1  LEU  15          1HD1      LEU  15  -2.593  -0.721   3.945
  131   2HD1  LEU  15          2HD1      LEU  15  -2.997   0.724   4.870
  132   3HD1  LEU  15          3HD1      LEU  15  -3.095  -0.865   5.629
  133   1HD2  LEU  15          1HD2      LEU  15  -5.418   1.405   5.094
  134   2HD2  LEU  15          2HD2      LEU  15  -6.629   0.126   5.009
  135   3HD2  LEU  15          3HD2      LEU  15  -5.369   0.065   6.241
  136    H    GLU  16           H        GLU  16  -7.337  -2.797   1.978
  137    HA   GLU  16           HA       GLU  16  -9.516  -1.110   0.913
  138   1HB   GLU  16          1HB       GLU  16  -8.576  -3.813   0.082
  139   2HB   GLU  16          2HB       GLU  16 -10.314  -3.550   0.090
  140   1HG   GLU  16          1HG       GLU  16  -9.672  -1.398  -1.285
  141   2HG   GLU  16          2HG       GLU  16  -8.205  -2.313  -1.624
  142    H    VAL  17           H        VAL  17 -11.569  -1.293   1.750
  143    HA   VAL  17           HA       VAL  17 -11.865  -2.532   4.371
  144    HB   VAL  17           HB       VAL  17 -12.330  -0.074   4.022
  145   1HG1  VAL  17          1HG1      VAL  17 -13.554  -0.004   1.924
  146   2HG1  VAL  17          2HG1      VAL  17 -14.927  -0.815   2.681
  147   3HG1  VAL  17          3HG1      VAL  17 -14.449   0.795   3.216
  148   1HG2  VAL  17          1HG2      VAL  17 -13.115  -1.166   6.029
  149   2HG2  VAL  17          2HG2      VAL  17 -14.231   0.107   5.531
  150   3HG2  VAL  17          3HG2      VAL  17 -14.633  -1.585   5.236

  No H/Q in entry =         150
  Start of MODEL   19
    1    H1   MET   1           H1       MET   1 -13.817   0.546  -0.659
    2    H2   MET   1           H2       MET   1 -13.963   0.889   0.991
    3    H3   MET   1           H3       MET   1 -14.898   1.738  -0.136
    4    HA   MET   1           HA       MET   1 -13.144   2.950  -0.940
    5   1HB   MET   1          1HB       MET   1 -11.922   3.903   1.104
    6   2HB   MET   1          2HB       MET   1 -13.668   3.980   1.130
    7   1HG   MET   1          1HG       MET   1 -13.618   1.988   2.711
    8   2HG   MET   1          2HG       MET   1 -11.867   2.177   2.770
    9   1HE   MET   1          1HE       MET   1 -10.643   4.103   3.545
   10   2HE   MET   1          2HE       MET   1 -11.167   5.154   4.861
   11   3HE   MET   1          3HE       MET   1 -11.003   3.418   5.130
   12    H    GLN   2           H        GLN   2 -11.156   3.181  -1.781
   13    HA   GLN   2           HA       GLN   2  -9.068   1.188  -1.197
   14   1HB   GLN   2          1HB       GLN   2 -10.435   1.267  -3.577
   15   2HB   GLN   2          2HB       GLN   2  -9.059   2.291  -3.946
   16   1HG   GLN   2          1HG       GLN   2  -7.535   0.486  -3.348
   17   2HG   GLN   2          2HG       GLN   2  -8.904  -0.543  -2.932
   18   2HE2  GLN   2          2HE2      GLN   2  -7.053   0.884  -5.561
   19   1HE2  GLN   2          1HE2      GLN   2  -7.770  -0.058  -6.818
   20    H    ILE   3           H        ILE   3  -7.143   1.909  -0.652
   21    HA   ILE   3           HA       ILE   3  -6.059   4.483  -1.420
   22    HB   ILE   3           HB       ILE   3  -5.318   5.030   1.016
   23   1HG1  ILE   3          1HG1      ILE   3  -7.838   4.259   2.302
   24   2HG1  ILE   3          2HG1      ILE   3  -7.026   2.818   1.715
   25   1HG2  ILE   3          1HG2      ILE   3  -6.796   6.379  -0.430
   26   2HG2  ILE   3          2HG2      ILE   3  -8.192   5.566   0.276
   27   3HG2  ILE   3          3HG2      ILE   3  -7.146   6.562   1.289
   28   1HD1  ILE   3          1HD1      ILE   3  -5.386   4.742   3.252
   29   2HD1  ILE   3          2HD1      ILE   3  -6.615   3.829   4.130
   30   3HD1  ILE   3          3HD1      ILE   3  -5.357   2.978   3.233
   31    H    PHE   4           H        PHE   4  -4.068   4.344  -1.988
   32    HA   PHE   4           HA       PHE   4  -2.497   1.915  -1.619
   33   1HB   PHE   4          1HB       PHE   4  -2.544   4.205  -3.507
   34   2HB   PHE   4          2HB       PHE   4  -0.960   3.530  -3.202
   35    HD1  PHE   4           HD1      PHE   4  -4.488   2.686  -4.624
   36    HD2  PHE   4           HD2      PHE   4  -0.156   1.477  -4.305
   37    HE1  PHE   4           HE1      PHE   4  -4.829   0.959  -6.515
   38    HE2  PHE   4           HE2      PHE   4  -0.507  -0.243  -6.211
   39    HZ   PHE   4           HZ       PHE   4  -2.838  -0.501  -7.322
   40    H    VAL   5           H        VAL   5  -0.461   1.705  -0.740
   41    HA   VAL   5           HA       VAL   5   0.902   3.941   0.562
   42    HB   VAL   5           HB       VAL   5   1.406   2.488   2.654
   43   1HG1  VAL   5          1HG1      VAL   5   0.030   4.575   2.529
   44   2HG1  VAL   5          2HG1      VAL   5  -1.399   3.541   2.510
   45   3HG1  VAL   5          3HG1      VAL   5  -0.306   3.510   3.894
   46   1HG2  VAL   5          1HG2      VAL   5   0.349   0.337   2.017
   47   2HG2  VAL   5          2HG2      VAL   5  -0.346   0.989   3.501
   48   3HG2  VAL   5          3HG2      VAL   5  -1.228   1.124   1.977
   49    H    LYS   6           H        LYS   6   3.053   3.951   0.458
   50    HA   LYS   6           HA       LYS   6   4.534   1.573  -0.476
   51   1HB   LYS   6          1HB       LYS   6   4.003   3.746  -2.057
   52   2HB   LYS   6          2HB       LYS   6   5.559   4.201  -1.385
   53   1HG   LYS   6          1HG       LYS   6   6.649   2.358  -2.356
   54   2HG   LYS   6          2HG       LYS   6   5.132   1.526  -2.694
   55   1HD   LYS   6          1HD       LYS   6   4.679   2.791  -4.560
   56   2HD   LYS   6          2HD       LYS   6   5.586   4.189  -3.982
   57   1HE   LYS   6          1HE       LYS   6   7.656   3.210  -4.567
   58   2HE   LYS   6          2HE       LYS   6   6.926   1.620  -4.796
   59   1HZ   LYS   6          1HZ       LYS   6   5.715   2.510  -6.705
   60   2HZ   LYS   6          2HZ       LYS   6   6.461   4.013  -6.494
   61   3HZ   LYS   6          3HZ       LYS   6   7.387   2.660  -6.913
   62    H    THR   7           H        THR   7   6.615   1.233   0.226
   63    HA   THR   7           HA       THR   7   7.724   2.885   2.427
   64    HB   THR   7           HB       THR   7   8.852   0.684   3.188
   65    HG1  THR   7           HG1      THR   7   7.825  -1.209   2.610
   66   1HG2  THR   7          1HG2      THR   7   5.977   1.386   3.613
   67   2HG2  THR   7          2HG2      THR   7   6.628  -0.090   4.327
   68   3HG2  THR   7          3HG2      THR   7   7.334   1.474   4.736
   69    H    LEU   8           H        LEU   8   9.955   3.213   2.564
   70    HA   LEU   8           HA       LEU   8  11.483   3.454   0.165
   71   1HB   LEU   8          1HB       LEU   8  11.947   4.010   3.058
   72   2HB   LEU   8          2HB       LEU   8  13.350   3.951   2.013
   73    HG   LEU   8           HG       LEU   8  11.365   5.611   0.725
   74   1HD1  LEU   8          1HD1      LEU   8  10.436   5.895   3.007
   75   2HD1  LEU   8          2HD1      LEU   8  11.984   6.576   3.507
   76   3HD1  LEU   8          3HD1      LEU   8  11.020   7.390   2.274
   77   1HD2  LEU   8          1HD2      LEU   8  13.803   5.756   0.401
   78   2HD2  LEU   8          2HD2      LEU   8  13.073   7.313   0.790
   79   3HD2  LEU   8          3HD2      LEU   8  13.963   6.423   2.026
   80    H    ASP   9           H        ASP   9  11.256   0.767   2.374
   81    HA   ASP   9           HA       ASP   9  13.808  -0.511   2.000
   82   1HB   ASP   9          1HB       ASP   9  11.862  -0.822   3.852
   83   2HB   ASP   9          2HB       ASP   9  11.501  -2.197   2.817
   84    H    GLY  10           H        GLY  10  10.608  -0.908   0.416
   85   1HA   GLY  10          2HA       GLY  10  11.744  -2.775  -1.601
   86   2HA   GLY  10          1HA       GLY  10  10.696  -1.437  -2.033
   87    H    LYS  11           H        LYS  11   8.586  -1.503  -0.403
   88    HA   LYS  11           HA       LYS  11   7.193  -4.037  -0.983
   89   1HB   LYS  11          1HB       LYS  11   7.420  -2.719   1.714
   90   2HB   LYS  11          2HB       LYS  11   5.963  -3.606   1.310
   91   1HG   LYS  11          1HG       LYS  11   6.921  -5.577   1.718
   92   2HG   LYS  11          2HG       LYS  11   8.313  -5.203   0.716
   93   1HD   LYS  11          1HD       LYS  11   9.572  -5.105   2.563
   94   2HD   LYS  11          2HD       LYS  11   8.681  -3.678   3.073
   95   1HE   LYS  11          1HE       LYS  11   6.976  -5.433   4.007
   96   2HE   LYS  11          2HE       LYS  11   8.350  -6.533   3.912
   97   1HZ   LYS  11          1HZ       LYS  11   8.375  -3.939   5.355
   98   2HZ   LYS  11          2HZ       LYS  11   8.108  -5.439   6.093
   99   3HZ   LYS  11          3HZ       LYS  11   9.596  -5.110   5.358
  100    H    THR  12           H        THR  12   5.025  -3.906  -1.499
  101    HA   THR  12           HA       THR  12   3.579  -1.347  -1.445
  102    HB   THR  12           HB       THR  12   2.630  -1.933  -3.793
  103    HG1  THR  12           HG1      THR  12   3.525  -3.866  -4.289
  104   1HG2  THR  12          1HG2      THR  12   5.341  -0.740  -3.303
  105   2HG2  THR  12          2HG2      THR  12   4.667  -0.828  -4.930
  106   3HG2  THR  12          3HG2      THR  12   3.818   0.072  -3.672
  107    H    ILE  13           H        ILE  13   1.551  -1.498  -0.745
  108    HA   ILE  13           HA       ILE  13  -0.094  -3.894  -0.988
  109    HB   ILE  13           HB       ILE  13  -0.785  -3.843   1.491
  110   1HG1  ILE  13          1HG1      ILE  13   1.876  -3.218   2.591
  111   2HG1  ILE  13          2HG1      ILE  13   1.211  -1.808   1.782
  112   1HG2  ILE  13          1HG2      ILE  13   1.874  -4.992   0.667
  113   2HG2  ILE  13          2HG2      ILE  13   0.998  -5.452   2.127
  114   3HG2  ILE  13          3HG2      ILE  13   0.280  -5.742   0.540
  115   1HD1  ILE  13          1HD1      ILE  13  -0.240  -3.358   3.914
  116   2HD1  ILE  13          2HD1      ILE  13   0.738  -1.920   4.217
  117   3HD1  ILE  13          3HD1      ILE  13  -0.708  -1.807   3.212
  118    H    THR  14           H        THR  14  -2.257  -3.608  -1.057
  119    HA   THR  14           HA       THR  14  -3.332  -0.858  -1.073
  120    HB   THR  14           HB       THR  14  -5.367  -1.936  -2.219
  121    HG1  THR  14           HG1      THR  14  -5.247  -4.059  -2.239
  122   1HG2  THR  14          1HG2      THR  14  -3.459  -0.642  -3.335
  123   2HG2  THR  14          2HG2      THR  14  -2.921  -2.219  -3.913
  124   3HG2  THR  14          3HG2      THR  14  -4.525  -1.621  -4.341
  125    H    LEU  15           H        LEU  15  -5.156  -0.204   0.032
  126    HA   LEU  15           HA       LEU  15  -6.105  -1.921   2.226
  127   1HB   LEU  15          1HB       LEU  15  -5.007   0.537   2.468
  128   2HB   LEU  15          2HB       LEU  15  -6.679   1.012   2.258
  129    HG   LEU  15           HG       LEU  15  -6.560  -1.103   4.245
  130   1HD1  LEU  15          1HD1      LEU  15  -4.205  -0.236   4.508
  131   2HD1  LEU  15          2HD1      LEU  15  -4.920   1.274   5.068
  132   3HD1  LEU  15          3HD1      LEU  15  -5.211  -0.222   5.956
  133   1HD2  LEU  15          1HD2      LEU  15  -8.369   0.541   4.065
  134   2HD2  LEU  15          2HD2      LEU  15  -7.663   0.522   5.681
  135   3HD2  LEU  15          3HD2      LEU  15  -7.258   1.819   4.556
  136    H    GLU  16           H        GLU  16  -7.713  -3.087   1.497
  137    HA   GLU  16           HA       GLU  16 -10.012  -1.876   0.091
  138   1HB   GLU  16          1HB       GLU  16  -8.412  -4.318  -0.504
  139   2HB   GLU  16          2HB       GLU  16 -10.144  -4.422  -0.779
  140   1HG   GLU  16          1HG       GLU  16  -9.881  -2.296  -2.173
  141   2HG   GLU  16          2HG       GLU  16  -8.147  -2.595  -2.096
  142    H    VAL  17           H        VAL  17 -12.095  -2.518   0.592
  143    HA   VAL  17           HA       VAL  17 -12.537  -3.764   3.185
  144    HB   VAL  17           HB       VAL  17 -13.498  -1.498   2.615
  145   1HG1  VAL  17          1HG1      VAL  17 -14.336  -1.838   0.331
  146   2HG1  VAL  17          2HG1      VAL  17 -15.633  -2.850   0.970
  147   3HG1  VAL  17          3HG1      VAL  17 -15.546  -1.145   1.409
  148   1HG2  VAL  17          1HG2      VAL  17 -14.369  -3.048   4.451
  149   2HG2  VAL  17          2HG2      VAL  17 -15.344  -1.649   4.001
  150   3HG2  VAL  17          3HG2      VAL  17 -15.782  -3.255   3.419

  No H/Q in entry =         150
  Start of MODEL   20
    1    H1   MET   1           H1       MET   1 -13.980   0.129  -1.823
    2    H2   MET   1           H2       MET   1 -13.791  -0.064  -0.154
    3    H3   MET   1           H3       MET   1 -14.932   1.031  -0.754
    4    HA   MET   1           HA       MET   1 -13.189   2.388  -1.702
    5   1HB   MET   1          1HB       MET   1 -13.987   2.206   0.923
    6   2HB   MET   1          2HB       MET   1 -12.239   2.120   1.091
    7   1HG   MET   1          1HG       MET   1 -11.926   4.274   0.344
    8   2HG   MET   1          2HG       MET   1 -13.434   4.294  -0.571
    9   1HE   MET   1          1HE       MET   1 -15.808   4.347   0.566
   10   2HE   MET   1          2HE       MET   1 -16.032   5.622   1.766
   11   3HE   MET   1          3HE       MET   1 -15.235   5.983   0.234
   12    H    GLN   2           H        GLN   2 -11.081   2.820  -2.226
   13    HA   GLN   2           HA       GLN   2  -8.944   0.906  -1.595
   14   1HB   GLN   2          1HB       GLN   2 -10.070   0.839  -4.063
   15   2HB   GLN   2          2HB       GLN   2  -8.869   2.088  -4.337
   16   1HG   GLN   2          1HG       GLN   2  -7.176   0.412  -3.379
   17   2HG   GLN   2          2HG       GLN   2  -8.439  -0.794  -3.597
   18   2HE2  GLN   2          2HE2      GLN   2  -8.869  -1.580  -5.658
   19   1HE2  GLN   2          1HE2      GLN   2  -7.945  -1.123  -7.044
   20    H    ILE   3           H        ILE   3  -7.151   1.755  -0.866
   21    HA   ILE   3           HA       ILE   3  -6.187   4.420  -1.461
   22    HB   ILE   3           HB       ILE   3  -5.705   4.898   1.065
   23   1HG1  ILE   3          1HG1      ILE   3  -8.288   3.983   2.076
   24   2HG1  ILE   3          2HG1      ILE   3  -7.400   2.592   1.479
   25   1HG2  ILE   3          1HG2      ILE   3  -8.384   5.350  -0.223
   26   2HG2  ILE   3          2HG2      ILE   3  -7.872   6.160   1.257
   27   3HG2  ILE   3          3HG2      ILE   3  -6.967   6.402  -0.237
   28   1HD1  ILE   3          1HD1      ILE   3  -6.204   4.546   3.415
   29   2HD1  ILE   3          2HD1      ILE   3  -7.159   3.152   3.922
   30   3HD1  ILE   3          3HD1      ILE   3  -5.660   2.914   3.022
   31    H    PHE   4           H        PHE   4  -4.160   4.346  -1.930
   32    HA   PHE   4           HA       PHE   4  -2.536   1.982  -1.447
   33   1HB   PHE   4          1HB       PHE   4  -2.553   4.237  -3.359
   34   2HB   PHE   4          2HB       PHE   4  -0.955   3.669  -2.933
   35    HD1  PHE   4           HD1      PHE   4  -4.305   2.628  -4.603
   36    HD2  PHE   4           HD2      PHE   4   0.030   1.603  -3.900
   37    HE1  PHE   4           HE1      PHE   4  -4.428   0.830  -6.456
   38    HE2  PHE   4           HE2      PHE   4  -0.101  -0.187  -5.769
   39    HZ   PHE   4           HZ       PHE   4  -2.323  -0.572  -7.051
   40    H    VAL   5           H        VAL   5  -0.657   1.764  -0.365
   41    HA   VAL   5           HA       VAL   5   0.624   3.991   1.027
   42    HB   VAL   5           HB       VAL   5  -1.066   2.980   2.612
   43   1HG1  VAL   5          1HG1      VAL   5  -1.029   0.617   2.152
   44   2HG1  VAL   5          2HG1      VAL   5   0.633   0.494   2.728
   45   3HG1  VAL   5          3HG1      VAL   5  -0.664   0.907   3.852
   46   1HG2  VAL   5          1HG2      VAL   5   0.791   4.252   3.507
   47   2HG2  VAL   5          2HG2      VAL   5   0.307   2.969   4.615
   48   3HG2  VAL   5          3HG2      VAL   5   1.760   2.785   3.631
   49    H    LYS   6           H        LYS   6   2.753   4.035   0.682
   50    HA   LYS   6           HA       LYS   6   4.216   1.640  -0.245
   51   1HB   LYS   6          1HB       LYS   6   3.773   3.923  -1.677
   52   2HB   LYS   6          2HB       LYS   6   5.323   4.300  -0.945
   53   1HG   LYS   6          1HG       LYS   6   6.394   2.493  -2.015
   54   2HG   LYS   6          2HG       LYS   6   4.864   1.736  -2.452
   55   1HD   LYS   6          1HD       LYS   6   4.503   3.145  -4.232
   56   2HD   LYS   6          2HD       LYS   6   5.426   4.472  -3.526
   57   1HE   LYS   6          1HE       LYS   6   7.487   3.485  -4.127
   58   2HE   LYS   6          2HE       LYS   6   6.728   1.935  -4.489
   59   1HZ   LYS   6          1HZ       LYS   6   5.575   3.015  -6.351
   60   2HZ   LYS   6          2HZ       LYS   6   6.401   4.455  -6.026
   61   3HZ   LYS   6          3HZ       LYS   6   7.258   3.082  -6.518
   62    H    THR   7           H        THR   7   6.259   1.169   0.457
   63    HA   THR   7           HA       THR   7   7.358   2.564   2.833
   64    HB   THR   7           HB       THR   7   8.493   0.260   3.286
   65    HG1  THR   7           HG1      THR   7   7.971  -1.225   1.903
   66   1HG2  THR   7          1HG2      THR   7   5.647   0.977   3.850
   67   2HG2  THR   7          2HG2      THR   7   6.248  -0.609   4.333
   68   3HG2  THR   7          3HG2      THR   7   7.018   0.852   4.952
   69    H    LEU   8           H        LEU   8   9.564   2.916   3.039
   70    HA   LEU   8           HA       LEU   8  11.128   3.464   0.718
   71   1HB   LEU   8          1HB       LEU   8  11.192   4.075   3.508
   72   2HB   LEU   8          2HB       LEU   8  12.776   3.474   3.067
   73    HG   LEU   8           HG       LEU   8  12.105   5.349   1.036
   74   1HD1  LEU   8          1HD1      LEU   8  11.413   6.449   3.758
   75   2HD1  LEU   8          2HD1      LEU   8  11.736   7.435   2.331
   76   3HD1  LEU   8          3HD1      LEU   8  10.359   6.332   2.348
   77   1HD2  LEU   8          1HD2      LEU   8  13.952   5.616   3.404
   78   2HD2  LEU   8          2HD2      LEU   8  14.355   5.006   1.799
   79   3HD2  LEU   8          3HD2      LEU   8  13.933   6.705   2.017
   80    H    ASP   9           H        ASP   9  10.873   0.510   2.506
   81    HA   ASP   9           HA       ASP   9  13.457  -0.689   2.143
   82   1HB   ASP   9          1HB       ASP   9  11.311  -1.302   3.700
   83   2HB   ASP   9          2HB       ASP   9  11.146  -2.518   2.439
   84    H    GLY  10           H        GLY  10  10.459  -0.762   0.192
   85   1HA   GLY  10          2HA       GLY  10  11.836  -2.170  -2.032
   86   2HA   GLY  10          1HA       GLY  10  10.629  -0.917  -2.247
   87    H    LYS  11           H        LYS  11   8.541  -1.646  -0.654
   88    HA   LYS  11           HA       LYS  11   7.415  -3.975  -1.997
   89   1HB   LYS  11          1HB       LYS  11   6.347  -4.870   0.157
   90   2HB   LYS  11          2HB       LYS  11   8.041  -5.215  -0.084
   91   1HG   LYS  11          1HG       LYS  11   8.277  -3.055   1.520
   92   2HG   LYS  11          2HG       LYS  11   6.681  -3.601   2.031
   93   1HD   LYS  11          1HD       LYS  11   7.810  -5.919   2.280
   94   2HD   LYS  11          2HD       LYS  11   9.325  -5.016   2.228
   95   1HE   LYS  11          1HE       LYS  11   8.793  -3.820   4.195
   96   2HE   LYS  11          2HE       LYS  11   7.108  -4.337   4.144
   97   1HZ   LYS  11          1HZ       LYS  11   9.437  -6.115   4.633
   98   2HZ   LYS  11          2HZ       LYS  11   8.376  -5.542   5.819
   99   3HZ   LYS  11          3HZ       LYS  11   7.814  -6.592   4.616
  100    H    THR  12           H        THR  12   5.341  -3.793  -2.609
  101    HA   THR  12           HA       THR  12   3.740  -1.462  -1.714
  102    HB   THR  12           HB       THR  12   2.574  -1.682  -4.022
  103    HG1  THR  12           HG1      THR  12   3.559  -3.592  -4.740
  104   1HG2  THR  12          1HG2      THR  12   3.932   0.254  -3.423
  105   2HG2  THR  12          2HG2      THR  12   5.395  -0.610  -3.894
  106   3HG2  THR  12          3HG2      THR  12   4.191  -0.189  -5.111
  107    H    ILE  13           H        ILE  13   1.703  -1.707  -1.030
  108    HA   ILE  13           HA       ILE  13   0.067  -4.063  -1.493
  109    HB   ILE  13           HB       ILE  13  -0.526  -4.333   1.003
  110   1HG1  ILE  13          1HG1      ILE  13   2.165  -3.940   2.092
  111   2HG1  ILE  13          2HG1      ILE  13   1.581  -2.413   1.450
  112   1HG2  ILE  13          1HG2      ILE  13   2.059  -5.402  -0.100
  113   2HG2  ILE  13          2HG2      ILE  13   1.255  -6.032   1.338
  114   3HG2  ILE  13          3HG2      ILE  13   0.446  -6.105  -0.229
  115   1HD1  ILE  13          1HD1      ILE  13   0.041  -4.096   3.411
  116   2HD1  ILE  13          2HD1      ILE  13   1.124  -2.780   3.870
  117   3HD1  ILE  13          3HD1      ILE  13  -0.313  -2.442   2.903
  118    H    THR  14           H        THR  14  -2.097  -3.747  -1.462
  119    HA   THR  14           HA       THR  14  -3.118  -1.009  -1.245
  120    HB   THR  14           HB       THR  14  -5.302  -2.022  -2.123
  121    HG1  THR  14           HG1      THR  14  -5.358  -4.126  -2.267
  122   1HG2  THR  14          1HG2      THR  14  -3.444  -0.893  -3.514
  123   2HG2  THR  14          2HG2      THR  14  -3.145  -2.524  -4.117
  124   3HG2  THR  14          3HG2      THR  14  -4.734  -1.781  -4.324
  125    H    LEU  15           H        LEU  15  -4.754  -0.272   0.071
  126    HA   LEU  15           HA       LEU  15  -5.618  -1.966   2.321
  127   1HB   LEU  15          1HB       LEU  15  -4.223   0.425   2.480
  128   2HB   LEU  15          2HB       LEU  15  -5.877   0.953   2.703
  129    HG   LEU  15           HG       LEU  15  -5.408  -1.357   4.399
  130   1HD1  LEU  15          1HD1      LEU  15  -3.022  -0.625   4.228
  131   2HD1  LEU  15          2HD1      LEU  15  -3.499   0.890   4.993
  132   3HD1  LEU  15          3HD1      LEU  15  -3.688  -0.635   5.860
  133   1HD2  LEU  15          1HD2      LEU  15  -5.930   1.537   5.078
  134   2HD2  LEU  15          2HD2      LEU  15  -7.142   0.278   4.839
  135   3HD2  LEU  15          3HD2      LEU  15  -6.033   0.186   6.208
  136    H    GLU  16           H        GLU  16  -7.478  -2.814   1.803
  137    HA   GLU  16           HA       GLU  16  -9.677  -1.203   0.668
  138   1HB   GLU  16          1HB       GLU  16  -8.571  -3.848  -0.145
  139   2HB   GLU  16          2HB       GLU  16 -10.316  -3.658  -0.236
  140   1HG   GLU  16          1HG       GLU  16  -9.688  -1.458  -1.542
  141   2HG   GLU  16          2HG       GLU  16  -8.166  -2.305  -1.809
  142    H    VAL  17           H        VAL  17 -11.763  -1.494   1.388
  143    HA   VAL  17           HA       VAL  17 -12.144  -2.812   3.962
  144    HB   VAL  17           HB       VAL  17 -12.676  -0.361   3.656
  145   1HG1  VAL  17          1HG1      VAL  17 -15.101  -1.199   2.076
  146   2HG1  VAL  17          2HG1      VAL  17 -14.885   0.387   2.818
  147   3HG1  VAL  17          3HG1      VAL  17 -13.780  -0.154   1.553
  148   1HG2  VAL  17          1HG2      VAL  17 -13.627  -1.850   5.496
  149   2HG2  VAL  17          2HG2      VAL  17 -14.350  -0.261   5.252
  150   3HG2  VAL  17          3HG2      VAL  17 -15.162  -1.703   4.641

  No H/Q in entry =         150
  Start of MODEL   21
    1    H1   MET   1           H1       MET   1 -13.946   0.177  -2.506
    2    H2   MET   1           H2       MET   1 -13.929  -0.121  -0.840
    3    H3   MET   1           H3       MET   1 -15.023   0.994  -1.488
    4    HA   MET   1           HA       MET   1 -13.259   2.464  -2.119
    5   1HB   MET   1          1HB       MET   1 -14.207   1.990   0.418
    6   2HB   MET   1          2HB       MET   1 -12.470   1.915   0.683
    7   1HG   MET   1          1HG       MET   1 -12.163   4.142   0.184
    8   2HG   MET   1          2HG       MET   1 -13.621   4.235  -0.806
    9   1HE   MET   1          1HE       MET   1 -16.050   4.129   0.196
   10   2HE   MET   1          2HE       MET   1 -16.364   5.264   1.510
   11   3HE   MET   1          3HE       MET   1 -15.493   5.800   0.073
   12    H    GLN   2           H        GLN   2 -11.134   2.985  -2.470
   13    HA   GLN   2           HA       GLN   2  -8.996   1.042  -1.925
   14   1HB   GLN   2          1HB       GLN   2  -9.825   2.103  -4.586
   15   2HB   GLN   2          2HB       GLN   2  -8.096   2.055  -4.275
   16   1HG   GLN   2          1HG       GLN   2  -8.075  -0.273  -4.055
   17   2HG   GLN   2          2HG       GLN   2  -9.825  -0.359  -3.861
   18   2HE2  GLN   2          2HE2      GLN   2  -7.179  -0.092  -6.155
   19   1HE2  GLN   2          1HE2      GLN   2  -8.136  -0.358  -7.569
   20    H    ILE   3           H        ILE   3  -7.246   1.817  -1.020
   21    HA   ILE   3           HA       ILE   3  -6.284   4.532  -1.276
   22    HB   ILE   3           HB       ILE   3  -5.965   4.769   1.313
   23   1HG1  ILE   3          2HG1      ILE   3  -8.608   3.774   2.054
   24   2HG1  ILE   3          1HG1      ILE   3  -7.674   2.442   1.395
   25   1HG2  ILE   3          1HG2      ILE   3  -7.194   6.319  -0.078
   26   2HG2  ILE   3          2HG2      ILE   3  -8.644   5.324   0.049
   27   3HG2  ILE   3          3HG2      ILE   3  -7.994   6.123   1.481
   28   1HD1  ILE   3          1HD1      ILE   3  -6.548   4.195   3.540
   29   2HD1  ILE   3          2HD1      ILE   3  -7.629   2.852   3.913
   30   3HD1  ILE   3          3HD1      ILE   3  -6.096   2.550   3.093
   31    H    PHE   4           H        PHE   4  -4.249   4.500  -1.644
   32    HA   PHE   4           HA       PHE   4  -2.625   2.117  -1.266
   33   1HB   PHE   4          1HB       PHE   4  -2.596   4.494  -3.022
   34   2HB   PHE   4          2HB       PHE   4  -1.006   3.930  -2.560
   35    HD1  PHE   4           HD1      PHE   4  -4.257   2.914  -4.434
   36    HD2  PHE   4           HD2      PHE   4   0.073   1.960  -3.615
   37    HE1  PHE   4           HE1      PHE   4  -4.258   1.224  -6.390
   38    HE2  PHE   4           HE2      PHE   4   0.066   0.283  -5.590
   39    HZ   PHE   4           HZ       PHE   4  -2.093  -0.083  -6.983
   40    H    VAL   5           H        VAL   5  -0.714   1.875  -0.223
   41    HA   VAL   5           HA       VAL   5   0.573   3.987   1.303
   42    HB   VAL   5           HB       VAL   5   0.796   2.475   3.405
   43   1HG1  VAL   5          1HG1      VAL   5  -0.342   4.597   3.413
   44   2HG1  VAL   5          2HG1      VAL   5  -1.830   3.831   2.855
   45   3HG1  VAL   5          3HG1      VAL   5  -1.183   3.442   4.448
   46   1HG2  VAL   5          1HG2      VAL   5  -0.395   0.427   2.455
   47   2HG2  VAL   5          2HG2      VAL   5  -0.937   0.957   4.048
   48   3HG2  VAL   5          3HG2      VAL   5  -1.901   1.329   2.620
   49    H    LYS   6           H        LYS   6   2.711   3.902   1.201
   50    HA   LYS   6           HA       LYS   6   4.088   1.428   0.326
   51   1HB   LYS   6          1HB       LYS   6   4.263   4.231  -0.706
   52   2HB   LYS   6          2HB       LYS   6   5.734   3.271  -0.698
   53   1HG   LYS   6          1HG       LYS   6   4.411   1.506  -1.968
   54   2HG   LYS   6          2HG       LYS   6   3.175   2.745  -2.186
   55   1HD   LYS   6          1HD       LYS   6   5.040   4.201  -3.145
   56   2HD   LYS   6          2HD       LYS   6   6.008   2.727  -3.200
   57   1HE   LYS   6          1HE       LYS   6   4.410   1.677  -4.667
   58   2HE   LYS   6          2HE       LYS   6   3.317   3.054  -4.520
   59   1HZ   LYS   6          1HZ       LYS   6   6.024   3.119  -5.741
   60   2HZ   LYS   6          2HZ       LYS   6   4.559   3.126  -6.589
   61   3HZ   LYS   6          3HZ       LYS   6   4.974   4.437  -5.605
   62    H    THR   7           H        THR   7   6.069   0.891   1.134
   63    HA   THR   7           HA       THR   7   6.937   2.043   3.688
   64    HB   THR   7           HB       THR   7   8.582   0.017   3.590
   65    HG1  THR   7           HG1      THR   7   8.428  -1.072   1.800
   66   1HG2  THR   7          1HG2      THR   7   6.561   0.251   5.077
   67   2HG2  THR   7          2HG2      THR   7   5.660  -0.663   3.867
   68   3HG2  THR   7          3HG2      THR   7   7.026  -1.406   4.696
   69    H    LEU   8           H        LEU   8   8.068   1.792   0.346
   70    HA   LEU   8           HA       LEU   8   9.630   2.770  -0.955
   71   1HB   LEU   8          1HB       LEU   8  10.106   4.471   1.481
   72   2HB   LEU   8          2HB       LEU   8  11.305   4.509   0.206
   73    HG   LEU   8           HG       LEU   8   8.797   4.843  -1.103
   74   1HD1  LEU   8          1HD1      LEU   8   7.891   5.417   1.161
   75   2HD1  LEU   8          2HD1      LEU   8   8.976   6.807   1.169
   76   3HD1  LEU   8          3HD1      LEU   8   7.717   6.678  -0.059
   77   1HD2  LEU   8          1HD2      LEU   8  10.894   5.848  -1.832
   78   2HD2  LEU   8          2HD2      LEU   8   9.630   7.067  -1.669
   79   3HD2  LEU   8          3HD2      LEU   8  10.879   6.921  -0.432
   80    H    ASP   9           H        ASP   9  10.418   0.722   1.586
   81    HA   ASP   9           HA       ASP   9  13.266   0.381   1.335
   82   1HB   ASP   9          1HB       ASP   9  11.310  -0.466   3.151
   83   2HB   ASP   9          2HB       ASP   9  11.914  -1.950   2.427
   84    H    GLY  10           H        GLY  10  10.433  -1.250  -0.141
   85   1HA   GLY  10          2HA       GLY  10  11.817  -3.437  -1.401
   86   2HA   GLY  10          1HA       GLY  10  11.568  -2.106  -2.514
   87    H    LYS  11           H        LYS  11   9.520  -3.578   0.054
   88    HA   LYS  11           HA       LYS  11   7.610  -4.764  -1.737
   89   1HB   LYS  11          1HB       LYS  11   6.323  -5.382   0.371
   90   2HB   LYS  11          2HB       LYS  11   7.930  -6.036   0.223
   91   1HG   LYS  11          1HG       LYS  11   8.188  -5.448   2.380
   92   2HG   LYS  11          2HG       LYS  11   8.400  -3.805   1.781
   93   1HD   LYS  11          1HD       LYS  11   6.201  -3.195   2.325
   94   2HD   LYS  11          2HD       LYS  11   5.661  -4.871   2.429
   95   1HE   LYS  11          1HE       LYS  11   6.981  -5.178   4.458
   96   2HE   LYS  11          2HE       LYS  11   7.564  -3.518   4.343
   97   1HZ   LYS  11          1HZ       LYS  11   5.204  -2.804   4.519
   98   2HZ   LYS  11          2HZ       LYS  11   4.778  -4.408   4.841
   99   3HZ   LYS  11          3HZ       LYS  11   5.793  -3.572   5.905
  100    H    THR  12           H        THR  12   5.423  -4.386  -2.095
  101    HA   THR  12           HA       THR  12   4.178  -1.840  -1.274
  102    HB   THR  12           HB       THR  12   3.186  -1.678  -3.666
  103    HG1  THR  12           HG1      THR  12   4.403  -2.568  -5.313
  104   1HG2  THR  12          1HG2      THR  12   4.812  -0.063  -2.673
  105   2HG2  THR  12          2HG2      THR  12   6.117  -1.005  -3.395
  106   3HG2  THR  12          3HG2      THR  12   4.926  -0.209  -4.426
  107    H    ILE  13           H        ILE  13   2.070  -1.980  -0.718
  108    HA   ILE  13           HA       ILE  13   0.283  -4.115  -1.581
  109    HB   ILE  13           HB       ILE  13  -0.506  -4.619   0.823
  110   1HG1  ILE  13          1HG1      ILE  13   2.127  -4.570   2.111
  111   2HG1  ILE  13          2HG1      ILE  13   1.695  -2.937   1.629
  112   1HG2  ILE  13          1HG2      ILE  13   2.059  -5.759  -0.254
  113   2HG2  ILE  13          2HG2      ILE  13   1.131  -6.480   1.062
  114   3HG2  ILE  13          3HG2      ILE  13   0.409  -6.317  -0.539
  115   1HD1  ILE  13          1HD1      ILE  13  -0.064  -4.726   3.290
  116   2HD1  ILE  13          2HD1      ILE  13   1.048  -3.525   3.949
  117   3HD1  ILE  13          3HD1      ILE  13  -0.309  -3.013   2.944
  118    H    THR  14           H        THR  14  -1.877  -3.703  -1.553
  119    HA   THR  14           HA       THR  14  -2.775  -0.945  -1.161
  120    HB   THR  14           HB       THR  14  -5.004  -1.852  -2.095
  121    HG1  THR  14           HG1      THR  14  -4.617  -4.076  -1.848
  122   1HG2  THR  14          1HG2      THR  14  -2.508  -1.450  -3.621
  123   2HG2  THR  14          2HG2      THR  14  -3.878  -2.163  -4.473
  124   3HG2  THR  14          3HG2      THR  14  -4.055  -0.598  -3.684
  125    H    LEU  15           H        LEU  15  -4.403  -0.222   0.177
  126    HA   LEU  15           HA       LEU  15  -5.356  -2.006   2.317
  127   1HB   LEU  15          1HB       LEU  15  -3.909   0.326   2.633
  128   2HB   LEU  15          2HB       LEU  15  -5.551   0.905   2.818
  129    HG   LEU  15           HG       LEU  15  -5.235  -1.488   4.428
  130   1HD1  LEU  15          1HD1      LEU  15  -3.154   0.622   4.957
  131   2HD1  LEU  15          2HD1      LEU  15  -3.599  -0.667   6.074
  132   3HD1  LEU  15          3HD1      LEU  15  -2.873  -1.063   4.517
  133   1HD2  LEU  15          1HD2      LEU  15  -6.911   0.233   4.852
  134   2HD2  LEU  15          2HD2      LEU  15  -5.897  -0.032   6.271
  135   3HD2  LEU  15          3HD2      LEU  15  -5.639   1.385   5.255
  136    H    GLU  16           H        GLU  16  -7.255  -2.765   1.822
  137    HA   GLU  16           HA       GLU  16  -9.389  -1.065   0.687
  138   1HB   GLU  16          1HB       GLU  16  -8.363  -3.731  -0.161
  139   2HB   GLU  16          2HB       GLU  16 -10.099  -3.484  -0.262
  140   1HG   GLU  16          1HG       GLU  16  -9.406  -1.294  -1.532
  141   2HG   GLU  16          2HG       GLU  16  -7.893  -2.158  -1.782
  142    H    VAL  17           H        VAL  17 -11.493  -1.305   1.380
  143    HA   VAL  17           HA       VAL  17 -12.077  -3.108   3.628
  144    HB   VAL  17           HB       VAL  17 -11.628  -0.736   4.374
  145   1HG1  VAL  17          1HG1      VAL  17 -12.656   0.637   2.663
  146   2HG1  VAL  17          2HG1      VAL  17 -14.258   0.077   3.143
  147   3HG1  VAL  17          3HG1      VAL  17 -13.292   1.040   4.259
  148   1HG2  VAL  17          1HG2      VAL  17 -12.811  -2.228   5.846
  149   2HG2  VAL  17          2HG2      VAL  17 -13.419  -0.582   6.029
  150   3HG2  VAL  17          3HG2      VAL  17 -14.352  -1.773   5.122

  No H/Q in entry =         150
  Start of MODEL   22
    1    H1   MET   1           H1       MET   1 -13.885   1.154  -3.182
    2    H2   MET   1           H2       MET   1 -14.231   1.105  -1.526
    3    H3   MET   1           H3       MET   1 -14.846   2.356  -2.483
    4    HA   MET   1           HA       MET   1 -12.655   3.211  -2.888
    5   1HB   MET   1          1HB       MET   1 -14.125   3.376  -0.562
    6   2HB   MET   1          2HB       MET   1 -12.540   2.932   0.053
    7   1HG   MET   1          1HG       MET   1 -11.556   4.899  -0.710
    8   2HG   MET   1          2HG       MET   1 -12.860   5.221  -1.855
    9   1HE   MET   1          1HE       MET   1 -15.310   5.865  -1.107
   10   2HE   MET   1          2HE       MET   1 -15.394   7.221   0.020
   11   3HE   MET   1          3HE       MET   1 -14.311   7.295  -1.371
   12    H    GLN   2           H        GLN   2 -10.421   3.157  -2.744
   13    HA   GLN   2           HA       GLN   2  -9.027   0.856  -1.579
   14   1HB   GLN   2          1HB       GLN   2  -9.433   1.000  -4.323
   15   2HB   GLN   2          2HB       GLN   2  -7.854   1.749  -4.145
   16   1HG   GLN   2          1HG       GLN   2  -6.934  -0.209  -3.174
   17   2HG   GLN   2          2HG       GLN   2  -8.520  -0.945  -2.994
   18   2HE2  GLN   2          2HE2      GLN   2  -9.497  -1.955  -4.788
   19   1HE2  GLN   2          1HE2      GLN   2  -8.626  -2.250  -6.250
   20    H    ILE   3           H        ILE   3  -7.306   1.381  -0.409
   21    HA   ILE   3           HA       ILE   3  -6.084   4.029  -0.671
   22    HB   ILE   3           HB       ILE   3  -7.760   3.831   1.220
   23   1HG1  ILE   3          1HG1      ILE   3  -5.618   4.816   2.850
   24   2HG1  ILE   3          2HG1      ILE   3  -5.229   5.190   1.181
   25   1HG2  ILE   3          1HG2      ILE   3  -5.838   1.936   2.480
   26   2HG2  ILE   3          2HG2      ILE   3  -6.800   3.017   3.490
   27   3HG2  ILE   3          3HG2      ILE   3  -7.599   1.888   2.392
   28   1HD1  ILE   3          1HD1      ILE   3  -7.980   5.820   2.075
   29   2HD1  ILE   3          2HD1      ILE   3  -6.666   6.802   2.727
   30   3HD1  ILE   3          3HD1      ILE   3  -6.905   6.695   0.983
   31    H    PHE   4           H        PHE   4  -4.059   3.993  -1.257
   32    HA   PHE   4           HA       PHE   4  -2.368   1.616  -0.950
   33   1HB   PHE   4          1HB       PHE   4  -2.651   3.756  -2.980
   34   2HB   PHE   4          2HB       PHE   4  -0.998   3.268  -2.667
   35    HD1  PHE   4           HD1      PHE   4  -4.405   2.115  -4.078
   36    HD2  PHE   4           HD2      PHE   4  -0.059   1.056  -3.478
   37    HE1  PHE   4           HE1      PHE   4  -4.635   0.185  -5.775
   38    HE2  PHE   4           HE2      PHE   4  -0.303  -0.868  -5.191
   39    HZ   PHE   4           HZ       PHE   4  -2.588  -1.307  -6.343
   40    H    VAL   5           H        VAL   5  -0.419   1.535   0.016
   41    HA   VAL   5           HA       VAL   5   0.841   3.907   1.179
   42    HB   VAL   5           HB       VAL   5  -0.668   2.863   2.922
   43   1HG1  VAL   5          1HG1      VAL   5  -0.281   0.438   2.420
   44   2HG1  VAL   5          2HG1      VAL   5   1.252   0.575   3.280
   45   3HG1  VAL   5          3HG1      VAL   5  -0.266   0.878   4.128
   46   1HG2  VAL   5          1HG2      VAL   5   1.423   4.235   3.439
   47   2HG2  VAL   5          2HG2      VAL   5   0.663   3.337   4.752
   48   3HG2  VAL   5          3HG2      VAL   5   2.124   2.713   3.986
   49    H    LYS   6           H        LYS   6   2.943   4.062   0.723
   50    HA   LYS   6           HA       LYS   6   4.480   1.737  -0.258
   51   1HB   LYS   6          1HB       LYS   6   3.857   4.013  -1.648
   52   2HB   LYS   6          2HB       LYS   6   5.431   4.443  -1.000
   53   1HG   LYS   6          1HG       LYS   6   6.509   2.694  -2.146
   54   2HG   LYS   6          2HG       LYS   6   4.990   1.869  -2.493
   55   1HD   LYS   6          1HD       LYS   6   4.458   3.262  -4.244
   56   2HD   LYS   6          2HD       LYS   6   5.363   4.629  -3.589
   57   1HE   LYS   6          1HE       LYS   6   7.450   3.633  -4.246
   58   2HE   LYS   6          2HE       LYS   6   6.637   2.146  -4.735
   59   1HZ   LYS   6          1HZ       LYS   6   6.144   4.790  -5.989
   60   2HZ   LYS   6          2HZ       LYS   6   7.225   3.642  -6.602
   61   3HZ   LYS   6          3HZ       LYS   6   5.574   3.289  -6.520
   62    H    THR   7           H        THR   7   6.568   1.358   0.367
   63    HA   THR   7           HA       THR   7   7.734   2.861   2.644
   64    HB   THR   7           HB       THR   7   8.903   0.623   3.207
   65    HG1  THR   7           HG1      THR   7   8.423  -0.898   1.832
   66   1HG2  THR   7          1HG2      THR   7   6.010   1.196   3.752
   67   2HG2  THR   7          2HG2      THR   7   6.780  -0.254   4.400
   68   3HG2  THR   7          3HG2      THR   7   7.399   1.342   4.829
   69    H    LEU   8           H        LEU   8   9.961   3.203   2.740
   70    HA   LEU   8           HA       LEU   8  11.423   3.618   0.323
   71   1HB   LEU   8          1HB       LEU   8  11.902   4.033   3.230
   72   2HB   LEU   8          2HB       LEU   8  13.323   3.979   2.208
   73    HG   LEU   8           HG       LEU   8  11.472   5.741   0.910
   74   1HD1  LEU   8          1HD1      LEU   8  11.720   6.348   3.851
   75   2HD1  LEU   8          2HD1      LEU   8  11.206   7.511   2.627
   76   3HD1  LEU   8          3HD1      LEU   8  10.240   6.067   2.933
   77   1HD2  LEU   8          1HD2      LEU   8  13.903   5.914   0.775
   78   2HD2  LEU   8          2HD2      LEU   8  13.178   7.440   1.281
   79   3HD2  LEU   8          3HD2      LEU   8  13.970   6.403   2.468
   80    H    ASP   9           H        ASP   9  11.232   0.778   2.307
   81    HA   ASP   9           HA       ASP   9  13.789  -0.459   1.846
   82   1HB   ASP   9          1HB       ASP   9  11.767  -0.927   3.623
   83   2HB   ASP   9          2HB       ASP   9  11.536  -2.258   2.497
   84    H    GLY  10           H        GLY  10  10.599  -0.730   0.213
   85   1HA   GLY  10          2HA       GLY  10  11.759  -2.419  -1.944
   86   2HA   GLY  10          1HA       GLY  10  10.688  -1.066  -2.264
   87    H    LYS  11           H        LYS  11   8.565  -1.272  -0.724
   88    HA   LYS  11           HA       LYS  11   7.244  -3.818  -1.424
   89   1HB   LYS  11          1HB       LYS  11   7.412  -2.571   1.298
   90   2HB   LYS  11          2HB       LYS  11   5.919  -3.374   0.843
   91   1HG   LYS  11          1HG       LYS  11   7.131  -5.450   0.476
   92   2HG   LYS  11          2HG       LYS  11   8.650  -4.641   0.882
   93   1HD   LYS  11          1HD       LYS  11   7.604  -4.057   3.110
   94   2HD   LYS  11          2HD       LYS  11   6.289  -5.151   2.688
   95   1HE   LYS  11          1HE       LYS  11   9.098  -6.162   2.553
   96   2HE   LYS  11          2HE       LYS  11   8.344  -5.941   4.129
   97   1HZ   LYS  11          1HZ       LYS  11   6.530  -7.383   3.421
   98   2HZ   LYS  11          2HZ       LYS  11   7.276  -7.616   1.921
   99   3HZ   LYS  11          3HZ       LYS  11   8.017  -8.185   3.330
  100    H    THR  12           H        THR  12   5.091  -3.723  -2.018
  101    HA   THR  12           HA       THR  12   3.550  -1.240  -1.900
  102    HB   THR  12           HB       THR  12   2.761  -1.654  -4.349
  103    HG1  THR  12           HG1      THR  12   5.301  -2.946  -4.432
  104   1HG2  THR  12          1HG2      THR  12   4.158   0.290  -3.497
  105   2HG2  THR  12          2HG2      THR  12   5.564  -0.578  -4.114
  106   3HG2  THR  12          3HG2      THR  12   4.287  -0.071  -5.219
  107    H    ILE  13           H        ILE  13   1.716  -1.664  -0.959
  108    HA   ILE  13           HA       ILE  13  -0.016  -3.910  -1.604
  109    HB   ILE  13           HB       ILE  13  -0.446  -4.477   0.881
  110   1HG1  ILE  13          1HG1      ILE  13   2.367  -4.199   1.750
  111   2HG1  ILE  13          2HG1      ILE  13   1.646  -2.627   1.451
  112   1HG2  ILE  13          1HG2      ILE  13   2.050  -5.453  -0.495
  113   2HG2  ILE  13          2HG2      ILE  13   1.275  -6.256   0.872
  114   3HG2  ILE  13          3HG2      ILE  13   0.412  -6.087  -0.658
  115   1HD1  ILE  13          1HD1      ILE  13   0.405  -4.694   3.250
  116   2HD1  ILE  13          2HD1      ILE  13   1.515  -3.443   3.812
  117   3HD1  ILE  13          3HD1      ILE  13  -0.035  -2.992   3.095
  118    H    THR  14           H        THR  14  -2.170  -3.573  -1.339
  119    HA   THR  14           HA       THR  14  -3.057  -1.016  -0.184
  120    HB   THR  14           HB       THR  14  -3.273  -0.787  -2.586
  121    HG1  THR  14           HG1      THR  14  -5.323  -0.023  -2.625
  122   1HG2  THR  14          1HG2      THR  14  -4.928  -3.317  -2.615
  123   2HG2  THR  14          2HG2      THR  14  -5.106  -2.075  -3.859
  124   3HG2  THR  14          3HG2      THR  14  -3.554  -2.882  -3.632
  125    H    LEU  15           H        LEU  15  -5.002  -0.815   0.892
  126    HA   LEU  15           HA       LEU  15  -6.226  -3.258   2.005
  127   1HB   LEU  15          1HB       LEU  15  -4.782  -1.409   3.386
  128   2HB   LEU  15          2HB       LEU  15  -6.392  -0.737   3.558
  129    HG   LEU  15           HG       LEU  15  -6.523  -3.568   4.173
  130   1HD1  LEU  15          1HD1      LEU  15  -4.101  -3.331   4.662
  131   2HD1  LEU  15          2HD1      LEU  15  -4.508  -2.125   5.882
  132   3HD1  LEU  15          3HD1      LEU  15  -5.076  -3.784   6.059
  133   1HD2  LEU  15          1HD2      LEU  15  -8.076  -1.831   4.994
  134   2HD2  LEU  15          2HD2      LEU  15  -7.418  -2.831   6.289
  135   3HD2  LEU  15          3HD2      LEU  15  -6.793  -1.202   6.028
  136    H    GLU  16           H        GLU  16  -8.382  -3.522   1.940
  137    HA   GLU  16           HA       GLU  16 -10.179  -1.357   1.032
  138   1HB   GLU  16          1HB       GLU  16  -9.769  -4.077  -0.145
  139   2HB   GLU  16          2HB       GLU  16 -11.402  -3.429  -0.137
  140   1HG   GLU  16          1HG       GLU  16 -10.360  -1.346  -1.242
  141   2HG   GLU  16          2HG       GLU  16  -8.970  -2.380  -1.556
  142    H    VAL  17           H        VAL  17 -12.240  -1.261   1.837
  143    HA   VAL  17           HA       VAL  17 -12.888  -2.901   4.194
  144    HB   VAL  17           HB       VAL  17 -14.687  -1.113   4.706
  145   1HG1  VAL  17          1HG1      VAL  17 -12.548  -1.489   5.922
  146   2HG1  VAL  17          2HG1      VAL  17 -11.848  -0.179   4.971
  147   3HG1  VAL  17          3HG1      VAL  17 -13.206   0.142   6.047
  148   1HG2  VAL  17          1HG2      VAL  17 -14.491   0.164   2.491
  149   2HG2  VAL  17          2HG2      VAL  17 -14.477   1.142   3.959
  150   3HG2  VAL  17          3HG2      VAL  17 -12.969   0.806   3.106

  No H/Q in entry =         150
  Start of MODEL   23
    1    H1   MET   1           H1       MET   1 -14.124   0.424  -2.191
    2    H2   MET   1           H2       MET   1 -14.064   0.164  -0.521
    3    H3   MET   1           H3       MET   1 -15.112   1.330  -1.158
    4    HA   MET   1           HA       MET   1 -13.287   2.675  -1.887
    5   1HB   MET   1          1HB       MET   1 -14.169   2.320   0.692
    6   2HB   MET   1          2HB       MET   1 -12.432   2.139   0.900
    7   1HG   MET   1          1HG       MET   1 -12.007   4.331   0.388
    8   2HG   MET   1          2HG       MET   1 -13.440   4.492  -0.627
    9   1HE   MET   1          1HE       MET   1 -15.866   4.569   0.309
   10   2HE   MET   1          2HE       MET   1 -16.164   5.712   1.621
   11   3HE   MET   1          3HE       MET   1 -15.236   6.214   0.208
   12    H    GLN   2           H        GLN   2 -11.146   3.065  -2.312
   13    HA   GLN   2           HA       GLN   2  -9.113   1.000  -1.810
   14   1HB   GLN   2          1HB       GLN   2  -9.906   2.153  -4.461
   15   2HB   GLN   2          2HB       GLN   2  -8.199   1.839  -4.181
   16   1HG   GLN   2          1HG       GLN   2  -8.506  -0.452  -4.020
   17   2HG   GLN   2          2HG       GLN   2 -10.227  -0.299  -3.667
   18   2HE2  GLN   2          2HE2      GLN   2  -7.787  -0.377  -6.195
   19   1HE2  GLN   2          1HE2      GLN   2  -8.895  -0.500  -7.514
   20    H    ILE   3           H        ILE   3  -7.298   1.680  -0.954
   21    HA   ILE   3           HA       ILE   3  -6.198   4.343  -1.264
   22    HB   ILE   3           HB       ILE   3  -5.781   4.559   1.313
   23   1HG1  ILE   3          1HG1      ILE   3  -8.436   3.695   2.156
   24   2HG1  ILE   3          2HG1      ILE   3  -7.608   2.319   1.447
   25   1HG2  ILE   3          1HG2      ILE   3  -8.432   5.254   0.067
   26   2HG2  ILE   3          2HG2      ILE   3  -7.810   5.959   1.558
   27   3HG2  ILE   3          3HG2      ILE   3  -6.948   6.206   0.038
   28   1HD1  ILE   3          1HD1      ILE   3  -6.198   3.956   3.495
   29   2HD1  ILE   3          2HD1      ILE   3  -7.449   2.816   3.992
   30   3HD1  ILE   3          3HD1      ILE   3  -6.034   2.243   3.107
   31    H    PHE   4           H        PHE   4  -4.172   4.203  -1.701
   32    HA   PHE   4           HA       PHE   4  -2.647   1.745  -1.335
   33   1HB   PHE   4          1HB       PHE   4  -2.562   4.094  -3.132
   34   2HB   PHE   4          2HB       PHE   4  -0.993   3.435  -2.725
   35    HD1  PHE   4           HD1      PHE   4  -4.384   2.581  -4.442
   36    HD2  PHE   4           HD2      PHE   4  -0.070   1.431  -3.822
   37    HE1  PHE   4           HE1      PHE   4  -4.552   0.898  -6.397
   38    HE2  PHE   4           HE2      PHE   4  -0.250  -0.259  -5.777
   39    HZ   PHE   4           HZ       PHE   4  -2.483  -0.521  -7.074
   40    H    VAL   5           H        VAL   5  -0.714   1.448  -0.321
   41    HA   VAL   5           HA       VAL   5   0.536   3.578   1.248
   42    HB   VAL   5           HB       VAL   5  -1.096   2.337   2.731
   43   1HG1  VAL   5          1HG1      VAL   5  -0.767   0.005   1.905
   44   2HG1  VAL   5          2HG1      VAL   5   0.742  -0.044   2.817
   45   3HG1  VAL   5          3HG1      VAL   5  -0.792   0.183   3.658
   46   1HG2  VAL   5          1HG2      VAL   5   0.862   3.587   3.632
   47   2HG2  VAL   5          2HG2      VAL   5   0.206   2.348   4.703
   48   3HG2  VAL   5          3HG2      VAL   5   1.693   2.042   3.808
   49    H    LYS   6           H        LYS   6   2.655   3.741   0.898
   50    HA   LYS   6           HA       LYS   6   4.207   1.508  -0.264
   51   1HB   LYS   6          1HB       LYS   6   3.621   3.886  -1.494
   52   2HB   LYS   6          2HB       LYS   6   5.180   4.257  -0.777
   53   1HG   LYS   6          1HG       LYS   6   6.287   2.620  -2.038
   54   2HG   LYS   6          2HG       LYS   6   4.788   1.790  -2.447
   55   1HD   LYS   6          1HD       LYS   6   4.282   3.225  -4.153
   56   2HD   LYS   6          2HD       LYS   6   5.049   4.612  -3.382
   57   1HE   LYS   6          1HE       LYS   6   6.515   4.272  -5.096
   58   2HE   LYS   6          2HE       LYS   6   7.257   3.220  -3.893
   59   1HZ   LYS   6          1HZ       LYS   6   5.335   2.292  -5.962
   60   2HZ   LYS   6          2HZ       LYS   6   7.016   2.200  -6.121
   61   3HZ   LYS   6          3HZ       LYS   6   6.235   1.326  -4.902
   62    H    THR   7           H        THR   7   6.289   1.093   0.371
   63    HA   THR   7           HA       THR   7   7.348   2.360   2.835
   64    HB   THR   7           HB       THR   7   8.627   0.121   3.106
   65    HG1  THR   7           HG1      THR   7   8.136  -0.866   1.160
   66   1HG2  THR   7          1HG2      THR   7   5.718   0.531   3.676
   67   2HG2  THR   7          2HG2      THR   7   6.483  -1.006   4.080
   68   3HG2  THR   7          3HG2      THR   7   7.085   0.493   4.790
   69    H    LEU   8           H        LEU   8   9.535   2.828   3.045
   70    HA   LEU   8           HA       LEU   8  11.029   3.611   0.730
   71   1HB   LEU   8          1HB       LEU   8  11.001   4.234   3.469
   72   2HB   LEU   8          2HB       LEU   8  12.600   3.586   3.179
   73    HG   LEU   8           HG       LEU   8  12.150   5.437   1.063
   74   1HD1  LEU   8          1HD1      LEU   8  11.275   6.601   3.703
   75   2HD1  LEU   8          2HD1      LEU   8  11.743   7.555   2.294
   76   3HD1  LEU   8          3HD1      LEU   8  10.336   6.494   2.213
   77   1HD2  LEU   8          1HD2      LEU   8  14.313   4.986   2.097
   78   2HD2  LEU   8          2HD2      LEU   8  13.965   6.714   2.074
   79   3HD2  LEU   8          3HD2      LEU   8  13.788   5.800   3.572
   80    H    ASP   9           H        ASP   9  11.039   0.617   2.514
   81    HA   ASP   9           HA       ASP   9  13.694  -0.368   2.019
   82   1HB   ASP   9          1HB       ASP   9  11.750  -1.122   3.738
   83   2HB   ASP   9          2HB       ASP   9  11.529  -2.347   2.496
   84    H    GLY  10           H        GLY  10  10.591  -0.735   0.264
   85   1HA   GLY  10          2HA       GLY  10  11.920  -2.185  -1.966
   86   2HA   GLY  10          1HA       GLY  10  10.763  -0.894  -2.220
   87    H    LYS  11           H        LYS  11   8.660  -1.444  -0.606
   88    HA   LYS  11           HA       LYS  11   7.492  -3.923  -1.687
   89   1HB   LYS  11          1HB       LYS  11   7.936  -3.322   1.163
   90   2HB   LYS  11          2HB       LYS  11   6.267  -3.718   0.806
   91   1HG   LYS  11          1HG       LYS  11   6.762  -5.874   0.885
   92   2HG   LYS  11          2HG       LYS  11   7.806  -5.686  -0.515
   93   1HD   LYS  11          1HD       LYS  11   9.579  -6.218   0.742
   94   2HD   LYS  11          2HD       LYS  11   9.321  -4.784   1.728
   95   1HE   LYS  11          1HE       LYS  11   9.253  -6.393   3.352
   96   2HE   LYS  11          2HE       LYS  11   7.545  -6.362   2.919
   97   1HZ   LYS  11          1HZ       LYS  11   8.058  -8.226   1.354
   98   2HZ   LYS  11          2HZ       LYS  11   9.593  -8.326   2.055
   99   3HZ   LYS  11          3HZ       LYS  11   8.217  -8.614   2.993
  100    H    THR  12           H        THR  12   5.327  -3.876  -2.218
  101    HA   THR  12           HA       THR  12   3.701  -1.469  -1.729
  102    HB   THR  12           HB       THR  12   2.782  -1.732  -4.145
  103    HG1  THR  12           HG1      THR  12   3.758  -3.195  -5.300
  104   1HG2  THR  12          1HG2      THR  12   5.436  -0.476  -3.496
  105   2HG2  THR  12          2HG2      THR  12   4.684  -0.301  -5.082
  106   3HG2  THR  12          3HG2      THR  12   3.857   0.295  -3.643
  107    H    ILE  13           H        ILE  13   1.712  -1.847  -1.060
  108    HA   ILE  13           HA       ILE  13   0.115  -4.176  -1.726
  109    HB   ILE  13           HB       ILE  13  -0.505  -4.639   0.747
  110   1HG1  ILE  13          1HG1      ILE  13   2.202  -4.349   1.847
  111   2HG1  ILE  13          2HG1      ILE  13   1.601  -2.775   1.356
  112   1HG2  ILE  13          1HG2      ILE  13   2.070  -5.641  -0.439
  113   2HG2  ILE  13          2HG2      ILE  13   1.256  -6.379   0.941
  114   3HG2  ILE  13          3HG2      ILE  13   0.451  -6.314  -0.629
  115   1HD1  ILE  13          1HD1      ILE  13   0.074  -4.636   3.157
  116   2HD1  ILE  13          2HD1      ILE  13   1.186  -3.398   3.744
  117   3HD1  ILE  13          3HD1      ILE  13  -0.254  -2.932   2.837
  118    H    THR  14           H        THR  14  -2.065  -3.891  -1.660
  119    HA   THR  14           HA       THR  14  -3.105  -1.185  -1.296
  120    HB   THR  14           HB       THR  14  -5.313  -2.205  -2.113
  121    HG1  THR  14           HG1      THR  14  -3.575  -4.382  -2.742
  122   1HG2  THR  14          1HG2      THR  14  -3.448  -1.016  -3.525
  123   2HG2  THR  14          2HG2      THR  14  -3.318  -2.614  -4.263
  124   3HG2  THR  14          3HG2      THR  14  -4.863  -1.759  -4.275
  125    H    LEU  15           H        LEU  15  -4.695  -0.489   0.069
  126    HA   LEU  15           HA       LEU  15  -5.559  -2.225   2.282
  127   1HB   LEU  15          1HB       LEU  15  -4.055   0.129   2.468
  128   2HB   LEU  15          2HB       LEU  15  -5.681   0.657   2.845
  129    HG   LEU  15           HG       LEU  15  -5.125  -1.760   4.351
  130   1HD1  LEU  15          1HD1      LEU  15  -3.070   0.411   4.729
  131   2HD1  LEU  15          2HD1      LEU  15  -3.337  -0.951   5.819
  132   3HD1  LEU  15          3HD1      LEU  15  -2.774  -1.236   4.172
  133   1HD2  LEU  15          1HD2      LEU  15  -6.785  -0.025   4.945
  134   2HD2  LEU  15          2HD2      LEU  15  -5.692  -0.418   6.271
  135   3HD2  LEU  15          3HD2      LEU  15  -5.461   1.068   5.348
  136    H    GLU  16           H        GLU  16  -7.511  -2.908   1.866
  137    HA   GLU  16           HA       GLU  16  -9.614  -1.122   0.811
  138   1HB   GLU  16          1HB       GLU  16  -8.735  -3.828  -0.078
  139   2HB   GLU  16          2HB       GLU  16 -10.462  -3.505  -0.112
  140   1HG   GLU  16          1HG       GLU  16  -9.703  -1.335  -1.400
  141   2HG   GLU  16          2HG       GLU  16  -8.263  -2.294  -1.728
  142    H    VAL  17           H        VAL  17 -11.695  -1.274   1.588
  143    HA   VAL  17           HA       VAL  17 -12.450  -3.221   3.635
  144    HB   VAL  17           HB       VAL  17 -13.535  -1.373   5.088
  145   1HG1  VAL  17          1HG1      VAL  17 -11.666  -2.833   5.749
  146   2HG1  VAL  17          2HG1      VAL  17 -10.542  -1.584   5.213
  147   3HG1  VAL  17          3HG1      VAL  17 -11.654  -1.258   6.543
  148   1HG2  VAL  17          1HG2      VAL  17 -13.092   0.639   3.686
  149   2HG2  VAL  17          2HG2      VAL  17 -12.414   0.791   5.309
  150   3HG2  VAL  17          3HG2      VAL  17 -11.361   0.420   3.944

  No H/Q in entry =         150
  Start of MODEL   24
    1    H1   MET   1           H1       MET   1 -13.630   0.543  -2.478
    2    H2   MET   1           H2       MET   1 -13.989   0.613  -0.827
    3    H3   MET   1           H3       MET   1 -14.788   1.638  -1.912
    4    HA   MET   1           HA       MET   1 -12.885   2.888  -2.351
    5   1HB   MET   1          1HB       MET   1 -12.099   3.644  -0.010
    6   2HB   MET   1          2HB       MET   1 -13.799   3.802  -0.378
    7   1HG   MET   1          1HG       MET   1 -13.908   1.480   0.957
    8   2HG   MET   1          2HG       MET   1 -12.418   2.111   1.656
    9   1HE   MET   1          1HE       MET   1 -12.145   4.250   2.790
   10   2HE   MET   1          2HE       MET   1 -13.374   4.953   3.842
   11   3HE   MET   1          3HE       MET   1 -12.805   3.306   4.126
   12    H    GLN   2           H        GLN   2 -10.771   3.179  -2.720
   13    HA   GLN   2           HA       GLN   2  -8.834   1.118  -1.886
   14   1HB   GLN   2          1HB       GLN   2  -9.298   2.296  -4.604
   15   2HB   GLN   2          2HB       GLN   2  -7.644   1.915  -4.139
   16   1HG   GLN   2          1HG       GLN   2  -8.116  -0.379  -3.923
   17   2HG   GLN   2          2HG       GLN   2  -9.857  -0.108  -3.949
   18   2HE2  GLN   2          2HE2      GLN   2  -6.945  -0.391  -5.898
   19   1HE2  GLN   2          1HE2      GLN   2  -7.754  -0.476  -7.422
   20    H    ILE   3           H        ILE   3  -7.073   1.739  -0.883
   21    HA   ILE   3           HA       ILE   3  -5.974   4.428  -1.023
   22    HB   ILE   3           HB       ILE   3  -5.676   4.476   1.575
   23   1HG1  ILE   3          1HG1      ILE   3  -8.349   3.473   2.213
   24   2HG1  ILE   3          2HG1      ILE   3  -7.416   2.175   1.489
   25   1HG2  ILE   3          1HG2      ILE   3  -6.848   6.163   0.329
   26   2HG2  ILE   3          2HG2      ILE   3  -8.311   5.177   0.291
   27   3HG2  ILE   3          3HG2      ILE   3  -7.723   5.826   1.822
   28   1HD1  ILE   3          1HD1      ILE   3  -6.096   3.707   3.640
   29   2HD1  ILE   3          2HD1      ILE   3  -7.453   2.676   4.096
   30   3HD1  ILE   3          3HD1      ILE   3  -6.054   1.982   3.275
   31    H    PHE   4           H        PHE   4  -3.920   4.399  -1.337
   32    HA   PHE   4           HA       PHE   4  -2.327   1.979  -0.865
   33   1HB   PHE   4          1HB       PHE   4  -2.487   3.994  -2.998
   34   2HB   PHE   4          2HB       PHE   4  -0.837   3.654  -2.520
   35    HD1  PHE   4           HD1      PHE   4  -3.998   2.192  -4.170
   36    HD2  PHE   4           HD2      PHE   4   0.326   1.468  -3.100
   37    HE1  PHE   4           HE1      PHE   4  -3.933   0.176  -5.781
   38    HE2  PHE   4           HE2      PHE   4   0.373  -0.560  -4.706
   39    HZ   PHE   4           HZ       PHE   4  -1.750  -1.204  -6.056
   40    H    VAL   5           H        VAL   5  -0.355   1.921   0.099
   41    HA   VAL   5           HA       VAL   5   0.940   4.276   1.219
   42    HB   VAL   5           HB       VAL   5   1.365   3.065   3.478
   43   1HG1  VAL   5          1HG1      VAL   5   0.130   5.115   3.314
   44   2HG1  VAL   5          2HG1      VAL   5  -1.346   4.237   2.917
   45   3HG1  VAL   5          3HG1      VAL   5  -0.616   4.058   4.513
   46   1HG2  VAL   5          1HG2      VAL   5   0.241   0.857   2.898
   47   2HG2  VAL   5          2HG2      VAL   5  -0.263   1.578   4.426
   48   3HG2  VAL   5          3HG2      VAL   5  -1.306   1.700   3.009
   49    H    LYS   6           H        LYS   6   3.053   4.277   0.904
   50    HA   LYS   6           HA       LYS   6   4.450   1.781   0.147
   51   1HB   LYS   6          1HB       LYS   6   4.605   4.566  -0.950
   52   2HB   LYS   6          2HB       LYS   6   6.036   3.549  -1.025
   53   1HG   LYS   6          1HG       LYS   6   4.442   1.809  -2.116
   54   2HG   LYS   6          2HG       LYS   6   3.387   3.196  -2.386
   55   1HD   LYS   6          1HD       LYS   6   5.454   4.298  -3.459
   56   2HD   LYS   6          2HD       LYS   6   6.136   2.672  -3.485
   57   1HE   LYS   6          1HE       LYS   6   4.055   1.944  -4.708
   58   2HE   LYS   6          2HE       LYS   6   3.645   3.653  -4.862
   59   1HZ   LYS   6          1HZ       LYS   6   5.825   3.958  -5.978
   60   2HZ   LYS   6          2HZ       LYS   6   6.031   2.278  -5.968
   61   3HZ   LYS   6          3HZ       LYS   6   4.754   2.969  -6.836
   62    H    THR   7           H        THR   7   6.437   1.254   0.885
   63    HA   THR   7           HA       THR   7   7.440   2.468   3.365
   64    HB   THR   7           HB       THR   7   8.982   0.383   3.329
   65    HG1  THR   7           HG1      THR   7   8.647  -0.289   1.216
   66   1HG2  THR   7          1HG2      THR   7   6.959   0.700   4.802
   67   2HG2  THR   7          2HG2      THR   7   6.038  -0.210   3.606
   68   3HG2  THR   7          3HG2      THR   7   7.382  -0.976   4.454
   69    H    LEU   8           H        LEU   8   8.476   1.900   0.010
   70    HA   LEU   8           HA       LEU   8  10.040   2.712  -1.400
   71   1HB   LEU   8          1HB       LEU   8  10.772   4.541   0.888
   72   2HB   LEU   8          2HB       LEU   8  11.826   4.451  -0.505
   73    HG   LEU   8           HG       LEU   8   9.069   4.845  -1.377
   74   1HD1  LEU   8          1HD1      LEU   8   8.727   5.919   0.782
   75   2HD1  LEU   8          2HD1      LEU   8  10.114   6.969   0.488
   76   3HD1  LEU   8          3HD1      LEU   8   8.681   7.093  -0.533
   77   1HD2  LEU   8          1HD2      LEU   8  11.172   5.342  -2.661
   78   2HD2  LEU   8          2HD2      LEU   8   9.962   6.624  -2.676
   79   3HD2  LEU   8          3HD2      LEU   8  11.378   6.763  -1.636
   80    H    ASP   9           H        ASP   9  10.781   0.846   1.303
   81    HA   ASP   9           HA       ASP   9  13.593   0.295   0.991
   82   1HB   ASP   9          1HB       ASP   9  11.846  -0.115   3.029
   83   2HB   ASP   9          2HB       ASP   9  11.919  -1.739   2.356
   84    H    GLY  10           H        GLY  10  10.601  -1.287  -0.206
   85   1HA   GLY  10          2HA       GLY  10  12.068  -3.440  -1.596
   86   2HA   GLY  10          1HA       GLY  10  11.144  -2.310  -2.561
   87    H    LYS  11           H        LYS  11   8.864  -2.050  -0.749
   88    HA   LYS  11           HA       LYS  11   7.320  -4.390  -1.491
   89   1HB   LYS  11          1HB       LYS  11   6.254  -4.678   0.833
   90   2HB   LYS  11          2HB       LYS  11   7.844  -5.362   0.600
   91   1HG   LYS  11          1HG       LYS  11   8.680  -3.183   1.790
   92   2HG   LYS  11          2HG       LYS  11   7.005  -3.035   2.318
   93   1HD   LYS  11          1HD       LYS  11   7.270  -5.463   3.136
   94   2HD   LYS  11          2HD       LYS  11   9.001  -5.191   2.943
   95   1HE   LYS  11          1HE       LYS  11   8.999  -3.448   4.551
   96   2HE   LYS  11          2HE       LYS  11   7.237  -3.379   4.573
   97   1HZ   LYS  11          1HZ       LYS  11   8.855  -5.689   5.505
   98   2HZ   LYS  11          2HZ       LYS  11   8.165  -4.521   6.516
   99   3HZ   LYS  11          3HZ       LYS  11   7.173  -5.541   5.600
  100    H    THR  12           H        THR  12   5.189  -4.037  -1.905
  101    HA   THR  12           HA       THR  12   3.918  -1.456  -1.234
  102    HB   THR  12           HB       THR  12   2.832  -1.500  -3.582
  103    HG1  THR  12           HG1      THR  12   3.534  -2.935  -4.949
  104   1HG2  THR  12          1HG2      THR  12   5.666  -0.676  -3.049
  105   2HG2  THR  12          2HG2      THR  12   4.935  -0.418  -4.634
  106   3HG2  THR  12          3HG2      THR  12   4.224   0.326  -3.203
  107    H    ILE  13           H        ILE  13   1.862  -1.563  -0.539
  108    HA   ILE  13           HA       ILE  13   0.041  -3.760  -1.132
  109    HB   ILE  13           HB       ILE  13  -0.612  -4.103   1.327
  110   1HG1  ILE  13          1HG1      ILE  13   2.080  -3.854   2.485
  111   2HG1  ILE  13          2HG1      ILE  13   1.521  -2.284   1.930
  112   1HG2  ILE  13          1HG2      ILE  13   1.971  -5.262   0.304
  113   2HG2  ILE  13          2HG2      ILE  13   1.027  -5.919   1.641
  114   3HG2  ILE  13          3HG2      ILE  13   0.335  -5.858   0.018
  115   1HD1  ILE  13          1HD1      ILE  13  -0.044  -4.063   3.783
  116   2HD1  ILE  13          2HD1      ILE  13   1.029  -2.768   4.316
  117   3HD1  ILE  13          3HD1      ILE  13  -0.401  -2.390   3.352
  118    H    THR  14           H        THR  14  -2.125  -3.353  -0.978
  119    HA   THR  14           HA       THR  14  -3.018  -0.688  -0.097
  120    HB   THR  14           HB       THR  14  -3.134  -0.535  -2.494
  121    HG1  THR  14           HG1      THR  14  -4.840   0.539  -1.842
  122   1HG2  THR  14          1HG2      THR  14  -3.336  -3.025  -3.056
  123   2HG2  THR  14          2HG2      THR  14  -5.070  -2.836  -2.791
  124   3HG2  THR  14          3HG2      THR  14  -4.262  -1.901  -4.053
  125    H    LEU  15           H        LEU  15  -4.964  -0.421   0.924
  126    HA   LEU  15           HA       LEU  15  -6.181  -2.813   2.139
  127   1HB   LEU  15          1HB       LEU  15  -5.003  -0.702   3.386
  128   2HB   LEU  15          2HB       LEU  15  -6.668  -0.159   3.365
  129    HG   LEU  15           HG       LEU  15  -6.634  -2.900   4.293
  130   1HD1  LEU  15          1HD1      LEU  15  -4.316  -2.541   4.938
  131   2HD1  LEU  15          2HD1      LEU  15  -4.783  -1.106   5.852
  132   3HD1  LEU  15          3HD1      LEU  15  -5.357  -2.696   6.354
  133   1HD2  LEU  15          1HD2      LEU  15  -7.244  -0.340   5.769
  134   2HD2  LEU  15          2HD2      LEU  15  -8.388  -1.300   4.832
  135   3HD2  LEU  15          3HD2      LEU  15  -7.673  -1.967   6.300
  136    H    GLU  16           H        GLU  16  -8.212  -3.360   1.775
  137    HA   GLU  16           HA       GLU  16 -10.215  -1.493   0.671
  138   1HB   GLU  16          1HB       GLU  16  -9.212  -4.032  -0.564
  139   2HB   GLU  16          2HB       GLU  16 -10.924  -3.669  -0.721
  140   1HG   GLU  16          1HG       GLU  16 -10.079  -1.351  -1.571
  141   2HG   GLU  16          2HG       GLU  16  -8.564  -2.208  -1.849
  142    H    VAL  17           H        VAL  17 -12.367  -1.848   1.195
  143    HA   VAL  17           HA       VAL  17 -12.935  -3.493   3.535
  144    HB   VAL  17           HB       VAL  17 -15.282  -2.415   3.479
  145   1HG1  VAL  17          1HG1      VAL  17 -13.542  -1.852   5.083
  146   2HG1  VAL  17          2HG1      VAL  17 -12.929  -0.613   3.987
  147   3HG1  VAL  17          3HG1      VAL  17 -14.543  -0.458   4.680
  148   1HG2  VAL  17          1HG2      VAL  17 -15.349  -1.412   1.228
  149   2HG2  VAL  17          2HG2      VAL  17 -15.517  -0.168   2.470
  150   3HG2  VAL  17          3HG2      VAL  17 -13.980  -0.378   1.634

  No H/Q in entry =         150
  Start of MODEL   25
    1    H1   MET   1           H1       MET   1 -14.025  -0.038  -1.171
    2    H2   MET   1           H2       MET   1 -13.718  -0.144   0.489
    3    H3   MET   1           H3       MET   1 -14.938   0.879  -0.080
    4    HA   MET   1           HA       MET   1 -13.339   2.273  -1.182
    5   1HB   MET   1          1HB       MET   1 -13.857   2.101   1.527
    6   2HB   MET   1          2HB       MET   1 -12.101   2.123   1.496
    7   1HG   MET   1          2HG       MET   1 -12.463   4.349   1.635
    8   2HG   MET   1          1HG       MET   1 -12.545   4.197  -0.118
    9   1HE   MET   1          1HE       MET   1 -14.462   4.374   3.192
   10   2HE   MET   1          2HE       MET   1 -14.232   6.046   2.674
   11   3HE   MET   1          3HE       MET   1 -15.858   5.368   2.768
   12    H    GLN   2           H        GLN   2 -11.293   2.785  -1.887
   13    HA   GLN   2           HA       GLN   2  -9.062   0.914  -1.474
   14   1HB   GLN   2          1HB       GLN   2 -10.420   0.975  -3.846
   15   2HB   GLN   2          2HB       GLN   2  -9.194   2.189  -4.156
   16   1HG   GLN   2          1HG       GLN   2  -7.477   0.467  -3.497
   17   2HG   GLN   2          2HG       GLN   2  -8.780  -0.716  -3.490
   18   2HE2  GLN   2          2HE2      GLN   2  -6.732   1.319  -5.499
   19   1HE2  GLN   2          1HE2      GLN   2  -7.171   0.589  -7.002
   20    H    ILE   3           H        ILE   3  -7.229   1.787  -0.851
   21    HA   ILE   3           HA       ILE   3  -6.363   4.480  -1.464
   22    HB   ILE   3           HB       ILE   3  -5.719   4.962   1.015
   23   1HG1  ILE   3          1HG1      ILE   3  -8.182   3.924   2.210
   24   2HG1  ILE   3          2HG1      ILE   3  -7.254   2.583   1.560
   25   1HG2  ILE   3          1HG2      ILE   3  -8.489   5.319  -0.091
   26   2HG2  ILE   3          2HG2      ILE   3  -7.946   6.108   1.390
   27   3HG2  ILE   3          3HG2      ILE   3  -7.126   6.439  -0.136
   28   1HD1  ILE   3          1HD1      ILE   3  -5.793   4.543   3.228
   29   2HD1  ILE   3          2HD1      ILE   3  -6.953   3.484   4.032
   30   3HD1  ILE   3          3HD1      ILE   3  -5.618   2.791   3.110
   31    H    PHE   4           H        PHE   4  -4.367   4.477  -2.052
   32    HA   PHE   4           HA       PHE   4  -2.653   2.148  -1.727
   33   1HB   PHE   4          1HB       PHE   4  -2.843   4.449  -3.581
   34   2HB   PHE   4          2HB       PHE   4  -1.215   3.884  -3.283
   35    HD1  PHE   4           HD1      PHE   4  -4.677   2.812  -4.712
   36    HD2  PHE   4           HD2      PHE   4  -0.275   1.888  -4.393
   37    HE1  PHE   4           HE1      PHE   4  -4.905   1.066  -6.603
   38    HE2  PHE   4           HE2      PHE   4  -0.517   0.136  -6.284
   39    HZ   PHE   4           HZ       PHE   4  -2.825  -0.271  -7.399
   40    H    VAL   5           H        VAL   5  -0.669   1.983  -0.818
   41    HA   VAL   5           HA       VAL   5   0.730   4.203   0.433
   42    HB   VAL   5           HB       VAL   5   1.114   2.865   2.631
   43   1HG1  VAL   5          1HG1      VAL   5  -0.051   5.005   2.472
   44   2HG1  VAL   5          2HG1      VAL   5  -1.575   4.151   2.232
   45   3HG1  VAL   5          3HG1      VAL   5  -0.698   3.979   3.752
   46   1HG2  VAL   5          1HG2      VAL   5  -0.076   0.742   2.077
   47   2HG2  VAL   5          2HG2      VAL   5  -0.705   1.505   3.535
   48   3HG2  VAL   5          3HG2      VAL   5  -1.597   1.629   2.017
   49    H    LYS   6           H        LYS   6   2.884   4.078   0.346
   50    HA   LYS   6           HA       LYS   6   4.169   1.598  -0.616
   51   1HB   LYS   6          1HB       LYS   6   4.050   4.042  -1.883
   52   2HB   LYS   6          2HB       LYS   6   5.613   4.128  -1.088
   53   1HG   LYS   6          1HG       LYS   6   6.452   2.289  -2.287
   54   2HG   LYS   6          2HG       LYS   6   4.846   1.768  -2.782
   55   1HD   LYS   6          1HD       LYS   6   5.029   2.916  -4.687
   56   2HD   LYS   6          2HD       LYS   6   5.217   4.424  -3.799
   57   1HE   LYS   6          1HE       LYS   6   7.640   4.048  -3.681
   58   2HE   LYS   6          2HE       LYS   6   7.450   2.527  -4.552
   59   1HZ   LYS   6          1HZ       LYS   6   6.485   3.851  -6.407
   60   2HZ   LYS   6          2HZ       LYS   6   6.921   5.260  -5.578
   61   3HZ   LYS   6          3HZ       LYS   6   8.116   4.180  -6.100
   62    H    THR   7           H        THR   7   6.110   0.885   0.173
   63    HA   THR   7           HA       THR   7   7.034   1.877   2.786
   64    HB   THR   7           HB       THR   7   8.200  -0.682   1.966
   65    HG1  THR   7           HG1      THR   7   5.372  -0.580   2.276
   66   1HG2  THR   7          1HG2      THR   7   8.199   0.292   4.289
   67   2HG2  THR   7          2HG2      THR   7   6.490  -0.135   4.381
   68   3HG2  THR   7          3HG2      THR   7   7.705  -1.398   4.178
   69    H    LEU   8           H        LEU   8   9.166   2.315   3.279
   70    HA   LEU   8           HA       LEU   8  10.884   3.403   1.256
   71   1HB   LEU   8          1HB       LEU   8  10.711   3.399   4.165
   72   2HB   LEU   8          2HB       LEU   8  12.372   3.287   3.629
   73    HG   LEU   8           HG       LEU   8  11.175   5.369   2.071
   74   1HD1  LEU   8          1HD1      LEU   8   9.404   5.470   3.797
   75   2HD1  LEU   8          2HD1      LEU   8  10.642   5.824   5.002
   76   3HD1  LEU   8          3HD1      LEU   8  10.355   6.951   3.676
   77   1HD2  LEU   8          1HD2      LEU   8  13.533   5.246   2.758
   78   2HD2  LEU   8          2HD2      LEU   8  12.804   6.809   3.129
   79   3HD2  LEU   8          3HD2      LEU   8  13.057   5.628   4.413
   80    H    ASP   9           H        ASP   9  10.863   0.263   2.863
   81    HA   ASP   9           HA       ASP   9  13.571  -0.587   2.397
   82   1HB   ASP   9          1HB       ASP   9  11.523  -1.509   3.977
   83   2HB   ASP   9          2HB       ASP   9  11.579  -2.734   2.716
   84    H    GLY  10           H        GLY  10  10.531  -1.005   0.555
   85   1HA   GLY  10          2HA       GLY  10  11.936  -2.388  -1.670
   86   2HA   GLY  10          1HA       GLY  10  10.835  -1.052  -1.947
   87    H    LYS  11           H        LYS  11   8.642  -1.531  -0.480
   88    HA   LYS  11           HA       LYS  11   7.454  -4.000  -1.578
   89   1HB   LYS  11          1HB       LYS  11   7.529  -3.154   1.295
   90   2HB   LYS  11          2HB       LYS  11   6.054  -3.903   0.707
   91   1HG   LYS  11          1HG       LYS  11   7.256  -5.898   0.090
   92   2HG   LYS  11          2HG       LYS  11   8.793  -5.142   0.517
   93   1HD   LYS  11          1HD       LYS  11   7.870  -4.872   2.854
   94   2HD   LYS  11          2HD       LYS  11   6.534  -5.910   2.356
   95   1HE   LYS  11          1HE       LYS  11   8.315  -7.597   1.665
   96   2HE   LYS  11          2HE       LYS  11   9.455  -6.589   2.559
   97   1HZ   LYS  11          1HZ       LYS  11   8.049  -6.880   4.534
   98   2HZ   LYS  11          2HZ       LYS  11   7.043  -7.923   3.663
   99   3HZ   LYS  11          3HZ       LYS  11   8.653  -8.350   3.958
  100    H    THR  12           H        THR  12   5.293  -3.915  -2.198
  101    HA   THR  12           HA       THR  12   3.745  -1.428  -1.909
  102    HB   THR  12           HB       THR  12   2.913  -1.798  -4.349
  103    HG1  THR  12           HG1      THR  12   5.439  -3.112  -4.493
  104   1HG2  THR  12          1HG2      THR  12   5.641  -0.642  -3.771
  105   2HG2  THR  12          2HG2      THR  12   4.773  -0.410  -5.289
  106   3HG2  THR  12          3HG2      THR  12   4.095   0.207  -3.783
  107    H    ILE  13           H        ILE  13   1.740  -1.726  -1.239
  108    HA   ILE  13           HA       ILE  13   0.069  -4.004  -1.865
  109    HB   ILE  13           HB       ILE  13  -0.584  -4.408   0.566
  110   1HG1  ILE  13          1HG1      ILE  13   0.611  -2.730   1.888
  111   2HG1  ILE  13          2HG1      ILE  13   1.093  -4.316   2.409
  112   1HG2  ILE  13          1HG2      ILE  13   0.336  -6.102  -0.821
  113   2HG2  ILE  13          2HG2      ILE  13   1.981  -5.607  -0.421
  114   3HG2  ILE  13          3HG2      ILE  13   0.937  -6.284   0.829
  115   1HD1  ILE  13          1HD1      ILE  13   3.325  -3.932   1.295
  116   2HD1  ILE  13          2HD1      ILE  13   2.799  -2.296   0.898
  117   3HD1  ILE  13          3HD1      ILE  13   2.967  -2.785   2.586
  118    H    THR  14           H        THR  14  -2.101  -3.649  -1.784
  119    HA   THR  14           HA       THR  14  -3.063  -0.909  -1.417
  120    HB   THR  14           HB       THR  14  -5.297  -1.862  -2.264
  121    HG1  THR  14           HG1      THR  14  -5.330  -3.880  -3.093
  122   1HG2  THR  14          1HG2      THR  14  -3.776  -0.564  -3.676
  123   2HG2  THR  14          2HG2      THR  14  -2.980  -2.060  -4.172
  124   3HG2  THR  14          3HG2      THR  14  -4.677  -1.786  -4.573
  125    H    LEU  15           H        LEU  15  -4.635  -0.190  -0.030
  126    HA   LEU  15           HA       LEU  15  -5.410  -1.924   2.220
  127   1HB   LEU  15          1HB       LEU  15  -4.118   0.543   2.288
  128   2HB   LEU  15          2HB       LEU  15  -5.780   0.971   2.623
  129    HG   LEU  15           HG       LEU  15  -5.060  -1.309   4.270
  130   1HD1  LEU  15          1HD1      LEU  15  -3.193   1.040   4.549
  131   2HD1  LEU  15          2HD1      LEU  15  -3.355  -0.287   5.700
  132   3HD1  LEU  15          3HD1      LEU  15  -2.755  -0.601   4.072
  133   1HD2  LEU  15          1HD2      LEU  15  -5.758   1.545   4.960
  134   2HD2  LEU  15          2HD2      LEU  15  -6.860   0.170   4.866
  135   3HD2  LEU  15          3HD2      LEU  15  -5.631   0.230   6.129
  136    H    GLU  16           H        GLU  16  -7.260  -2.840   1.788
  137    HA   GLU  16           HA       GLU  16  -9.567  -1.315   0.755
  138   1HB   GLU  16          1HB       GLU  16  -8.387  -3.897  -0.148
  139   2HB   GLU  16          2HB       GLU  16 -10.142  -3.794  -0.142
  140   1HG   GLU  16          1HG       GLU  16  -9.716  -1.564  -1.453
  141   2HG   GLU  16          2HG       GLU  16  -8.151  -2.296  -1.795
  142    H    VAL  17           H        VAL  17 -11.604  -1.704   1.571
  143    HA   VAL  17           HA       VAL  17 -12.102  -3.725   3.622
  144    HB   VAL  17           HB       VAL  17 -13.350  -2.014   5.110
  145   1HG1  VAL  17          1HG1      VAL  17 -11.329  -3.269   5.733
  146   2HG1  VAL  17          2HG1      VAL  17 -10.348  -1.914   5.174
  147   3HG1  VAL  17          3HG1      VAL  17 -11.458  -1.699   6.528
  148   1HG2  VAL  17          1HG2      VAL  17 -11.484  -0.012   3.787
  149   2HG2  VAL  17          2HG2      VAL  17 -13.243   0.070   3.866
  150   3HG2  VAL  17          3HG2      VAL  17 -12.288   0.250   5.336

  No H/Q in entry =         150
  Start of MODEL   26
    1    H1   MET   1           H1       MET   1 -13.891   0.626  -2.146
    2    H2   MET   1           H2       MET   1 -13.833   0.258  -0.495
    3    H3   MET   1           H3       MET   1 -14.830   1.507  -1.049
    4    HA   MET   1           HA       MET   1 -12.933   2.795  -1.730
    5   1HB   MET   1          1HB       MET   1 -13.862   2.381   0.825
    6   2HB   MET   1          2HB       MET   1 -12.141   2.108   1.042
    7   1HG   MET   1          1HG       MET   1 -11.624   4.285   0.794
    8   2HG   MET   1          2HG       MET   1 -12.853   4.559  -0.444
    9   1HE   MET   1          1HE       MET   1 -11.955   4.170   3.173
   10   2HE   MET   1          2HE       MET   1 -11.983   5.928   3.020
   11   3HE   MET   1          3HE       MET   1 -13.156   5.114   4.057
   12    H    GLN   2           H        GLN   2 -10.773   3.090  -2.124
   13    HA   GLN   2           HA       GLN   2  -8.851   0.911  -1.671
   14   1HB   GLN   2          1HB       GLN   2  -9.533   2.211  -4.284
   15   2HB   GLN   2          2HB       GLN   2  -7.848   1.798  -3.985
   16   1HG   GLN   2          1HG       GLN   2  -8.375  -0.514  -3.746
   17   2HG   GLN   2          2HG       GLN   2 -10.106  -0.182  -3.758
   18   2HE2  GLN   2          2HE2      GLN   2  -7.210  -0.510  -5.724
   19   1HE2  GLN   2          1HE2      GLN   2  -8.026  -0.525  -7.247
   20    H    ILE   3           H        ILE   3  -7.017   1.460  -0.772
   21    HA   ILE   3           HA       ILE   3  -5.842   4.114  -0.915
   22    HB   ILE   3           HB       ILE   3  -5.390   4.098   1.666
   23   1HG1  ILE   3          1HG1      ILE   3  -8.068   3.218   2.440
   24   2HG1  ILE   3          2HG1      ILE   3  -7.248   1.890   1.637
   25   1HG2  ILE   3          1HG2      ILE   3  -6.595   5.822   0.419
   26   2HG2  ILE   3          2HG2      ILE   3  -8.102   4.932   0.645
   27   3HG2  ILE   3          3HG2      ILE   3  -7.253   5.600   2.039
   28   1HD1  ILE   3          1HD1      ILE   3  -5.848   3.359   3.816
   29   2HD1  ILE   3          2HD1      ILE   3  -7.103   2.183   4.208
   30   3HD1  ILE   3          3HD1      ILE   3  -5.679   1.682   3.294
   31    H    PHE   4           H        PHE   4  -3.806   4.026  -1.326
   32    HA   PHE   4           HA       PHE   4  -2.266   1.548  -0.960
   33   1HB   PHE   4          1HB       PHE   4  -2.420   3.642  -3.050
   34   2HB   PHE   4          2HB       PHE   4  -0.796   3.090  -2.699
   35    HD1  PHE   4           HD1      PHE   4  -4.237   2.028  -4.115
   36    HD2  PHE   4           HD2      PHE   4   0.065   0.839  -3.454
   37    HE1  PHE   4           HE1      PHE   4  -4.520   0.065  -5.768
   38    HE2  PHE   4           HE2      PHE   4  -0.229  -1.116  -5.123
   39    HZ   PHE   4           HZ       PHE   4  -2.518  -1.506  -6.282
   40    H    VAL   5           H        VAL   5  -0.234   1.442  -0.102
   41    HA   VAL   5           HA       VAL   5   1.038   3.806   1.094
   42    HB   VAL   5           HB       VAL   5   1.774   2.364   3.125
   43   1HG1  VAL   5          1HG1      VAL   5   0.211   4.312   3.128
   44   2HG1  VAL   5          2HG1      VAL   5  -1.120   3.154   3.131
   45   3HG1  VAL   5          3HG1      VAL   5   0.027   3.183   4.470
   46   1HG2  VAL   5          1HG2      VAL   5   0.783   0.151   2.338
   47   2HG2  VAL   5          2HG2      VAL   5   0.384   0.619   3.993
   48   3HG2  VAL   5          3HG2      VAL   5  -0.805   0.824   2.707
   49    H    LYS   6           H        LYS   6   3.148   4.032   0.777
   50    HA   LYS   6           HA       LYS   6   4.721   1.827  -0.401
   51   1HB   LYS   6          1HB       LYS   6   4.007   4.144  -1.659
   52   2HB   LYS   6          2HB       LYS   6   5.570   4.603  -1.002
   53   1HG   LYS   6          1HG       LYS   6   6.736   3.141  -2.336
   54   2HG   LYS   6          2HG       LYS   6   5.381   2.024  -2.496
   55   1HD   LYS   6          1HD       LYS   6   4.425   3.198  -4.231
   56   2HD   LYS   6          2HD       LYS   6   5.121   4.741  -3.727
   57   1HE   LYS   6          1HE       LYS   6   7.257   4.154  -4.598
   58   2HE   LYS   6          2HE       LYS   6   6.768   2.479  -4.846
   59   1HZ   LYS   6          1HZ       LYS   6   5.540   4.776  -6.266
   60   2HZ   LYS   6          2HZ       LYS   6   6.813   3.858  -6.895
   61   3HZ   LYS   6          3HZ       LYS   6   5.314   3.133  -6.593
   62    H    THR   7           H        THR   7   6.825   1.477   0.156
   63    HA   THR   7           HA       THR   7   8.036   2.915   2.449
   64    HB   THR   7           HB       THR   7   9.171   0.655   2.990
   65    HG1  THR   7           HG1      THR   7   8.596  -0.633   1.313
   66   1HG2  THR   7          1HG2      THR   7   6.323   1.337   3.602
   67   2HG2  THR   7          2HG2      THR   7   6.995  -0.192   4.173
   68   3HG2  THR   7          3HG2      THR   7   7.732   1.334   4.663
   69    H    LEU   8           H        LEU   8  10.271   3.225   2.483
   70    HA   LEU   8           HA       LEU   8  11.667   3.596   0.017
   71   1HB   LEU   8          1HB       LEU   8  12.277   4.013   2.905
   72   2HB   LEU   8          2HB       LEU   8  13.631   3.992   1.793
   73    HG   LEU   8           HG       LEU   8  11.601   5.723   0.679
   74   1HD1  LEU   8          1HD1      LEU   8  10.788   5.914   3.011
   75   2HD1  LEU   8          2HD1      LEU   8  12.368   6.555   3.466
   76   3HD1  LEU   8          3HD1      LEU   8  11.356   7.434   2.320
   77   1HD2  LEU   8          1HD2      LEU   8  14.330   6.308   1.820
   78   2HD2  LEU   8          2HD2      LEU   8  13.929   5.965   0.137
   79   3HD2  LEU   8          3HD2      LEU   8  13.359   7.452   0.893
   80    H    ASP   9           H        ASP   9  11.534   0.806   2.095
   81    HA   ASP   9           HA       ASP   9  14.051  -0.470   1.508
   82   1HB   ASP   9          1HB       ASP   9  11.592  -1.207   3.010
   83   2HB   ASP   9          2HB       ASP   9  12.568  -2.540   2.405
   84    H    GLY  10           H        GLY  10  10.753  -0.749   0.116
   85   1HA   GLY  10          2HA       GLY  10  11.729  -2.535  -2.051
   86   2HA   GLY  10          1HA       GLY  10  10.668  -1.171  -2.349
   87    H    LYS  11           H        LYS  11   8.678  -1.329  -0.537
   88    HA   LYS  11           HA       LYS  11   7.213  -3.793  -1.215
   89   1HB   LYS  11          1HB       LYS  11   7.905  -2.885   1.518
   90   2HB   LYS  11          2HB       LYS  11   6.214  -3.289   1.298
   91   1HG   LYS  11          1HG       LYS  11   6.644  -5.459   1.470
   92   2HG   LYS  11          2HG       LYS  11   7.790  -5.391   0.142
   93   1HD   LYS  11          1HD       LYS  11   9.440  -5.856   1.581
   94   2HD   LYS  11          2HD       LYS  11   9.170  -4.310   2.372
   95   1HE   LYS  11          1HE       LYS  11   8.952  -5.718   4.164
   96   2HE   LYS  11          2HE       LYS  11   7.273  -5.679   3.625
   97   1HZ   LYS  11          1HZ       LYS  11   7.676  -7.745   2.409
   98   2HZ   LYS  11          2HZ       LYS  11   9.270  -7.784   2.974
   99   3HZ   LYS  11          3HZ       LYS  11   7.984  -7.935   4.062
  100    H    THR  12           H        THR  12   5.041  -3.604  -1.594
  101    HA   THR  12           HA       THR  12   3.585  -1.085  -1.177
  102    HB   THR  12           HB       THR  12   2.545  -1.386  -3.543
  103    HG1  THR  12           HG1      THR  12   5.028  -2.730  -3.933
  104   1HG2  THR  12          1HG2      THR  12   5.277  -0.229  -3.050
  105   2HG2  THR  12          2HG2      THR  12   4.468  -0.073  -4.609
  106   3HG2  THR  12          3HG2      THR  12   3.728   0.607  -3.159
  107    H    ILE  13           H        ILE  13   1.568  -1.347  -0.458
  108    HA   ILE  13           HA       ILE  13  -0.068  -3.703  -0.966
  109    HB   ILE  13           HB       ILE  13  -0.693  -3.996   1.514
  110   1HG1  ILE  13          1HG1      ILE  13   2.003  -3.509   2.609
  111   2HG1  ILE  13          2HG1      ILE  13   1.295  -2.008   2.035
  112   1HG2  ILE  13          1HG2      ILE  13   1.950  -5.013   0.489
  113   2HG2  ILE  13          2HG2      ILE  13   1.080  -5.685   1.871
  114   3HG2  ILE  13          3HG2      ILE  13   0.356  -5.733   0.261
  115   1HD1  ILE  13          1HD1      ILE  13  -0.064  -3.870   3.970
  116   2HD1  ILE  13          2HD1      ILE  13   0.910  -2.477   4.444
  117   3HD1  ILE  13          3HD1      ILE  13  -0.571  -2.243   3.516
  118    H    THR  14           H        THR  14  -2.243  -3.448  -0.874
  119    HA   THR  14           HA       THR  14  -3.348  -0.838  -0.075
  120    HB   THR  14           HB       THR  14  -3.366  -0.746  -2.483
  121    HG1  THR  14           HG1      THR  14  -5.984  -1.205  -1.501
  122   1HG2  THR  14          1HG2      THR  14  -3.854  -3.504  -2.620
  123   2HG2  THR  14          2HG2      THR  14  -5.326  -2.753  -3.237
  124   3HG2  THR  14          3HG2      THR  14  -3.766  -2.369  -3.969
  125    H    LEU  15           H        LEU  15  -5.373  -0.684   0.829
  126    HA   LEU  15           HA       LEU  15  -6.567  -3.136   1.957
  127   1HB   LEU  15          1HB       LEU  15  -5.381  -1.127   3.360
  128   2HB   LEU  15          2HB       LEU  15  -7.037  -0.558   3.341
  129    HG   LEU  15           HG       LEU  15  -7.074  -3.350   4.092
  130   1HD1  LEU  15          1HD1      LEU  15  -4.757  -3.089   4.791
  131   2HD1  LEU  15          2HD1      LEU  15  -5.205  -1.708   5.792
  132   3HD1  LEU  15          3HD1      LEU  15  -5.822  -3.315   6.177
  133   1HD2  LEU  15          1HD2      LEU  15  -8.733  -1.564   4.681
  134   2HD2  LEU  15          2HD2      LEU  15  -8.248  -2.605   6.018
  135   3HD2  LEU  15          3HD2      LEU  15  -7.580  -0.979   5.880
  136    H    GLU  16           H        GLU  16  -8.644  -3.582   1.609
  137    HA   GLU  16           HA       GLU  16 -10.475  -1.598   0.405
  138   1HB   GLU  16          1HB       GLU  16  -9.730  -4.332  -0.555
  139   2HB   GLU  16          2HB       GLU  16 -11.391  -3.808  -0.789
  140   1HG   GLU  16          1HG       GLU  16 -10.389  -1.720  -1.892
  141   2HG   GLU  16          2HG       GLU  16  -8.873  -2.618  -1.931
  142    H    VAL  17           H        VAL  17 -12.623  -1.624   0.946
  143    HA   VAL  17           HA       VAL  17 -13.712  -3.605   2.814
  144    HB   VAL  17           HB       VAL  17 -14.896  -1.735   4.155
  145   1HG1  VAL  17          1HG1      VAL  17 -11.960  -2.236   4.552
  146   2HG1  VAL  17          2HG1      VAL  17 -13.053  -1.578   5.770
  147   3HG1  VAL  17          3HG1      VAL  17 -13.302  -3.211   5.150
  148   1HG2  VAL  17          1HG2      VAL  17 -14.243   0.283   2.872
  149   2HG2  VAL  17          2HG2      VAL  17 -13.701   0.380   4.548
  150   3HG2  VAL  17          3HG2      VAL  17 -12.549  -0.013   3.272

  No H/Q in entry =         150
  Start of MODEL   27
    1    H1   MET   1           H1       MET   1 -14.093   0.395  -1.886
    2    H2   MET   1           H2       MET   1 -13.964   0.119  -0.222
    3    H3   MET   1           H3       MET   1 -15.067   1.262  -0.808
    4    HA   MET   1           HA       MET   1 -13.306   2.663  -1.589
    5   1HB   MET   1          1HB       MET   1 -14.081   2.254   1.019
    6   2HB   MET   1          2HB       MET   1 -12.334   2.138   1.158
    7   1HG   MET   1          1HG       MET   1 -12.003   4.341   0.661
    8   2HG   MET   1          2HG       MET   1 -13.469   4.463  -0.313
    9   1HE   MET   1          1HE       MET   1 -11.847   4.279   3.060
   10   2HE   MET   1          2HE       MET   1 -12.076   6.019   2.884
   11   3HE   MET   1          3HE       MET   1 -12.937   5.139   4.149
   12    H    GLN   2           H        GLN   2 -11.187   3.119  -2.076
   13    HA   GLN   2           HA       GLN   2  -9.094   1.091  -1.676
   14   1HB   GLN   2          1HB       GLN   2 -10.011   2.279  -4.265
   15   2HB   GLN   2          2HB       GLN   2  -8.281   2.051  -4.053
   16   1HG   GLN   2          1HG       GLN   2  -8.468  -0.263  -3.920
   17   2HG   GLN   2          2HG       GLN   2 -10.192  -0.198  -3.553
   18   2HE2  GLN   2          2HE2      GLN   2  -7.768  -0.102  -6.095
   19   1HE2  GLN   2          1HE2      GLN   2  -8.879  -0.245  -7.412
   20    H    ILE   3           H        ILE   3  -7.269   1.785  -0.852
   21    HA   ILE   3           HA       ILE   3  -6.223   4.466  -1.136
   22    HB   ILE   3           HB       ILE   3  -5.750   4.686   1.421
   23   1HG1  ILE   3          1HG1      ILE   3  -8.375   3.668   2.277
   24   2HG1  ILE   3          2HG1      ILE   3  -7.402   2.355   1.638
   25   1HG2  ILE   3          1HG2      ILE   3  -7.170   6.143  -0.048
   26   2HG2  ILE   3          2HG2      ILE   3  -8.576   5.261   0.551
   27   3HG2  ILE   3          3HG2      ILE   3  -7.571   6.183   1.669
   28   1HD1  ILE   3          1HD1      ILE   3  -6.130   4.160   3.618
   29   2HD1  ILE   3          2HD1      ILE   3  -7.366   3.035   4.184
   30   3HD1  ILE   3          3HD1      ILE   3  -5.927   2.426   3.364
   31    H    PHE   4           H        PHE   4  -4.244   4.337  -1.688
   32    HA   PHE   4           HA       PHE   4  -2.658   1.910  -1.411
   33   1HB   PHE   4          1HB       PHE   4  -2.700   4.284  -3.173
   34   2HB   PHE   4          2HB       PHE   4  -1.099   3.664  -2.842
   35    HD1  PHE   4           HD1      PHE   4  -4.536   2.743  -4.429
   36    HD2  PHE   4           HD2      PHE   4  -0.169   1.698  -4.003
   37    HE1  PHE   4           HE1      PHE   4  -4.739   1.081  -6.400
   38    HE2  PHE   4           HE2      PHE   4  -0.387   0.028  -5.971
   39    HZ   PHE   4           HZ       PHE   4  -2.664  -0.275  -7.179
   40    H    VAL   5           H        VAL   5  -0.643   1.648  -0.529
   41    HA   VAL   5           HA       VAL   5   0.677   3.777   0.982
   42    HB   VAL   5           HB       VAL   5   1.197   2.129   2.922
   43   1HG1  VAL   5          1HG1      VAL   5  -0.151   4.178   3.091
   44   2HG1  VAL   5          2HG1      VAL   5  -1.600   3.220   2.787
   45   3HG1  VAL   5          3HG1      VAL   5  -0.634   2.923   4.233
   46   1HG2  VAL   5          1HG2      VAL   5   0.044   0.083   1.874
   47   2HG2  VAL   5          2HG2      VAL   5  -0.318   0.416   3.569
   48   3HG2  VAL   5          3HG2      VAL   5  -1.482   0.849   2.317
   49    H    LYS   6           H        LYS   6   2.823   3.846   0.832
   50    HA   LYS   6           HA       LYS   6   4.324   1.590  -0.345
   51   1HB   LYS   6          1HB       LYS   6   3.750   3.915  -1.669
   52   2HB   LYS   6          2HB       LYS   6   5.308   4.315  -0.966
   53   1HG   LYS   6          1HG       LYS   6   6.425   2.653  -2.169
   54   2HG   LYS   6          2HG       LYS   6   4.940   1.770  -2.518
   55   1HD   LYS   6          1HD       LYS   6   4.329   3.185  -4.235
   56   2HD   LYS   6          2HD       LYS   6   5.248   4.549  -3.597
   57   1HE   LYS   6          1HE       LYS   6   7.295   3.655  -4.368
   58   2HE   LYS   6          2HE       LYS   6   6.574   2.078  -4.688
   59   1HZ   LYS   6          1HZ       LYS   6   5.893   4.577  -6.142
   60   2HZ   LYS   6          2HZ       LYS   6   6.946   3.382  -6.715
   61   3HZ   LYS   6          3HZ       LYS   6   5.309   3.027  -6.484
   62    H    THR   7           H        THR   7   6.412   1.191   0.288
   63    HA   THR   7           HA       THR   7   7.520   2.575   2.667
   64    HB   THR   7           HB       THR   7   8.718   0.322   3.103
   65    HG1  THR   7           HG1      THR   7   8.160  -1.335   1.938
   66   1HG2  THR   7          1HG2      THR   7   5.833   0.880   3.658
   67   2HG2  THR   7          2HG2      THR   7   6.537  -0.656   4.164
   68   3HG2  THR   7          3HG2      THR   7   7.208   0.861   4.764
   69    H    LEU   8           H        LEU   8   9.720   2.987   2.810
   70    HA   LEU   8           HA       LEU   8  11.213   3.515   0.420
   71   1HB   LEU   8          1HB       LEU   8  11.534   3.995   3.322
   72   2HB   LEU   8          2HB       LEU   8  13.029   3.913   2.417
   73    HG   LEU   8           HG       LEU   8  11.278   5.634   0.934
   74   1HD1  LEU   8          1HD1      LEU   8   9.978   5.909   3.007
   75   2HD1  LEU   8          2HD1      LEU   8  11.430   6.497   3.816
   76   3HD1  LEU   8          3HD1      LEU   8  10.743   7.405   2.470
   77   1HD2  LEU   8          1HD2      LEU   8  13.739   5.762   1.007
   78   2HD2  LEU   8          2HD2      LEU   8  12.963   7.318   1.300
   79   3HD2  LEU   8          3HD2      LEU   8  13.638   6.401   2.648
   80    H    ASP   9           H        ASP   9  11.135   0.691   2.455
   81    HA   ASP   9           HA       ASP   9  13.750  -0.427   2.042
   82   1HB   ASP   9          1HB       ASP   9  11.255  -1.275   3.363
   83   2HB   ASP   9          2HB       ASP   9  12.208  -2.598   2.701
   84    H    GLY  10           H        GLY  10  10.634  -0.828   0.322
   85   1HA   GLY  10          2HA       GLY  10  11.902  -2.510  -1.776
   86   2HA   GLY  10          1HA       GLY  10  10.805  -1.192  -2.145
   87    H    LYS  11           H        LYS  11   8.676  -1.513  -0.499
   88    HA   LYS  11           HA       LYS  11   7.397  -4.011  -1.391
   89   1HB   LYS  11          1HB       LYS  11   7.828  -3.197   1.420
   90   2HB   LYS  11          2HB       LYS  11   6.170  -3.628   1.053
   91   1HG   LYS  11          1HG       LYS  11   6.662  -5.775   1.272
   92   2HG   LYS  11          2HG       LYS  11   7.780  -5.671  -0.078
   93   1HD   LYS  11          1HD       LYS  11   9.487  -6.097   1.303
   94   2HD   LYS  11          2HD       LYS  11   9.162  -4.610   2.183
   95   1HE   LYS  11          1HE       LYS  11   9.011  -6.110   3.898
   96   2HE   LYS  11          2HE       LYS  11   7.331  -6.139   3.364
   97   1HZ   LYS  11          1HZ       LYS  11   7.954  -8.089   1.962
   98   2HZ   LYS  11          2HZ       LYS  11   9.459  -8.109   2.732
   99   3HZ   LYS  11          3HZ       LYS  11   8.048  -8.369   3.627
  100    H    THR  12           H        THR  12   5.250  -3.903  -1.947
  101    HA   THR  12           HA       THR  12   3.692  -1.432  -1.598
  102    HB   THR  12           HB       THR  12   2.823  -1.750  -4.029
  103    HG1  THR  12           HG1      THR  12   5.355  -3.039  -4.250
  104   1HG2  THR  12          1HG2      THR  12   5.500  -0.544  -3.368
  105   2HG2  THR  12          2HG2      THR  12   4.765  -0.383  -4.964
  106   3HG2  THR  12          3HG2      THR  12   3.943   0.265  -3.544
  107    H    ILE  13           H        ILE  13   1.677  -1.753  -0.954
  108    HA   ILE  13           HA       ILE  13   0.056  -4.076  -1.594
  109    HB   ILE  13           HB       ILE  13  -0.631  -4.464   0.869
  110   1HG1  ILE  13          1HG1      ILE  13   2.041  -4.159   2.046
  111   2HG1  ILE  13          2HG1      ILE  13   1.469  -2.595   1.488
  112   1HG2  ILE  13          1HG2      ILE  13   1.984  -5.518  -0.179
  113   2HG2  ILE  13          2HG2      ILE  13   1.081  -6.221   1.164
  114   3HG2  ILE  13          3HG2      ILE  13   0.368  -6.172  -0.449
  115   1HD1  ILE  13          1HD1      ILE  13  -0.105  -4.396   3.311
  116   2HD1  ILE  13          2HD1      ILE  13   0.962  -3.107   3.870
  117   3HD1  ILE  13          3HD1      ILE  13  -0.456  -2.717   2.897
  118    H    THR  14           H        THR  14  -2.122  -3.774  -1.569
  119    HA   THR  14           HA       THR  14  -3.152  -1.049  -1.237
  120    HB   THR  14           HB       THR  14  -5.327  -2.053  -2.172
  121    HG1  THR  14           HG1      THR  14  -5.273  -4.047  -3.048
  122   1HG2  THR  14          1HG2      THR  14  -3.420  -0.798  -3.461
  123   2HG2  THR  14          2HG2      THR  14  -3.238  -2.368  -4.247
  124   3HG2  THR  14          3HG2      THR  14  -4.790  -1.528  -4.296
  125    H    LEU  15           H        LEU  15  -4.808  -0.390   0.083
  126    HA   LEU  15           HA       LEU  15  -5.701  -2.195   2.231
  127   1HB   LEU  15          1HB       LEU  15  -4.378   0.299   2.433
  128   2HB   LEU  15          2HB       LEU  15  -6.040   0.626   2.874
  129    HG   LEU  15           HG       LEU  15  -5.159  -1.764   4.270
  130   1HD1  LEU  15          1HD1      LEU  15  -2.896  -0.728   3.926
  131   2HD1  LEU  15          2HD1      LEU  15  -3.446   0.616   4.926
  132   3HD1  LEU  15          3HD1      LEU  15  -3.364  -1.011   5.603
  133   1HD2  LEU  15          1HD2      LEU  15  -6.997  -0.217   4.944
  134   2HD2  LEU  15          2HD2      LEU  15  -5.867  -0.610   6.239
  135   3HD2  LEU  15          3HD2      LEU  15  -5.768   0.952   5.428
  136    H    GLU  16           H        GLU  16  -7.596  -2.978   1.749
  137    HA   GLU  16           HA       GLU  16  -9.762  -1.306   0.636
  138   1HB   GLU  16          1HB       GLU  16  -8.686  -3.938  -0.251
  139   2HB   GLU  16          2HB       GLU  16 -10.430  -3.740  -0.324
  140   1HG   GLU  16          1HG       GLU  16  -9.815  -1.516  -1.579
  141   2HG   GLU  16          2HG       GLU  16  -8.285  -2.341  -1.865
  142    H    VAL  17           H        VAL  17 -11.860  -1.599   1.337
  143    HA   VAL  17           HA       VAL  17 -12.345  -3.345   3.658
  144    HB   VAL  17           HB       VAL  17 -12.158  -0.887   4.210
  145   1HG1  VAL  17          1HG1      VAL  17 -13.286   0.208   2.349
  146   2HG1  VAL  17          2HG1      VAL  17 -14.835  -0.442   2.893
  147   3HG1  VAL  17          3HG1      VAL  17 -13.957   0.709   3.901
  148   1HG2  VAL  17          1HG2      VAL  17 -13.258  -2.409   5.753
  149   2HG2  VAL  17          2HG2      VAL  17 -13.949  -0.789   5.836
  150   3HG2  VAL  17          3HG2      VAL  17 -14.812  -2.075   4.990

  No H/Q in entry =         150


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