*HEADER    DE NOVO PROTEIN                         04-JUN-09   2KJO              
*TITLE     PH DEPENDENT STRUCTURES OF LAH4 IN MICELLAR ENVIRONMENT: MODE OF      
*TITLE    2 ACTING                                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: LAH4;                                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: ARTIFICIAL GENE;                                
*SOURCE   4 ORGANISM_TAXID: 32630                                                
*KEYWDS    LAH4 NEUTRAL, DE NOVO PROTEIN                                         
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    J.GEORGESCU, B.BECHINGER                                              
*REVDAT   1   23-JUN-10 2KJO    0                                                


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assig (resid  10 and name hb2) (resid  10 and name HN)  3.3   0.4   0.4
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assig (resid  11 and name hb2) (resid  12 and name HN)  4.3   0.6   0.8
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assig (resid  11 and name Hb1) (resid  11 and name He1)  4.8   0.6   0.8
assig (resid  11 and name Hb1) (resid  11 and name Hd2)  3.1   0.4   0.4
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assig (resid  12 and name Hb#) (resid  13 and name HN)  2.8   0.3   1.3 
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assig (resid  17 and name Hb#)  (resid   18 and name HN)  2.9   0.3   1.3
assig (resid  17 and name Hd#) (resid   18 and name Hd2)  3.6   0.4   2.4
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assig (resid  26 and name ha) (resid  26 and name HN)  2.7   0.3   0.3
assig (resid  26 and name ha) (resid 26 and name Hb#)  2.8   0.4   0.4

assig (resid   4 and name O) (resid   7 and name HN)  1.8   0.3   0.5
assig (resid   4 and name O) (resid   8 and name HN)  1.8   0.3   0.5
assig (resid   5 and name O) (resid   9 and name HN)  1.8   0.3   0.5
assig (resid   6 and name O) (resid  10 and name HN)  1.8   0.3   0.5
assig (resid  16 and name O) (resid  19 and name HN)  1.8   0.3   0.5
assig (resid  16 and name O) (resid  20 and name HN)  1.8   0.3   0.5
assig (resid  17 and name O) (resid  21 and name HN)  1.8   0.3   0.5
assig (resid  18 and name O) (resid  22 and name HN)  1.8   0.3   0.5
assig (resid  19 and name O) (resid  23 and name HN)  1.8   0.3   0.5
assig (resid  20 and name O) (resid  24 and name HN)  1.8   0.3   0.5
assig (resid  21 and name O) (resid  25 and name HN)  1.8   0.3   0.5

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LYS   1           1HT      LYS   1 -20.495  -8.644   2.339
    2    H2   LYS   1           2HT      LYS   1 -20.121  -7.692   3.696
    3    H3   LYS   1           3HT      LYS   1 -18.901  -8.570   2.915
    4    HA   LYS   1           HA       LYS   1 -20.145  -6.925   1.017
    5    HB2  LYS   1           2HB      LYS   1 -19.817  -5.754   3.713
    6    HB3  LYS   1           1HB      LYS   1 -19.025  -4.834   2.432
    7    HG2  LYS   1           2HG      LYS   1 -21.433  -5.416   1.254
    8    HG3  LYS   1           1HG      LYS   1 -21.909  -5.242   2.944
    9    HD2  LYS   1           2HD      LYS   1 -20.556  -3.065   2.953
   10    HD3  LYS   1           1HD      LYS   1 -20.493  -3.216   1.199
   11    HE2  LYS   1           2HE      LYS   1 -22.977  -3.010   2.915
   12    HE3  LYS   1           1HE      LYS   1 -22.380  -1.802   1.782
   13    HZ1  LYS   1           2HZ      LYS   1 -24.078  -3.961   1.274
   14    HZ2  LYS   1           3HZ      LYS   1 -22.634  -4.243   0.426
   15    HZ3  LYS   1           1HZ      LYS   1 -23.495  -2.807   0.174
   16    H    LYS   2           H        LYS   2 -18.494  -6.015  -0.282
   17    HA   LYS   2           HA       LYS   2 -15.717  -6.338   0.579
   18    HB2  LYS   2           2HB      LYS   2 -17.065  -8.099  -1.340
   19    HB3  LYS   2           1HB      LYS   2 -15.617  -7.337  -1.994
   20    HG2  LYS   2           2HG      LYS   2 -15.586  -8.626   0.742
   21    HG3  LYS   2           1HG      LYS   2 -15.326  -9.581  -0.717
   22    HD2  LYS   2           2HD      LYS   2 -13.290  -8.606  -1.170
   23    HD3  LYS   2           1HD      LYS   2 -13.765  -7.059  -0.467
   24    HE2  LYS   2           2HE      LYS   2 -12.011  -8.456   0.828
   25    HE3  LYS   2           1HE      LYS   2 -13.372  -7.808   1.746
   26    HZ1  LYS   2           3HZ      LYS   2 -12.617 -10.413   1.664
   27    HZ2  LYS   2           1HZ      LYS   2 -13.916 -10.373   0.573
   28    HZ3  LYS   2           2HZ      LYS   2 -14.134  -9.842   2.173
   29    H    ALA   3           H        ALA   3 -15.329  -4.179   0.430
   30    HA   ALA   3           HA       ALA   3 -16.258  -2.561  -1.744
   31    HB1  ALA   3           1HB      ALA   3 -14.056  -1.965   0.255
   32    HB2  ALA   3           2HB      ALA   3 -15.764  -1.630   0.515
   33    HB3  ALA   3           3HB      ALA   3 -14.890  -0.796  -0.765
   34    H    LEU   4           H        LEU   4 -15.287  -4.441  -3.182
   35    HA   LEU   4           HA       LEU   4 -12.606  -4.730  -3.768
   36    HB2  LEU   4           2HB      LEU   4 -14.739  -4.497  -5.898
   37    HB3  LEU   4           1HB      LEU   4 -13.253  -5.439  -5.966
   38    HG   LEU   4           HG       LEU   4 -15.635  -5.941  -4.160
   39   HD11  LEU   4          1HD1      LEU   4 -15.541  -8.166  -5.393
   40   HD12  LEU   4          2HD1      LEU   4 -14.407  -7.403  -6.506
   41   HD13  LEU   4          3HD1      LEU   4 -16.053  -6.782  -6.360
   42   HD21  LEU   4          3HD2      LEU   4 -12.889  -7.208  -4.280
   43   HD22  LEU   4          1HD2      LEU   4 -14.270  -7.962  -3.485
   44   HD23  LEU   4          2HD2      LEU   4 -13.648  -6.426  -2.893
   45    H    LEU   5           H        LEU   5 -14.839  -2.513  -5.272
   46    HA   LEU   5           HA       LEU   5 -13.219  -1.060  -6.917
   47    HB2  LEU   5           2HB      LEU   5 -14.940   0.746  -5.396
   48    HB3  LEU   5           1HB      LEU   5 -14.969   0.349  -7.111
   49    HG   LEU   5           HG       LEU   5 -16.071  -1.876  -6.422
   50   HD11  LEU   5          1HD1      LEU   5 -17.225  -0.680  -4.018
   51   HD12  LEU   5          2HD1      LEU   5 -15.486  -0.919  -3.852
   52   HD13  LEU   5          3HD1      LEU   5 -16.526  -2.287  -4.242
   53   HD21  LEU   5          3HD2      LEU   5 -17.247   0.082  -7.447
   54   HD22  LEU   5          1HD2      LEU   5 -17.587   0.686  -5.828
   55   HD23  LEU   5          2HD2      LEU   5 -18.279  -0.849  -6.360
   56    H    ALA   6           H        ALA   6 -13.749  -0.510  -3.492
   57    HA   ALA   6           HA       ALA   6 -11.862   1.627  -3.272
   58    HB1  ALA   6           1HB      ALA   6 -12.191   1.463  -0.895
   59    HB2  ALA   6           2HB      ALA   6 -12.872  -0.154  -1.053
   60    HB3  ALA   6           3HB      ALA   6 -13.760   1.241  -1.670
   61    H    LEU   7           H        LEU   7 -11.811  -1.812  -2.570
   62    HA   LEU   7           HA       LEU   7  -9.240  -1.985  -1.468
   63    HB2  LEU   7           2HB      LEU   7 -10.105  -4.057  -1.219
   64    HB3  LEU   7           1HB      LEU   7 -11.238  -3.814  -2.540
   65    HG   LEU   7           HG       LEU   7  -9.247  -4.234  -4.118
   66   HD11  LEU   7          1HD1      LEU   7  -7.239  -4.355  -3.090
   67   HD12  LEU   7          2HD1      LEU   7  -7.743  -5.948  -2.526
   68   HD13  LEU   7          3HD1      LEU   7  -7.974  -4.536  -1.492
   69   HD21  LEU   7          3HD2      LEU   7 -10.785  -5.970  -4.091
   70   HD22  LEU   7          1HD2      LEU   7 -10.630  -6.227  -2.354
   71   HD23  LEU   7          2HD2      LEU   7  -9.372  -6.803  -3.448
   72    H    ALA   8           H        ALA   8 -10.351  -2.138  -4.786
   73    HA   ALA   8           HA       ALA   8  -7.832  -2.608  -6.007
   74    HB1  ALA   8           1HB      ALA   8 -10.467  -2.395  -6.862
   75    HB2  ALA   8           2HB      ALA   8  -9.055  -2.666  -7.883
   76    HB3  ALA   8           3HB      ALA   8  -9.656  -1.027  -7.629
   77    H    LEU   9           H        LEU   9  -9.752   0.309  -5.719
   78    HA   LEU   9           HA       LEU   9  -7.864   2.121  -6.755
   79    HB2  LEU   9           2HB      LEU   9 -10.424   2.279  -5.315
   80    HB3  LEU   9           1HB      LEU   9  -9.351   3.647  -5.030
   81    HG   LEU   9           HG       LEU   9 -10.783   4.089  -6.964
   82   HD11  LEU   9          1HD1      LEU   9  -8.155   3.512  -8.253
   83   HD12  LEU   9          2HD1      LEU   9  -8.145   4.550  -6.829
   84   HD13  LEU   9          3HD1      LEU   9  -9.100   5.004  -8.238
   85   HD21  LEU   9          3HD2      LEU   9 -10.233   2.608  -9.036
   86   HD22  LEU   9          1HD2      LEU   9 -11.351   1.982  -7.820
   87   HD23  LEU   9          2HD2      LEU   9  -9.674   1.432  -7.847
   88    H    HIS  10           H        HIS  10  -8.855   1.717  -3.409
   89    HA   HIS  10           HA       HIS  10  -7.024   3.354  -2.174
   90    HB2  HIS  10           2HB      HIS  10  -8.890   2.285  -0.993
   91    HB3  HIS  10           1HB      HIS  10  -8.066   0.731  -1.099
   92    HD1  HIS  10           1HD      HIS  10  -8.028   3.978   0.741
   93    HD2  HIS  10           2HD      HIS  10  -5.730   0.502   0.556
   94    HE1  HIS  10           1HE      HIS  10  -6.441   4.054   2.713
   95    HE2  HIS  10           2HE      HIS  10  -5.059   1.926   2.636
   96    H    HIS  11           H        HIS  11  -6.614  -0.157  -2.078
   97    HA   HIS  11           HA       HIS  11  -3.878  -0.006  -1.400
   98    HB2  HIS  11           2HB      HIS  11  -5.420  -2.329  -2.569
   99    HB3  HIS  11           1HB      HIS  11  -3.833  -2.435  -1.813
  100    HD1  HIS  11           1HD      HIS  11  -3.764  -1.538   0.777
  101    HD2  HIS  11           2HD      HIS  11  -7.506  -2.536  -0.773
  102    HE1  HIS  11           1HE      HIS  11  -5.326  -1.760   2.764
  103    HE2  HIS  11           2HE      HIS  11  -7.625  -2.344   1.829
  104    H    LEU  12           H        LEU  12  -3.589   1.658  -3.242
  105    HA   LEU  12           HA       LEU  12  -2.868   0.384  -5.789
  106    HB2  LEU  12           2HB      LEU  12  -3.571   3.103  -4.929
  107    HB3  LEU  12           1HB      LEU  12  -2.179   3.046  -6.010
  108    HG   LEU  12           HG       LEU  12  -4.778   1.599  -6.605
  109   HD11  LEU  12          1HD1      LEU  12  -5.270   3.465  -8.135
  110   HD12  LEU  12          2HD1      LEU  12  -3.833   4.313  -7.575
  111   HD13  LEU  12          3HD1      LEU  12  -5.179   4.033  -6.472
  112   HD21  LEU  12          3HD2      LEU  12  -2.789   0.761  -7.785
  113   HD22  LEU  12          1HD2      LEU  12  -2.389   2.400  -8.297
  114   HD23  LEU  12          2HD2      LEU  12  -3.840   1.616  -8.907
  115    H    ALA  13           H        ALA  13  -1.422   2.704  -3.549
  116    HA   ALA  13           HA       ALA  13   1.258   1.704  -4.250
  117    HB1  ALA  13           1HB      ALA  13   0.305   4.291  -3.834
  118    HB2  ALA  13           2HB      ALA  13   1.998   3.802  -3.921
  119    HB3  ALA  13           3HB      ALA  13   1.189   3.909  -2.358
  120    H    HIS  14           H        HIS  14   2.580   0.805  -2.724
  121    HA   HIS  14           HA       HIS  14   2.439   0.863   0.022
  122    HB2  HIS  14           2HB      HIS  14   0.162  -0.480  -0.978
  123    HB3  HIS  14           1HB      HIS  14   1.218  -1.715  -0.307
  124    HD1  HIS  14           1HD      HIS  14   0.520  -2.170   2.018
  125    HD2  HIS  14           2HD      HIS  14   0.361   1.916   1.142
  126    HE1  HIS  14           1HE      HIS  14  -0.178  -1.001   4.163
  127    HE2  HIS  14           2HE      HIS  14  -0.301   1.488   3.646
  128    H    LEU  15           H        LEU  15   2.692  -1.405  -2.644
  129    HA   LEU  15           HA       LEU  15   4.539  -3.149  -1.355
  130    HB2  LEU  15           2HB      LEU  15   4.258  -2.773  -4.336
  131    HB3  LEU  15           1HB      LEU  15   4.750  -4.222  -3.460
  132    HG   LEU  15           HG       LEU  15   2.343  -3.900  -2.327
  133   HD11  LEU  15          1HD1      LEU  15   2.345  -2.112  -4.643
  134   HD12  LEU  15          2HD1      LEU  15   1.179  -2.239  -3.326
  135   HD13  LEU  15          3HD1      LEU  15   1.050  -3.309  -4.721
  136   HD21  LEU  15          3HD2      LEU  15   1.962  -5.850  -3.402
  137   HD22  LEU  15          1HD2      LEU  15   3.462  -5.575  -4.287
  138   HD23  LEU  15          2HD2      LEU  15   1.922  -5.051  -4.971
  139    H    ALA  16           H        ALA  16   4.781  -0.160  -2.985
  140    HA   ALA  16           HA       ALA  16   7.453  -0.300  -3.866
  141    HB1  ALA  16           1HB      ALA  16   7.295   2.121  -4.110
  142    HB2  ALA  16           2HB      ALA  16   5.836   2.134  -3.123
  143    HB3  ALA  16           3HB      ALA  16   5.824   1.348  -4.698
  144    H    LEU  17           H        LEU  17   6.170   1.568  -1.167
  145    HA   LEU  17           HA       LEU  17   8.307   2.575   0.053
  146    HB2  LEU  17           2HB      LEU  17   6.903   1.243   2.165
  147    HB3  LEU  17           1HB      LEU  17   6.874   2.949   1.728
  148    HG   LEU  17           HG       LEU  17   5.244   0.914   0.214
  149   HD11  LEU  17          1HD1      LEU  17   4.501   2.390   2.749
  150   HD12  LEU  17          2HD1      LEU  17   4.549   0.644   2.505
  151   HD13  LEU  17          3HD1      LEU  17   3.331   1.613   1.684
  152   HD21  LEU  17          3HD2      LEU  17   4.360   2.715  -0.846
  153   HD22  LEU  17          1HD2      LEU  17   5.740   3.606  -0.215
  154   HD23  LEU  17          2HD2      LEU  17   4.205   3.627   0.653
  155    H    HIS  18           H        HIS  18   7.256  -0.725   0.531
  156    HA   HIS  18           HA       HIS  18   9.397  -1.536   2.203
  157    HB2  HIS  18           2HB      HIS  18   7.955  -3.310   0.234
  158    HB3  HIS  18           1HB      HIS  18   8.772  -3.786   1.714
  159    HD1  HIS  18           1HD      HIS  18   7.604  -2.964   4.006
  160    HD2  HIS  18           2HD      HIS  18   5.369  -2.499   0.530
  161    HE1  HIS  18           1HE      HIS  18   5.220  -2.528   4.749
  162    HE2  HIS  18           2HE      HIS  18   3.842  -2.204   2.637
  163    H    LEU  19           H        LEU  19   8.866  -2.249  -1.189
  164    HA   LEU  19           HA       LEU  19  11.332  -3.388  -1.763
  165    HB2  LEU  19           2HB      LEU  19  10.338  -3.624  -3.770
  166    HB3  LEU  19           1HB      LEU  19   8.976  -2.717  -3.119
  167    HG   LEU  19           HG       LEU  19  10.230  -0.598  -3.835
  168   HD11  LEU  19          1HD1      LEU  19  12.258  -2.479  -4.399
  169   HD12  LEU  19          2HD1      LEU  19  12.253  -0.765  -4.823
  170   HD13  LEU  19          3HD1      LEU  19  11.649  -1.958  -5.973
  171   HD21  LEU  19          3HD2      LEU  19   8.311  -1.865  -5.069
  172   HD22  LEU  19          1HD2      LEU  19   9.581  -2.384  -6.180
  173   HD23  LEU  19          2HD2      LEU  19   9.231  -0.670  -5.975
  174    H    ALA  20           H        ALA  20  10.255  -0.109  -1.705
  175    HA   ALA  20           HA       ALA  20  12.542   1.136  -2.832
  176    HB1  ALA  20           1HB      ALA  20  10.375   2.094  -0.974
  177    HB2  ALA  20           2HB      ALA  20  10.626   2.508  -2.669
  178    HB3  ALA  20           3HB      ALA  20  11.713   3.145  -1.434
  179    H    LEU  21           H        LEU  21  11.559   0.710   0.532
  180    HA   LEU  21           HA       LEU  21  13.891   1.656   1.754
  181    HB2  LEU  21           2HB      LEU  21  11.800  -0.349   2.582
  182    HB3  LEU  21           1HB      LEU  21  13.184   0.001   3.618
  183    HG   LEU  21           HG       LEU  21  11.603   2.294   2.505
  184   HD11  LEU  21          1HD1      LEU  21   9.952   0.665   3.454
  185   HD12  LEU  21          2HD1      LEU  21  10.045   2.166   4.375
  186   HD13  LEU  21          3HD1      LEU  21  10.842   0.714   4.975
  187   HD21  LEU  21          3HD2      LEU  21  13.635   2.788   3.737
  188   HD22  LEU  21          1HD2      LEU  21  13.156   1.710   5.047
  189   HD23  LEU  21          2HD2      LEU  21  12.269   3.207   4.767
  190    H    ALA  22           H        ALA  22  12.936  -1.605   0.866
  191    HA   ALA  22           HA       ALA  22  15.217  -2.993   1.657
  192    HB1  ALA  22           1HB      ALA  22  13.524  -3.581  -0.773
  193    HB2  ALA  22           2HB      ALA  22  13.124  -4.072   0.872
  194    HB3  ALA  22           3HB      ALA  22  14.558  -4.723   0.080
  195    H    LEU  23           H        LEU  23  14.537  -1.386  -1.404
  196    HA   LEU  23           HA       LEU  23  17.019  -2.106  -2.631
  197    HB2  LEU  23           2HB      LEU  23  14.659  -0.985  -3.526
  198    HB3  LEU  23           1HB      LEU  23  15.800   0.356  -3.637
  199    HG   LEU  23           HG       LEU  23  16.496  -2.391  -4.682
  200   HD11  LEU  23          1HD1      LEU  23  14.532  -1.896  -5.913
  201   HD12  LEU  23          2HD1      LEU  23  15.852  -1.353  -6.948
  202   HD13  LEU  23          3HD1      LEU  23  14.927  -0.183  -6.009
  203   HD21  LEU  23          3HD2      LEU  23  18.255  -0.594  -4.326
  204   HD22  LEU  23          1HD2      LEU  23  17.415   0.365  -5.544
  205   HD23  LEU  23          2HD2      LEU  23  18.126  -1.188  -5.981
  206    H    LYS  24           H        LYS  24  15.823   0.977  -1.351
  207    HA   LYS  24           HA       LYS  24  18.263   2.372  -1.585
  208    HB2  LYS  24           2HB      LYS  24  16.017   2.802   0.389
  209    HB3  LYS  24           1HB      LYS  24  17.304   3.958   0.042
  210    HG2  LYS  24           2HG      LYS  24  16.590   4.046  -2.320
  211    HG3  LYS  24           1HG      LYS  24  15.302   2.894  -1.975
  212    HD2  LYS  24           2HD      LYS  24  15.602   5.679  -0.812
  213    HD3  LYS  24           1HD      LYS  24  14.372   5.141  -1.952
  214    HE2  LYS  24           2HE      LYS  24  13.087   4.735  -0.133
  215    HE3  LYS  24           1HE      LYS  24  14.103   3.319   0.121
  216    HZ1  LYS  24           3HZ      LYS  24  15.594   4.737   1.447
  217    HZ2  LYS  24           1HZ      LYS  24  14.039   4.627   2.107
  218    HZ3  LYS  24           2HZ      LYS  24  14.504   6.025   1.264
  219    H    LYS  25           H        LYS  25  16.944   0.358   0.963
  220    HA   LYS  25           HA       LYS  25  17.875  -0.521   2.875
  221    HB2  LYS  25           2HB      LYS  25  19.632  -1.066   0.907
  222    HB3  LYS  25           1HB      LYS  25  20.655  -0.044   1.912
  223    HG2  LYS  25           2HG      LYS  25  21.054  -2.131   2.864
  224    HG3  LYS  25           1HG      LYS  25  19.722  -1.559   3.869
  225    HD2  LYS  25           2HD      LYS  25  18.142  -2.922   2.779
  226    HD3  LYS  25           1HD      LYS  25  19.169  -3.132   1.360
  227    HE2  LYS  25           2HE      LYS  25  19.710  -4.277   4.122
  228    HE3  LYS  25           1HE      LYS  25  19.146  -5.186   2.721
  229    HZ1  LYS  25           3HZ      LYS  25  21.302  -5.513   2.331
  230    HZ2  LYS  25           1HZ      LYS  25  21.797  -4.257   3.355
  231    HZ3  LYS  25           2HZ      LYS  25  21.321  -3.920   1.760
  232    H    ALA  26           H        ALA  26  20.304   0.086   4.157
  233    HA   ALA  26           HA       ALA  26  20.337   2.960   4.597
  234    HB1  ALA  26           1HB      ALA  26  18.807   1.234   6.256
  235    HB2  ALA  26           2HB      ALA  26  19.152   2.946   6.494
  236    HB3  ALA  26           3HB      ALA  26  20.227   1.732   7.177
  Start of MODEL    2
    1    H1   LYS   1           1HT      LYS   1 -10.743   9.548 -20.977
    2    H2   LYS   1           2HT      LYS   1 -10.829  11.053 -21.757
    3    H3   LYS   1           3HT      LYS   1 -12.208  10.392 -21.029
    4    HA   LYS   1           HA       LYS   1 -10.889  12.241 -19.811
    5    HB2  LYS   1           2HB      LYS   1 -11.556   9.713 -18.273
    6    HB3  LYS   1           1HB      LYS   1 -11.623  11.374 -17.691
    7    HG2  LYS   1           2HG      LYS   1 -13.439  11.833 -19.355
    8    HG3  LYS   1           1HG      LYS   1 -13.429  10.123 -19.785
    9    HD2  LYS   1           2HD      LYS   1 -14.032   9.487 -17.526
   10    HD3  LYS   1           1HD      LYS   1 -13.885  11.153 -16.971
   11    HE2  LYS   1           2HE      LYS   1 -16.259  10.443 -17.381
   12    HE3  LYS   1           1HE      LYS   1 -15.775  11.840 -18.338
   13    HZ1  LYS   1           2HZ      LYS   1 -15.580  10.552 -20.255
   14    HZ2  LYS   1           3HZ      LYS   1 -16.995   9.970 -19.515
   15    HZ3  LYS   1           1HZ      LYS   1 -15.552   9.089 -19.389
   16    H    LYS   2           H        LYS   2  -9.326  12.220 -17.916
   17    HA   LYS   2           HA       LYS   2  -6.787  11.336 -18.706
   18    HB2  LYS   2           2HB      LYS   2  -7.791  11.907 -15.902
   19    HB3  LYS   2           1HB      LYS   2  -6.097  11.823 -16.385
   20    HG2  LYS   2           2HG      LYS   2  -7.641  13.632 -18.097
   21    HG3  LYS   2           1HG      LYS   2  -7.700  14.114 -16.401
   22    HD2  LYS   2           2HD      LYS   2  -5.005  13.318 -17.227
   23    HD3  LYS   2           1HD      LYS   2  -5.629  14.655 -18.194
   24    HE2  LYS   2           2HE      LYS   2  -5.372  14.538 -15.174
   25    HE3  LYS   2           1HE      LYS   2  -4.534  15.624 -16.279
   26    HZ1  LYS   2           3HZ      LYS   2  -7.212  15.983 -16.800
   27    HZ2  LYS   2           1HZ      LYS   2  -6.199  17.040 -15.949
   28    HZ3  LYS   2           2HZ      LYS   2  -7.119  15.889 -15.106
   29    H    ALA   3           H        ALA   3  -5.546   9.550 -18.114
   30    HA   ALA   3           HA       ALA   3  -6.937   7.101 -17.793
   31    HB1  ALA   3           1HB      ALA   3  -4.059   7.131 -17.120
   32    HB2  ALA   3           2HB      ALA   3  -4.473   7.769 -18.710
   33    HB3  ALA   3           3HB      ALA   3  -4.942   6.129 -18.269
   34    H    LEU   4           H        LEU   4  -7.916   8.435 -15.719
   35    HA   LEU   4           HA       LEU   4  -6.594   8.354 -13.261
   36    HB2  LEU   4           2HB      LEU   4  -9.388   8.488 -14.181
   37    HB3  LEU   4           1HB      LEU   4  -9.192   7.731 -12.601
   38    HG   LEU   4           HG       LEU   4  -7.869   9.698 -11.847
   39   HD11  LEU   4          1HD1      LEU   4  -6.921  10.787 -13.617
   40   HD12  LEU   4          2HD1      LEU   4  -8.411  11.728 -13.546
   41   HD13  LEU   4          3HD1      LEU   4  -8.262  10.404 -14.702
   42   HD21  LEU   4          3HD2      LEU   4  -9.759  11.107 -11.509
   43   HD22  LEU   4          1HD2      LEU   4 -10.417   9.482 -11.659
   44   HD23  LEU   4          2HD2      LEU   4 -10.511  10.597 -13.021
   45    H    LEU   5           H        LEU   5  -9.000   6.083 -14.416
   46    HA   LEU   5           HA       LEU   5  -8.693   4.059 -12.563
   47    HB2  LEU   5           2HB      LEU   5  -9.106   3.501 -15.503
   48    HB3  LEU   5           1HB      LEU   5  -9.714   2.575 -14.130
   49    HG   LEU   5           HG       LEU   5 -10.578   5.354 -14.984
   50   HD11  LEU   5          1HD1      LEU   5 -12.838   4.003 -14.873
   51   HD12  LEU   5          2HD1      LEU   5 -11.780   2.602 -15.050
   52   HD13  LEU   5          3HD1      LEU   5 -11.796   3.862 -16.288
   53   HD21  LEU   5          3HD2      LEU   5 -10.715   5.562 -12.678
   54   HD22  LEU   5          1HD2      LEU   5 -10.907   3.825 -12.432
   55   HD23  LEU   5          2HD2      LEU   5 -12.266   4.791 -13.004
   56    H    ALA   6           H        ALA   6  -7.162   4.305 -15.702
   57    HA   ALA   6           HA       ALA   6  -5.458   2.133 -15.624
   58    HB1  ALA   6           1HB      ALA   6  -4.188   3.154 -17.330
   59    HB2  ALA   6           2HB      ALA   6  -4.535   4.775 -16.733
   60    HB3  ALA   6           3HB      ALA   6  -5.800   3.838 -17.526
   61    H    LEU   7           H        LEU   7  -4.886   5.369 -14.383
   62    HA   LEU   7           HA       LEU   7  -2.274   4.858 -13.376
   63    HB2  LEU   7           2HB      LEU   7  -4.297   6.995 -13.143
   64    HB3  LEU   7           1HB      LEU   7  -3.234   6.833 -11.752
   65    HG   LEU   7           HG       LEU   7  -1.271   7.141 -13.108
   66   HD11  LEU   7          1HD1      LEU   7  -1.345   6.232 -15.180
   67   HD12  LEU   7          2HD1      LEU   7  -2.113   7.736 -15.686
   68   HD13  LEU   7          3HD1      LEU   7  -3.102   6.341 -15.257
   69   HD21  LEU   7          3HD2      LEU   7  -3.014   9.149 -14.425
   70   HD22  LEU   7          1HD2      LEU   7  -1.561   9.384 -13.456
   71   HD23  LEU   7          2HD2      LEU   7  -3.105   9.082 -12.664
   72    H    ALA   8           H        ALA   8  -5.328   5.298 -11.704
   73    HA   ALA   8           HA       ALA   8  -4.675   4.528  -9.150
   74    HB1  ALA   8           1HB      ALA   8  -6.877   4.927  -8.971
   75    HB2  ALA   8           2HB      ALA   8  -7.170   3.322  -9.643
   76    HB3  ALA   8           3HB      ALA   8  -7.089   4.724 -10.710
   77    H    LEU   9           H        LEU   9  -5.855   2.455 -11.708
   78    HA   LEU   9           HA       LEU   9  -5.777  -0.022 -10.489
   79    HB2  LEU   9           2HB      LEU   9  -5.527   0.943 -13.272
   80    HB3  LEU   9           1HB      LEU   9  -4.909  -0.678 -12.976
   81    HG   LEU   9           HG       LEU   9  -7.632   0.152 -11.965
   82   HD11  LEU   9          1HD1      LEU   9  -7.165  -1.243 -14.606
   83   HD12  LEU   9          2HD1      LEU   9  -7.333   0.508 -14.502
   84   HD13  LEU   9          3HD1      LEU   9  -8.659  -0.538 -13.993
   85   HD21  LEU   9          3HD2      LEU   9  -6.356  -1.977 -11.238
   86   HD22  LEU   9          1HD2      LEU   9  -6.646  -2.564 -12.872
   87   HD23  LEU   9          2HD2      LEU   9  -8.010  -2.194 -11.812
   88    H    HIS  10           H        HIS  10  -3.252   1.101 -12.657
   89    HA   HIS  10           HA       HIS  10  -1.328  -0.776 -11.911
   90    HB2  HIS  10           2HB      HIS  10  -0.680   0.191 -13.866
   91    HB3  HIS  10           1HB      HIS  10  -1.350   1.760 -13.425
   92    HD1  HIS  10           1HD      HIS  10   1.381  -0.338 -11.747
   93    HD2  HIS  10           2HD      HIS  10   0.806   3.487 -13.326
   94    HE1  HIS  10           1HE      HIS  10   3.530   0.947 -11.338
   95    HE2  HIS  10           2HE      HIS  10   3.189   3.285 -12.278
   96    H    HIS  11           H        HIS  11  -1.798   2.539 -10.769
   97    HA   HIS  11           HA       HIS  11   0.460   2.524  -9.047
   98    HB2  HIS  11           2HB      HIS  11  -1.951   4.301  -9.288
   99    HB3  HIS  11           1HB      HIS  11  -0.813   4.507  -7.955
  100    HD1  HIS  11           1HD      HIS  11   1.859   4.048  -9.213
  101    HD2  HIS  11           2HD      HIS  11  -1.159   6.144 -11.195
  102    HE1  HIS  11           1HE      HIS  11   3.004   5.459 -10.985
  103    HE2  HIS  11           2HE      HIS  11   1.181   6.773 -12.186
  104    H    LEU  12           H        LEU  12  -0.630   0.155  -8.462
  105    HA   LEU  12           HA       LEU  12  -2.481  -0.005  -6.376
  106    HB2  LEU  12           2HB      LEU  12   0.003  -1.701  -6.724
  107    HB3  LEU  12           1HB      LEU  12  -1.439  -2.141  -5.813
  108    HG   LEU  12           HG       LEU  12  -1.574  -1.446  -8.753
  109   HD11  LEU  12          1HD1      LEU  12  -0.016  -3.287  -8.631
  110   HD12  LEU  12          2HD1      LEU  12  -1.577  -3.947  -9.118
  111   HD13  LEU  12          3HD1      LEU  12  -1.022  -4.129  -7.454
  112   HD21  LEU  12          3HD2      LEU  12  -3.345  -2.795  -6.715
  113   HD22  LEU  12          1HD2      LEU  12  -3.576  -3.078  -8.443
  114   HD23  LEU  12          2HD2      LEU  12  -3.726  -1.449  -7.788
  115    H    ALA  13           H        ALA  13   0.971   0.483  -6.381
  116    HA   ALA  13           HA       ALA  13   2.464   1.308  -4.853
  117    HB1  ALA  13           1HB      ALA  13   1.690   3.086  -3.390
  118    HB2  ALA  13           2HB      ALA  13   0.015   2.591  -3.626
  119    HB3  ALA  13           3HB      ALA  13   0.934   3.255  -4.977
  120    H    HIS  14           H        HIS  14   2.483   1.745  -2.233
  121    HA   HIS  14           HA       HIS  14   2.576   0.810  -0.151
  122    HB2  HIS  14           2HB      HIS  14   0.150  -0.407  -1.264
  123    HB3  HIS  14           1HB      HIS  14   0.957  -1.406  -0.058
  124    HD1  HIS  14           1HD      HIS  14   1.290  -0.341   2.344
  125    HD2  HIS  14           2HD      HIS  14  -1.051   1.925  -0.263
  126    HE1  HIS  14           1HE      HIS  14   0.115   1.403   3.763
  127    HE2  HIS  14           2HE      HIS  14  -1.309   2.802   2.184
  128    H    LEU  15           H        LEU  15   2.692  -1.170  -2.955
  129    HA   LEU  15           HA       LEU  15   4.153  -3.350  -1.717
  130    HB2  LEU  15           2HB      LEU  15   3.426  -2.653  -4.561
  131    HB3  LEU  15           1HB      LEU  15   4.380  -4.075  -4.133
  132    HG   LEU  15           HG       LEU  15   1.862  -3.678  -2.597
  133   HD11  LEU  15          1HD1      LEU  15   1.096  -3.092  -4.839
  134   HD12  LEU  15          2HD1      LEU  15   0.521  -4.711  -4.429
  135   HD13  LEU  15          3HD1      LEU  15   1.897  -4.510  -5.514
  136   HD21  LEU  15          3HD2      LEU  15   2.599  -6.201  -4.001
  137   HD22  LEU  15          1HD2      LEU  15   1.999  -5.960  -2.355
  138   HD23  LEU  15          2HD2      LEU  15   3.694  -5.651  -2.735
  139    H    ALA  16           H        ALA  16   4.916  -0.283  -2.795
  140    HA   ALA  16           HA       ALA  16   7.649  -1.034  -3.565
  141    HB1  ALA  16           1HB      ALA  16   6.014   0.572  -4.915
  142    HB2  ALA  16           2HB      ALA  16   7.761   0.820  -4.893
  143    HB3  ALA  16           3HB      ALA  16   6.722   1.770  -3.831
  144    H    LEU  17           H        LEU  17   5.924   1.050  -1.292
  145    HA   LEU  17           HA       LEU  17   7.856   2.613  -0.239
  146    HB2  LEU  17           2HB      LEU  17   6.770   2.386   1.979
  147    HB3  LEU  17           1HB      LEU  17   5.629   2.677   0.671
  148    HG   LEU  17           HG       LEU  17   5.645  -0.042   0.687
  149   HD11  LEU  17          1HD1      LEU  17   6.013  -0.950   2.795
  150   HD12  LEU  17          2HD1      LEU  17   5.620   0.555   3.619
  151   HD13  LEU  17          3HD1      LEU  17   7.190   0.361   2.848
  152   HD21  LEU  17          3HD2      LEU  17   3.496   0.143   1.608
  153   HD22  LEU  17          1HD2      LEU  17   3.772   1.774   0.995
  154   HD23  LEU  17          2HD2      LEU  17   3.973   1.430   2.713
  155    H    HIS  18           H        HIS  18   7.284  -0.694   0.730
  156    HA   HIS  18           HA       HIS  18   9.570  -0.854   2.449
  157    HB2  HIS  18           2HB      HIS  18   9.005  -3.151   2.700
  158    HB3  HIS  18           1HB      HIS  18   7.491  -2.282   2.501
  159    HD1  HIS  18           1HD      HIS  18   9.201  -5.146   1.207
  160    HD2  HIS  18           2HD      HIS  18   6.677  -2.243  -0.413
  161    HE1  HIS  18           1HE      HIS  18   8.362  -6.063  -0.999
  162    HE2  HIS  18           2HE      HIS  18   6.834  -4.307  -2.003
  163    H    LEU  19           H        LEU  19   8.840  -1.866  -0.802
  164    HA   LEU  19           HA       LEU  19  11.259  -3.124  -1.451
  165    HB2  LEU  19           2HB      LEU  19   8.939  -2.684  -2.794
  166    HB3  LEU  19           1HB      LEU  19   9.971  -1.471  -3.556
  167    HG   LEU  19           HG       LEU  19  10.042  -3.646  -4.753
  168   HD11  LEU  19          1HD1      LEU  19  12.306  -3.531  -5.181
  169   HD12  LEU  19          2HD1      LEU  19  12.734  -3.386  -3.478
  170   HD13  LEU  19          3HD1      LEU  19  12.076  -2.000  -4.345
  171   HD21  LEU  19          3HD2      LEU  19  11.680  -4.973  -2.702
  172   HD22  LEU  19          1HD2      LEU  19  10.405  -5.630  -3.726
  173   HD23  LEU  19          2HD2      LEU  19   9.990  -4.776  -2.239
  174    H    ALA  20           H        ALA  20  10.290   0.179  -1.156
  175    HA   ALA  20           HA       ALA  20  12.469   1.405  -2.498
  176    HB1  ALA  20           1HB      ALA  20  11.653   3.397  -1.694
  177    HB2  ALA  20           2HB      ALA  20  11.329   2.737  -0.091
  178    HB3  ALA  20           3HB      ALA  20  10.224   2.400  -1.423
  179    H    LEU  21           H        LEU  21  11.896   0.836   0.941
  180    HA   LEU  21           HA       LEU  21  14.445   1.564   1.861
  181    HB2  LEU  21           2HB      LEU  21  12.639  -0.576   3.015
  182    HB3  LEU  21           1HB      LEU  21  13.919   0.293   3.866
  183    HG   LEU  21           HG       LEU  21  11.834   1.957   2.526
  184   HD11  LEU  21          1HD1      LEU  21  10.129   0.842   3.530
  185   HD12  LEU  21          2HD1      LEU  21  10.722   1.568   5.021
  186   HD13  LEU  21          3HD1      LEU  21  11.219  -0.067   4.578
  187   HD21  LEU  21          3HD2      LEU  21  12.304   3.445   4.318
  188   HD22  LEU  21          1HD2      LEU  21  13.866   2.734   3.918
  189   HD23  LEU  21          2HD2      LEU  21  12.970   2.158   5.322
  190    H    ALA  22           H        ALA  22  13.128  -1.547   0.882
  191    HA   ALA  22           HA       ALA  22  15.446  -3.100   1.288
  192    HB1  ALA  22           1HB      ALA  22  14.298  -4.399  -0.774
  193    HB2  ALA  22           2HB      ALA  22  12.940  -3.385  -0.282
  194    HB3  ALA  22           3HB      ALA  22  13.677  -4.492   0.874
  195    H    LEU  23           H        LEU  23  14.397  -1.067  -1.337
  196    HA   LEU  23           HA       LEU  23  16.524  -1.839  -3.126
  197    HB2  LEU  23           2HB      LEU  23  14.378  -1.073  -4.025
  198    HB3  LEU  23           1HB      LEU  23  14.575   0.480  -3.215
  199    HG   LEU  23           HG       LEU  23  16.859  -0.306  -4.923
  200   HD11  LEU  23          1HD1      LEU  23  15.713   0.225  -7.032
  201   HD12  LEU  23          2HD1      LEU  23  14.186   0.412  -6.173
  202   HD13  LEU  23          3HD1      LEU  23  14.956  -1.172  -6.265
  203   HD21  LEU  23          3HD2      LEU  23  15.238   2.135  -4.262
  204   HD22  LEU  23          1HD2      LEU  23  16.226   2.138  -5.729
  205   HD23  LEU  23          2HD2      LEU  23  16.979   1.890  -4.154
  206    H    LYS  24           H        LYS  24  15.960   0.539  -0.677
  207    HA   LYS  24           HA       LYS  24  18.165   2.229  -1.427
  208    HB2  LYS  24           2HB      LYS  24  15.980   2.740   0.028
  209    HB3  LYS  24           1HB      LYS  24  17.073   2.308   1.343
  210    HG2  LYS  24           2HG      LYS  24  18.553   3.989  -0.392
  211    HG3  LYS  24           1HG      LYS  24  16.975   4.750  -0.207
  212    HD2  LYS  24           2HD      LYS  24  18.224   5.616   1.601
  213    HD3  LYS  24           1HD      LYS  24  17.273   4.322   2.328
  214    HE2  LYS  24           2HE      LYS  24  19.821   4.451   2.875
  215    HE3  LYS  24           1HE      LYS  24  19.126   2.880   2.487
  216    HZ1  LYS  24           3HZ      LYS  24  20.330   4.599   0.398
  217    HZ2  LYS  24           1HZ      LYS  24  20.025   2.928   0.351
  218    HZ3  LYS  24           2HZ      LYS  24  21.278   3.531   1.331
  219    H    LYS  25           H        LYS  25  17.632  -0.434   0.778
  220    HA   LYS  25           HA       LYS  25  19.065  -1.617   2.142
  221    HB2  LYS  25           2HB      LYS  25  21.208  -0.634   0.231
  222    HB3  LYS  25           1HB      LYS  25  21.275  -2.064   1.256
  223    HG2  LYS  25           2HG      LYS  25  20.242  -3.289  -0.322
  224    HG3  LYS  25           1HG      LYS  25  18.878  -2.174  -0.320
  225    HD2  LYS  25           2HD      LYS  25  19.497  -1.668  -2.439
  226    HD3  LYS  25           1HD      LYS  25  20.811  -0.756  -1.702
  227    HE2  LYS  25           2HE      LYS  25  21.758  -2.266  -3.358
  228    HE3  LYS  25           1HE      LYS  25  22.209  -2.848  -1.755
  229    HZ1  LYS  25           3HZ      LYS  25  21.417  -4.766  -2.619
  230    HZ2  LYS  25           1HZ      LYS  25  20.369  -3.996  -3.703
  231    HZ3  LYS  25           2HZ      LYS  25  19.936  -4.145  -2.071
  232    H    ALA  26           H        ALA  26  22.028  -0.247   1.860
  233    HA   ALA  26           HA       ALA  26  21.753   1.171   4.391
  234    HB1  ALA  26           1HB      ALA  26  24.378   1.447   3.679
  235    HB2  ALA  26           2HB      ALA  26  23.953  -0.067   2.881
  236    HB3  ALA  26           3HB      ALA  26  23.731   0.100   4.622
  Start of MODEL    3
    1    H1   LYS   1           1HT      LYS   1  14.112  11.734  12.661
    2    H2   LYS   1           2HT      LYS   1  14.678  10.423  13.573
    3    H3   LYS   1           3HT      LYS   1  13.020  10.592  13.268
    4    HA   LYS   1           HA       LYS   1  14.455   8.931  11.884
    5    HB2  LYS   1           2HB      LYS   1  12.456  10.847  10.641
    6    HB3  LYS   1           1HB      LYS   1  12.890   9.267  10.001
    7    HG2  LYS   1           2HG      LYS   1  11.594   9.773  12.705
    8    HG3  LYS   1           1HG      LYS   1  10.761   9.177  11.272
    9    HD2  LYS   1           2HD      LYS   1  12.722   7.354  11.355
   10    HD3  LYS   1           1HD      LYS   1  12.698   7.772  13.067
   11    HE2  LYS   1           2HE      LYS   1  10.601   6.428  11.413
   12    HE3  LYS   1           1HE      LYS   1  11.101   6.103  13.072
   13    HZ1  LYS   1           2HZ      LYS   1  10.104   8.502  13.409
   14    HZ2  LYS   1           3HZ      LYS   1   9.132   7.115  13.471
   15    HZ3  LYS   1           1HZ      LYS   1   9.179   8.048  12.058
   16    H    LYS   2           H        LYS   2  15.057   9.107   9.406
   17    HA   LYS   2           HA       LYS   2  16.555  11.581   8.857
   18    HB2  LYS   2           2HB      LYS   2  17.726   8.796   8.998
   19    HB3  LYS   2           1HB      LYS   2  18.487  10.087   8.066
   20    HG2  LYS   2           2HG      LYS   2  17.709  10.696  10.886
   21    HG3  LYS   2           1HG      LYS   2  19.107   9.659  10.635
   22    HD2  LYS   2           2HD      LYS   2  19.527  11.697   8.799
   23    HD3  LYS   2           1HD      LYS   2  18.813  12.545  10.171
   24    HE2  LYS   2           2HE      LYS   2  21.280  12.432  10.361
   25    HE3  LYS   2           1HE      LYS   2  20.492  11.565  11.679
   26    HZ1  LYS   2           3HZ      LYS   2  21.109  10.034   9.275
   27    HZ2  LYS   2           1HZ      LYS   2  21.184   9.573  10.908
   28    HZ3  LYS   2           2HZ      LYS   2  22.425  10.515  10.240
   29    H    ALA   3           H        ALA   3  17.664   9.242   6.827
   30    HA   ALA   3           HA       ALA   3  16.648  10.181   4.472
   31    HB1  ALA   3           1HB      ALA   3  17.033   7.831   3.573
   32    HB2  ALA   3           2HB      ALA   3  17.444   7.369   5.226
   33    HB3  ALA   3           3HB      ALA   3  18.410   8.583   4.382
   34    H    LEU   4           H        LEU   4  15.017   8.230   6.801
   35    HA   LEU   4           HA       LEU   4  13.034   6.926   5.470
   36    HB2  LEU   4           2HB      LEU   4  12.768   6.654   7.732
   37    HB3  LEU   4           1HB      LEU   4  13.189   8.327   8.085
   38    HG   LEU   4           HG       LEU   4  10.634   7.805   6.615
   39   HD11  LEU   4          1HD1      LEU   4   9.446   7.241   8.569
   40   HD12  LEU   4          2HD1      LEU   4  10.816   7.624   9.610
   41   HD13  LEU   4          3HD1      LEU   4  10.860   6.189   8.584
   42   HD21  LEU   4          3HD2      LEU   4  11.930   9.975   8.009
   43   HD22  LEU   4          1HD2      LEU   4  10.392   9.612   8.795
   44   HD23  LEU   4          2HD2      LEU   4  10.434  10.004   7.076
   45    H    LEU   5           H        LEU   5  13.239  10.342   6.175
   46    HA   LEU   5           HA       LEU   5  10.811  11.314   5.371
   47    HB2  LEU   5           2HB      LEU   5  12.495  12.831   6.202
   48    HB3  LEU   5           1HB      LEU   5  13.559  12.460   4.847
   49    HG   LEU   5           HG       LEU   5  11.938  13.452   3.279
   50   HD11  LEU   5          1HD1      LEU   5  10.010  14.751   4.266
   51   HD12  LEU   5          2HD1      LEU   5  10.333  13.945   5.803
   52   HD13  LEU   5          3HD1      LEU   5   9.851  13.001   4.388
   53   HD21  LEU   5          3HD2      LEU   5  13.131  15.323   3.680
   54   HD22  LEU   5          1HD2      LEU   5  13.349  14.879   5.372
   55   HD23  LEU   5          2HD2      LEU   5  11.918  15.783   4.875
   56    H    ALA   6           H        ALA   6  13.579  10.617   3.299
   57    HA   ALA   6           HA       ALA   6  12.304  11.242   0.848
   58    HB1  ALA   6           1HB      ALA   6  14.601  11.094   0.578
   59    HB2  ALA   6           2HB      ALA   6  14.106   9.512  -0.030
   60    HB3  ALA   6           3HB      ALA   6  14.731   9.669   1.611
   61    H    LEU   7           H        LEU   7  12.668   8.255   2.641
   62    HA   LEU   7           HA       LEU   7  11.438   6.527   0.798
   63    HB2  LEU   7           2HB      LEU   7  12.643   5.485   2.539
   64    HB3  LEU   7           1HB      LEU   7  11.846   6.443   3.782
   65    HG   LEU   7           HG       LEU   7   9.690   5.275   3.242
   66   HD11  LEU   7          1HD1      LEU   7  11.517   3.960   1.256
   67   HD12  LEU   7          2HD1      LEU   7   9.849   4.497   1.055
   68   HD13  LEU   7          3HD1      LEU   7  10.197   3.018   1.952
   69   HD21  LEU   7          3HD2      LEU   7  10.794   4.353   5.107
   70   HD22  LEU   7          1HD2      LEU   7  12.131   3.741   4.135
   71   HD23  LEU   7          2HD2      LEU   7  10.555   2.950   4.063
   72    H    ALA   8           H        ALA   8  10.197   8.399   3.482
   73    HA   ALA   8           HA       ALA   8   7.476   7.582   3.233
   74    HB1  ALA   8           1HB      ALA   8   8.453   8.517   5.309
   75    HB2  ALA   8           2HB      ALA   8   7.016   9.398   4.788
   76    HB3  ALA   8           3HB      ALA   8   8.620  10.075   4.497
   77    H    LEU   9           H        LEU   9   9.195  10.511   2.421
   78    HA   LEU   9           HA       LEU   9   7.290  12.114   1.351
   79    HB2  LEU   9           2HB      LEU   9   9.624  12.783   1.559
   80    HB3  LEU   9           1HB      LEU   9  10.074  11.678   0.262
   81    HG   LEU   9           HG       LEU   9   8.474  12.959  -1.244
   82   HD11  LEU   9          1HD1      LEU   9   7.030  14.228   0.009
   83   HD12  LEU   9          2HD1      LEU   9   8.303  15.433  -0.181
   84   HD13  LEU   9          3HD1      LEU   9   8.207  14.480   1.302
   85   HD21  LEU   9          3HD2      LEU   9  10.972  13.304  -1.176
   86   HD22  LEU   9          1HD2      LEU   9  10.703  14.627  -0.043
   87   HD23  LEU   9          2HD2      LEU   9  10.063  14.729  -1.683
   88    H    HIS  10           H        HIS  10   9.316  10.256  -0.875
   89    HA   HIS  10           HA       HIS  10   7.334  10.485  -2.942
   90    HB2  HIS  10           2HB      HIS  10   9.554  10.666  -3.690
   91    HB3  HIS  10           1HB      HIS  10  10.053   9.212  -2.827
   92    HD1  HIS  10           1HD      HIS  10   7.197   9.865  -5.285
   93    HD2  HIS  10           2HD      HIS  10  10.414   7.260  -4.738
   94    HE1  HIS  10           1HE      HIS  10   7.078   8.173  -7.166
   95    HE2  HIS  10           2HE      HIS  10   9.040   6.583  -6.858
   96    H    HIS  11           H        HIS  11   9.032   7.553  -1.975
   97    HA   HIS  11           HA       HIS  11   7.351   5.730  -3.127
   98    HB2  HIS  11           2HB      HIS  11   8.768   5.272  -0.505
   99    HB3  HIS  11           1HB      HIS  11   8.326   4.059  -1.706
  100    HD1  HIS  11           1HD      HIS  11   9.743   3.935  -3.877
  101    HD2  HIS  11           2HD      HIS  11  11.035   6.858  -1.191
  102    HE1  HIS  11           1HE      HIS  11  12.036   4.673  -4.668
  103    HE2  HIS  11           2HE      HIS  11  12.815   6.500  -3.073
  104    H    LEU  12           H        LEU  12   5.173   6.487  -2.841
  105    HA   LEU  12           HA       LEU  12   3.990   6.310  -0.177
  106    HB2  LEU  12           2HB      LEU  12   2.806   6.905  -2.899
  107    HB3  LEU  12           1HB      LEU  12   1.870   6.862  -1.407
  108    HG   LEU  12           HG       LEU  12   4.126   8.756  -2.104
  109   HD11  LEU  12          1HD1      LEU  12   1.771   9.175  -2.934
  110   HD12  LEU  12          2HD1      LEU  12   2.439  10.448  -1.913
  111   HD13  LEU  12          3HD1      LEU  12   1.278   9.301  -1.245
  112   HD21  LEU  12          3HD2      LEU  12   4.574   8.427   0.149
  113   HD22  LEU  12          1HD2      LEU  12   2.901   8.005   0.527
  114   HD23  LEU  12          2HD2      LEU  12   3.345   9.687   0.248
  115    H    ALA  13           H        ALA  13   3.717   4.752  -3.298
  116    HA   ALA  13           HA       ALA  13   1.764   2.916  -2.978
  117    HB1  ALA  13           1HB      ALA  13   4.232   2.982  -4.533
  118    HB2  ALA  13           2HB      ALA  13   2.606   2.488  -5.000
  119    HB3  ALA  13           3HB      ALA  13   3.670   1.348  -4.181
  120    H    HIS  14           H        HIS  14   1.402   1.015  -2.055
  121    HA   HIS  14           HA       HIS  14   2.720   0.336   0.359
  122    HB2  HIS  14           2HB      HIS  14   0.838  -1.367  -1.280
  123    HB3  HIS  14           1HB      HIS  14   1.212  -1.563   0.429
  124    HD1  HIS  14           1HD      HIS  14  -0.352  -0.421   2.002
  125    HD2  HIS  14           2HD      HIS  14  -0.417   1.347  -1.780
  126    HE1  HIS  14           1HE      HIS  14  -2.142   1.377   2.064
  127    HE2  HIS  14           2HE      HIS  14  -2.181   2.462  -0.223
  128    H    LEU  15           H        LEU  15   2.535  -1.322  -2.740
  129    HA   LEU  15           HA       LEU  15   4.371  -3.387  -2.023
  130    HB2  LEU  15           2HB      LEU  15   3.029  -2.477  -4.531
  131    HB3  LEU  15           1HB      LEU  15   4.375  -3.610  -4.636
  132    HG   LEU  15           HG       LEU  15   2.092  -4.112  -2.722
  133   HD11  LEU  15          1HD1      LEU  15   2.250  -4.886  -5.650
  134   HD12  LEU  15          2HD1      LEU  15   1.037  -3.842  -4.908
  135   HD13  LEU  15          3HD1      LEU  15   1.094  -5.559  -4.504
  136   HD21  LEU  15          3HD2      LEU  15   2.836  -6.450  -3.004
  137   HD22  LEU  15          1HD2      LEU  15   4.192  -5.435  -2.510
  138   HD23  LEU  15          2HD2      LEU  15   4.030  -5.937  -4.194
  139    H    ALA  16           H        ALA  16   4.819  -0.203  -2.660
  140    HA   ALA  16           HA       ALA  16   7.440  -0.610  -3.909
  141    HB1  ALA  16           1HB      ALA  16   5.964   1.997  -3.585
  142    HB2  ALA  16           2HB      ALA  16   5.779   0.942  -4.987
  143    HB3  ALA  16           3HB      ALA  16   7.345   1.666  -4.629
  144    H    LEU  17           H        LEU  17   5.959   1.356  -1.350
  145    HA   LEU  17           HA       LEU  17   8.137   2.594  -0.306
  146    HB2  LEU  17           2HB      LEU  17   7.004   2.719   1.809
  147    HB3  LEU  17           1HB      LEU  17   5.823   2.860   0.515
  148    HG   LEU  17           HG       LEU  17   5.675   0.213   0.865
  149   HD11  LEU  17          1HD1      LEU  17   5.932   0.930   3.729
  150   HD12  LEU  17          2HD1      LEU  17   7.460   0.792   2.860
  151   HD13  LEU  17          3HD1      LEU  17   6.343  -0.574   2.909
  152   HD21  LEU  17          3HD2      LEU  17   3.887   2.010   1.118
  153   HD22  LEU  17          1HD2      LEU  17   4.353   2.109   2.817
  154   HD23  LEU  17          2HD2      LEU  17   3.701   0.608   2.170
  155    H    HIS  18           H        HIS  18   7.067  -0.604   0.627
  156    HA   HIS  18           HA       HIS  18   9.168  -1.147   2.435
  157    HB2  HIS  18           2HB      HIS  18   8.397  -3.391   2.404
  158    HB3  HIS  18           1HB      HIS  18   6.991  -2.376   2.125
  159    HD1  HIS  18           1HD      HIS  18   8.562  -5.276   0.760
  160    HD2  HIS  18           2HD      HIS  18   6.574  -1.971  -0.838
  161    HE1  HIS  18           1HE      HIS  18   7.886  -5.919  -1.600
  162    HE2  HIS  18           2HE      HIS  18   6.694  -3.904  -2.603
  163    H    LEU  19           H        LEU  19   8.759  -1.888  -0.952
  164    HA   LEU  19           HA       LEU  19  11.231  -3.236  -1.304
  165    HB2  LEU  19           2HB      LEU  19   9.348  -3.431  -2.905
  166    HB3  LEU  19           1HB      LEU  19   9.563  -1.736  -3.344
  167    HG   LEU  19           HG       LEU  19  12.119  -3.013  -3.523
  168   HD11  LEU  19          1HD1      LEU  19  11.686  -4.726  -5.197
  169   HD12  LEU  19          2HD1      LEU  19   9.951  -4.423  -5.100
  170   HD13  LEU  19          3HD1      LEU  19  10.800  -5.116  -3.722
  171   HD21  LEU  19          3HD2      LEU  19  12.024  -2.210  -5.798
  172   HD22  LEU  19          1HD2      LEU  19  11.206  -1.019  -4.792
  173   HD23  LEU  19          2HD2      LEU  19  10.263  -2.150  -5.763
  174    H    ALA  20           H        ALA  20  10.176   0.061  -1.342
  175    HA   ALA  20           HA       ALA  20  12.407   1.272  -2.575
  176    HB1  ALA  20           1HB      ALA  20  10.173   2.348  -1.888
  177    HB2  ALA  20           2HB      ALA  20  11.631   3.320  -1.694
  178    HB3  ALA  20           3HB      ALA  20  10.903   2.533  -0.296
  179    H    LEU  21           H        LEU  21  11.721   0.677   0.829
  180    HA   LEU  21           HA       LEU  21  14.144   1.649   1.857
  181    HB2  LEU  21           2HB      LEU  21  12.171   1.088   3.266
  182    HB3  LEU  21           1HB      LEU  21  12.463  -0.624   2.947
  183    HG   LEU  21           HG       LEU  21  14.746  -0.376   3.948
  184   HD11  LEU  21          1HD1      LEU  21  13.800   2.451   4.157
  185   HD12  LEU  21          2HD1      LEU  21  15.415   1.827   3.813
  186   HD13  LEU  21          3HD1      LEU  21  14.799   1.819   5.466
  187   HD21  LEU  21          3HD2      LEU  21  12.512  -0.912   5.240
  188   HD22  LEU  21          1HD2      LEU  21  12.780   0.670   5.971
  189   HD23  LEU  21          2HD2      LEU  21  13.990  -0.599   6.144
  190    H    ALA  22           H        ALA  22  13.174  -1.637   1.032
  191    HA   ALA  22           HA       ALA  22  15.592  -2.934   1.520
  192    HB1  ALA  22           1HB      ALA  22  13.178  -3.490  -0.093
  193    HB2  ALA  22           2HB      ALA  22  14.022  -4.518   1.065
  194    HB3  ALA  22           3HB      ALA  22  14.636  -4.357  -0.583
  195    H    LEU  23           H        LEU  23  14.443  -1.267  -1.351
  196    HA   LEU  23           HA       LEU  23  16.594  -1.901  -3.055
  197    HB2  LEU  23           2HB      LEU  23  14.256  -0.509  -3.352
  198    HB3  LEU  23           1HB      LEU  23  15.442   0.794  -3.380
  199    HG   LEU  23           HG       LEU  23  15.082  -0.002  -5.647
  200   HD11  LEU  23          1HD1      LEU  23  17.420   0.585  -4.853
  201   HD12  LEU  23          2HD1      LEU  23  17.360  -0.463  -6.275
  202   HD13  LEU  23          3HD1      LEU  23  17.717  -1.143  -4.686
  203   HD21  LEU  23          3HD2      LEU  23  16.207  -2.626  -5.557
  204   HD22  LEU  23          1HD2      LEU  23  14.566  -2.161  -6.020
  205   HD23  LEU  23          2HD2      LEU  23  14.931  -2.555  -4.342
  206    H    LYS  24           H        LYS  24  15.996   1.010  -1.135
  207    HA   LYS  24           HA       LYS  24  18.508   2.193  -1.599
  208    HB2  LYS  24           2HB      LYS  24  16.194   2.761   0.007
  209    HB3  LYS  24           1HB      LYS  24  17.645   2.962   0.986
  210    HG2  LYS  24           2HG      LYS  24  17.250   4.207  -1.754
  211    HG3  LYS  24           1HG      LYS  24  16.987   5.053  -0.235
  212    HD2  LYS  24           2HD      LYS  24  19.626   3.729  -0.929
  213    HD3  LYS  24           1HD      LYS  24  19.273   5.411  -1.319
  214    HE2  LYS  24           2HE      LYS  24  19.256   4.184   1.459
  215    HE3  LYS  24           1HE      LYS  24  20.476   5.275   0.812
  216    HZ1  LYS  24           3HZ      LYS  24  18.712   6.949   0.525
  217    HZ2  LYS  24           1HZ      LYS  24  18.947   6.509   2.143
  218    HZ3  LYS  24           2HZ      LYS  24  17.615   5.903   1.288
  219    H    LYS  25           H        LYS  25  17.325   0.405   1.212
  220    HA   LYS  25           HA       LYS  25  19.594  -1.188   1.582
  221    HB2  LYS  25           2HB      LYS  25  20.583  -0.070   3.601
  222    HB3  LYS  25           1HB      LYS  25  20.873   0.792   2.097
  223    HG2  LYS  25           2HG      LYS  25  19.594   2.572   2.708
  224    HG3  LYS  25           1HG      LYS  25  18.384   1.573   3.501
  225    HD2  LYS  25           2HD      LYS  25  21.084   2.387   4.616
  226    HD3  LYS  25           1HD      LYS  25  19.506   2.943   5.165
  227    HE2  LYS  25           2HE      LYS  25  20.715   0.182   5.464
  228    HE3  LYS  25           1HE      LYS  25  20.156   1.271   6.726
  229    HZ1  LYS  25           3HZ      LYS  25  18.177   0.436   4.744
  230    HZ2  LYS  25           1HZ      LYS  25  18.007   0.704   6.410
  231    HZ3  LYS  25           2HZ      LYS  25  18.701  -0.745   5.852
  232    H    ALA  26           H        ALA  26  18.935  -2.819   2.850
  233    HA   ALA  26           HA       ALA  26  16.478  -2.497   4.388
  234    HB1  ALA  26           1HB      ALA  26  16.593  -4.936   4.651
  235    HB2  ALA  26           2HB      ALA  26  18.187  -4.950   3.895
  236    HB3  ALA  26           3HB      ALA  26  16.768  -4.483   2.954
  Start of MODEL    4
    1    H1   LYS   1           1HT      LYS   1  19.981  17.043  -6.924
    2    H2   LYS   1           2HT      LYS   1  20.804  17.901  -5.713
    3    H3   LYS   1           3HT      LYS   1  19.296  18.445  -6.268
    4    HA   LYS   1           HA       LYS   1  19.646  16.983  -4.057
    5    HB2  LYS   1           2HB      LYS   1  17.264  17.022  -5.939
    6    HB3  LYS   1           1HB      LYS   1  17.204  16.485  -4.261
    7    HG2  LYS   1           2HG      LYS   1  18.180  19.244  -5.066
    8    HG3  LYS   1           1HG      LYS   1  16.498  18.907  -4.657
    9    HD2  LYS   1           2HD      LYS   1  17.340  17.949  -2.455
   10    HD3  LYS   1           1HD      LYS   1  18.924  18.609  -2.872
   11    HE2  LYS   1           2HE      LYS   1  17.920  20.300  -1.561
   12    HE3  LYS   1           1HE      LYS   1  17.698  20.850  -3.220
   13    HZ1  LYS   1           2HZ      LYS   1  15.732  19.765  -1.339
   14    HZ2  LYS   1           3HZ      LYS   1  15.503  19.482  -2.995
   15    HZ3  LYS   1           1HZ      LYS   1  15.596  21.069  -2.419
   16    H    LYS   2           H        LYS   2  19.876  14.879  -3.486
   17    HA   LYS   2           HA       LYS   2  20.185  12.911  -5.633
   18    HB2  LYS   2           2HB      LYS   2  20.700  12.633  -2.657
   19    HB3  LYS   2           1HB      LYS   2  21.195  11.506  -3.920
   20    HG2  LYS   2           2HG      LYS   2  22.566  13.350  -4.948
   21    HG3  LYS   2           1HG      LYS   2  22.155  14.361  -3.560
   22    HD2  LYS   2           2HD      LYS   2  24.140  13.469  -2.783
   23    HD3  LYS   2           1HD      LYS   2  23.033  12.225  -2.213
   24    HE2  LYS   2           2HE      LYS   2  24.999  11.256  -3.398
   25    HE3  LYS   2           1HE      LYS   2  23.477  10.866  -4.197
   26    HZ1  LYS   2           3HZ      LYS   2  24.993  13.262  -4.992
   27    HZ2  LYS   2           1HZ      LYS   2  23.874  12.357  -5.892
   28    HZ3  LYS   2           2HZ      LYS   2  25.426  11.737  -5.600
   29    H    ALA   3           H        ALA   3  18.272  13.478  -2.703
   30    HA   ALA   3           HA       ALA   3  16.828  11.022  -2.861
   31    HB1  ALA   3           1HB      ALA   3  15.726  11.733  -0.967
   32    HB2  ALA   3           2HB      ALA   3  15.666  13.412  -1.497
   33    HB3  ALA   3           3HB      ALA   3  17.170  12.743  -0.873
   34    H    LEU   4           H        LEU   4  16.427  11.309  -5.262
   35    HA   LEU   4           HA       LEU   4  13.954  12.877  -5.716
   36    HB2  LEU   4           2HB      LEU   4  16.244  12.144  -7.523
   37    HB3  LEU   4           1HB      LEU   4  14.659  12.534  -8.193
   38    HG   LEU   4           HG       LEU   4  15.981  14.366  -6.194
   39   HD11  LEU   4          1HD1      LEU   4  16.904  15.642  -8.082
   40   HD12  LEU   4          2HD1      LEU   4  16.320  14.414  -9.208
   41   HD13  LEU   4          3HD1      LEU   4  17.582  14.014  -8.040
   42   HD21  LEU   4          3HD2      LEU   4  13.608  14.715  -6.702
   43   HD22  LEU   4          1HD2      LEU   4  13.971  14.757  -8.429
   44   HD23  LEU   4          2HD2      LEU   4  14.575  16.033  -7.368
   45    H    LEU   5           H        LEU   5  15.344  10.348  -7.676
   46    HA   LEU   5           HA       LEU   5  13.008   9.023  -8.306
   47    HB2  LEU   5           2HB      LEU   5  14.676   6.965  -8.474
   48    HB3  LEU   5           1HB      LEU   5  14.747   8.296  -9.622
   49    HG   LEU   5           HG       LEU   5  16.317   8.741  -7.158
   50   HD11  LEU   5          1HD1      LEU   5  18.184   7.259  -8.102
   51   HD12  LEU   5          2HD1      LEU   5  16.922   6.452  -9.031
   52   HD13  LEU   5          3HD1      LEU   5  16.864   6.440  -7.269
   53   HD21  LEU   5          3HD2      LEU   5  16.806  10.321  -8.771
   54   HD22  LEU   5          1HD2      LEU   5  16.508   9.206 -10.103
   55   HD23  LEU   5          2HD2      LEU   5  18.019   9.115  -9.198
   56    H    ALA   6           H        ALA   6  15.289   8.269  -5.730
   57    HA   ALA   6           HA       ALA   6  14.169   6.011  -4.649
   58    HB1  ALA   6           1HB      ALA   6  15.275   8.315  -3.036
   59    HB2  ALA   6           2HB      ALA   6  16.263   7.094  -3.842
   60    HB3  ALA   6           3HB      ALA   6  15.180   6.627  -2.534
   61    H    LEU   7           H        LEU   7  13.256   9.346  -4.061
   62    HA   LEU   7           HA       LEU   7  11.212   8.825  -2.162
   63    HB2  LEU   7           2HB      LEU   7  12.030  11.121  -3.862
   64    HB3  LEU   7           1HB      LEU   7  10.374  11.130  -3.262
   65    HG   LEU   7           HG       LEU   7  11.163  10.895  -0.966
   66   HD11  LEU   7          1HD1      LEU   7  13.883  10.764  -2.291
   67   HD12  LEU   7          2HD1      LEU   7  13.145   9.573  -1.222
   68   HD13  LEU   7          3HD1      LEU   7  13.671  11.125  -0.579
   69   HD21  LEU   7          3HD2      LEU   7  12.424  13.073  -2.640
   70   HD22  LEU   7          1HD2      LEU   7  12.519  13.066  -0.879
   71   HD23  LEU   7          2HD2      LEU   7  10.948  13.148  -1.675
   72    H    ALA   8           H        ALA   8  10.980   9.812  -5.526
   73    HA   ALA   8           HA       ALA   8   8.316   9.463  -6.043
   74    HB1  ALA   8           1HB      ALA   8   8.952   9.760  -8.194
   75    HB2  ALA   8           2HB      ALA   8   9.933   8.294  -8.169
   76    HB3  ALA   8           3HB      ALA   8  10.607   9.813  -7.587
   77    H    LEU   9           H        LEU   9  10.842   7.063  -6.355
   78    HA   LEU   9           HA       LEU   9   9.251   4.827  -6.957
   79    HB2  LEU   9           2HB      LEU   9  11.676   4.781  -7.229
   80    HB3  LEU   9           1HB      LEU   9  11.897   4.973  -5.490
   81    HG   LEU   9           HG       LEU   9  10.460   2.809  -5.294
   82   HD11  LEU   9          1HD1      LEU   9  11.532   2.325  -8.067
   83   HD12  LEU   9          2HD1      LEU   9   9.920   2.993  -7.821
   84   HD13  LEU   9          3HD1      LEU   9  10.321   1.401  -7.179
   85   HD21  LEU   9          3HD2      LEU   9  13.016   3.138  -4.989
   86   HD22  LEU   9          1HD2      LEU   9  13.155   2.402  -6.584
   87   HD23  LEU   9          2HD2      LEU   9  12.420   1.500  -5.255
   88    H    HIS  10           H        HIS  10  10.771   5.544  -3.850
   89    HA   HIS  10           HA       HIS  10   9.456   3.701  -2.272
   90    HB2  HIS  10           2HB      HIS  10  11.324   5.087  -1.476
   91    HB3  HIS  10           1HB      HIS  10  10.281   6.507  -1.501
   92    HD1  HIS  10           1HD      HIS  10  10.784   3.239   0.333
   93    HD2  HIS  10           2HD      HIS  10   8.486   6.705   0.660
   94    HE1  HIS  10           1HE      HIS  10   9.697   3.166   2.619
   95    HE2  HIS  10           2HE      HIS  10   8.289   5.269   2.831
   96    H    HIS  11           H        HIS  11   8.312   6.792  -3.435
   97    HA   HIS  11           HA       HIS  11   5.851   6.535  -1.862
   98    HB2  HIS  11           2HB      HIS  11   6.918   8.763  -3.596
   99    HB3  HIS  11           1HB      HIS  11   5.328   8.794  -2.828
  100    HD1  HIS  11           1HD      HIS  11   5.602   8.028  -0.066
  101    HD2  HIS  11           2HD      HIS  11   8.737  10.026  -1.967
  102    HE1  HIS  11           1HE      HIS  11   7.044   9.020   1.775
  103    HE2  HIS  11           2HE      HIS  11   8.961  10.254   0.629
  104    H    LEU  12           H        LEU  12   6.683   4.973  -4.480
  105    HA   LEU  12           HA       LEU  12   4.712   5.701  -6.419
  106    HB2  LEU  12           2HB      LEU  12   6.610   3.486  -6.043
  107    HB3  LEU  12           1HB      LEU  12   5.104   3.004  -6.817
  108    HG   LEU  12           HG       LEU  12   6.838   5.326  -7.712
  109   HD11  LEU  12          1HD1      LEU  12   6.435   2.740  -9.208
  110   HD12  LEU  12          2HD1      LEU  12   7.716   2.902  -8.005
  111   HD13  LEU  12          3HD1      LEU  12   7.695   3.958  -9.417
  112   HD21  LEU  12          3HD2      LEU  12   5.149   4.482  -9.782
  113   HD22  LEU  12          1HD2      LEU  12   4.961   5.940  -8.816
  114   HD23  LEU  12          2HD2      LEU  12   4.124   4.460  -8.345
  115    H    ALA  13           H        ALA  13   4.893   2.949  -4.217
  116    HA   ALA  13           HA       ALA  13   2.139   3.216  -3.414
  117    HB1  ALA  13           1HB      ALA  13   1.761   0.714  -4.164
  118    HB2  ALA  13           2HB      ALA  13   2.965   1.116  -5.387
  119    HB3  ALA  13           3HB      ALA  13   1.460   2.033  -5.295
  120    H    HIS  14           H        HIS  14   1.589   1.674  -1.725
  121    HA   HIS  14           HA       HIS  14   3.620   1.272   0.143
  122    HB2  HIS  14           2HB      HIS  14   1.963   0.473   1.462
  123    HB3  HIS  14           1HB      HIS  14   0.914   1.012   0.157
  124    HD1  HIS  14           1HD      HIS  14   2.647  -2.119   1.421
  125    HD2  HIS  14           2HD      HIS  14  -0.404  -1.021  -1.200
  126    HE1  HIS  14           1HE      HIS  14   1.526  -4.270   0.685
  127    HE2  HIS  14           2HE      HIS  14  -0.336  -3.616  -0.919
  128    H    LEU  15           H        LEU  15   2.504  -0.698  -2.464
  129    HA   LEU  15           HA       LEU  15   3.777  -3.150  -1.775
  130    HB2  LEU  15           2HB      LEU  15   2.682  -1.920  -4.288
  131    HB3  LEU  15           1HB      LEU  15   3.653  -3.388  -4.395
  132    HG   LEU  15           HG       LEU  15   1.244  -3.115  -2.573
  133   HD11  LEU  15          1HD1      LEU  15  -0.040  -4.297  -4.243
  134   HD12  LEU  15          2HD1      LEU  15   1.387  -4.517  -5.254
  135   HD13  LEU  15          3HD1      LEU  15   0.705  -2.907  -5.040
  136   HD21  LEU  15          3HD2      LEU  15   1.530  -5.751  -3.066
  137   HD22  LEU  15          1HD2      LEU  15   2.354  -4.948  -1.733
  138   HD23  LEU  15          2HD2      LEU  15   3.211  -5.255  -3.244
  139    H    ALA  16           H        ALA  16   4.915  -0.148  -2.629
  140    HA   ALA  16           HA       ALA  16   7.444  -1.259  -3.644
  141    HB1  ALA  16           1HB      ALA  16   6.791   1.629  -3.982
  142    HB2  ALA  16           2HB      ALA  16   5.936   0.461  -4.994
  143    HB3  ALA  16           3HB      ALA  16   7.697   0.548  -5.043
  144    H    LEU  17           H        LEU  17   6.002   1.084  -1.488
  145    HA   LEU  17           HA       LEU  17   8.045   2.483  -0.450
  146    HB2  LEU  17           2HB      LEU  17   6.688   2.929   1.325
  147    HB3  LEU  17           1HB      LEU  17   5.507   2.143   0.290
  148    HG   LEU  17           HG       LEU  17   6.243  -0.053   1.511
  149   HD11  LEU  17          1HD1      LEU  17   7.507   0.111   3.409
  150   HD12  LEU  17          2HD1      LEU  17   6.757   1.631   3.886
  151   HD13  LEU  17          3HD1      LEU  17   8.060   1.628   2.700
  152   HD21  LEU  17          3HD2      LEU  17   4.114   0.338   2.168
  153   HD22  LEU  17          1HD2      LEU  17   4.366   2.085   2.218
  154   HD23  LEU  17          2HD2      LEU  17   4.807   1.088   3.603
  155    H    HIS  18           H        HIS  18   7.240  -0.792   0.425
  156    HA   HIS  18           HA       HIS  18   9.430  -1.133   2.252
  157    HB2  HIS  18           2HB      HIS  18   8.703  -3.400   2.425
  158    HB3  HIS  18           1HB      HIS  18   7.260  -2.412   2.244
  159    HD1  HIS  18           1HD      HIS  18   9.046  -5.209   0.701
  160    HD2  HIS  18           2HD      HIS  18   6.230  -2.380  -0.510
  161    HE1  HIS  18           1HE      HIS  18   8.028  -6.082  -1.448
  162    HE2  HIS  18           2HE      HIS  18   6.308  -4.371  -2.201
  163    H    LEU  19           H        LEU  19   8.717  -2.245  -0.996
  164    HA   LEU  19           HA       LEU  19  11.124  -3.604  -1.489
  165    HB2  LEU  19           2HB      LEU  19   8.936  -3.454  -2.924
  166    HB3  LEU  19           1HB      LEU  19   9.709  -2.051  -3.651
  167    HG   LEU  19           HG       LEU  19  10.041  -4.392  -4.763
  168   HD11  LEU  19          1HD1      LEU  19  12.708  -3.581  -4.762
  169   HD12  LEU  19          2HD1      LEU  19  11.810  -2.104  -4.426
  170   HD13  LEU  19          3HD1      LEU  19  11.454  -3.040  -5.874
  171   HD21  LEU  19          3HD2      LEU  19  11.675  -5.824  -3.868
  172   HD22  LEU  19          1HD2      LEU  19  10.763  -5.333  -2.442
  173   HD23  LEU  19          2HD2      LEU  19  12.317  -4.579  -2.797
  174    H    ALA  20           H        ALA  20  10.259  -0.276  -1.437
  175    HA   ALA  20           HA       ALA  20  12.591   0.739  -2.772
  176    HB1  ALA  20           1HB      ALA  20  10.335   1.895  -1.221
  177    HB2  ALA  20           2HB      ALA  20  10.974   2.361  -2.794
  178    HB3  ALA  20           3HB      ALA  20  11.812   2.850  -1.323
  179    H    LEU  21           H        LEU  21  11.616   0.431   0.611
  180    HA   LEU  21           HA       LEU  21  13.875   1.480   1.844
  181    HB2  LEU  21           2HB      LEU  21  12.170  -0.885   2.657
  182    HB3  LEU  21           1HB      LEU  21  13.383  -0.145   3.704
  183    HG   LEU  21           HG       LEU  21  11.199   1.506   2.437
  184   HD11  LEU  21          1HD1      LEU  21  10.782  -0.593   4.295
  185   HD12  LEU  21          2HD1      LEU  21   9.636   0.648   3.802
  186   HD13  LEU  21          3HD1      LEU  21  10.668   0.916   5.203
  187   HD21  LEU  21          3HD2      LEU  21  11.756   2.586   4.869
  188   HD22  LEU  21          1HD2      LEU  21  12.602   3.037   3.391
  189   HD23  LEU  21          2HD2      LEU  21  13.313   1.858   4.493
  190    H    ALA  22           H        ALA  22  13.215  -1.837   0.901
  191    HA   ALA  22           HA       ALA  22  15.689  -2.982   1.520
  192    HB1  ALA  22           1HB      ALA  22  13.702  -3.689  -0.641
  193    HB2  ALA  22           2HB      ALA  22  13.779  -4.367   0.982
  194    HB3  ALA  22           3HB      ALA  22  15.062  -4.709  -0.176
  195    H    LEU  23           H        LEU  23  14.670  -1.054  -1.175
  196    HA   LEU  23           HA       LEU  23  16.998  -1.641  -2.801
  197    HB2  LEU  23           2HB      LEU  23  14.554  -0.873  -3.507
  198    HB3  LEU  23           1HB      LEU  23  15.249   0.733  -3.297
  199    HG   LEU  23           HG       LEU  23  16.779  -1.311  -4.874
  200   HD11  LEU  23          1HD1      LEU  23  15.602  -0.585  -6.928
  201   HD12  LEU  23          2HD1      LEU  23  14.463   0.334  -5.942
  202   HD13  LEU  23          3HD1      LEU  23  14.518  -1.426  -5.820
  203   HD21  LEU  23          3HD2      LEU  23  16.895   1.140  -6.139
  204   HD22  LEU  23          1HD2      LEU  23  18.075   0.551  -4.969
  205   HD23  LEU  23          2HD2      LEU  23  16.758   1.601  -4.443
  206    H    LYS  24           H        LYS  24  15.738   1.070  -0.961
  207    HA   LYS  24           HA       LYS  24  17.920   2.822  -1.366
  208    HB2  LYS  24           2HB      LYS  24  15.444   3.072  -0.227
  209    HB3  LYS  24           1HB      LYS  24  16.477   3.070   1.201
  210    HG2  LYS  24           2HG      LYS  24  17.318   4.779  -1.110
  211    HG3  LYS  24           1HG      LYS  24  15.941   5.322  -0.155
  212    HD2  LYS  24           2HD      LYS  24  18.494   4.447   1.193
  213    HD3  LYS  24           1HD      LYS  24  18.317   6.090   0.577
  214    HE2  LYS  24           2HE      LYS  24  16.578   4.716   2.645
  215    HE3  LYS  24           1HE      LYS  24  17.645   6.098   2.900
  216    HZ1  LYS  24           3HZ      LYS  24  16.197   7.162   1.049
  217    HZ2  LYS  24           1HZ      LYS  24  15.606   7.103   2.638
  218    HZ3  LYS  24           2HZ      LYS  24  15.068   5.975   1.491
  219    H    LYS  25           H        LYS  25  17.114   0.614   1.252
  220    HA   LYS  25           HA       LYS  25  19.491   1.141   2.759
  221    HB2  LYS  25           2HB      LYS  25  17.322   0.269   3.693
  222    HB3  LYS  25           1HB      LYS  25  17.675  -1.270   2.914
  223    HG2  LYS  25           2HG      LYS  25  20.037  -0.654   4.264
  224    HG3  LYS  25           1HG      LYS  25  18.771  -0.147   5.379
  225    HD2  LYS  25           2HD      LYS  25  18.554  -2.312   5.968
  226    HD3  LYS  25           1HD      LYS  25  17.869  -2.602   4.372
  227    HE2  LYS  25           2HE      LYS  25  19.740  -4.130   4.769
  228    HE3  LYS  25           1HE      LYS  25  20.149  -3.000   3.482
  229    HZ1  LYS  25           3HZ      LYS  25  20.890  -1.815   5.883
  230    HZ2  LYS  25           1HZ      LYS  25  21.910  -2.393   4.654
  231    HZ3  LYS  25           2HZ      LYS  25  21.453  -3.413   5.940
  232    H    ALA  26           H        ALA  26  21.370  -0.036   2.886
  233    HA   ALA  26           HA       ALA  26  21.790  -2.062   0.766
  234    HB1  ALA  26           1HB      ALA  26  23.754  -0.162   2.075
  235    HB2  ALA  26           2HB      ALA  26  23.204  -0.120   0.401
  236    HB3  ALA  26           3HB      ALA  26  24.209  -1.454   0.964
  Start of MODEL    5
    1    H1   LYS   1           1HT      LYS   1  -1.766  -0.931 -29.177
    2    H2   LYS   1           2HT      LYS   1  -0.760  -1.159 -27.829
    3    H3   LYS   1           3HT      LYS   1  -1.671   0.263 -27.986
    4    HA   LYS   1           HA       LYS   1  -3.663  -1.407 -28.067
    5    HB2  LYS   1           2HB      LYS   1  -1.350  -2.929 -26.958
    6    HB3  LYS   1           1HB      LYS   1  -2.873  -3.065 -26.084
    7    HG2  LYS   1           2HG      LYS   1  -3.385  -4.672 -27.601
    8    HG3  LYS   1           1HG      LYS   1  -3.709  -3.325 -28.687
    9    HD2  LYS   1           2HD      LYS   1  -1.639  -3.513 -29.762
   10    HD3  LYS   1           1HD      LYS   1  -0.910  -4.409 -28.431
   11    HE2  LYS   1           2HE      LYS   1  -3.180  -5.489 -30.129
   12    HE3  LYS   1           1HE      LYS   1  -1.478  -5.821 -30.455
   13    HZ1  LYS   1           2HZ      LYS   1  -2.194  -6.267 -27.717
   14    HZ2  LYS   1           3HZ      LYS   1  -1.390  -7.292 -28.807
   15    HZ3  LYS   1           1HZ      LYS   1  -3.087  -7.242 -28.787
   16    H    LYS   2           H        LYS   2  -4.602  -1.794 -25.704
   17    HA   LYS   2           HA       LYS   2  -4.899   0.679 -24.496
   18    HB2  LYS   2           2HB      LYS   2  -5.119  -1.862 -22.900
   19    HB3  LYS   2           1HB      LYS   2  -6.114  -0.409 -22.806
   20    HG2  LYS   2           2HG      LYS   2  -6.362  -1.306 -25.474
   21    HG3  LYS   2           1HG      LYS   2  -6.472  -2.755 -24.474
   22    HD2  LYS   2           2HD      LYS   2  -8.091  -1.249 -23.020
   23    HD3  LYS   2           1HD      LYS   2  -8.256  -0.341 -24.521
   24    HE2  LYS   2           2HE      LYS   2  -9.081  -3.156 -23.907
   25    HE3  LYS   2           1HE      LYS   2  -9.963  -1.900 -24.770
   26    HZ1  LYS   2           3HZ      LYS   2  -7.617  -3.420 -25.766
   27    HZ2  LYS   2           1HZ      LYS   2  -8.353  -2.143 -26.604
   28    HZ3  LYS   2           2HZ      LYS   2  -9.218  -3.573 -26.300
   29    H    ALA   3           H        ALA   3  -3.944   1.765 -22.853
   30    HA   ALA   3           HA       ALA   3  -1.242   1.020 -22.133
   31    HB1  ALA   3           1HB      ALA   3  -1.465   3.329 -22.444
   32    HB2  ALA   3           2HB      ALA   3  -1.510   3.171 -20.687
   33    HB3  ALA   3           3HB      ALA   3  -3.007   3.396 -21.590
   34    H    LEU   4           H        LEU   4  -4.121  -0.025 -21.098
   35    HA   LEU   4           HA       LEU   4  -4.394   0.161 -18.403
   36    HB2  LEU   4           2HB      LEU   4  -5.964  -1.189 -19.580
   37    HB3  LEU   4           1HB      LEU   4  -4.695  -2.226 -20.232
   38    HG   LEU   4           HG       LEU   4  -4.206  -3.049 -17.943
   39   HD11  LEU   4          1HD1      LEU   4  -6.041  -2.510 -16.214
   40   HD12  LEU   4          2HD1      LEU   4  -6.438  -1.141 -17.254
   41   HD13  LEU   4          3HD1      LEU   4  -4.837  -1.264 -16.531
   42   HD21  LEU   4          3HD2      LEU   4  -7.140  -3.276 -18.699
   43   HD22  LEU   4          1HD2      LEU   4  -6.229  -4.401 -17.685
   44   HD23  LEU   4          2HD2      LEU   4  -5.830  -4.235 -19.396
   45    H    LEU   5           H        LEU   5  -2.121  -1.808 -20.167
   46    HA   LEU   5           HA       LEU   5  -0.964  -3.349 -18.213
   47    HB2  LEU   5           2HB      LEU   5   0.236  -1.936 -20.588
   48    HB3  LEU   5           1HB      LEU   5   1.214  -2.957 -19.540
   49    HG   LEU   5           HG       LEU   5  -0.169  -4.883 -20.018
   50   HD11  LEU   5          1HD1      LEU   5  -2.367  -3.885 -20.180
   51   HD12  LEU   5          2HD1      LEU   5  -2.028  -4.670 -21.718
   52   HD13  LEU   5          3HD1      LEU   5  -1.877  -2.921 -21.571
   53   HD21  LEU   5          3HD2      LEU   5   0.209  -3.547 -22.686
   54   HD22  LEU   5          1HD2      LEU   5   0.490  -5.228 -22.243
   55   HD23  LEU   5          2HD2      LEU   5   1.601  -3.975 -21.688
   56    H    ALA   6           H        ALA   6   0.082  -0.165 -19.251
   57    HA   ALA   6           HA       ALA   6   2.011   0.310 -17.286
   58    HB1  ALA   6           1HB      ALA   6   1.785   2.677 -17.831
   59    HB2  ALA   6           2HB      ALA   6   0.232   2.367 -18.608
   60    HB3  ALA   6           3HB      ALA   6   1.712   1.716 -19.310
   61    H    LEU   7           H        LEU   7  -1.450   0.911 -17.262
   62    HA   LEU   7           HA       LEU   7  -1.541   2.274 -14.767
   63    HB2  LEU   7           2HB      LEU   7  -3.410   2.537 -16.220
   64    HB3  LEU   7           1HB      LEU   7  -3.623   0.793 -16.375
   65    HG   LEU   7           HG       LEU   7  -4.193   0.655 -13.967
   66   HD11  LEU   7          1HD1      LEU   7  -2.886   2.627 -13.229
   67   HD12  LEU   7          2HD1      LEU   7  -4.561   2.730 -12.701
   68   HD13  LEU   7          3HD1      LEU   7  -4.019   3.685 -14.079
   69   HD21  LEU   7          3HD2      LEU   7  -6.017   0.925 -15.564
   70   HD22  LEU   7          1HD2      LEU   7  -5.793   2.675 -15.570
   71   HD23  LEU   7          2HD2      LEU   7  -6.376   1.863 -14.117
   72    H    ALA   8           H        ALA   8  -2.029  -1.066 -15.722
   73    HA   ALA   8           HA       ALA   8  -2.620  -2.087 -13.131
   74    HB1  ALA   8           1HB      ALA   8  -2.427  -4.250 -14.138
   75    HB2  ALA   8           2HB      ALA   8  -1.429  -3.615 -15.448
   76    HB3  ALA   8           3HB      ALA   8  -3.141  -3.193 -15.356
   77    H    LEU   9           H        LEU   9   0.245  -2.294 -15.161
   78    HA   LEU   9           HA       LEU   9   1.969  -3.614 -13.439
   79    HB2  LEU   9           2HB      LEU   9   2.290  -1.817 -15.759
   80    HB3  LEU   9           1HB      LEU   9   3.693  -1.943 -14.703
   81    HG   LEU   9           HG       LEU   9   2.234  -4.396 -15.693
   82   HD11  LEU   9          1HD1      LEU   9   2.906  -3.454 -17.736
   83   HD12  LEU   9          2HD1      LEU   9   4.296  -4.453 -17.301
   84   HD13  LEU   9          3HD1      LEU   9   4.340  -2.710 -17.028
   85   HD21  LEU   9          3HD2      LEU   9   4.548  -5.358 -15.260
   86   HD22  LEU   9          1HD2      LEU   9   3.698  -4.795 -13.816
   87   HD23  LEU   9          2HD2      LEU   9   4.972  -3.807 -14.531
   88    H    HIS  10           H        HIS  10   2.179  -0.155 -14.033
   89    HA   HIS  10           HA       HIS  10   3.535   0.265 -11.502
   90    HB2  HIS  10           2HB      HIS  10   4.164   1.394 -13.684
   91    HB3  HIS  10           1HB      HIS  10   2.690   2.348 -13.524
   92    HD1  HIS  10           1HD      HIS  10   5.669   1.457 -11.297
   93    HD2  HIS  10           2HD      HIS  10   3.153   4.679 -12.137
   94    HE1  HIS  10           1HE      HIS  10   6.436   3.374  -9.824
   95    HE2  HIS  10           2HE      HIS  10   4.920   5.351 -10.335
   96    H    HIS  11           H        HIS  11   2.850   2.501 -10.455
   97    HA   HIS  11           HA       HIS  11   1.335   3.754  -9.294
   98    HB2  HIS  11           2HB      HIS  11  -0.901   2.329 -10.722
   99    HB3  HIS  11           1HB      HIS  11  -0.923   3.925  -9.977
  100    HD1  HIS  11           1HD      HIS  11   0.585   5.797 -11.186
  101    HD2  HIS  11           2HD      HIS  11  -0.074   2.307 -13.380
  102    HE1  HIS  11           1HE      HIS  11   1.208   6.328 -13.590
  103    HE2  HIS  11           2HE      HIS  11   0.778   4.216 -14.950
  104    H    LEU  12           H        LEU  12   1.487   0.391  -9.245
  105    HA   LEU  12           HA       LEU  12  -0.522  -0.358  -7.490
  106    HB2  LEU  12           2HB      LEU  12   1.201  -2.057  -6.608
  107    HB3  LEU  12           1HB      LEU  12   0.765  -2.138  -8.310
  108    HG   LEU  12           HG       LEU  12   2.838  -0.469  -8.555
  109   HD11  LEU  12          1HD1      LEU  12   4.310  -2.019  -6.634
  110   HD12  LEU  12          2HD1      LEU  12   2.969  -1.226  -5.808
  111   HD13  LEU  12          3HD1      LEU  12   4.129  -0.266  -6.723
  112   HD21  LEU  12          3HD2      LEU  12   2.476  -2.826  -9.489
  113   HD22  LEU  12          1HD2      LEU  12   3.337  -3.414  -8.069
  114   HD23  LEU  12          2HD2      LEU  12   4.152  -2.348  -9.217
  115    H    ALA  13           H        ALA  13   2.678   0.865  -6.726
  116    HA   ALA  13           HA       ALA  13   3.583   1.765  -4.803
  117    HB1  ALA  13           1HB      ALA  13   2.493   3.635  -4.127
  118    HB2  ALA  13           2HB      ALA  13   0.991   2.770  -3.814
  119    HB3  ALA  13           3HB      ALA  13   1.401   3.255  -5.457
  120    H    HIS  14           H        HIS  14   3.104   1.996  -2.329
  121    HA   HIS  14           HA       HIS  14   2.709   1.023  -0.284
  122    HB2  HIS  14           2HB      HIS  14   0.886  -0.931  -1.684
  123    HB3  HIS  14           1HB      HIS  14   0.837  -0.396  -0.015
  124    HD1  HIS  14           1HD      HIS  14  -0.379   0.427  -3.392
  125    HD2  HIS  14           2HD      HIS  14  -0.036   2.405   0.266
  126    HE1  HIS  14           1HE      HIS  14  -1.853   2.487  -3.545
  127    HE2  HIS  14           2HE      HIS  14  -1.651   3.713  -1.317
  128    H    LEU  15           H        LEU  15   2.762  -1.149  -2.943
  129    HA   LEU  15           HA       LEU  15   4.159  -3.292  -1.597
  130    HB2  LEU  15           2HB      LEU  15   3.695  -2.730  -4.537
  131    HB3  LEU  15           1HB      LEU  15   4.368  -4.224  -3.885
  132    HG   LEU  15           HG       LEU  15   1.595  -3.107  -3.341
  133   HD11  LEU  15          1HD1      LEU  15   0.784  -4.906  -4.630
  134   HD12  LEU  15          2HD1      LEU  15   2.311  -5.783  -4.530
  135   HD13  LEU  15          3HD1      LEU  15   2.185  -4.346  -5.546
  136   HD21  LEU  15          3HD2      LEU  15   1.528  -5.571  -2.263
  137   HD22  LEU  15          1HD2      LEU  15   1.992  -4.156  -1.321
  138   HD23  LEU  15          2HD2      LEU  15   3.233  -5.213  -1.992
  139    H    ALA  16           H        ALA  16   4.980  -0.324  -2.907
  140    HA   ALA  16           HA       ALA  16   7.733  -1.096  -3.524
  141    HB1  ALA  16           1HB      ALA  16   6.376   1.583  -3.863
  142    HB2  ALA  16           2HB      ALA  16   6.518   0.360  -5.124
  143    HB3  ALA  16           3HB      ALA  16   7.964   1.129  -4.474
  144    H    LEU  17           H        LEU  17   5.869   0.886  -1.328
  145    HA   LEU  17           HA       LEU  17   7.589   2.486  -0.049
  146    HB2  LEU  17           2HB      LEU  17   5.701   2.686   1.138
  147    HB3  LEU  17           1HB      LEU  17   5.164   1.077   0.681
  148    HG   LEU  17           HG       LEU  17   7.338   1.201   2.716
  149   HD11  LEU  17          1HD1      LEU  17   5.990   2.998   3.559
  150   HD12  LEU  17          2HD1      LEU  17   5.585   1.567   4.504
  151   HD13  LEU  17          3HD1      LEU  17   4.501   2.116   3.226
  152   HD21  LEU  17          3HD2      LEU  17   4.870  -0.320   3.209
  153   HD22  LEU  17          1HD2      LEU  17   6.543  -0.868   3.214
  154   HD23  LEU  17          2HD2      LEU  17   5.661  -0.743   1.690
  155    H    HIS  18           H        HIS  18   7.217  -0.912   0.709
  156    HA   HIS  18           HA       HIS  18   9.458  -0.971   2.510
  157    HB2  HIS  18           2HB      HIS  18   9.016  -3.286   2.723
  158    HB3  HIS  18           1HB      HIS  18   7.456  -2.519   2.477
  159    HD1  HIS  18           1HD      HIS  18   9.802  -4.918   0.940
  160    HD2  HIS  18           2HD      HIS  18   6.320  -2.877  -0.105
  161    HE1  HIS  18           1HE      HIS  18   8.935  -6.021  -1.173
  162    HE2  HIS  18           2HE      HIS  18   6.806  -4.786  -1.830
  163    H    LEU  19           H        LEU  19   8.872  -2.051  -0.765
  164    HA   LEU  19           HA       LEU  19  11.390  -3.126  -1.339
  165    HB2  LEU  19           2HB      LEU  19   9.653  -3.472  -2.936
  166    HB3  LEU  19           1HB      LEU  19   9.347  -1.747  -3.072
  167    HG   LEU  19           HG       LEU  19  12.107  -2.638  -3.722
  168   HD11  LEU  19          1HD1      LEU  19  11.101  -3.051  -6.140
  169   HD12  LEU  19          2HD1      LEU  19   9.662  -3.505  -5.227
  170   HD13  LEU  19          3HD1      LEU  19  11.181  -4.362  -4.964
  171   HD21  LEU  19          3HD2      LEU  19  12.119  -0.576  -4.636
  172   HD22  LEU  19          1HD2      LEU  19  10.458  -0.349  -4.087
  173   HD23  LEU  19          2HD2      LEU  19  10.773  -0.999  -5.695
  174    H    ALA  20           H        ALA  20  10.222   0.105  -1.057
  175    HA   ALA  20           HA       ALA  20  12.342   1.479  -2.340
  176    HB1  ALA  20           1HB      ALA  20  11.500   3.438  -1.350
  177    HB2  ALA  20           2HB      ALA  20  10.933   2.583   0.080
  178    HB3  ALA  20           3HB      ALA  20  10.070   2.410  -1.448
  179    H    LEU  21           H        LEU  21  11.743   0.611   1.017
  180    HA   LEU  21           HA       LEU  21  14.253   1.491   2.025
  181    HB2  LEU  21           2HB      LEU  21  12.095  -0.341   3.012
  182    HB3  LEU  21           1HB      LEU  21  13.664  -0.372   3.815
  183    HG   LEU  21           HG       LEU  21  13.523   2.070   4.191
  184   HD11  LEU  21          1HD1      LEU  21  11.314   3.172   3.735
  185   HD12  LEU  21          2HD1      LEU  21  10.820   1.727   2.857
  186   HD13  LEU  21          3HD1      LEU  21  12.167   2.696   2.266
  187   HD21  LEU  21          3HD2      LEU  21  12.489   0.307   5.765
  188   HD22  LEU  21          1HD2      LEU  21  10.931   0.801   5.101
  189   HD23  LEU  21          2HD2      LEU  21  11.935   1.971   5.961
  190    H    ALA  22           H        ALA  22  13.036  -1.490   0.695
  191    HA   ALA  22           HA       ALA  22  15.285  -3.133   1.185
  192    HB1  ALA  22           1HB      ALA  22  14.158  -4.726  -0.001
  193    HB2  ALA  22           2HB      ALA  22  13.745  -3.609  -1.304
  194    HB3  ALA  22           3HB      ALA  22  12.816  -3.604   0.197
  195    H    LEU  23           H        LEU  23  14.343  -1.276  -1.672
  196    HA   LEU  23           HA       LEU  23  16.594  -1.891  -3.256
  197    HB2  LEU  23           2HB      LEU  23  14.324  -0.114  -3.398
  198    HB3  LEU  23           1HB      LEU  23  15.780   0.720  -3.941
  199    HG   LEU  23           HG       LEU  23  16.254  -1.263  -5.425
  200   HD11  LEU  23          1HD1      LEU  23  14.960  -3.117  -5.358
  201   HD12  LEU  23          2HD1      LEU  23  13.482  -2.165  -5.463
  202   HD13  LEU  23          3HD1      LEU  23  14.235  -2.452  -3.897
  203   HD21  LEU  23          3HD2      LEU  23  14.630  -0.612  -7.116
  204   HD22  LEU  23          1HD2      LEU  23  15.161   0.819  -6.239
  205   HD23  LEU  23          2HD2      LEU  23  13.590   0.100  -5.888
  206    H    LYS  24           H        LYS  24  15.881   1.073  -1.491
  207    HA   LYS  24           HA       LYS  24  18.472   2.192  -1.743
  208    HB2  LYS  24           2HB      LYS  24  16.203   3.298  -1.103
  209    HB3  LYS  24           1HB      LYS  24  16.623   2.815   0.543
  210    HG2  LYS  24           2HG      LYS  24  18.984   3.934  -0.417
  211    HG3  LYS  24           1HG      LYS  24  17.734   4.971  -1.105
  212    HD2  LYS  24           2HD      LYS  24  18.138   5.956   0.983
  213    HD3  LYS  24           1HD      LYS  24  16.718   4.957   1.288
  214    HE2  LYS  24           2HE      LYS  24  19.168   3.427   1.646
  215    HE3  LYS  24           1HE      LYS  24  19.166   4.861   2.666
  216    HZ1  LYS  24           3HZ      LYS  24  17.855   2.498   3.144
  217    HZ2  LYS  24           1HZ      LYS  24  16.627   3.582   2.688
  218    HZ3  LYS  24           2HZ      LYS  24  17.653   3.963   3.983
  219    H    LYS  25           H        LYS  25  17.081  -0.130   0.360
  220    HA   LYS  25           HA       LYS  25  18.102  -1.601   1.818
  221    HB2  LYS  25           2HB      LYS  25  20.273  -1.028   0.544
  222    HB3  LYS  25           1HB      LYS  25  20.576   0.127   1.839
  223    HG2  LYS  25           2HG      LYS  25  19.807  -2.633   2.662
  224    HG3  LYS  25           1HG      LYS  25  21.415  -2.429   1.971
  225    HD2  LYS  25           2HD      LYS  25  22.032  -0.828   3.633
  226    HD3  LYS  25           1HD      LYS  25  20.370  -0.670   4.197
  227    HE2  LYS  25           2HE      LYS  25  21.854  -3.300   4.316
  228    HE3  LYS  25           1HE      LYS  25  21.919  -2.133   5.634
  229    HZ1  LYS  25           3HZ      LYS  25  19.386  -3.190   4.511
  230    HZ2  LYS  25           1HZ      LYS  25  19.578  -2.270   5.930
  231    HZ3  LYS  25           2HZ      LYS  25  20.170  -3.866   5.850
  232    H    ALA  26           H        ALA  26  17.719  -1.628   3.947
  233    HA   ALA  26           HA       ALA  26  18.170   0.756   5.572
  234    HB1  ALA  26           1HB      ALA  26  15.842   0.938   4.582
  235    HB2  ALA  26           2HB      ALA  26  15.902   0.927   6.342
  236    HB3  ALA  26           3HB      ALA  26  15.432  -0.530   5.470
  Start of MODEL    6
    1    H1   LYS   1           1HT      LYS   1  10.106   0.844  15.946
    2    H2   LYS   1           2HT      LYS   1   9.364   1.014  14.432
    3    H3   LYS   1           3HT      LYS   1   9.338  -0.484  15.227
    4    HA   LYS   1           HA       LYS   1   7.993   0.482  17.010
    5    HB2  LYS   1           2HB      LYS   1   8.061   2.891  15.165
    6    HB3  LYS   1           1HB      LYS   1   6.934   2.704  16.507
    7    HG2  LYS   1           2HG      LYS   1   9.736   2.220  17.260
    8    HG3  LYS   1           1HG      LYS   1   9.436   3.863  16.693
    9    HD2  LYS   1           2HD      LYS   1   7.344   3.723  18.286
   10    HD3  LYS   1           1HD      LYS   1   8.258   2.425  19.053
   11    HE2  LYS   1           2HE      LYS   1   9.174   5.289  18.643
   12    HE3  LYS   1           1HE      LYS   1   8.790   4.515  20.177
   13    HZ1  LYS   1           2HZ      LYS   1  10.941   4.033  20.262
   14    HZ2  LYS   1           3HZ      LYS   1  11.196   4.394  18.620
   15    HZ3  LYS   1           1HZ      LYS   1  10.637   2.859  19.077
   16    H    LYS   2           H        LYS   2   7.580  -1.492  15.367
   17    HA   LYS   2           HA       LYS   2   5.999  -2.659  14.183
   18    HB2  LYS   2           2HB      LYS   2   4.215  -2.103  15.548
   19    HB3  LYS   2           1HB      LYS   2   4.410  -0.369  15.284
   20    HG2  LYS   2           2HG      LYS   2   3.594  -0.674  12.939
   21    HG3  LYS   2           1HG      LYS   2   3.322  -2.380  13.292
   22    HD2  LYS   2           2HD      LYS   2   1.566  -1.919  14.780
   23    HD3  LYS   2           1HD      LYS   2   2.067  -0.242  15.004
   24    HE2  LYS   2           2HE      LYS   2   0.021  -0.885  13.396
   25    HE3  LYS   2           1HE      LYS   2   1.096   0.461  13.022
   26    HZ1  LYS   2           3HZ      LYS   2   0.588  -1.463  11.296
   27    HZ2  LYS   2           1HZ      LYS   2   1.901  -2.187  12.083
   28    HZ3  LYS   2           2HZ      LYS   2   2.088  -0.667  11.337
   29    H    ALA   3           H        ALA   3   4.726  -2.630  12.140
   30    HA   ALA   3           HA       ALA   3   6.107  -1.187  10.105
   31    HB1  ALA   3           1HB      ALA   3   4.353  -2.128   8.607
   32    HB2  ALA   3           2HB      ALA   3   3.506  -2.744  10.028
   33    HB3  ALA   3           3HB      ALA   3   5.109  -3.359   9.615
   34    H    LEU   4           H        LEU   4   5.924   1.003  10.479
   35    HA   LEU   4           HA       LEU   4   3.338   2.209   9.858
   36    HB2  LEU   4           2HB      LEU   4   3.260   2.071  12.292
   37    HB3  LEU   4           1HB      LEU   4   4.859   2.803  12.407
   38    HG   LEU   4           HG       LEU   4   3.945   4.839  11.238
   39   HD11  LEU   4          1HD1      LEU   4   2.037   4.119  10.079
   40   HD12  LEU   4          2HD1      LEU   4   1.340   4.952  11.469
   41   HD13  LEU   4          3HD1      LEU   4   1.432   3.190  11.452
   42   HD21  LEU   4          3HD2      LEU   4   4.157   4.835  13.665
   43   HD22  LEU   4          1HD2      LEU   4   2.628   3.968  13.832
   44   HD23  LEU   4          2HD2      LEU   4   2.643   5.626  13.233
   45    H    LEU   5           H        LEU   5   6.486   3.167  11.151
   46    HA   LEU   5           HA       LEU   5   6.799   5.584   9.890
   47    HB2  LEU   5           2HB      LEU   5   9.259   3.957   9.856
   48    HB3  LEU   5           1HB      LEU   5   8.956   5.529  10.589
   49    HG   LEU   5           HG       LEU   5   8.054   2.858  11.712
   50   HD11  LEU   5          1HD1      LEU   5  10.206   4.793  12.611
   51   HD12  LEU   5          2HD1      LEU   5  10.472   3.208  11.890
   52   HD13  LEU   5          3HD1      LEU   5   9.714   3.337  13.472
   53   HD21  LEU   5          3HD2      LEU   5   7.023   4.002  13.446
   54   HD22  LEU   5          1HD2      LEU   5   6.722   5.135  12.130
   55   HD23  LEU   5          2HD2      LEU   5   8.046   5.424  13.257
   56    H    ALA   6           H        ALA   6   7.506   2.395   8.617
   57    HA   ALA   6           HA       ALA   6   8.595   3.128   6.152
   58    HB1  ALA   6           1HB      ALA   6   8.238   0.769   7.270
   59    HB2  ALA   6           2HB      ALA   6   8.297   0.914   5.515
   60    HB3  ALA   6           3HB      ALA   6   6.742   0.785   6.336
   61    H    LEU   7           H        LEU   7   5.250   2.588   7.099
   62    HA   LEU   7           HA       LEU   7   4.115   3.186   4.552
   63    HB2  LEU   7           2HB      LEU   7   2.550   3.722   7.033
   64    HB3  LEU   7           1HB      LEU   7   2.055   2.899   5.554
   65    HG   LEU   7           HG       LEU   7   3.913   1.767   7.672
   66   HD11  LEU   7          1HD1      LEU   7   2.056   0.184   8.075
   67   HD12  LEU   7          2HD1      LEU   7   1.066   1.063   6.910
   68   HD13  LEU   7          3HD1      LEU   7   1.572   1.847   8.404
   69   HD21  LEU   7          3HD2      LEU   7   3.465  -0.359   6.270
   70   HD22  LEU   7          1HD2      LEU   7   4.590   0.821   5.598
   71   HD23  LEU   7          2HD2      LEU   7   2.933   0.744   5.004
   72    H    ALA   8           H        ALA   8   4.656   4.968   7.507
   73    HA   ALA   8           HA       ALA   8   3.528   7.440   6.830
   74    HB1  ALA   8           1HB      ALA   8   6.049   7.034   8.446
   75    HB2  ALA   8           2HB      ALA   8   4.427   6.767   9.088
   76    HB3  ALA   8           3HB      ALA   8   4.914   8.378   8.561
   77    H    LEU   9           H        LEU   9   6.833   6.323   6.541
   78    HA   LEU   9           HA       LEU   9   7.994   8.513   5.328
   79    HB2  LEU   9           2HB      LEU   9   9.319   6.615   6.098
   80    HB3  LEU   9           1HB      LEU   9   8.602   5.588   4.856
   81    HG   LEU   9           HG       LEU   9   9.556   7.068   3.104
   82   HD11  LEU   9          1HD1      LEU   9  10.869   8.446   5.470
   83   HD12  LEU   9          2HD1      LEU   9   9.647   9.157   4.413
   84   HD13  LEU   9          3HD1      LEU   9  11.239   8.753   3.774
   85   HD21  LEU   9          3HD2      LEU   9  11.637   6.133   5.103
   86   HD22  LEU   9          1HD2      LEU   9  11.865   6.350   3.367
   87   HD23  LEU   9          2HD2      LEU   9  10.800   5.075   3.962
   88    H    HIS  10           H        HIS  10   6.810   5.642   3.583
   89    HA   HIS  10           HA       HIS  10   6.019   7.450   1.410
   90    HB2  HIS  10           2HB      HIS  10   8.057   5.330   1.275
   91    HB3  HIS  10           1HB      HIS  10   6.894   5.353  -0.052
   92    HD1  HIS  10           1HD      HIS  10   9.873   6.237  -0.487
   93    HD2  HIS  10           2HD      HIS  10   6.724   8.874   0.346
   94    HE1  HIS  10           1HE      HIS  10  10.595   8.525  -1.322
   95    HE2  HIS  10           2HE      HIS  10   8.706  10.142  -0.799
   96    H    HIS  11           H        HIS  11   3.951   7.259   1.833
   97    HA   HIS  11           HA       HIS  11   2.582   4.660   1.823
   98    HB2  HIS  11           2HB      HIS  11   0.586   6.315   2.167
   99    HB3  HIS  11           1HB      HIS  11   1.735   6.116   3.495
  100    HD1  HIS  11           1HD      HIS  11   0.953   8.463   0.609
  101    HD2  HIS  11           2HD      HIS  11   3.295   8.373   4.066
  102    HE1  HIS  11           1HE      HIS  11   2.025  10.755   0.825
  103    HE2  HIS  11           2HE      HIS  11   3.452  10.721   2.923
  104    H    LEU  12           H        LEU  12   3.921   6.044  -0.575
  105    HA   LEU  12           HA       LEU  12   1.828   6.969  -2.263
  106    HB2  LEU  12           2HB      LEU  12   4.666   6.121  -2.802
  107    HB3  LEU  12           1HB      LEU  12   3.583   6.681  -4.074
  108    HG   LEU  12           HG       LEU  12   3.570   8.424  -1.710
  109   HD11  LEU  12          1HD1      LEU  12   5.751   9.212  -1.745
  110   HD12  LEU  12          2HD1      LEU  12   6.061   8.600  -3.366
  111   HD13  LEU  12          3HD1      LEU  12   6.019   7.487  -2.000
  112   HD21  LEU  12          3HD2      LEU  12   3.517  10.127  -3.352
  113   HD22  LEU  12          1HD2      LEU  12   2.639   8.786  -4.099
  114   HD23  LEU  12          2HD2      LEU  12   4.314   9.112  -4.554
  115    H    ALA  13           H        ALA  13   3.913   4.185  -2.813
  116    HA   ALA  13           HA       ALA  13   1.725   2.877  -4.258
  117    HB1  ALA  13           1HB      ALA  13   4.275   1.445  -4.104
  118    HB2  ALA  13           2HB      ALA  13   4.418   3.065  -4.784
  119    HB3  ALA  13           3HB      ALA  13   3.317   1.895  -5.513
  120    H    HIS  14           H        HIS  14   3.724   2.427  -1.447
  121    HA   HIS  14           HA       HIS  14   3.450   1.158   0.459
  122    HB2  HIS  14           2HB      HIS  14   0.949   0.156  -0.936
  123    HB3  HIS  14           1HB      HIS  14   1.454  -0.293   0.681
  124    HD1  HIS  14           1HD      HIS  14   0.245   1.027   2.408
  125    HD2  HIS  14           2HD      HIS  14   0.946   3.283  -1.034
  126    HE1  HIS  14           1HE      HIS  14  -0.704   3.336   2.845
  127    HE2  HIS  14           2HE      HIS  14  -0.273   4.725   0.761
  128    H    LEU  15           H        LEU  15   2.708  -0.338  -2.563
  129    HA   LEU  15           HA       LEU  15   3.714  -2.952  -1.971
  130    HB2  LEU  15           2HB      LEU  15   2.210  -1.881  -3.991
  131    HB3  LEU  15           1HB      LEU  15   3.782  -2.000  -4.779
  132    HG   LEU  15           HG       LEU  15   2.617  -4.048  -5.186
  133   HD11  LEU  15          1HD1      LEU  15   4.470  -4.717  -2.903
  134   HD12  LEU  15          2HD1      LEU  15   5.072  -4.125  -4.451
  135   HD13  LEU  15          3HD1      LEU  15   4.176  -5.641  -4.379
  136   HD21  LEU  15          3HD2      LEU  15   2.376  -4.978  -2.418
  137   HD22  LEU  15          1HD2      LEU  15   1.188  -5.028  -3.724
  138   HD23  LEU  15          2HD2      LEU  15   1.372  -3.570  -2.752
  139    H    ALA  16           H        ALA  16   4.989   0.027  -2.960
  140    HA   ALA  16           HA       ALA  16   7.598  -1.124  -3.620
  141    HB1  ALA  16           1HB      ALA  16   8.054   0.818  -4.785
  142    HB2  ALA  16           2HB      ALA  16   7.049   1.812  -3.726
  143    HB3  ALA  16           3HB      ALA  16   6.297   0.769  -4.939
  144    H    LEU  17           H        LEU  17   6.011   0.966  -1.315
  145    HA   LEU  17           HA       LEU  17   7.877   2.284   0.051
  146    HB2  LEU  17           2HB      LEU  17   6.440   2.327   1.829
  147    HB3  LEU  17           1HB      LEU  17   5.356   1.659   0.621
  148    HG   LEU  17           HG       LEU  17   6.150  -0.658   1.471
  149   HD11  LEU  17          1HD1      LEU  17   6.560   0.293   4.155
  150   HD12  LEU  17          2HD1      LEU  17   7.763   1.030   3.099
  151   HD13  LEU  17          3HD1      LEU  17   7.618  -0.724   3.182
  152   HD21  LEU  17          3HD2      LEU  17   4.619  -0.309   3.590
  153   HD22  LEU  17          1HD2      LEU  17   3.926  -0.148   1.978
  154   HD23  LEU  17          2HD2      LEU  17   4.364   1.290   2.899
  155    H    HIS  18           H        HIS  18   7.332  -1.140   0.364
  156    HA   HIS  18           HA       HIS  18   9.569  -1.483   2.180
  157    HB2  HIS  18           2HB      HIS  18   8.918  -3.762   2.297
  158    HB3  HIS  18           1HB      HIS  18   7.444  -2.812   2.207
  159    HD1  HIS  18           1HD      HIS  18   9.377  -5.374   0.349
  160    HD2  HIS  18           2HD      HIS  18   6.124  -2.843  -0.344
  161    HE1  HIS  18           1HE      HIS  18   8.242  -6.212  -1.758
  162    HE2  HIS  18           2HE      HIS  18   6.265  -4.681  -2.197
  163    H    LEU  19           H        LEU  19   8.774  -2.443  -1.094
  164    HA   LEU  19           HA       LEU  19  11.200  -3.726  -1.742
  165    HB2  LEU  19           2HB      LEU  19   9.122  -3.792  -3.141
  166    HB3  LEU  19           1HB      LEU  19   9.428  -2.119  -3.607
  167    HG   LEU  19           HG       LEU  19  11.752  -3.902  -3.942
  168   HD11  LEU  19          1HD1      LEU  19  10.541  -4.600  -6.228
  169   HD12  LEU  19          2HD1      LEU  19   9.113  -4.518  -5.195
  170   HD13  LEU  19          3HD1      LEU  19  10.446  -5.597  -4.777
  171   HD21  LEU  19          3HD2      LEU  19  11.498  -2.739  -6.286
  172   HD22  LEU  19          1HD2      LEU  19  11.998  -1.779  -4.897
  173   HD23  LEU  19          2HD2      LEU  19  10.325  -1.723  -5.452
  174    H    ALA  20           H        ALA  20  10.261  -0.428  -1.500
  175    HA   ALA  20           HA       ALA  20  12.541   0.690  -2.853
  176    HB1  ALA  20           1HB      ALA  20  10.426   1.950  -2.678
  177    HB2  ALA  20           2HB      ALA  20  11.759   2.836  -1.944
  178    HB3  ALA  20           3HB      ALA  20  10.600   1.988  -0.924
  179    H    LEU  21           H        LEU  21  11.512   0.677   0.532
  180    HA   LEU  21           HA       LEU  21  13.817   1.671   1.693
  181    HB2  LEU  21           2HB      LEU  21  11.519   0.097   2.579
  182    HB3  LEU  21           1HB      LEU  21  12.982  -0.284   3.487
  183    HG   LEU  21           HG       LEU  21  11.732   1.570   4.535
  184   HD11  LEU  21          1HD1      LEU  21  14.158   2.867   3.342
  185   HD12  LEU  21          2HD1      LEU  21  14.364   1.409   4.314
  186   HD13  LEU  21          3HD1      LEU  21  13.613   2.841   5.019
  187   HD21  LEU  21          3HD2      LEU  21  11.529   2.431   1.790
  188   HD22  LEU  21          1HD2      LEU  21  12.291   3.703   2.742
  189   HD23  LEU  21          2HD2      LEU  21  10.710   3.080   3.207
  190    H    ALA  22           H        ALA  22  13.042  -1.572   0.690
  191    HA   ALA  22           HA       ALA  22  15.240  -2.940   1.726
  192    HB1  ALA  22           1HB      ALA  22  13.165  -3.890   0.577
  193    HB2  ALA  22           2HB      ALA  22  14.699  -4.691   0.240
  194    HB3  ALA  22           3HB      ALA  22  14.009  -3.578  -0.942
  195    H    LEU  23           H        LEU  23  14.852  -1.431  -1.446
  196    HA   LEU  23           HA       LEU  23  17.619  -1.934  -2.157
  197    HB2  LEU  23           2HB      LEU  23  15.551  -0.252  -3.578
  198    HB3  LEU  23           1HB      LEU  23  17.062  -0.853  -4.260
  199    HG   LEU  23           HG       LEU  23  14.836  -2.626  -3.205
  200   HD11  LEU  23          1HD1      LEU  23  15.606  -2.025  -6.074
  201   HD12  LEU  23          2HD1      LEU  23  14.228  -1.297  -5.250
  202   HD13  LEU  23          3HD1      LEU  23  14.268  -3.036  -5.524
  203   HD21  LEU  23          3HD2      LEU  23  16.202  -4.267  -4.717
  204   HD22  LEU  23          1HD2      LEU  23  16.821  -3.889  -3.108
  205   HD23  LEU  23          2HD2      LEU  23  17.505  -3.092  -4.528
  206    H    LYS  24           H        LYS  24  15.614   0.870  -1.486
  207    HA   LYS  24           HA       LYS  24  17.555   2.850  -1.852
  208    HB2  LYS  24           2HB      LYS  24  15.083   3.223  -1.615
  209    HB3  LYS  24           1HB      LYS  24  15.277   2.982   0.121
  210    HG2  LYS  24           2HG      LYS  24  17.168   4.914  -1.106
  211    HG3  LYS  24           1HG      LYS  24  15.474   5.412  -1.096
  212    HD2  LYS  24           2HD      LYS  24  15.387   5.580   1.190
  213    HD3  LYS  24           1HD      LYS  24  16.497   4.232   1.439
  214    HE2  LYS  24           2HE      LYS  24  17.378   6.552   2.078
  215    HE3  LYS  24           1HE      LYS  24  18.409   5.603   1.003
  216    HZ1  LYS  24           3HZ      LYS  24  16.907   8.033   0.467
  217    HZ2  LYS  24           1HZ      LYS  24  16.858   6.867  -0.757
  218    HZ3  LYS  24           2HZ      LYS  24  18.351   7.468  -0.233
  219    H    LYS  25           H        LYS  25  16.540   1.304   1.177
  220    HA   LYS  25           HA       LYS  25  18.698   2.619   2.614
  221    HB2  LYS  25           2HB      LYS  25  16.282   1.938   3.477
  222    HB3  LYS  25           1HB      LYS  25  17.093   0.417   3.850
  223    HG2  LYS  25           2HG      LYS  25  18.765   2.619   4.664
  224    HG3  LYS  25           1HG      LYS  25  17.156   2.822   5.353
  225    HD2  LYS  25           2HD      LYS  25  17.245   0.766   6.499
  226    HD3  LYS  25           1HD      LYS  25  18.535   0.141   5.473
  227    HE2  LYS  25           2HE      LYS  25  19.811   2.286   6.504
  228    HE3  LYS  25           1HE      LYS  25  18.698   1.957   7.828
  229    HZ1  LYS  25           3HZ      LYS  25  20.280  -0.230   6.609
  230    HZ2  LYS  25           1HZ      LYS  25  19.583  -0.138   8.158
  231    HZ3  LYS  25           2HZ      LYS  25  20.960   0.784   7.805
  232    H    ALA  26           H        ALA  26  20.079   1.281   4.075
  233    HA   ALA  26           HA       ALA  26  21.289  -0.891   2.515
  234    HB1  ALA  26           1HB      ALA  26  22.667   1.071   3.334
  235    HB2  ALA  26           2HB      ALA  26  23.267  -0.511   3.823
  236    HB3  ALA  26           3HB      ALA  26  22.391   0.487   4.978
  Start of MODEL    7
    1    H1   LYS   1           1HT      LYS   1   3.619  14.716 -24.503
    2    H2   LYS   1           2HT      LYS   1   4.150  13.359 -25.367
    3    H3   LYS   1           3HT      LYS   1   5.115  14.016 -24.136
    4    HA   LYS   1           HA       LYS   1   2.473  13.287 -23.257
    5    HB2  LYS   1           2HB      LYS   1   4.416  11.192 -24.285
    6    HB3  LYS   1           1HB      LYS   1   3.091  10.835 -23.183
    7    HG2  LYS   1           2HG      LYS   1   2.605  12.249 -25.808
    8    HG3  LYS   1           1HG      LYS   1   2.667  10.490 -25.710
    9    HD2  LYS   1           2HD      LYS   1   0.797  10.396 -24.239
   10    HD3  LYS   1           1HD      LYS   1   0.884  12.123 -23.893
   11    HE2  LYS   1           2HE      LYS   1  -0.950  11.473 -25.497
   12    HE3  LYS   1           1HE      LYS   1   0.163  12.689 -26.117
   13    HZ1  LYS   1           2HZ      LYS   1  -0.150  11.065 -27.797
   14    HZ2  LYS   1           3HZ      LYS   1   0.145   9.787 -26.727
   15    HZ3  LYS   1           1HZ      LYS   1   1.410  10.823 -27.172
   16    H    LYS   2           H        LYS   2   2.808  13.970 -21.213
   17    HA   LYS   2           HA       LYS   2   5.403  13.934 -19.970
   18    HB2  LYS   2           2HB      LYS   2   2.624  14.512 -18.913
   19    HB3  LYS   2           1HB      LYS   2   4.084  14.631 -17.930
   20    HG2  LYS   2           2HG      LYS   2   4.971  16.391 -19.264
   21    HG3  LYS   2           1HG      LYS   2   3.812  16.103 -20.562
   22    HD2  LYS   2           2HD      LYS   2   2.504  17.687 -19.627
   23    HD3  LYS   2           1HD      LYS   2   2.223  16.563 -18.297
   24    HE2  LYS   2           2HE      LYS   2   3.057  18.775 -17.497
   25    HE3  LYS   2           1HE      LYS   2   4.152  17.452 -17.087
   26    HZ1  LYS   2           3HZ      LYS   2   4.513  18.966 -19.594
   27    HZ2  LYS   2           1HZ      LYS   2   5.655  18.080 -18.709
   28    HZ3  LYS   2           2HZ      LYS   2   5.121  19.577 -18.128
   29    H    ALA   3           H        ALA   3   5.710  12.853 -17.815
   30    HA   ALA   3           HA       ALA   3   5.195  10.045 -18.045
   31    HB1  ALA   3           1HB      ALA   3   7.219  11.037 -16.924
   32    HB2  ALA   3           2HB      ALA   3   6.382   9.833 -15.950
   33    HB3  ALA   3           3HB      ALA   3   6.173  11.548 -15.600
   34    H    LEU   4           H        LEU   4   2.762  11.183 -18.191
   35    HA   LEU   4           HA       LEU   4   1.424  11.330 -15.641
   36    HB2  LEU   4           2HB      LEU   4   0.871  12.145 -18.253
   37    HB3  LEU   4           1HB      LEU   4  -0.309  10.875 -17.928
   38    HG   LEU   4           HG       LEU   4   0.212  13.312 -16.195
   39   HD11  LEU   4          1HD1      LEU   4  -1.023  14.055 -18.062
   40   HD12  LEU   4          2HD1      LEU   4  -2.263  13.715 -16.855
   41   HD13  LEU   4          3HD1      LEU   4  -1.959  12.562 -18.155
   42   HD21  LEU   4          3HD2      LEU   4  -0.707  12.090 -14.525
   43   HD22  LEU   4          1HD2      LEU   4  -1.076  10.757 -15.622
   44   HD23  LEU   4          2HD2      LEU   4  -2.212  12.096 -15.448
   45    H    LEU   5           H        LEU   5   0.938   9.221 -18.424
   46    HA   LEU   5           HA       LEU   5  -0.646   7.276 -17.374
   47    HB2  LEU   5           2HB      LEU   5  -0.035   7.127 -19.676
   48    HB3  LEU   5           1HB      LEU   5   1.680   7.026 -19.283
   49    HG   LEU   5           HG       LEU   5   1.308   4.840 -18.192
   50   HD11  LEU   5          1HD1      LEU   5  -0.835   4.689 -17.395
   51   HD12  LEU   5          2HD1      LEU   5  -1.072   3.866 -18.932
   52   HD13  LEU   5          3HD1      LEU   5  -1.526   5.559 -18.760
   53   HD21  LEU   5          3HD2      LEU   5   1.940   4.695 -20.472
   54   HD22  LEU   5          1HD2      LEU   5   0.348   5.207 -21.034
   55   HD23  LEU   5          2HD2      LEU   5   0.560   3.608 -20.314
   56    H    ALA   6           H        ALA   6   2.828   7.552 -17.081
   57    HA   ALA   6           HA       ALA   6   3.501   5.233 -15.759
   58    HB1  ALA   6           1HB      ALA   6   5.084   6.970 -14.441
   59    HB2  ALA   6           2HB      ALA   6   4.570   8.000 -15.781
   60    HB3  ALA   6           3HB      ALA   6   5.393   6.472 -16.107
   61    H    LEU   7           H        LEU   7   2.414   8.265 -14.320
   62    HA   LEU   7           HA       LEU   7   2.342   7.405 -11.635
   63    HB2  LEU   7           2HB      LEU   7   0.292   9.342 -12.656
   64    HB3  LEU   7           1HB      LEU   7   1.194   9.376 -11.143
   65    HG   LEU   7           HG       LEU   7   2.304   9.935 -13.904
   66   HD11  LEU   7          1HD1      LEU   7   0.925  11.575 -12.082
   67   HD12  LEU   7          2HD1      LEU   7   1.843  12.088 -13.497
   68   HD13  LEU   7          3HD1      LEU   7   2.629  12.004 -11.921
   69   HD21  LEU   7          3HD2      LEU   7   4.044   8.890 -12.652
   70   HD22  LEU   7          1HD2      LEU   7   3.586   9.740 -11.175
   71   HD23  LEU   7          2HD2      LEU   7   4.336  10.626 -12.507
   72    H    ALA   8           H        ALA   8  -0.106   7.488 -14.126
   73    HA   ALA   8           HA       ALA   8  -2.361   6.640 -12.841
   74    HB1  ALA   8           1HB      ALA   8  -1.603   5.349 -15.434
   75    HB2  ALA   8           2HB      ALA   8  -1.921   7.082 -15.369
   76    HB3  ALA   8           3HB      ALA   8  -3.182   5.936 -14.909
   77    H    LEU   9           H        LEU   9   0.053   4.560 -14.301
   78    HA   LEU   9           HA       LEU   9  -1.057   2.208 -12.987
   79    HB2  LEU   9           2HB      LEU   9   0.420   0.922 -14.320
   80    HB3  LEU   9           1HB      LEU   9  -0.126   2.233 -15.359
   81    HG   LEU   9           HG       LEU   9   2.164   3.222 -14.023
   82   HD11  LEU   9          1HD1      LEU   9   2.535   0.717 -13.557
   83   HD12  LEU   9          2HD1      LEU   9   3.864   1.582 -14.322
   84   HD13  LEU   9          3HD1      LEU   9   2.805   0.554 -15.286
   85   HD21  LEU   9          3HD2      LEU   9   1.971   2.070 -16.824
   86   HD22  LEU   9          1HD2      LEU   9   3.090   3.315 -16.271
   87   HD23  LEU   9          2HD2      LEU   9   1.365   3.662 -16.370
   88    H    HIS  10           H        HIS  10   0.986   4.612 -12.015
   89    HA   HIS  10           HA       HIS  10   2.941   3.032 -10.573
   90    HB2  HIS  10           2HB      HIS  10   3.212   5.438 -11.504
   91    HB3  HIS  10           1HB      HIS  10   2.327   5.941 -10.073
   92    HD1  HIS  10           1HD      HIS  10   5.454   4.002 -11.039
   93    HD2  HIS  10           2HD      HIS  10   3.901   6.135  -7.799
   94    HE1  HIS  10           1HE      HIS  10   7.312   4.149  -9.317
   95    HE2  HIS  10           2HE      HIS  10   6.390   5.460  -7.341
   96    H    HIS  11           H        HIS  11   2.554   5.152  -8.359
   97    HA   HIS  11           HA       HIS  11   1.763   5.168  -6.221
   98    HB2  HIS  11           2HB      HIS  11  -0.751   4.436  -7.721
   99    HB3  HIS  11           1HB      HIS  11  -0.716   4.899  -6.018
  100    HD1  HIS  11           1HD      HIS  11   0.611   7.298  -5.590
  101    HD2  HIS  11           2HD      HIS  11  -0.899   6.625  -9.415
  102    HE1  HIS  11           1HE      HIS  11   0.417   9.566  -6.698
  103    HE2  HIS  11           2HE      HIS  11  -0.552   9.180  -9.013
  104    H    LEU  12           H        LEU  12   3.127   2.829  -6.861
  105    HA   LEU  12           HA       LEU  12   1.650   0.518  -5.993
  106    HB2  LEU  12           2HB      LEU  12   4.529   1.130  -6.557
  107    HB3  LEU  12           1HB      LEU  12   4.130  -0.308  -5.614
  108    HG   LEU  12           HG       LEU  12   2.577  -1.029  -7.432
  109   HD11  LEU  12          1HD1      LEU  12   1.896   0.749  -8.720
  110   HD12  LEU  12          2HD1      LEU  12   3.321   0.324  -9.671
  111   HD13  LEU  12          3HD1      LEU  12   3.406   1.628  -8.484
  112   HD21  LEU  12          3HD2      LEU  12   5.511  -0.574  -7.870
  113   HD22  LEU  12          1HD2      LEU  12   4.558  -1.253  -9.187
  114   HD23  LEU  12          2HD2      LEU  12   4.642  -2.089  -7.636
  115    H    ALA  13           H        ALA  13   3.695   2.943  -4.601
  116    HA   ALA  13           HA       ALA  13   4.528   3.183  -2.418
  117    HB1  ALA  13           1HB      ALA  13   2.598   4.583  -2.449
  118    HB2  ALA  13           2HB      ALA  13   2.562   3.712  -0.917
  119    HB3  ALA  13           3HB      ALA  13   1.515   3.208  -2.245
  120    H    HIS  14           H        HIS  14   1.677   1.545  -1.306
  121    HA   HIS  14           HA       HIS  14   2.706   0.105   0.744
  122    HB2  HIS  14           2HB      HIS  14   0.513  -0.583  -1.190
  123    HB3  HIS  14           1HB      HIS  14   0.923  -1.650   0.149
  124    HD1  HIS  14           1HD      HIS  14  -0.029  -1.063   2.406
  125    HD2  HIS  14           2HD      HIS  14  -0.291   2.112  -0.295
  126    HE1  HIS  14           1HE      HIS  14  -1.411   0.743   3.534
  127    HE2  HIS  14           2HE      HIS  14  -1.575   2.685   1.898
  128    H    LEU  15           H        LEU  15   2.681  -0.801  -2.627
  129    HA   LEU  15           HA       LEU  15   4.085  -3.312  -2.074
  130    HB2  LEU  15           2HB      LEU  15   2.583  -2.134  -4.335
  131    HB3  LEU  15           1HB      LEU  15   3.913  -3.213  -4.758
  132    HG   LEU  15           HG       LEU  15   1.928  -4.030  -2.644
  133   HD11  LEU  15          1HD1      LEU  15   0.431  -3.563  -4.405
  134   HD12  LEU  15          2HD1      LEU  15   0.794  -5.276  -4.614
  135   HD13  LEU  15          3HD1      LEU  15   1.582  -4.076  -5.642
  136   HD21  LEU  15          3HD2      LEU  15   2.635  -6.244  -3.236
  137   HD22  LEU  15          1HD2      LEU  15   4.100  -5.272  -3.130
  138   HD23  LEU  15          2HD2      LEU  15   3.420  -5.670  -4.708
  139    H    ALA  16           H        ALA  16   4.934  -0.162  -2.578
  140    HA   ALA  16           HA       ALA  16   7.491  -0.946  -3.838
  141    HB1  ALA  16           1HB      ALA  16   5.750   1.429  -4.217
  142    HB2  ALA  16           2HB      ALA  16   6.698   0.527  -5.399
  143    HB3  ALA  16           3HB      ALA  16   7.493   1.668  -4.317
  144    H    LEU  17           H        LEU  17   6.084   1.295  -1.483
  145    HA   LEU  17           HA       LEU  17   8.262   2.596  -0.530
  146    HB2  LEU  17           2HB      LEU  17   7.194   2.713   1.660
  147    HB3  LEU  17           1HB      LEU  17   6.017   2.946   0.377
  148    HG   LEU  17           HG       LEU  17   5.778   0.282   0.670
  149   HD11  LEU  17          1HD1      LEU  17   7.441   1.003   2.837
  150   HD12  LEU  17          2HD1      LEU  17   6.609  -0.533   2.608
  151   HD13  LEU  17          3HD1      LEU  17   5.839   0.752   3.531
  152   HD21  LEU  17          3HD2      LEU  17   4.496   2.454   2.353
  153   HD22  LEU  17          1HD2      LEU  17   3.879   0.807   2.255
  154   HD23  LEU  17          2HD2      LEU  17   3.914   1.826   0.815
  155    H    HIS  18           H        HIS  18   7.227  -0.574   0.504
  156    HA   HIS  18           HA       HIS  18   9.343  -1.098   2.299
  157    HB2  HIS  18           2HB      HIS  18   8.620  -3.385   2.225
  158    HB3  HIS  18           1HB      HIS  18   7.199  -2.362   2.075
  159    HD1  HIS  18           1HD      HIS  18   8.616  -5.252   0.568
  160    HD2  HIS  18           2HD      HIS  18   6.612  -1.886  -0.890
  161    HE1  HIS  18           1HE      HIS  18   7.818  -5.846  -1.772
  162    HE2  HIS  18           2HE      HIS  18   6.619  -3.798  -2.690
  163    H    LEU  19           H        LEU  19   8.872  -2.018  -1.047
  164    HA   LEU  19           HA       LEU  19  11.373  -3.260  -1.456
  165    HB2  LEU  19           2HB      LEU  19   9.618  -3.628  -3.054
  166    HB3  LEU  19           1HB      LEU  19   9.444  -1.897  -3.349
  167    HG   LEU  19           HG       LEU  19  11.718  -1.826  -4.297
  168   HD11  LEU  19          1HD1      LEU  19  12.886  -3.548  -3.150
  169   HD12  LEU  19          2HD1      LEU  19  12.731  -4.150  -4.798
  170   HD13  LEU  19          3HD1      LEU  19  11.655  -4.754  -3.540
  171   HD21  LEU  19          3HD2      LEU  19   9.819  -2.267  -5.806
  172   HD22  LEU  19          1HD2      LEU  19   9.937  -3.997  -5.466
  173   HD23  LEU  19          2HD2      LEU  19  11.233  -3.179  -6.335
  174    H    ALA  20           H        ALA  20  10.254   0.007  -1.504
  175    HA   ALA  20           HA       ALA  20  12.512   1.221  -2.739
  176    HB1  ALA  20           1HB      ALA  20  10.155   2.214  -2.145
  177    HB2  ALA  20           2HB      ALA  20  11.570   3.263  -2.146
  178    HB3  ALA  20           3HB      ALA  20  10.932   2.643  -0.622
  179    H    LEU  21           H        LEU  21  11.625   0.627   0.598
  180    HA   LEU  21           HA       LEU  21  13.955   1.717   1.777
  181    HB2  LEU  21           2HB      LEU  21  11.588   0.629   2.725
  182    HB3  LEU  21           1HB      LEU  21  12.797  -0.563   3.204
  183    HG   LEU  21           HG       LEU  21  13.127   2.404   3.718
  184   HD11  LEU  21          1HD1      LEU  21  12.067   0.246   5.571
  185   HD12  LEU  21          2HD1      LEU  21  11.132   1.581   4.901
  186   HD13  LEU  21          3HD1      LEU  21  12.436   1.906   6.041
  187   HD21  LEU  21          3HD2      LEU  21  14.672   1.341   5.527
  188   HD22  LEU  21          1HD2      LEU  21  15.232   1.337   3.853
  189   HD23  LEU  21          2HD2      LEU  21  14.543  -0.125   4.556
  190    H    ALA  22           H        ALA  22  13.027  -1.549   0.853
  191    HA   ALA  22           HA       ALA  22  15.394  -2.867   1.599
  192    HB1  ALA  22           1HB      ALA  22  14.695  -4.632   0.046
  193    HB2  ALA  22           2HB      ALA  22  13.535  -3.529  -0.694
  194    HB3  ALA  22           3HB      ALA  22  13.316  -4.051   0.976
  195    H    LEU  23           H        LEU  23  14.426  -1.297  -1.400
  196    HA   LEU  23           HA       LEU  23  16.708  -1.928  -2.923
  197    HB2  LEU  23           2HB      LEU  23  14.566  -0.948  -3.818
  198    HB3  LEU  23           1HB      LEU  23  15.068   0.598  -3.139
  199    HG   LEU  23           HG       LEU  23  17.305   0.091  -4.484
  200   HD11  LEU  23          1HD1      LEU  23  16.854  -1.105  -6.578
  201   HD12  LEU  23          2HD1      LEU  23  15.196  -1.413  -6.067
  202   HD13  LEU  23          3HD1      LEU  23  16.537  -2.166  -5.207
  203   HD21  LEU  23          3HD2      LEU  23  14.668   1.148  -5.504
  204   HD22  LEU  23          1HD2      LEU  23  16.105   1.179  -6.523
  205   HD23  LEU  23          2HD2      LEU  23  16.088   2.056  -4.994
  206    H    LYS  24           H        LYS  24  15.930   0.865  -0.926
  207    HA   LYS  24           HA       LYS  24  18.372   2.251  -1.287
  208    HB2  LYS  24           2HB      LYS  24  16.274   3.255  -0.352
  209    HB3  LYS  24           1HB      LYS  24  16.550   2.343   1.129
  210    HG2  LYS  24           2HG      LYS  24  18.682   4.156  -0.003
  211    HG3  LYS  24           1HG      LYS  24  17.405   4.793   1.033
  212    HD2  LYS  24           2HD      LYS  24  18.282   2.503   2.372
  213    HD3  LYS  24           1HD      LYS  24  19.764   3.238   1.763
  214    HE2  LYS  24           2HE      LYS  24  17.635   4.803   3.239
  215    HE3  LYS  24           1HE      LYS  24  19.008   4.047   4.046
  216    HZ1  LYS  24           3HZ      LYS  24  18.921   6.406   2.395
  217    HZ2  LYS  24           1HZ      LYS  24  20.192   5.346   2.010
  218    HZ3  LYS  24           2HZ      LYS  24  20.039   5.954   3.588
  219    H    LYS  25           H        LYS  25  17.215   0.104   1.233
  220    HA   LYS  25           HA       LYS  25  18.726  -1.687   2.004
  221    HB2  LYS  25           2HB      LYS  25  20.792  -0.580   1.136
  222    HB3  LYS  25           1HB      LYS  25  20.680   0.596   2.446
  223    HG2  LYS  25           2HG      LYS  25  20.479  -1.779   3.810
  224    HG3  LYS  25           1HG      LYS  25  21.567  -2.217   2.499
  225    HD2  LYS  25           2HD      LYS  25  23.226  -0.764   3.194
  226    HD3  LYS  25           1HD      LYS  25  22.082   0.365   3.913
  227    HE2  LYS  25           2HE      LYS  25  23.635  -1.338   5.363
  228    HE3  LYS  25           1HE      LYS  25  22.089  -0.706   5.926
  229    HZ1  LYS  25           3HZ      LYS  25  21.065  -2.672   5.631
  230    HZ2  LYS  25           1HZ      LYS  25  22.642  -3.287   5.803
  231    HZ3  LYS  25           2HZ      LYS  25  21.979  -3.084   4.251
  232    H    ALA  26           H        ALA  26  18.600  -2.269   4.132
  233    HA   ALA  26           HA       ALA  26  17.892  -0.156   6.076
  234    HB1  ALA  26           1HB      ALA  26  16.562  -2.871   5.905
  235    HB2  ALA  26           2HB      ALA  26  15.866  -1.390   5.251
  236    HB3  ALA  26           3HB      ALA  26  16.141  -1.540   6.984
  Start of MODEL    8
    1    H1   LYS   1           1HT      LYS   1  13.562  -5.316 -11.101
    2    H2   LYS   1           2HT      LYS   1  12.560  -6.114 -12.211
    3    H3   LYS   1           3HT      LYS   1  12.350  -6.359 -10.550
    4    HA   LYS   1           HA       LYS   1  11.285  -4.407 -10.216
    5    HB2  LYS   1           2HB      LYS   1  12.965  -3.455 -12.543
    6    HB3  LYS   1           1HB      LYS   1  11.586  -2.515 -11.976
    7    HG2  LYS   1           2HG      LYS   1  13.171  -3.366  -9.715
    8    HG3  LYS   1           1HG      LYS   1  14.200  -2.541 -10.883
    9    HD2  LYS   1           2HD      LYS   1  11.532  -1.397 -10.016
   10    HD3  LYS   1           1HD      LYS   1  13.016  -1.060  -9.127
   11    HE2  LYS   1           2HE      LYS   1  12.368  -0.347 -11.998
   12    HE3  LYS   1           1HE      LYS   1  12.771   0.742 -10.672
   13    HZ1  LYS   1           2HZ      LYS   1  14.726   0.580 -11.857
   14    HZ2  LYS   1           3HZ      LYS   1  14.539  -1.077 -12.167
   15    HZ3  LYS   1           1HZ      LYS   1  14.958  -0.550 -10.612
   16    H    LYS   2           H        LYS   2  10.041  -6.536 -11.138
   17    HA   LYS   2           HA       LYS   2   8.811  -6.091 -13.725
   18    HB2  LYS   2           2HB      LYS   2   7.877  -8.052 -11.632
   19    HB3  LYS   2           1HB      LYS   2   7.656  -8.132 -13.379
   20    HG2  LYS   2           2HG      LYS   2   9.502  -9.432 -13.431
   21    HG3  LYS   2           1HG      LYS   2  10.425  -7.972 -13.085
   22    HD2  LYS   2           2HD      LYS   2  11.025  -9.648 -11.440
   23    HD3  LYS   2           1HD      LYS   2  10.084  -8.395 -10.640
   24    HE2  LYS   2           2HE      LYS   2   9.534 -10.976 -10.277
   25    HE3  LYS   2           1HE      LYS   2   8.262  -9.762 -10.318
   26    HZ1  LYS   2           3HZ      LYS   2   9.122 -11.052 -12.816
   27    HZ2  LYS   2           1HZ      LYS   2   7.623 -10.361 -12.428
   28    HZ3  LYS   2           2HZ      LYS   2   8.064 -11.865 -11.779
   29    H    ALA   3           H        ALA   3   7.180  -4.696 -14.032
   30    HA   ALA   3           HA       ALA   3   4.933  -4.608 -12.235
   31    HB1  ALA   3           1HB      ALA   3   6.230  -3.125 -10.918
   32    HB2  ALA   3           2HB      ALA   3   5.168  -2.092 -11.874
   33    HB3  ALA   3           3HB      ALA   3   6.860  -2.287 -12.339
   34    H    LEU   4           H        LEU   4   3.669  -5.055 -14.029
   35    HA   LEU   4           HA       LEU   4   3.672  -3.023 -16.170
   36    HB2  LEU   4           2HB      LEU   4   2.008  -5.233 -16.869
   37    HB3  LEU   4           1HB      LEU   4   3.499  -4.702 -17.636
   38    HG   LEU   4           HG       LEU   4   4.607  -5.964 -15.558
   39   HD11  LEU   4          1HD1      LEU   4   2.837  -6.799 -14.327
   40   HD12  LEU   4          2HD1      LEU   4   3.092  -8.148 -15.428
   41   HD13  LEU   4          3HD1      LEU   4   1.801  -6.989 -15.738
   42   HD21  LEU   4          3HD2      LEU   4   4.689  -8.022 -17.005
   43   HD22  LEU   4          1HD2      LEU   4   5.070  -6.536 -17.873
   44   HD23  LEU   4          2HD2      LEU   4   3.484  -7.281 -18.054
   45    H    LEU   5           H        LEU   5   1.211  -5.247 -14.978
   46    HA   LEU   5           HA       LEU   5  -0.973  -3.580 -15.335
   47    HB2  LEU   5           2HB      LEU   5  -1.332  -5.906 -14.823
   48    HB3  LEU   5           1HB      LEU   5  -0.476  -5.752 -13.291
   49    HG   LEU   5           HG       LEU   5  -2.226  -4.172 -12.494
   50   HD11  LEU   5          1HD1      LEU   5  -4.366  -4.128 -13.822
   51   HD12  LEU   5          2HD1      LEU   5  -3.481  -4.866 -15.157
   52   HD13  LEU   5          3HD1      LEU   5  -3.024  -3.267 -14.572
   53   HD21  LEU   5          3HD2      LEU   5  -2.462  -6.506 -11.895
   54   HD22  LEU   5          1HD2      LEU   5  -3.175  -6.887 -13.461
   55   HD23  LEU   5          2HD2      LEU   5  -4.058  -5.882 -12.310
   56    H    ALA   6           H        ALA   6   0.969  -4.090 -12.440
   57    HA   ALA   6           HA       ALA   6  -0.261  -2.216 -10.771
   58    HB1  ALA   6           1HB      ALA   6   1.373  -3.887  -9.967
   59    HB2  ALA   6           2HB      ALA   6   1.795  -2.254  -9.457
   60    HB3  ALA   6           3HB      ALA   6   2.657  -3.006 -10.798
   61    H    LEU   7           H        LEU   7   2.350  -1.865 -13.107
   62    HA   LEU   7           HA       LEU   7   3.060   0.794 -12.556
   63    HB2  LEU   7           2HB      LEU   7   4.532  -0.299 -14.024
   64    HB3  LEU   7           1HB      LEU   7   3.225  -0.898 -15.036
   65    HG   LEU   7           HG       LEU   7   2.749   1.468 -15.734
   66   HD11  LEU   7          1HD1      LEU   7   3.727   3.177 -14.635
   67   HD12  LEU   7          2HD1      LEU   7   5.322   2.564 -15.075
   68   HD13  LEU   7          3HD1      LEU   7   4.550   2.021 -13.587
   69   HD21  LEU   7          3HD2      LEU   7   4.507   1.535 -17.338
   70   HD22  LEU   7          1HD2      LEU   7   4.282  -0.174 -16.968
   71   HD23  LEU   7          2HD2      LEU   7   5.629   0.713 -16.255
   72    H    ALA   8           H        ALA   8   0.664  -0.573 -14.717
   73    HA   ALA   8           HA       ALA   8  -0.365   1.830 -15.762
   74    HB1  ALA   8           1HB      ALA   8  -1.976   0.506 -16.699
   75    HB2  ALA   8           2HB      ALA   8  -2.265  -0.376 -15.202
   76    HB3  ALA   8           3HB      ALA   8  -0.878  -0.783 -16.204
   77    H    LEU   9           H        LEU   9  -1.458  -0.185 -13.112
   78    HA   LEU   9           HA       LEU   9  -3.528   1.407 -12.137
   79    HB2  LEU   9           2HB      LEU   9  -1.857  -0.774 -11.054
   80    HB3  LEU   9           1HB      LEU   9  -2.638   0.258  -9.856
   81    HG   LEU   9           HG       LEU   9  -4.784  -0.055 -11.268
   82   HD11  LEU   9          1HD1      LEU   9  -3.039  -2.300 -12.299
   83   HD12  LEU   9          2HD1      LEU   9  -3.798  -1.023 -13.247
   84   HD13  LEU   9          3HD1      LEU   9  -4.791  -2.261 -12.479
   85   HD21  LEU   9          3HD2      LEU   9  -3.561  -2.389  -9.766
   86   HD22  LEU   9          1HD2      LEU   9  -5.277  -2.198 -10.123
   87   HD23  LEU   9          2HD2      LEU   9  -4.466  -1.054  -9.053
   88    H    HIS  10           H        HIS  10  -0.477   1.066 -10.363
   89    HA   HIS  10           HA       HIS  10  -0.118   3.939 -10.160
   90    HB2  HIS  10           2HB      HIS  10  -1.962   3.224  -8.486
   91    HB3  HIS  10           1HB      HIS  10  -0.643   2.505  -7.568
   92    HD1  HIS  10           1HD      HIS  10  -1.233   4.369  -5.731
   93    HD2  HIS  10           2HD      HIS  10   0.345   5.813  -9.313
   94    HE1  HIS  10           1HE      HIS  10  -0.452   6.738  -5.270
   95    HE2  HIS  10           2HE      HIS  10   0.510   7.638  -7.449
   96    H    HIS  11           H        HIS  11   1.491   1.658 -10.985
   97    HA   HIS  11           HA       HIS  11   3.690   1.034 -10.871
   98    HB2  HIS  11           2HB      HIS  11   4.133   3.001  -8.641
   99    HB3  HIS  11           1HB      HIS  11   5.293   2.402  -9.814
  100    HD1  HIS  11           1HD      HIS  11   4.612   5.476  -9.384
  101    HD2  HIS  11           2HD      HIS  11   2.999   3.053 -12.375
  102    HE1  HIS  11           1HE      HIS  11   3.845   7.027 -11.246
  103    HE2  HIS  11           2HE      HIS  11   2.867   5.559 -13.072
  104    H    LEU  12           H        LEU  12   3.645   1.875  -7.476
  105    HA   LEU  12           HA       LEU  12   3.173  -0.875  -6.645
  106    HB2  LEU  12           2HB      LEU  12   5.817   0.550  -6.337
  107    HB3  LEU  12           1HB      LEU  12   5.337  -0.769  -5.270
  108    HG   LEU  12           HG       LEU  12   5.399  -1.014  -8.288
  109   HD11  LEU  12          1HD1      LEU  12   7.661  -0.616  -7.609
  110   HD12  LEU  12          2HD1      LEU  12   7.500  -2.357  -7.809
  111   HD13  LEU  12          3HD1      LEU  12   7.487  -1.654  -6.194
  112   HD21  LEU  12          3HD2      LEU  12   3.982  -2.684  -7.340
  113   HD22  LEU  12          1HD2      LEU  12   5.071  -2.935  -5.976
  114   HD23  LEU  12          2HD2      LEU  12   5.532  -3.482  -7.587
  115    H    ALA  13           H        ALA  13   4.391   2.263  -5.656
  116    HA   ALA  13           HA       ALA  13   4.052   3.547  -3.774
  117    HB1  ALA  13           1HB      ALA  13   1.254   2.459  -4.191
  118    HB2  ALA  13           2HB      ALA  13   1.921   3.944  -4.879
  119    HB3  ALA  13           3HB      ALA  13   1.663   3.816  -3.138
  120    H    HIS  14           H        HIS  14   1.446   1.874  -2.409
  121    HA   HIS  14           HA       HIS  14   2.713   1.352   0.013
  122    HB2  HIS  14           2HB      HIS  14   0.144   0.746  -1.204
  123    HB3  HIS  14           1HB      HIS  14   0.691  -0.550  -0.144
  124    HD1  HIS  14           1HD      HIS  14  -1.228   0.214   1.552
  125    HD2  HIS  14           2HD      HIS  14   1.796   3.023   0.914
  126    HE1  HIS  14           1HE      HIS  14  -1.405   1.906   3.442
  127    HE2  HIS  14           2HE      HIS  14   0.442   3.626   3.064
  128    H    LEU  15           H        LEU  15   2.780  -0.449  -2.908
  129    HA   LEU  15           HA       LEU  15   3.823  -2.851  -1.568
  130    HB2  LEU  15           2HB      LEU  15   2.792  -2.170  -4.274
  131    HB3  LEU  15           1HB      LEU  15   4.050  -3.404  -4.194
  132    HG   LEU  15           HG       LEU  15   1.587  -3.493  -2.428
  133   HD11  LEU  15          1HD1      LEU  15   0.916  -5.315  -4.163
  134   HD12  LEU  15          2HD1      LEU  15   2.018  -4.470  -5.249
  135   HD13  LEU  15          3HD1      LEU  15   0.626  -3.625  -4.572
  136   HD21  LEU  15          3HD2      LEU  15   2.688  -5.258  -1.544
  137   HD22  LEU  15          1HD2      LEU  15   4.004  -5.058  -2.703
  138   HD23  LEU  15          2HD2      LEU  15   2.609  -6.052  -3.114
  139    H    ALA  16           H        ALA  16   4.890   0.060  -2.765
  140    HA   ALA  16           HA       ALA  16   7.477  -0.932  -3.683
  141    HB1  ALA  16           1HB      ALA  16   7.449   1.908  -3.537
  142    HB2  ALA  16           2HB      ALA  16   5.909   1.386  -4.217
  143    HB3  ALA  16           3HB      ALA  16   7.419   0.885  -4.974
  144    H    LEU  17           H        LEU  17   6.318   1.357  -1.225
  145    HA   LEU  17           HA       LEU  17   8.507   2.261  -0.036
  146    HB2  LEU  17           2HB      LEU  17   7.419   2.093   2.184
  147    HB3  LEU  17           1HB      LEU  17   6.354   2.727   0.935
  148    HG   LEU  17           HG       LEU  17   5.873   0.009   0.790
  149   HD11  LEU  17          1HD1      LEU  17   5.344   0.002   3.538
  150   HD12  LEU  17          2HD1      LEU  17   6.977   0.647   3.422
  151   HD13  LEU  17          3HD1      LEU  17   6.607  -0.925   2.728
  152   HD21  LEU  17          3HD2      LEU  17   4.315   2.039   0.874
  153   HD22  LEU  17          1HD2      LEU  17   4.400   1.902   2.629
  154   HD23  LEU  17          2HD2      LEU  17   3.725   0.584   1.677
  155    H    HIS  18           H        HIS  18   7.270  -0.955   0.523
  156    HA   HIS  18           HA       HIS  18   9.296  -1.842   2.293
  157    HB2  HIS  18           2HB      HIS  18   8.205  -3.764   0.279
  158    HB3  HIS  18           1HB      HIS  18   8.540  -3.998   1.988
  159    HD1  HIS  18           1HD      HIS  18   6.601  -3.699   3.586
  160    HD2  HIS  18           2HD      HIS  18   5.813  -2.160  -0.211
  161    HE1  HIS  18           1HE      HIS  18   4.150  -3.040   3.572
  162    HE2  HIS  18           2HE      HIS  18   3.661  -2.073   1.270
  163    H    LEU  19           H        LEU  19   8.921  -2.620  -1.108
  164    HA   LEU  19           HA       LEU  19  11.499  -3.675  -1.506
  165    HB2  LEU  19           2HB      LEU  19   9.519  -4.011  -3.001
  166    HB3  LEU  19           1HB      LEU  19   9.687  -2.345  -3.548
  167    HG   LEU  19           HG       LEU  19  10.751  -4.239  -4.980
  168   HD11  LEU  19          1HD1      LEU  19  12.948  -2.364  -4.509
  169   HD12  LEU  19          2HD1      LEU  19  11.380  -1.560  -4.623
  170   HD13  LEU  19          3HD1      LEU  19  11.941  -2.584  -5.942
  171   HD21  LEU  19          3HD2      LEU  19  13.041  -3.933  -3.028
  172   HD22  LEU  19          1HD2      LEU  19  12.848  -5.118  -4.319
  173   HD23  LEU  19          2HD2      LEU  19  11.862  -5.237  -2.863
  174    H    ALA  20           H        ALA  20  10.261  -0.478  -1.409
  175    HA   ALA  20           HA       ALA  20  12.378   0.857  -2.769
  176    HB1  ALA  20           1HB      ALA  20  10.007   1.724  -1.988
  177    HB2  ALA  20           2HB      ALA  20  11.377   2.830  -2.110
  178    HB3  ALA  20           3HB      ALA  20  10.899   2.188  -0.536
  179    H    LEU  21           H        LEU  21  11.649   0.563   0.673
  180    HA   LEU  21           HA       LEU  21  14.036   1.650   1.641
  181    HB2  LEU  21           2HB      LEU  21  12.009   1.151   3.015
  182    HB3  LEU  21           1HB      LEU  21  12.414  -0.563   2.920
  183    HG   LEU  21           HG       LEU  21  14.694   0.045   3.901
  184   HD11  LEU  21          1HD1      LEU  21  14.761   2.192   5.154
  185   HD12  LEU  21          2HD1      LEU  21  13.202   2.629   4.458
  186   HD13  LEU  21          3HD1      LEU  21  14.615   2.460   3.415
  187   HD21  LEU  21          3HD2      LEU  21  12.499  -0.785   5.133
  188   HD22  LEU  21          1HD2      LEU  21  12.533   0.836   5.834
  189   HD23  LEU  21          2HD2      LEU  21  13.898  -0.259   6.071
  190    H    ALA  22           H        ALA  22  13.157  -1.666   0.896
  191    HA   ALA  22           HA       ALA  22  15.480  -2.976   1.700
  192    HB1  ALA  22           1HB      ALA  22  14.845  -4.605  -0.210
  193    HB2  ALA  22           2HB      ALA  22  13.442  -3.561  -0.427
  194    HB3  ALA  22           3HB      ALA  22  13.706  -4.378   1.111
  195    H    LEU  23           H        LEU  23  14.856  -1.095  -1.158
  196    HA   LEU  23           HA       LEU  23  17.434  -1.871  -2.328
  197    HB2  LEU  23           2HB      LEU  23  14.890  -1.044  -3.402
  198    HB3  LEU  23           1HB      LEU  23  16.155   0.040  -3.969
  199    HG   LEU  23           HG       LEU  23  15.905  -1.870  -5.501
  200   HD11  LEU  23          1HD1      LEU  23  18.186  -0.805  -4.826
  201   HD12  LEU  23          2HD1      LEU  23  18.201  -2.324  -5.725
  202   HD13  LEU  23          3HD1      LEU  23  18.468  -2.324  -3.982
  203   HD21  LEU  23          3HD2      LEU  23  15.071  -3.498  -3.820
  204   HD22  LEU  23          1HD2      LEU  23  16.671  -3.547  -3.084
  205   HD23  LEU  23          2HD2      LEU  23  16.436  -4.146  -4.724
  206    H    LYS  24           H        LYS  24  15.663   0.975  -1.307
  207    HA   LYS  24           HA       LYS  24  17.668   2.879  -1.870
  208    HB2  LYS  24           2HB      LYS  24  15.288   2.832  -0.036
  209    HB3  LYS  24           1HB      LYS  24  16.408   4.196  -0.017
  210    HG2  LYS  24           2HG      LYS  24  15.909   4.806  -2.233
  211    HG3  LYS  24           1HG      LYS  24  15.279   3.206  -2.630
  212    HD2  LYS  24           2HD      LYS  24  13.513   5.024  -2.329
  213    HD3  LYS  24           1HD      LYS  24  13.280   3.569  -1.364
  214    HE2  LYS  24           2HE      LYS  24  12.963   5.760  -0.105
  215    HE3  LYS  24           1HE      LYS  24  14.109   4.640   0.623
  216    HZ1  LYS  24           3HZ      LYS  24  15.637   6.228   0.495
  217    HZ2  LYS  24           1HZ      LYS  24  14.548   7.266  -0.288
  218    HZ3  LYS  24           2HZ      LYS  24  15.517   6.213  -1.198
  219    H    LYS  25           H        LYS  25  16.691   1.596   1.273
  220    HA   LYS  25           HA       LYS  25  19.334   2.295   2.346
  221    HB2  LYS  25           2HB      LYS  25  16.735   2.514   3.377
  222    HB3  LYS  25           1HB      LYS  25  17.484   1.203   4.285
  223    HG2  LYS  25           2HG      LYS  25  19.538   2.877   4.390
  224    HG3  LYS  25           1HG      LYS  25  18.296   4.087   4.093
  225    HD2  LYS  25           2HD      LYS  25  18.501   3.899   6.476
  226    HD3  LYS  25           1HD      LYS  25  17.000   3.092   6.033
  227    HE2  LYS  25           2HE      LYS  25  18.315   1.770   7.660
  228    HE3  LYS  25           1HE      LYS  25  18.099   0.910   6.141
  229    HZ1  LYS  25           3HZ      LYS  25  20.314   0.636   6.318
  230    HZ2  LYS  25           1HZ      LYS  25  20.513   1.981   7.342
  231    HZ3  LYS  25           2HZ      LYS  25  20.383   2.212   5.666
  232    H    ALA  26           H        ALA  26  19.521   0.557   4.427
  233    HA   ALA  26           HA       ALA  26  19.249  -2.179   3.541
  234    HB1  ALA  26           1HB      ALA  26  22.010  -0.971   3.852
  235    HB2  ALA  26           2HB      ALA  26  21.282  -1.449   2.317
  236    HB3  ALA  26           3HB      ALA  26  21.650  -2.667   3.539
  Start of MODEL    9
    1    H1   LYS   1           1HT      LYS   1  15.272   4.806 -12.855
    2    H2   LYS   1           2HT      LYS   1  15.987   3.302 -12.526
    3    H3   LYS   1           3HT      LYS   1  14.717   3.866 -11.560
    4    HA   LYS   1           HA       LYS   1  13.254   3.804 -13.540
    5    HB2  LYS   1           2HB      LYS   1  15.502   3.693 -14.989
    6    HB3  LYS   1           1HB      LYS   1  15.246   1.958 -14.799
    7    HG2  LYS   1           2HG      LYS   1  12.725   2.732 -15.451
    8    HG3  LYS   1           1HG      LYS   1  13.659   3.954 -16.319
    9    HD2  LYS   1           2HD      LYS   1  15.073   1.969 -17.195
   10    HD3  LYS   1           1HD      LYS   1  13.744   0.947 -16.637
   11    HE2  LYS   1           2HE      LYS   1  13.758   3.019 -18.814
   12    HE3  LYS   1           1HE      LYS   1  13.126   1.377 -18.848
   13    HZ1  LYS   1           2HZ      LYS   1  11.945   3.461 -17.105
   14    HZ2  LYS   1           3HZ      LYS   1  11.261   1.990 -17.615
   15    HZ3  LYS   1           1HZ      LYS   1  11.456   3.259 -18.716
   16    H    LYS   2           H        LYS   2  13.311   2.720 -11.053
   17    HA   LYS   2           HA       LYS   2  12.921  -0.175 -11.527
   18    HB2  LYS   2           2HB      LYS   2  14.633   1.061  -9.659
   19    HB3  LYS   2           1HB      LYS   2  13.257   0.484  -8.721
   20    HG2  LYS   2           2HG      LYS   2  14.924  -1.297  -8.849
   21    HG3  LYS   2           1HG      LYS   2  13.517  -1.761  -9.809
   22    HD2  LYS   2           2HD      LYS   2  14.635  -1.038 -11.866
   23    HD3  LYS   2           1HD      LYS   2  16.021  -0.469 -10.936
   24    HE2  LYS   2           2HE      LYS   2  15.977  -2.896 -12.068
   25    HE3  LYS   2           1HE      LYS   2  16.799  -2.609 -10.538
   26    HZ1  LYS   2           3HZ      LYS   2  15.216  -4.549 -10.614
   27    HZ2  LYS   2           1HZ      LYS   2  13.955  -3.421 -10.689
   28    HZ3  LYS   2           2HZ      LYS   2  14.983  -3.458  -9.338
   29    H    ALA   3           H        ALA   3  11.901   2.504  -9.402
   30    HA   ALA   3           HA       ALA   3   9.439   1.247  -8.667
   31    HB1  ALA   3           1HB      ALA   3   8.857   3.442  -7.730
   32    HB2  ALA   3           2HB      ALA   3  10.227   4.170  -8.568
   33    HB3  ALA   3           3HB      ALA   3  10.503   2.992  -7.285
   34    H    LEU   4           H        LEU   4   9.559   0.944 -11.335
   35    HA   LEU   4           HA       LEU   4   8.036   3.044 -12.649
   36    HB2  LEU   4           2HB      LEU   4   9.915   1.723 -13.766
   37    HB3  LEU   4           1HB      LEU   4   8.804   0.356 -13.790
   38    HG   LEU   4           HG       LEU   4   7.762   2.948 -14.842
   39   HD11  LEU   4          1HD1      LEU   4   8.765   2.230 -17.111
   40   HD12  LEU   4          2HD1      LEU   4   9.914   1.292 -16.161
   41   HD13  LEU   4          3HD1      LEU   4   9.834   3.044 -15.969
   42   HD21  LEU   4          3HD2      LEU   4   6.260   1.094 -14.897
   43   HD22  LEU   4          1HD2      LEU   4   7.508   0.006 -15.500
   44   HD23  LEU   4          2HD2      LEU   4   6.848   1.262 -16.550
   45    H    LEU   5           H        LEU   5   7.608  -0.461 -12.574
   46    HA   LEU   5           HA       LEU   5   4.947  -0.587 -13.230
   47    HB2  LEU   5           2HB      LEU   5   5.266  -2.577 -11.258
   48    HB3  LEU   5           1HB      LEU   5   5.410  -2.767 -13.000
   49    HG   LEU   5           HG       LEU   5   7.728  -1.765 -11.333
   50   HD11  LEU   5          1HD1      LEU   5   7.237  -4.650 -12.123
   51   HD12  LEU   5          2HD1      LEU   5   6.862  -4.018 -10.519
   52   HD13  LEU   5          3HD1      LEU   5   8.527  -4.021 -11.099
   53   HD21  LEU   5          3HD2      LEU   5   7.416  -1.772 -14.008
   54   HD22  LEU   5          1HD2      LEU   5   7.977  -3.429 -13.802
   55   HD23  LEU   5          2HD2      LEU   5   8.978  -2.087 -13.251
   56    H    ALA   6           H        ALA   6   6.348  -0.200 -10.033
   57    HA   ALA   6           HA       ALA   6   4.023  -0.194  -8.489
   58    HB1  ALA   6           1HB      ALA   6   6.652   1.249  -8.141
   59    HB2  ALA   6           2HB      ALA   6   6.083  -0.197  -7.305
   60    HB3  ALA   6           3HB      ALA   6   5.356   1.370  -6.957
   61    H    LEU   7           H        LEU   7   5.627   2.409 -10.208
   62    HA   LEU   7           HA       LEU   7   4.033   4.563  -9.431
   63    HB2  LEU   7           2HB      LEU   7   6.171   4.354 -11.026
   64    HB3  LEU   7           1HB      LEU   7   4.929   4.405 -12.275
   65    HG   LEU   7           HG       LEU   7   5.233   6.448 -10.051
   66   HD11  LEU   7          1HD1      LEU   7   6.990   7.073 -11.380
   67   HD12  LEU   7          2HD1      LEU   7   5.706   7.806 -12.341
   68   HD13  LEU   7          3HD1      LEU   7   6.356   6.230 -12.795
   69   HD21  LEU   7          3HD2      LEU   7   3.673   7.733 -11.647
   70   HD22  LEU   7          1HD2      LEU   7   2.947   6.421 -10.728
   71   HD23  LEU   7          2HD2      LEU   7   3.368   6.179 -12.421
   72    H    ALA   8           H        ALA   8   3.807   2.717 -12.421
   73    HA   ALA   8           HA       ALA   8   1.315   3.587 -13.303
   74    HB1  ALA   8           1HB      ALA   8   3.146   1.773 -14.207
   75    HB2  ALA   8           2HB      ALA   8   1.529   1.960 -14.879
   76    HB3  ALA   8           3HB      ALA   8   1.843   0.708 -13.678
   77    H    LEU   9           H        LEU   9   2.120   0.733 -11.425
   78    HA   LEU   9           HA       LEU   9  -0.293  -0.399 -10.908
   79    HB2  LEU   9           2HB      LEU   9   1.914  -1.194 -10.036
   80    HB3  LEU   9           1HB      LEU   9   1.819   0.053  -8.794
   81    HG   LEU   9           HG       LEU   9  -0.307  -0.923  -7.979
   82   HD11  LEU   9          1HD1      LEU   9  -0.442  -3.452  -9.009
   83   HD12  LEU   9          2HD1      LEU   9   0.059  -2.540 -10.431
   84   HD13  LEU   9          3HD1      LEU   9  -1.423  -2.100  -9.578
   85   HD21  LEU   9          3HD2      LEU   9   2.211  -1.802  -7.465
   86   HD22  LEU   9          1HD2      LEU   9   1.497  -3.290  -8.084
   87   HD23  LEU   9          2HD2      LEU   9   0.784  -2.487  -6.686
   88    H    HIS  10           H        HIS  10   1.130   1.937  -8.646
   89    HA   HIS  10           HA       HIS  10  -1.373   3.369  -8.387
   90    HB2  HIS  10           2HB      HIS  10  -1.137   1.137  -6.787
   91    HB3  HIS  10           1HB      HIS  10  -0.560   2.425  -5.729
   92    HD1  HIS  10           1HD      HIS  10  -3.456   0.820  -5.777
   93    HD2  HIS  10           2HD      HIS  10  -2.675   4.788  -6.832
   94    HE1  HIS  10           1HE      HIS  10  -5.647   2.075  -5.539
   95    HE2  HIS  10           2HE      HIS  10  -5.188   4.494  -6.169
   96    H    HIS  11           H        HIS  11   1.142   4.214  -9.191
   97    HA   HIS  11           HA       HIS  11   2.746   5.805  -8.813
   98    HB2  HIS  11           2HB      HIS  11   1.070   7.048  -6.680
   99    HB3  HIS  11           1HB      HIS  11   1.957   7.802  -8.001
  100    HD1  HIS  11           1HD      HIS  11  -1.273   7.903  -7.218
  101    HD2  HIS  11           2HD      HIS  11   0.533   6.023 -10.479
  102    HE1  HIS  11           1HE      HIS  11  -3.056   7.665  -9.006
  103    HE2  HIS  11           2HE      HIS  11  -1.969   6.541 -10.995
  104    H    LEU  12           H        LEU  12   1.443   5.753  -5.552
  105    HA   LEU  12           HA       LEU  12   4.085   5.468  -4.406
  106    HB2  LEU  12           2HB      LEU  12   1.611   5.135  -2.758
  107    HB3  LEU  12           1HB      LEU  12   3.109   5.980  -2.376
  108    HG   LEU  12           HG       LEU  12   0.971   6.947  -4.305
  109   HD11  LEU  12          1HD1      LEU  12   0.348   7.132  -1.922
  110   HD12  LEU  12          2HD1      LEU  12   0.649   8.722  -2.624
  111   HD13  LEU  12          3HD1      LEU  12   1.865   7.969  -1.597
  112   HD21  LEU  12          3HD2      LEU  12   3.498   8.332  -3.346
  113   HD22  LEU  12          1HD2      LEU  12   2.326   8.960  -4.507
  114   HD23  LEU  12          2HD2      LEU  12   3.326   7.573  -4.928
  115    H    ALA  13           H        ALA  13   1.303   3.564  -5.138
  116    HA   ALA  13           HA       ALA  13   0.887   1.320  -5.140
  117    HB1  ALA  13           1HB      ALA  13   3.490   1.543  -5.953
  118    HB2  ALA  13           2HB      ALA  13   2.554   0.051  -5.947
  119    HB3  ALA  13           3HB      ALA  13   3.616   0.429  -4.593
  120    H    HIS  14           H        HIS  14   3.222   2.223  -2.678
  121    HA   HIS  14           HA       HIS  14   3.229   1.879  -0.406
  122    HB2  HIS  14           2HB      HIS  14   1.222   1.766   0.551
  123    HB3  HIS  14           1HB      HIS  14   0.504   1.519  -1.030
  124    HD1  HIS  14           1HD      HIS  14   0.562   0.040   2.186
  125    HD2  HIS  14           2HD      HIS  14   0.718  -1.506  -1.691
  126    HE1  HIS  14           1HE      HIS  14  -0.158  -2.392   2.343
  127    HE2  HIS  14           2HE      HIS  14  -0.054  -3.350  -0.009
  128    H    LEU  15           H        LEU  15   2.606  -0.632  -2.669
  129    HA   LEU  15           HA       LEU  15   3.803  -2.752  -1.085
  130    HB2  LEU  15           2HB      LEU  15   2.758  -2.441  -3.873
  131    HB3  LEU  15           1HB      LEU  15   3.913  -3.735  -3.556
  132    HG   LEU  15           HG       LEU  15   1.414  -3.320  -1.896
  133   HD11  LEU  15          1HD1      LEU  15   1.845  -5.250  -4.193
  134   HD12  LEU  15          2HD1      LEU  15   0.843  -3.800  -4.271
  135   HD13  LEU  15          3HD1      LEU  15   0.396  -5.127  -3.195
  136   HD21  LEU  15          3HD2      LEU  15   3.632  -5.319  -2.019
  137   HD22  LEU  15          1HD2      LEU  15   2.014  -5.919  -1.660
  138   HD23  LEU  15          2HD2      LEU  15   2.753  -4.704  -0.619
  139    H    ALA  16           H        ALA  16   4.768  -0.047  -2.675
  140    HA   ALA  16           HA       ALA  16   7.313  -1.032  -3.658
  141    HB1  ALA  16           1HB      ALA  16   6.142   1.748  -3.536
  142    HB2  ALA  16           2HB      ALA  16   6.203   0.692  -4.948
  143    HB3  ALA  16           3HB      ALA  16   7.694   1.347  -4.270
  144    H    LEU  17           H        LEU  17   6.153   1.141  -1.127
  145    HA   LEU  17           HA       LEU  17   8.379   2.164  -0.019
  146    HB2  LEU  17           2HB      LEU  17   7.258   2.362   2.011
  147    HB3  LEU  17           1HB      LEU  17   5.935   2.180   0.869
  148    HG   LEU  17           HG       LEU  17   6.169  -0.372   1.418
  149   HD11  LEU  17          1HD1      LEU  17   7.570  -0.953   3.079
  150   HD12  LEU  17          2HD1      LEU  17   6.817   0.213   4.163
  151   HD13  LEU  17          3HD1      LEU  17   8.154   0.708   3.128
  152   HD21  LEU  17          3HD2      LEU  17   4.547  -0.111   3.236
  153   HD22  LEU  17          1HD2      LEU  17   4.221   1.074   1.973
  154   HD23  LEU  17          2HD2      LEU  17   5.039   1.565   3.457
  155    H    HIS  18           H        HIS  18   7.258  -1.102   0.386
  156    HA   HIS  18           HA       HIS  18   9.301  -2.044   2.109
  157    HB2  HIS  18           2HB      HIS  18   8.048  -3.760  -0.021
  158    HB3  HIS  18           1HB      HIS  18   8.592  -4.219   1.584
  159    HD1  HIS  18           1HD      HIS  18   6.983  -3.821   3.552
  160    HD2  HIS  18           2HD      HIS  18   5.566  -2.354  -0.082
  161    HE1  HIS  18           1HE      HIS  18   4.556  -3.182   3.937
  162    HE2  HIS  18           2HE      HIS  18   3.678  -2.272   1.726
  163    H    LEU  19           H        LEU  19   8.910  -2.608  -1.334
  164    HA   LEU  19           HA       LEU  19  11.477  -3.615  -1.848
  165    HB2  LEU  19           2HB      LEU  19   9.918  -3.984  -3.548
  166    HB3  LEU  19           1HB      LEU  19   9.327  -2.326  -3.501
  167    HG   LEU  19           HG       LEU  19  12.188  -2.703  -4.261
  168   HD11  LEU  19          1HD1      LEU  19  11.646  -3.300  -6.555
  169   HD12  LEU  19          2HD1      LEU  19   9.923  -3.302  -6.184
  170   HD13  LEU  19          3HD1      LEU  19  10.978  -4.526  -5.480
  171   HD21  LEU  19          3HD2      LEU  19  11.540  -0.468  -4.406
  172   HD22  LEU  19          1HD2      LEU  19   9.893  -0.868  -4.896
  173   HD23  LEU  19          2HD2      LEU  19  11.216  -1.003  -6.052
  174    H    ALA  20           H        ALA  20  10.235  -0.414  -1.530
  175    HA   ALA  20           HA       ALA  20  12.387   1.014  -2.705
  176    HB1  ALA  20           1HB      ALA  20  10.056   1.902  -2.037
  177    HB2  ALA  20           2HB      ALA  20  11.440   2.963  -1.780
  178    HB3  ALA  20           3HB      ALA  20  10.739   2.085  -0.422
  179    H    LEU  21           H        LEU  21  11.599   0.593   0.711
  180    HA   LEU  21           HA       LEU  21  13.933   1.572   1.820
  181    HB2  LEU  21           2HB      LEU  21  11.806  -0.268   2.684
  182    HB3  LEU  21           1HB      LEU  21  13.342  -0.468   3.530
  183    HG   LEU  21           HG       LEU  21  13.369   1.975   3.999
  184   HD11  LEU  21          1HD1      LEU  21  10.661   2.664   3.630
  185   HD12  LEU  21          2HD1      LEU  21  11.155   1.913   2.119
  186   HD13  LEU  21          3HD1      LEU  21  12.044   3.301   2.738
  187   HD21  LEU  21          3HD2      LEU  21  12.518   0.568   5.736
  188   HD22  LEU  21          1HD2      LEU  21  10.988   0.335   4.893
  189   HD23  LEU  21          2HD2      LEU  21  11.374   1.905   5.598
  190    H    ALA  22           H        ALA  22  13.207  -1.776   1.010
  191    HA   ALA  22           HA       ALA  22  15.557  -3.005   1.755
  192    HB1  ALA  22           1HB      ALA  22  14.996  -4.442  -0.453
  193    HB2  ALA  22           2HB      ALA  22  13.470  -3.574  -0.276
  194    HB3  ALA  22           3HB      ALA  22  14.070  -4.582   1.042
  195    H    LEU  23           H        LEU  23  14.888  -1.325  -1.256
  196    HA   LEU  23           HA       LEU  23  17.587  -1.856  -2.239
  197    HB2  LEU  23           2HB      LEU  23  15.072  -0.759  -3.404
  198    HB3  LEU  23           1HB      LEU  23  16.602  -0.281  -4.140
  199    HG   LEU  23           HG       LEU  23  17.204  -2.716  -4.310
  200   HD11  LEU  23          1HD1      LEU  23  15.986  -4.237  -3.198
  201   HD12  LEU  23          2HD1      LEU  23  14.576  -3.817  -4.172
  202   HD13  LEU  23          3HD1      LEU  23  14.881  -2.978  -2.656
  203   HD21  LEU  23          3HD2      LEU  23  16.070  -1.356  -6.148
  204   HD22  LEU  23          1HD2      LEU  23  14.561  -2.127  -5.661
  205   HD23  LEU  23          2HD2      LEU  23  15.895  -3.109  -6.267
  206    H    LYS  24           H        LYS  24  15.590   0.906  -1.388
  207    HA   LYS  24           HA       LYS  24  17.489   2.901  -1.922
  208    HB2  LYS  24           2HB      LYS  24  15.099   3.375  -1.615
  209    HB3  LYS  24           1HB      LYS  24  15.235   2.950   0.091
  210    HG2  LYS  24           2HG      LYS  24  17.137   4.992  -0.965
  211    HG3  LYS  24           1HG      LYS  24  15.458   5.482  -0.770
  212    HD2  LYS  24           2HD      LYS  24  15.554   5.416   1.498
  213    HD3  LYS  24           1HD      LYS  24  16.537   3.958   1.518
  214    HE2  LYS  24           2HE      LYS  24  17.412   6.822   1.297
  215    HE3  LYS  24           1HE      LYS  24  17.994   5.564   2.380
  216    HZ1  LYS  24           1HZ      LYS  24  18.580   5.920  -0.500
  217    HZ2  LYS  24           2HZ      LYS  24  18.828   4.426   0.277
  218    HZ3  LYS  24           3HZ      LYS  24  19.666   5.806   0.794
  219    H    LYS  25           H        LYS  25  16.718   1.267   1.127
  220    HA   LYS  25           HA       LYS  25  18.439   2.670   2.790
  221    HB2  LYS  25           2HB      LYS  25  16.773   0.914   3.510
  222    HB3  LYS  25           1HB      LYS  25  17.945  -0.306   3.003
  223    HG2  LYS  25           2HG      LYS  25  18.934   1.870   4.798
  224    HG3  LYS  25           1HG      LYS  25  17.880   0.651   5.514
  225    HD2  LYS  25           2HD      LYS  25  19.362  -1.140   4.705
  226    HD3  LYS  25           1HD      LYS  25  20.413   0.056   3.949
  227    HE2  LYS  25           2HE      LYS  25  19.795   0.002   6.916
  228    HE3  LYS  25           1HE      LYS  25  21.217  -0.751   6.200
  229    HZ1  LYS  25           3HZ      LYS  25  20.524   2.122   5.919
  230    HZ2  LYS  25           1HZ      LYS  25  21.948   1.369   5.370
  231    HZ3  LYS  25           2HZ      LYS  25  21.632   1.503   7.039
  232    H    ALA  26           H        ALA  26  20.556   2.768   3.071
  233    HA   ALA  26           HA       ALA  26  22.311   0.621   2.240
  234    HB1  ALA  26           1HB      ALA  26  22.861   1.465   0.231
  235    HB2  ALA  26           2HB      ALA  26  23.516   2.883   1.043
  236    HB3  ALA  26           3HB      ALA  26  21.840   2.875   0.493
  Start of MODEL   10
    1    H1   LYS   1           1HT      LYS   1  16.640  -7.460 -11.998
    2    H2   LYS   1           2HT      LYS   1  15.950  -6.841 -10.575
    3    H3   LYS   1           3HT      LYS   1  16.856  -5.829 -11.589
    4    HA   LYS   1           HA       LYS   1  15.229  -5.848 -13.261
    5    HB2  LYS   1           2HB      LYS   1  13.042  -7.239 -12.425
    6    HB3  LYS   1           1HB      LYS   1  14.238  -7.879 -13.545
    7    HG2  LYS   1           2HG      LYS   1  14.213  -9.589 -12.005
    8    HG3  LYS   1           1HG      LYS   1  15.455  -8.592 -11.270
    9    HD2  LYS   1           2HD      LYS   1  13.959  -7.710  -9.655
   10    HD3  LYS   1           1HD      LYS   1  12.541  -8.227 -10.570
   11    HE2  LYS   1           2HE      LYS   1  14.521 -10.012  -9.119
   12    HE3  LYS   1           1HE      LYS   1  12.832  -9.738  -8.694
   13    HZ1  LYS   1           2HZ      LYS   1  12.349 -10.599 -11.035
   14    HZ2  LYS   1           3HZ      LYS   1  12.802 -11.731  -9.859
   15    HZ3  LYS   1           1HZ      LYS   1  13.930 -11.210 -11.009
   16    H    LYS   2           H        LYS   2  13.801  -4.194 -13.153
   17    HA   LYS   2           HA       LYS   2  13.035  -3.266 -10.457
   18    HB2  LYS   2           2HB      LYS   2  13.724  -1.871 -13.014
   19    HB3  LYS   2           1HB      LYS   2  12.617  -1.082 -11.890
   20    HG2  LYS   2           2HG      LYS   2  15.216  -2.236 -10.886
   21    HG3  LYS   2           1HG      LYS   2  15.202  -0.659 -11.677
   22    HD2  LYS   2           2HD      LYS   2  13.061  -0.486  -9.919
   23    HD3  LYS   2           1HD      LYS   2  14.249  -1.412  -9.005
   24    HE2  LYS   2           2HE      LYS   2  14.491   1.363 -10.146
   25    HE3  LYS   2           1HE      LYS   2  14.801   0.818  -8.500
   26    HZ1  LYS   2           3HZ      LYS   2  16.572   0.934 -10.720
   27    HZ2  LYS   2           1HZ      LYS   2  16.524  -0.633 -10.077
   28    HZ3  LYS   2           2HZ      LYS   2  16.918   0.680  -9.080
   29    H    ALA   3           H        ALA   3  11.847  -3.658 -13.793
   30    HA   ALA   3           HA       ALA   3   9.709  -3.766 -14.661
   31    HB1  ALA   3           1HB      ALA   3   8.893  -4.768 -11.921
   32    HB2  ALA   3           2HB      ALA   3   9.739  -5.784 -13.093
   33    HB3  ALA   3           3HB      ALA   3   8.144  -5.136 -13.475
   34    H    LEU   4           H        LEU   4  10.598  -1.339 -13.451
   35    HA   LEU   4           HA       LEU   4   8.824  -0.062 -11.745
   36    HB2  LEU   4           2HB      LEU   4  10.800   0.742 -13.771
   37    HB3  LEU   4           1HB      LEU   4   9.526   1.929 -13.500
   38    HG   LEU   4           HG       LEU   4  11.048   0.639 -11.233
   39   HD11  LEU   4          1HD1      LEU   4  12.666   1.779 -12.669
   40   HD12  LEU   4          2HD1      LEU   4  12.420   2.705 -11.190
   41   HD13  LEU   4          3HD1      LEU   4  11.659   3.230 -12.691
   42   HD21  LEU   4          3HD2      LEU   4  10.233   3.221 -10.570
   43   HD22  LEU   4          1HD2      LEU   4   9.454   1.721 -10.073
   44   HD23  LEU   4          2HD2      LEU   4   8.883   2.579 -11.505
   45    H    LEU   5           H        LEU   5   8.905   0.249 -15.226
   46    HA   LEU   5           HA       LEU   5   6.536   1.570 -15.671
   47    HB2  LEU   5           2HB      LEU   5   7.454  -0.697 -17.442
   48    HB3  LEU   5           1HB      LEU   5   6.556   0.741 -17.915
   49    HG   LEU   5           HG       LEU   5   8.686   1.348 -18.585
   50   HD11  LEU   5          1HD1      LEU   5   9.052   2.158 -15.707
   51   HD12  LEU   5          2HD1      LEU   5   7.765   2.862 -16.684
   52   HD13  LEU   5          3HD1      LEU   5   9.448   3.055 -17.172
   53   HD21  LEU   5          3HD2      LEU   5  10.296   0.530 -16.277
   54   HD22  LEU   5          1HD2      LEU   5  10.555   0.225 -17.994
   55   HD23  LEU   5          2HD2      LEU   5   9.491  -0.828 -17.063
   56    H    ALA   6           H        ALA   6   7.048  -1.882 -15.322
   57    HA   ALA   6           HA       ALA   6   4.356  -2.678 -15.692
   58    HB1  ALA   6           1HB      ALA   6   5.297  -4.712 -15.588
   59    HB2  ALA   6           2HB      ALA   6   5.679  -4.457 -13.883
   60    HB3  ALA   6           3HB      ALA   6   6.826  -3.963 -15.124
   61    H    LEU   7           H        LEU   7   6.288  -2.009 -12.829
   62    HA   LEU   7           HA       LEU   7   4.302  -2.507 -10.892
   63    HB2  LEU   7           2HB      LEU   7   6.645  -2.245 -10.265
   64    HB3  LEU   7           1HB      LEU   7   6.631  -0.576 -10.828
   65    HG   LEU   7           HG       LEU   7   4.572  -1.348  -8.804
   66   HD11  LEU   7          1HD1      LEU   7   6.399  -0.723  -7.054
   67   HD12  LEU   7          2HD1      LEU   7   7.536  -1.194  -8.318
   68   HD13  LEU   7          3HD1      LEU   7   6.374  -2.368  -7.696
   69   HD21  LEU   7          3HD2      LEU   7   6.171   1.066  -9.607
   70   HD22  LEU   7          1HD2      LEU   7   5.508   0.985  -7.971
   71   HD23  LEU   7          2HD2      LEU   7   4.432   0.912  -9.367
   72    H    ALA   8           H        ALA   8   5.441   0.567 -12.181
   73    HA   ALA   8           HA       ALA   8   3.607   2.334 -11.150
   74    HB1  ALA   8           1HB      ALA   8   4.473   2.389 -14.042
   75    HB2  ALA   8           2HB      ALA   8   5.544   2.841 -12.717
   76    HB3  ALA   8           3HB      ALA   8   4.071   3.762 -13.010
   77    H    LEU   9           H        LEU   9   3.345   0.487 -14.099
   78    HA   LEU   9           HA       LEU   9   0.758   1.229 -14.870
   79    HB2  LEU   9           2HB      LEU   9   2.231   0.015 -16.368
   80    HB3  LEU   9           1HB      LEU   9   2.236  -1.378 -15.291
   81    HG   LEU   9           HG       LEU   9  -0.386  -0.334 -16.311
   82   HD11  LEU   9          1HD1      LEU   9  -0.177  -1.782 -18.294
   83   HD12  LEU   9          2HD1      LEU   9   1.486  -2.154 -17.846
   84   HD13  LEU   9          3HD1      LEU   9   1.045  -0.512 -18.306
   85   HD21  LEU   9          3HD2      LEU   9  -0.912  -2.110 -14.984
   86   HD22  LEU   9          1HD2      LEU   9   0.710  -2.791 -15.079
   87   HD23  LEU   9          2HD2      LEU   9  -0.441  -3.065 -16.388
   88    H    HIS  10           H        HIS  10   1.796  -1.679 -13.169
   89    HA   HIS  10           HA       HIS  10  -0.687  -2.732 -12.501
   90    HB2  HIS  10           2HB      HIS  10   1.613  -3.776 -12.173
   91    HB3  HIS  10           1HB      HIS  10   1.720  -2.839 -10.682
   92    HD1  HIS  10           1HD      HIS  10  -0.421  -5.507 -12.328
   93    HD2  HIS  10           2HD      HIS  10   0.258  -3.900  -8.534
   94    HE1  HIS  10           1HE      HIS  10  -1.657  -6.988 -10.682
   95    HE2  HIS  10           2HE      HIS  10  -1.276  -6.009  -8.371
   96    H    HIS  11           H        HIS  11   1.337  -0.514 -10.661
   97    HA   HIS  11           HA       HIS  11  -0.758   1.041  -9.628
   98    HB2  HIS  11           2HB      HIS  11  -0.763   0.338  -7.262
   99    HB3  HIS  11           1HB      HIS  11  -1.369  -0.936  -8.315
  100    HD1  HIS  11           1HD      HIS  11  -0.353  -1.903  -5.696
  101    HD2  HIS  11           2HD      HIS  11   2.241  -1.305  -8.906
  102    HE1  HIS  11           1HE      HIS  11   1.681  -3.339  -5.248
  103    HE2  HIS  11           2HE      HIS  11   3.280  -2.978  -7.193
  104    H    LEU  12           H        LEU  12   1.037   0.870  -6.926
  105    HA   LEU  12           HA       LEU  12   3.531   1.936  -7.824
  106    HB2  LEU  12           2HB      LEU  12   1.343   3.763  -7.703
  107    HB3  LEU  12           1HB      LEU  12   2.462   4.156  -6.402
  108    HG   LEU  12           HG       LEU  12   3.541   3.593  -9.151
  109   HD11  LEU  12          1HD1      LEU  12   2.127   6.087  -8.217
  110   HD12  LEU  12          2HD1      LEU  12   1.991   5.251  -9.766
  111   HD13  LEU  12          3HD1      LEU  12   3.438   6.187  -9.392
  112   HD21  LEU  12          3HD2      LEU  12   4.964   3.892  -7.043
  113   HD22  LEU  12          1HD2      LEU  12   4.447   5.577  -7.050
  114   HD23  LEU  12          2HD2      LEU  12   5.374   4.934  -8.404
  115    H    ALA  13           H        ALA  13   1.558   2.975  -5.113
  116    HA   ALA  13           HA       ALA  13   3.666   2.481  -3.252
  117    HB1  ALA  13           1HB      ALA  13   1.977   4.281  -2.981
  118    HB2  ALA  13           2HB      ALA  13   2.101   3.239  -1.565
  119    HB3  ALA  13           3HB      ALA  13   0.752   3.048  -2.685
  120    H    HIS  14           H        HIS  14   2.642   1.458  -1.069
  121    HA   HIS  14           HA       HIS  14   2.073  -0.414   0.113
  122    HB2  HIS  14           2HB      HIS  14   0.878  -1.341  -2.510
  123    HB3  HIS  14           1HB      HIS  14   0.653  -2.101  -0.946
  124    HD1  HIS  14           1HD      HIS  14  -1.426  -0.409  -2.958
  125    HD2  HIS  14           2HD      HIS  14   0.004   0.636   0.824
  126    HE1  HIS  14           1HE      HIS  14  -3.060   1.284  -2.016
  127    HE2  HIS  14           2HE      HIS  14  -2.183   1.963   0.279
  128    H    LEU  15           H        LEU  15   3.179  -0.965  -3.114
  129    HA   LEU  15           HA       LEU  15   4.860  -3.205  -2.158
  130    HB2  LEU  15           2HB      LEU  15   3.462  -2.614  -4.665
  131    HB3  LEU  15           1HB      LEU  15   5.116  -3.179  -4.889
  132    HG   LEU  15           HG       LEU  15   3.003  -4.591  -3.221
  133   HD11  LEU  15          1HD1      LEU  15   3.780  -4.738  -6.067
  134   HD12  LEU  15          2HD1      LEU  15   2.296  -5.272  -5.281
  135   HD13  LEU  15          3HD1      LEU  15   3.730  -6.296  -5.245
  136   HD21  LEU  15          3HD2      LEU  15   5.918  -5.086  -3.789
  137   HD22  LEU  15          1HD2      LEU  15   4.838  -6.454  -3.514
  138   HD23  LEU  15          2HD2      LEU  15   5.040  -5.228  -2.264
  139    H    ALA  16           H        ALA  16   4.985  -0.005  -2.809
  140    HA   ALA  16           HA       ALA  16   7.678  -0.028  -3.946
  141    HB1  ALA  16           1HB      ALA  16   7.398   2.477  -3.913
  142    HB2  ALA  16           2HB      ALA  16   5.753   2.209  -3.336
  143    HB3  ALA  16           3HB      ALA  16   6.244   1.606  -4.917
  144    H    LEU  17           H        LEU  17   6.169   1.616  -1.213
  145    HA   LEU  17           HA       LEU  17   8.249   2.695   0.093
  146    HB2  LEU  17           2HB      LEU  17   6.992   1.845   2.251
  147    HB3  LEU  17           1HB      LEU  17   6.272   3.059   1.199
  148    HG   LEU  17           HG       LEU  17   5.682   0.334   0.303
  149   HD11  LEU  17          1HD1      LEU  17   4.094  -0.154   2.157
  150   HD12  LEU  17          2HD1      LEU  17   4.755   1.214   3.051
  151   HD13  LEU  17          3HD1      LEU  17   5.776  -0.177   2.693
  152   HD21  LEU  17          3HD2      LEU  17   3.334   1.338   0.501
  153   HD22  LEU  17          1HD2      LEU  17   4.442   2.175  -0.586
  154   HD23  LEU  17          2HD2      LEU  17   4.119   2.827   1.021
  155    H    HIS  18           H        HIS  18   7.068  -0.473   0.923
  156    HA   HIS  18           HA       HIS  18   9.142  -1.257   2.598
  157    HB2  HIS  18           2HB      HIS  18   8.234  -3.421   2.475
  158    HB3  HIS  18           1HB      HIS  18   6.894  -2.351   2.093
  159    HD1  HIS  18           1HD      HIS  18   8.672  -5.219   0.763
  160    HD2  HIS  18           2HD      HIS  18   6.542  -2.000  -0.821
  161    HE1  HIS  18           1HE      HIS  18   8.144  -5.824  -1.641
  162    HE2  HIS  18           2HE      HIS  18   6.839  -3.875  -2.622
  163    H    LEU  19           H        LEU  19   8.784  -1.766  -0.847
  164    HA   LEU  19           HA       LEU  19  11.244  -3.176  -1.172
  165    HB2  LEU  19           2HB      LEU  19   9.493  -3.462  -2.824
  166    HB3  LEU  19           1HB      LEU  19   9.455  -1.731  -3.147
  167    HG   LEU  19           HG       LEU  19  11.885  -1.916  -3.858
  168   HD11  LEU  19          1HD1      LEU  19  12.271  -4.098  -2.684
  169   HD12  LEU  19          2HD1      LEU  19  12.760  -4.116  -4.380
  170   HD13  LEU  19          3HD1      LEU  19  11.248  -4.879  -3.890
  171   HD21  LEU  19          3HD2      LEU  19  11.257  -2.337  -6.042
  172   HD22  LEU  19          1HD2      LEU  19   9.669  -2.093  -5.318
  173   HD23  LEU  19          2HD2      LEU  19  10.264  -3.728  -5.603
  174    H    ALA  20           H        ALA  20  10.210   0.109  -1.171
  175    HA   ALA  20           HA       ALA  20  12.408   1.344  -2.418
  176    HB1  ALA  20           1HB      ALA  20  10.187   2.410  -1.618
  177    HB2  ALA  20           2HB      ALA  20  11.657   3.374  -1.491
  178    HB3  ALA  20           3HB      ALA  20  11.000   2.579  -0.061
  179    H    LEU  21           H        LEU  21  11.800   0.816   1.024
  180    HA   LEU  21           HA       LEU  21  14.301   1.642   1.981
  181    HB2  LEU  21           2HB      LEU  21  12.398  -0.466   3.029
  182    HB3  LEU  21           1HB      LEU  21  13.803   0.118   3.923
  183    HG   LEU  21           HG       LEU  21  11.779   2.070   2.840
  184   HD11  LEU  21          1HD1      LEU  21  10.666   0.215   4.213
  185   HD12  LEU  21          2HD1      LEU  21  10.416   1.868   4.770
  186   HD13  LEU  21          3HD1      LEU  21  11.583   0.833   5.589
  187   HD21  LEU  21          3HD2      LEU  21  13.793   2.017   5.109
  188   HD22  LEU  21          1HD2      LEU  21  12.569   3.279   4.958
  189   HD23  LEU  21          2HD2      LEU  21  13.783   3.074   3.698
  190    H    ALA  22           H        ALA  22  13.122  -1.581   1.190
  191    HA   ALA  22           HA       ALA  22  15.472  -3.013   1.597
  192    HB1  ALA  22           1HB      ALA  22  13.479  -3.639  -0.576
  193    HB2  ALA  22           2HB      ALA  22  13.167  -3.959   1.130
  194    HB3  ALA  22           3HB      ALA  22  14.502  -4.770   0.312
  195    H    LEU  23           H        LEU  23  14.260  -1.559  -1.377
  196    HA   LEU  23           HA       LEU  23  16.504  -2.277  -2.961
  197    HB2  LEU  23           2HB      LEU  23  14.320  -1.702  -3.937
  198    HB3  LEU  23           1HB      LEU  23  14.507  -0.041  -3.377
  199    HG   LEU  23           HG       LEU  23  16.764  -1.145  -4.964
  200   HD11  LEU  23          1HD1      LEU  23  14.119  -0.407  -6.252
  201   HD12  LEU  23          2HD1      LEU  23  14.787  -2.037  -6.160
  202   HD13  LEU  23          3HD1      LEU  23  15.613  -0.795  -7.102
  203   HD21  LEU  23          3HD2      LEU  23  17.206   1.067  -4.880
  204   HD22  LEU  23          1HD2      LEU  23  15.608   1.422  -4.228
  205   HD23  LEU  23          2HD2      LEU  23  15.844   1.321  -5.972
  206    H    LYS  24           H        LYS  24  15.574   0.740  -1.370
  207    HA   LYS  24           HA       LYS  24  17.811   2.260  -2.118
  208    HB2  LYS  24           2HB      LYS  24  15.716   3.114  -0.962
  209    HB3  LYS  24           1HB      LYS  24  16.393   2.490   0.541
  210    HG2  LYS  24           2HG      LYS  24  18.520   3.852  -0.171
  211    HG3  LYS  24           1HG      LYS  24  17.388   4.729  -1.197
  212    HD2  LYS  24           2HD      LYS  24  16.757   5.949   0.581
  213    HD3  LYS  24           1HD      LYS  24  16.148   4.488   1.351
  214    HE2  LYS  24           2HE      LYS  24  17.835   5.700   2.744
  215    HE3  LYS  24           1HE      LYS  24  18.321   4.052   2.352
  216    HZ1  LYS  24           3HZ      LYS  24  20.075   5.774   2.054
  217    HZ2  LYS  24           1HZ      LYS  24  19.163   6.424   0.785
  218    HZ3  LYS  24           2HZ      LYS  24  19.773   4.846   0.666
  219    H    LYS  25           H        LYS  25  17.243   0.290   0.748
  220    HA   LYS  25           HA       LYS  25  19.829   0.675   1.878
  221    HB2  LYS  25           2HB      LYS  25  17.933  -0.080   3.230
  222    HB3  LYS  25           1HB      LYS  25  17.824  -1.564   2.286
  223    HG2  LYS  25           2HG      LYS  25  20.493  -0.968   3.455
  224    HG3  LYS  25           1HG      LYS  25  19.221  -1.390   4.603
  225    HD2  LYS  25           2HD      LYS  25  19.084  -3.545   3.865
  226    HD3  LYS  25           1HD      LYS  25  19.359  -3.098   2.183
  227    HE2  LYS  25           2HE      LYS  25  21.493  -3.190   4.328
  228    HE3  LYS  25           1HE      LYS  25  21.227  -4.431   3.107
  229    HZ1  LYS  25           3HZ      LYS  25  22.911  -2.399   2.787
  230    HZ2  LYS  25           1HZ      LYS  25  21.520  -1.721   2.101
  231    HZ3  LYS  25           2HZ      LYS  25  22.133  -3.183   1.490
  232    H    ALA  26           H        ALA  26  18.377  -2.022   0.076
  233    HA   ALA  26           HA       ALA  26  19.265  -3.604  -1.301
  234    HB1  ALA  26           1HB      ALA  26  21.843  -2.038  -1.308
  235    HB2  ALA  26           2HB      ALA  26  20.446  -1.566  -2.272
  236    HB3  ALA  26           3HB      ALA  26  21.221  -3.122  -2.553
  Start of MODEL   11
    1    H1   LYS   1           1HT      LYS   1  15.567 -10.837  -3.736
    2    H2   LYS   1           2HT      LYS   1  15.718  -9.703  -2.486
    3    H3   LYS   1           3HT      LYS   1  15.245  -9.201  -4.030
    4    HA   LYS   1           HA       LYS   1  13.319 -10.928  -3.603
    5    HB2  LYS   1           2HB      LYS   1  14.566 -10.353  -0.986
    6    HB3  LYS   1           1HB      LYS   1  12.823 -10.088  -1.030
    7    HG2  LYS   1           2HG      LYS   1  12.372 -12.301  -1.189
    8    HG3  LYS   1           1HG      LYS   1  13.644 -12.565  -2.378
    9    HD2  LYS   1           2HD      LYS   1  15.335 -12.502  -0.543
   10    HD3  LYS   1           1HD      LYS   1  14.021 -12.329   0.624
   11    HE2  LYS   1           2HE      LYS   1  14.668 -14.703  -1.131
   12    HE3  LYS   1           1HE      LYS   1  14.469 -14.654   0.619
   13    HZ1  LYS   1           2HZ      LYS   1  12.099 -13.938   0.107
   14    HZ2  LYS   1           3HZ      LYS   1  12.495 -15.562  -0.166
   15    HZ3  LYS   1           1HZ      LYS   1  12.390 -14.489  -1.474
   16    H    LYS   2           H        LYS   2  11.243  -9.760  -2.876
   17    HA   LYS   2           HA       LYS   2   9.826  -7.962  -3.048
   18    HB2  LYS   2           2HB      LYS   2  12.293  -6.285  -2.503
   19    HB3  LYS   2           1HB      LYS   2  10.615  -5.762  -2.366
   20    HG2  LYS   2           2HG      LYS   2  11.019  -8.201  -0.862
   21    HG3  LYS   2           1HG      LYS   2  12.175  -6.972  -0.351
   22    HD2  LYS   2           2HD      LYS   2  10.495  -5.482   0.317
   23    HD3  LYS   2           1HD      LYS   2   9.275  -6.240  -0.709
   24    HE2  LYS   2           2HE      LYS   2   9.230  -6.673   1.891
   25    HE3  LYS   2           1HE      LYS   2   8.930  -8.007   0.779
   26    HZ1  LYS   2           3HZ      LYS   2  11.634  -7.361   1.794
   27    HZ2  LYS   2           1HZ      LYS   2  11.116  -8.784   1.032
   28    HZ3  LYS   2           2HZ      LYS   2  10.587  -8.430   2.606
   29    H    ALA   3           H        ALA   3  12.962  -7.138  -4.566
   30    HA   ALA   3           HA       ALA   3  11.830  -5.574  -6.654
   31    HB1  ALA   3           1HB      ALA   3  14.131  -5.232  -6.158
   32    HB2  ALA   3           2HB      ALA   3  14.091  -5.978  -7.755
   33    HB3  ALA   3           3HB      ALA   3  14.503  -6.943  -6.340
   34    H    LEU   4           H        LEU   4  10.199  -7.675  -6.654
   35    HA   LEU   4           HA       LEU   4  10.662  -8.870  -9.282
   36    HB2  LEU   4           2HB      LEU   4  10.596 -10.394  -6.720
   37    HB3  LEU   4           1HB      LEU   4   9.686 -11.069  -8.073
   38    HG   LEU   4           HG       LEU   4  12.539 -10.144  -8.430
   39   HD11  LEU   4          1HD1      LEU   4  11.551 -12.845  -7.466
   40   HD12  LEU   4          2HD1      LEU   4  12.652 -11.759  -6.622
   41   HD13  LEU   4          3HD1      LEU   4  13.171 -12.562  -8.105
   42   HD21  LEU   4          3HD2      LEU   4  12.473 -11.581 -10.358
   43   HD22  LEU   4          1HD2      LEU   4  10.972 -10.652 -10.383
   44   HD23  LEU   4          2HD2      LEU   4  10.963 -12.323  -9.829
   45    H    LEU   5           H        LEU   5   8.415  -9.875  -6.793
   46    HA   LEU   5           HA       LEU   5   6.110  -9.751  -8.318
   47    HB2  LEU   5           2HB      LEU   5   5.308  -9.032  -5.703
   48    HB3  LEU   5           1HB      LEU   5   5.300 -10.642  -6.417
   49    HG   LEU   5           HG       LEU   5   7.795  -9.466  -5.170
   50   HD11  LEU   5          1HD1      LEU   5   5.915  -9.527  -3.509
   51   HD12  LEU   5          2HD1      LEU   5   7.242 -10.616  -3.107
   52   HD13  LEU   5          3HD1      LEU   5   5.759 -11.256  -3.816
   53   HD21  LEU   5          3HD2      LEU   5   7.240 -11.801  -6.651
   54   HD22  LEU   5          1HD2      LEU   5   7.378 -12.327  -4.976
   55   HD23  LEU   5          2HD2      LEU   5   8.707 -11.455  -5.739
   56    H    ALA   6           H        ALA   6   7.463  -7.306  -6.177
   57    HA   ALA   6           HA       ALA   6   5.537  -5.315  -6.556
   58    HB1  ALA   6           1HB      ALA   6   7.207  -3.745  -5.768
   59    HB2  ALA   6           2HB      ALA   6   8.503  -4.881  -6.132
   60    HB3  ALA   6           3HB      ALA   6   7.356  -5.235  -4.841
   61    H    LEU   7           H        LEU   7   8.376  -6.179  -8.424
   62    HA   LEU   7           HA       LEU   7   8.193  -3.987 -10.258
   63    HB2  LEU   7           2HB      LEU   7  10.328  -4.954 -10.201
   64    HB3  LEU   7           1HB      LEU   7   9.690  -6.596 -10.201
   65    HG   LEU   7           HG       LEU   7   8.901  -6.245 -12.552
   66   HD11  LEU   7          1HD1      LEU   7   9.623  -4.318 -13.796
   67   HD12  LEU   7          2HD1      LEU   7  10.574  -3.723 -12.437
   68   HD13  LEU   7          3HD1      LEU   7   8.811  -3.725 -12.353
   69   HD21  LEU   7          3HD2      LEU   7  11.827  -5.901 -11.873
   70   HD22  LEU   7          1HD2      LEU   7  11.270  -6.141 -13.529
   71   HD23  LEU   7          2HD2      LEU   7  10.980  -7.384 -12.314
   72    H    ALA   8           H        ALA   8   7.094  -7.299 -10.191
   73    HA   ALA   8           HA       ALA   8   5.974  -7.393 -12.798
   74    HB1  ALA   8           1HB      ALA   8   4.745  -9.358 -11.975
   75    HB2  ALA   8           2HB      ALA   8   5.218  -8.960 -10.325
   76    HB3  ALA   8           3HB      ALA   8   6.444  -9.423 -11.504
   77    H    LEU   9           H        LEU   9   4.349  -7.191  -9.674
   78    HA   LEU   9           HA       LEU   9   1.818  -6.483 -10.733
   79    HB2  LEU   9           2HB      LEU   9   1.650  -7.311  -8.573
   80    HB3  LEU   9           1HB      LEU   9   3.083  -6.452  -8.020
   81    HG   LEU   9           HG       LEU   9   1.782  -4.294  -8.232
   82   HD11  LEU   9          1HD1      LEU   9  -0.636  -4.421  -8.448
   83   HD12  LEU   9          2HD1      LEU   9  -0.578  -6.182  -8.496
   84   HD13  LEU   9          3HD1      LEU   9   0.080  -5.241  -9.836
   85   HD21  LEU   9          3HD2      LEU   9   0.906  -4.522  -6.091
   86   HD22  LEU   9          1HD2      LEU   9   1.985  -5.916  -6.147
   87   HD23  LEU   9          2HD2      LEU   9   0.256  -6.126  -6.415
   88    H    HIS  10           H        HIS  10   4.580  -4.666  -9.678
   89    HA   HIS  10           HA       HIS  10   5.148  -2.553 -10.677
   90    HB2  HIS  10           2HB      HIS  10   2.926  -2.436 -11.874
   91    HB3  HIS  10           1HB      HIS  10   2.238  -1.793 -10.381
   92    HD1  HIS  10           1HD      HIS  10   2.038   0.149 -12.537
   93    HD2  HIS  10           2HD      HIS  10   5.607  -0.230 -10.410
   94    HE1  HIS  10           1HE      HIS  10   3.304   2.325 -12.853
   95    HE2  HIS  10           2HE      HIS  10   5.480   2.112 -11.558
   96    H    HIS  11           H        HIS  11   6.294  -1.714  -9.117
   97    HA   HIS  11           HA       HIS  11   5.500  -1.595  -6.393
   98    HB2  HIS  11           2HB      HIS  11   7.576   0.198  -6.584
   99    HB3  HIS  11           1HB      HIS  11   7.768  -1.542  -6.378
  100    HD1  HIS  11           1HD      HIS  11   7.639   1.096  -9.103
  101    HD2  HIS  11           2HD      HIS  11   8.903  -2.849  -8.575
  102    HE1  HIS  11           1HE      HIS  11   8.858   0.436 -11.229
  103    HE2  HIS  11           2HE      HIS  11   9.632  -1.968 -10.922
  104    H    LEU  12           H        LEU  12   3.466  -0.455  -7.728
  105    HA   LEU  12           HA       LEU  12   3.710   2.459  -7.486
  106    HB2  LEU  12           2HB      LEU  12   2.635   1.443  -9.497
  107    HB3  LEU  12           1HB      LEU  12   1.394   0.763  -8.447
  108    HG   LEU  12           HG       LEU  12   1.421   3.429  -7.696
  109   HD11  LEU  12          1HD1      LEU  12   2.908   3.557  -9.901
  110   HD12  LEU  12          2HD1      LEU  12   1.716   4.802  -9.535
  111   HD13  LEU  12          3HD1      LEU  12   1.331   3.521 -10.683
  112   HD21  LEU  12          3HD2      LEU  12  -0.665   2.385  -7.954
  113   HD22  LEU  12          1HD2      LEU  12  -0.264   1.761  -9.555
  114   HD23  LEU  12          2HD2      LEU  12  -0.638   3.471  -9.342
  115    H    ALA  13           H        ALA  13   2.070  -0.316  -6.155
  116    HA   ALA  13           HA       ALA  13   0.508   1.260  -4.281
  117    HB1  ALA  13           1HB      ALA  13   0.828  -1.734  -4.202
  118    HB2  ALA  13           2HB      ALA  13  -0.211  -0.956  -5.396
  119    HB3  ALA  13           3HB      ALA  13  -0.542  -0.753  -3.677
  120    H    HIS  14           H        HIS  14   0.520  -0.035  -1.994
  121    HA   HIS  14           HA       HIS  14   2.523   0.951  -0.434
  122    HB2  HIS  14           2HB      HIS  14   0.866  -1.541  -0.128
  123    HB3  HIS  14           1HB      HIS  14   1.955  -0.968   1.126
  124    HD1  HIS  14           1HD      HIS  14  -0.481  -0.721   2.415
  125    HD2  HIS  14           2HD      HIS  14   0.364   2.049  -0.592
  126    HE1  HIS  14           1HE      HIS  14  -2.088   1.209   2.734
  127    HE2  HIS  14           2HE      HIS  14  -1.590   2.901   0.910
  128    H    LEU  15           H        LEU  15   2.574  -2.023  -2.230
  129    HA   LEU  15           HA       LEU  15   4.759  -3.333  -1.107
  130    HB2  LEU  15           2HB      LEU  15   3.461  -3.322  -3.780
  131    HB3  LEU  15           1HB      LEU  15   5.109  -3.949  -3.709
  132    HG   LEU  15           HG       LEU  15   3.095  -4.839  -1.664
  133   HD11  LEU  15          1HD1      LEU  15   3.282  -5.665  -4.549
  134   HD12  LEU  15          2HD1      LEU  15   1.845  -5.437  -3.555
  135   HD13  LEU  15          3HD1      LEU  15   2.854  -6.864  -3.332
  136   HD21  LEU  15          3HD2      LEU  15   5.616  -5.954  -2.920
  137   HD22  LEU  15          1HD2      LEU  15   4.548  -6.935  -1.921
  138   HD23  LEU  15          2HD2      LEU  15   5.347  -5.527  -1.232
  139    H    ALA  16           H        ALA  16   4.562  -0.400  -2.724
  140    HA   ALA  16           HA       ALA  16   7.100  -0.258  -3.918
  141    HB1  ALA  16           1HB      ALA  16   5.197   1.196  -4.490
  142    HB2  ALA  16           2HB      ALA  16   6.634   2.128  -4.071
  143    HB3  ALA  16           3HB      ALA  16   5.323   1.959  -2.906
  144    H    LEU  17           H        LEU  17   5.953   1.432  -1.029
  145    HA   LEU  17           HA       LEU  17   8.219   2.560  -0.106
  146    HB2  LEU  17           2HB      LEU  17   7.361   2.434   2.153
  147    HB3  LEU  17           1HB      LEU  17   6.035   2.735   1.036
  148    HG   LEU  17           HG       LEU  17   6.009   0.017   1.104
  149   HD11  LEU  17          1HD1      LEU  17   6.232   0.426   3.997
  150   HD12  LEU  17          2HD1      LEU  17   7.773   0.650   3.165
  151   HD13  LEU  17          3HD1      LEU  17   6.892  -0.866   3.000
  152   HD21  LEU  17          3HD2      LEU  17   4.089   0.255   2.595
  153   HD22  LEU  17          1HD2      LEU  17   4.116   1.599   1.449
  154   HD23  LEU  17          2HD2      LEU  17   4.658   1.843   3.111
  155    H    HIS  18           H        HIS  18   7.281  -0.760   0.474
  156    HA   HIS  18           HA       HIS  18   9.524  -1.529   2.021
  157    HB2  HIS  18           2HB      HIS  18   8.292  -3.382  -0.005
  158    HB3  HIS  18           1HB      HIS  18   9.010  -3.773   1.549
  159    HD1  HIS  18           1HD      HIS  18   7.479  -3.741   3.582
  160    HD2  HIS  18           2HD      HIS  18   5.725  -2.116   0.171
  161    HE1  HIS  18           1HE      HIS  18   5.048  -3.317   4.166
  162    HE2  HIS  18           2HE      HIS  18   3.943  -2.352   2.085
  163    H    LEU  19           H        LEU  19   8.902  -2.047  -1.388
  164    HA   LEU  19           HA       LEU  19  11.421  -2.956  -2.148
  165    HB2  LEU  19           2HB      LEU  19   9.681  -3.237  -3.704
  166    HB3  LEU  19           1HB      LEU  19   9.180  -1.553  -3.584
  167    HG   LEU  19           HG       LEU  19  11.963  -2.000  -4.537
  168   HD11  LEU  19          1HD1      LEU  19  10.821  -3.830  -5.697
  169   HD12  LEU  19          2HD1      LEU  19  11.195  -2.539  -6.838
  170   HD13  LEU  19          3HD1      LEU  19   9.552  -2.729  -6.225
  171   HD21  LEU  19          3HD2      LEU  19  11.218   0.236  -4.576
  172   HD22  LEU  19          1HD2      LEU  19   9.620  -0.210  -5.174
  173   HD23  LEU  19          2HD2      LEU  19  11.017  -0.288  -6.251
  174    H    ALA  20           H        ALA  20  10.202   0.213  -1.522
  175    HA   ALA  20           HA       ALA  20  12.329   1.677  -2.758
  176    HB1  ALA  20           1HB      ALA  20  11.315   3.578  -1.919
  177    HB2  ALA  20           2HB      ALA  20  10.844   2.788  -0.414
  178    HB3  ALA  20           3HB      ALA  20   9.952   2.461  -1.901
  179    H    LEU  21           H        LEU  21  11.587   1.174   0.660
  180    HA   LEU  21           HA       LEU  21  14.081   2.042   1.632
  181    HB2  LEU  21           2HB      LEU  21  11.880   0.340   2.754
  182    HB3  LEU  21           1HB      LEU  21  13.405   0.472   3.629
  183    HG   LEU  21           HG       LEU  21  13.047   3.071   3.188
  184   HD11  LEU  21          1HD1      LEU  21  11.080   2.964   1.835
  185   HD12  LEU  21          2HD1      LEU  21  10.565   3.559   3.413
  186   HD13  LEU  21          3HD1      LEU  21  10.276   1.877   2.972
  187   HD21  LEU  21          3HD2      LEU  21  11.367   2.837   5.317
  188   HD22  LEU  21          1HD2      LEU  21  13.116   2.660   5.425
  189   HD23  LEU  21          2HD2      LEU  21  12.091   1.228   5.297
  190    H    ALA  22           H        ALA  22  12.847  -1.180   0.948
  191    HA   ALA  22           HA       ALA  22  15.088  -2.677   1.677
  192    HB1  ALA  22           1HB      ALA  22  13.228  -3.324  -0.615
  193    HB2  ALA  22           2HB      ALA  22  12.831  -3.602   1.081
  194    HB3  ALA  22           3HB      ALA  22  14.181  -4.460   0.338
  195    H    LEU  23           H        LEU  23  14.365  -0.986  -1.318
  196    HA   LEU  23           HA       LEU  23  16.423  -2.045  -2.892
  197    HB2  LEU  23           2HB      LEU  23  14.687  -0.686  -3.900
  198    HB3  LEU  23           1HB      LEU  23  15.169   0.705  -2.936
  199    HG   LEU  23           HG       LEU  23  17.345   0.769  -4.067
  200   HD11  LEU  23          1HD1      LEU  23  17.673  -1.610  -4.497
  201   HD12  LEU  23          2HD1      LEU  23  17.738  -0.739  -6.025
  202   HD13  LEU  23          3HD1      LEU  23  16.285  -1.635  -5.586
  203   HD21  LEU  23          3HD2      LEU  23  15.667   2.079  -5.147
  204   HD22  LEU  23          1HD2      LEU  23  14.896   0.651  -5.837
  205   HD23  LEU  23          2HD2      LEU  23  16.467   1.181  -6.437
  206    H    LYS  24           H        LYS  24  16.382   0.813  -0.811
  207    HA   LYS  24           HA       LYS  24  19.126   1.468  -1.173
  208    HB2  LYS  24           2HB      LYS  24  17.115   2.118   0.985
  209    HB3  LYS  24           1HB      LYS  24  18.801   2.614   1.118
  210    HG2  LYS  24           2HG      LYS  24  18.075   4.473   0.013
  211    HG3  LYS  24           1HG      LYS  24  18.265   3.450  -1.411
  212    HD2  LYS  24           2HD      LYS  24  15.687   3.030  -0.087
  213    HD3  LYS  24           1HD      LYS  24  15.906   4.700  -0.605
  214    HE2  LYS  24           2HE      LYS  24  16.402   2.310  -2.396
  215    HE3  LYS  24           1HE      LYS  24  14.886   3.210  -2.361
  216    HZ1  LYS  24           3HZ      LYS  24  17.090   3.824  -3.857
  217    HZ2  LYS  24           1HZ      LYS  24  17.150   4.931  -2.576
  218    HZ3  LYS  24           2HZ      LYS  24  15.766   4.844  -3.550
  219    H    LYS  25           H        LYS  25  17.442   0.026   1.556
  220    HA   LYS  25           HA       LYS  25  19.334  -2.094   1.898
  221    HB2  LYS  25           2HB      LYS  25  19.595  -0.965   4.436
  222    HB3  LYS  25           1HB      LYS  25  20.846  -1.066   3.207
  223    HG2  LYS  25           2HG      LYS  25  20.792   1.222   3.823
  224    HG3  LYS  25           1HG      LYS  25  19.909   1.169   2.306
  225    HD2  LYS  25           2HD      LYS  25  17.774   1.185   3.490
  226    HD3  LYS  25           1HD      LYS  25  18.603   1.075   5.041
  227    HE2  LYS  25           2HE      LYS  25  18.352   3.412   3.182
  228    HE3  LYS  25           1HE      LYS  25  18.214   3.359   4.938
  229    HZ1  LYS  25           3HZ      LYS  25  20.584   3.056   5.107
  230    HZ2  LYS  25           1HZ      LYS  25  20.254   4.444   4.196
  231    HZ3  LYS  25           2HZ      LYS  25  20.744   3.019   3.414
  232    H    ALA  26           H        ALA  26  17.711  -0.345   4.471
  233    HA   ALA  26           HA       ALA  26  15.281  -1.795   4.442
  234    HB1  ALA  26           1HB      ALA  26  16.394  -3.736   5.175
  235    HB2  ALA  26           2HB      ALA  26  15.829  -3.006   6.678
  236    HB3  ALA  26           3HB      ALA  26  17.510  -2.821   6.189
  Start of MODEL   12
    1    H1   LYS   1           1HT      LYS   1  -1.991  20.957  -7.684
    2    H2   LYS   1           2HT      LYS   1  -1.775  19.331  -8.120
    3    H3   LYS   1           3HT      LYS   1  -2.332  19.732  -6.568
    4    HA   LYS   1           HA       LYS   1  -4.429  20.203  -7.259
    5    HB2  LYS   1           2HB      LYS   1  -4.875  20.715  -9.718
    6    HB3  LYS   1           1HB      LYS   1  -3.975  21.931  -8.822
    7    HG2  LYS   1           2HG      LYS   1  -2.186  21.705 -10.177
    8    HG3  LYS   1           1HG      LYS   1  -2.170  19.958  -9.954
    9    HD2  LYS   1           2HD      LYS   1  -4.215  19.993 -11.595
   10    HD3  LYS   1           1HD      LYS   1  -3.581  21.571 -12.052
   11    HE2  LYS   1           2HE      LYS   1  -2.352  18.864 -12.402
   12    HE3  LYS   1           1HE      LYS   1  -2.421  20.213 -13.532
   13    HZ1  LYS   1           2HZ      LYS   1  -0.774  20.174 -11.051
   14    HZ2  LYS   1           3HZ      LYS   1  -0.780  21.381 -12.250
   15    HZ3  LYS   1           1HZ      LYS   1  -0.187  19.833 -12.606
   16    H    LYS   2           H        LYS   2  -5.737  18.516  -7.419
   17    HA   LYS   2           HA       LYS   2  -6.446  16.362  -7.755
   18    HB2  LYS   2           2HB      LYS   2  -5.427  16.978 -10.538
   19    HB3  LYS   2           1HB      LYS   2  -6.540  15.676 -10.120
   20    HG2  LYS   2           2HG      LYS   2  -8.294  17.085 -10.110
   21    HG3  LYS   2           1HG      LYS   2  -7.466  18.191  -9.015
   22    HD2  LYS   2           2HD      LYS   2  -7.510  19.613 -10.800
   23    HD3  LYS   2           1HD      LYS   2  -6.109  18.686 -11.334
   24    HE2  LYS   2           2HE      LYS   2  -8.998  18.285 -12.165
   25    HE3  LYS   2           1HE      LYS   2  -7.644  18.767 -13.191
   26    HZ1  LYS   2           3HZ      LYS   2  -6.644  16.535 -12.391
   27    HZ2  LYS   2           1HZ      LYS   2  -7.804  16.527 -13.626
   28    HZ3  LYS   2           2HZ      LYS   2  -8.253  16.131 -12.039
   29    H    ALA   3           H        ALA   3  -4.212  15.765 -10.286
   30    HA   ALA   3           HA       ALA   3  -3.319  13.325  -9.434
   31    HB1  ALA   3           1HB      ALA   3  -1.915  15.349 -11.177
   32    HB2  ALA   3           2HB      ALA   3  -2.999  14.061 -11.700
   33    HB3  ALA   3           3HB      ALA   3  -1.421  13.666 -11.021
   34    H    LEU   4           H        LEU   4  -2.885  13.573  -7.143
   35    HA   LEU   4           HA       LEU   4  -0.053  13.939  -6.673
   36    HB2  LEU   4           2HB      LEU   4  -2.103  15.823  -5.646
   37    HB3  LEU   4           1HB      LEU   4  -0.919  15.250  -4.471
   38    HG   LEU   4           HG       LEU   4   0.440  15.896  -6.934
   39   HD11  LEU   4          1HD1      LEU   4  -1.521  17.933  -5.886
   40   HD12  LEU   4          2HD1      LEU   4  -1.194  17.468  -7.557
   41   HD13  LEU   4          3HD1      LEU   4  -0.020  18.435  -6.665
   42   HD21  LEU   4          3HD2      LEU   4   1.777  17.267  -5.470
   43   HD22  LEU   4          1HD2      LEU   4   1.331  15.818  -4.565
   44   HD23  LEU   4          2HD2      LEU   4   0.490  17.341  -4.268
   45    H    LEU   5           H        LEU   5  -2.518  14.082  -4.232
   46    HA   LEU   5           HA       LEU   5  -1.591  11.830  -2.815
   47    HB2  LEU   5           2HB      LEU   5  -4.117  13.442  -2.797
   48    HB3  LEU   5           1HB      LEU   5  -4.094  11.905  -1.933
   49    HG   LEU   5           HG       LEU   5  -2.125  12.655  -0.645
   50   HD11  LEU   5          1HD1      LEU   5  -2.511  15.222  -2.212
   51   HD12  LEU   5          2HD1      LEU   5  -1.129  14.129  -2.327
   52   HD13  LEU   5          3HD1      LEU   5  -1.426  15.029  -0.841
   53   HD21  LEU   5          3HD2      LEU   5  -4.205  13.122   0.401
   54   HD22  LEU   5          1HD2      LEU   5  -4.570  14.433  -0.718
   55   HD23  LEU   5          2HD2      LEU   5  -3.308  14.635   0.499
   56    H    ALA   6           H        ALA   6  -4.530  12.209  -4.691
   57    HA   ALA   6           HA       ALA   6  -5.304   9.537  -4.844
   58    HB1  ALA   6           1HB      ALA   6  -6.806  10.208  -6.527
   59    HB2  ALA   6           2HB      ALA   6  -5.724  11.478  -7.104
   60    HB3  ALA   6           3HB      ALA   6  -6.569  11.666  -5.568
   61    H    LEU   7           H        LEU   7  -2.901  11.314  -6.629
   62    HA   LEU   7           HA       LEU   7  -2.591   9.526  -8.805
   63    HB2  LEU   7           2HB      LEU   7  -1.594  11.713  -8.987
   64    HB3  LEU   7           1HB      LEU   7  -0.652  11.462  -7.525
   65    HG   LEU   7           HG       LEU   7   0.474   9.510  -8.701
   66   HD11  LEU   7          1HD1      LEU   7  -0.991  10.750 -11.040
   67   HD12  LEU   7          2HD1      LEU   7  -1.148   9.101 -10.436
   68   HD13  LEU   7          3HD1      LEU   7   0.352   9.622 -11.200
   69   HD21  LEU   7          3HD2      LEU   7   1.456  11.823  -8.463
   70   HD22  LEU   7          1HD2      LEU   7   0.815  12.195 -10.064
   71   HD23  LEU   7          2HD2      LEU   7   2.030  10.933  -9.874
   72    H    ALA   8           H        ALA   8  -0.672   9.926  -5.869
   73    HA   ALA   8           HA       ALA   8   0.938   7.660  -6.094
   74    HB1  ALA   8           1HB      ALA   8  -0.231   8.798  -3.548
   75    HB2  ALA   8           2HB      ALA   8   1.190   9.452  -4.369
   76    HB3  ALA   8           3HB      ALA   8   1.233   7.822  -3.687
   77    H    LEU   9           H        LEU   9  -2.091   8.089  -4.389
   78    HA   LEU   9           HA       LEU   9  -2.527   5.487  -3.523
   79    HB2  LEU   9           2HB      LEU   9  -3.874   7.525  -2.903
   80    HB3  LEU   9           1HB      LEU   9  -4.665   7.410  -4.468
   81    HG   LEU   9           HG       LEU   9  -5.734   6.305  -2.291
   82   HD11  LEU   9          1HD1      LEU   9  -5.645   4.972  -5.018
   83   HD12  LEU   9          2HD1      LEU   9  -6.757   6.240  -4.508
   84   HD13  LEU   9          3HD1      LEU   9  -6.846   4.642  -3.772
   85   HD21  LEU   9          3HD2      LEU   9  -3.598   4.920  -1.981
   86   HD22  LEU   9          1HD2      LEU   9  -4.137   3.974  -3.375
   87   HD23  LEU   9          2HD2      LEU   9  -5.124   4.045  -1.917
   88    H    HIS  10           H        HIS  10  -3.481   7.005  -6.566
   89    HA   HIS  10           HA       HIS  10  -4.957   5.035  -7.745
   90    HB2  HIS  10           2HB      HIS  10  -4.882   6.636  -9.314
   91    HB3  HIS  10           1HB      HIS  10  -3.372   7.277  -8.678
   92    HD1  HIS  10           1HD      HIS  10  -4.546   4.354 -10.852
   93    HD2  HIS  10           2HD      HIS  10  -1.210   6.810 -10.347
   94    HE1  HIS  10           1HE      HIS  10  -2.914   3.748 -12.697
   95    HE2  HIS  10           2HE      HIS  10  -0.879   5.234 -12.403
   96    H    HIS  11           H        HIS  11  -1.487   5.104  -7.342
   97    HA   HIS  11           HA       HIS  11  -0.923   2.839  -8.983
   98    HB2  HIS  11           2HB      HIS  11   0.676   4.026  -6.701
   99    HB3  HIS  11           1HB      HIS  11   1.277   2.830  -7.848
  100    HD1  HIS  11           1HD      HIS  11   0.351   3.870 -10.512
  101    HD2  HIS  11           2HD      HIS  11   1.785   6.400  -7.519
  102    HE1  HIS  11           1HE      HIS  11   1.122   5.996 -11.674
  103    HE2  HIS  11           2HE      HIS  11   2.057   7.528  -9.861
  104    H    LEU  12           H        LEU  12  -1.937   3.271  -5.706
  105    HA   LEU  12           HA       LEU  12  -2.682   1.795  -4.108
  106    HB2  LEU  12           2HB      LEU  12  -3.799   0.495  -5.816
  107    HB3  LEU  12           1HB      LEU  12  -2.280  -0.227  -6.328
  108    HG   LEU  12           HG       LEU  12  -2.044  -1.329  -4.136
  109   HD11  LEU  12          1HD1      LEU  12  -4.332  -1.247  -2.784
  110   HD12  LEU  12          2HD1      LEU  12  -4.466   0.332  -3.558
  111   HD13  LEU  12          3HD1      LEU  12  -3.080  -0.031  -2.528
  112   HD21  LEU  12          3HD2      LEU  12  -3.289  -3.055  -4.898
  113   HD22  LEU  12          1HD2      LEU  12  -3.845  -1.968  -6.169
  114   HD23  LEU  12          2HD2      LEU  12  -4.793  -2.157  -4.695
  115    H    ALA  13           H        ALA  13   0.141   1.110  -5.919
  116    HA   ALA  13           HA       ALA  13   1.931  -0.404  -5.250
  117    HB1  ALA  13           1HB      ALA  13   2.148   2.430  -4.255
  118    HB2  ALA  13           2HB      ALA  13   2.801   1.735  -5.738
  119    HB3  ALA  13           3HB      ALA  13   3.504   1.304  -4.178
  120    H    HIS  14           H        HIS  14   2.428   1.519  -2.488
  121    HA   HIS  14           HA       HIS  14   2.511   1.103  -0.234
  122    HB2  HIS  14           2HB      HIS  14   0.281  -0.592  -1.113
  123    HB3  HIS  14           1HB      HIS  14   1.134  -1.223   0.292
  124    HD1  HIS  14           1HD      HIS  14  -0.521  -0.578   2.108
  125    HD2  HIS  14           2HD      HIS  14   0.513   2.637  -0.343
  126    HE1  HIS  14           1HE      HIS  14  -1.510   1.497   3.183
  127    HE2  HIS  14           2HE      HIS  14  -0.884   3.466   1.703
  128    H    LEU  15           H        LEU  15   3.005  -1.406  -2.526
  129    HA   LEU  15           HA       LEU  15   4.686  -3.027  -0.808
  130    HB2  LEU  15           2HB      LEU  15   3.670  -4.318  -2.478
  131    HB3  LEU  15           1HB      LEU  15   3.859  -3.063  -3.701
  132    HG   LEU  15           HG       LEU  15   6.372  -3.461  -3.581
  133   HD11  LEU  15          1HD1      LEU  15   7.113  -5.582  -2.591
  134   HD12  LEU  15          2HD1      LEU  15   5.471  -5.916  -2.040
  135   HD13  LEU  15          3HD1      LEU  15   6.370  -4.559  -1.365
  136   HD21  LEU  15          3HD2      LEU  15   5.123  -4.377  -5.429
  137   HD22  LEU  15          1HD2      LEU  15   4.530  -5.714  -4.435
  138   HD23  LEU  15          2HD2      LEU  15   6.238  -5.621  -4.868
  139    H    ALA  16           H        ALA  16   4.885  -0.422  -3.032
  140    HA   ALA  16           HA       ALA  16   7.573  -0.441  -3.769
  141    HB1  ALA  16           1HB      ALA  16   5.767   1.930  -3.254
  142    HB2  ALA  16           2HB      ALA  16   5.970   1.087  -4.789
  143    HB3  ALA  16           3HB      ALA  16   7.311   1.996  -4.097
  144    H    LEU  17           H        LEU  17   6.054   1.392  -1.166
  145    HA   LEU  17           HA       LEU  17   8.055   2.625   0.108
  146    HB2  LEU  17           2HB      LEU  17   6.187   2.852   1.384
  147    HB3  LEU  17           1HB      LEU  17   5.638   1.213   1.056
  148    HG   LEU  17           HG       LEU  17   7.507   0.428   2.638
  149   HD11  LEU  17          1HD1      LEU  17   7.996   2.322   4.366
  150   HD12  LEU  17          2HD1      LEU  17   7.603   3.405   3.032
  151   HD13  LEU  17          3HD1      LEU  17   8.939   2.266   2.878
  152   HD21  LEU  17          3HD2      LEU  17   6.111   0.671   4.553
  153   HD22  LEU  17          1HD2      LEU  17   5.022   0.655   3.168
  154   HD23  LEU  17          2HD2      LEU  17   5.426   2.180   3.947
  155    H    HIS  18           H        HIS  18   7.341  -0.785   0.386
  156    HA   HIS  18           HA       HIS  18   9.654  -1.387   2.014
  157    HB2  HIS  18           2HB      HIS  18   8.210  -3.399   0.308
  158    HB3  HIS  18           1HB      HIS  18   9.037  -3.638   1.839
  159    HD1  HIS  18           1HD      HIS  18   7.645  -3.348   3.958
  160    HD2  HIS  18           2HD      HIS  18   5.764  -1.883   0.547
  161    HE1  HIS  18           1HE      HIS  18   5.277  -2.747   4.651
  162    HE2  HIS  18           2HE      HIS  18   4.113  -1.839   2.577
  163    H    LEU  19           H        LEU  19   8.791  -2.187  -1.297
  164    HA   LEU  19           HA       LEU  19  11.168  -3.323  -2.146
  165    HB2  LEU  19           2HB      LEU  19   9.472  -3.518  -3.705
  166    HB3  LEU  19           1HB      LEU  19   8.921  -1.864  -3.465
  167    HG   LEU  19           HG       LEU  19  11.074  -1.109  -4.614
  168   HD11  LEU  19          1HD1      LEU  19  12.580  -2.850  -4.689
  169   HD12  LEU  19          2HD1      LEU  19  11.777  -3.140  -6.230
  170   HD13  LEU  19          3HD1      LEU  19  11.317  -4.075  -4.809
  171   HD21  LEU  19          3HD2      LEU  19   8.646  -1.652  -5.627
  172   HD22  LEU  19          1HD2      LEU  19   9.598  -2.812  -6.554
  173   HD23  LEU  19          2HD2      LEU  19   9.982  -1.093  -6.631
  174    H    ALA  20           H        ALA  20  10.281  -0.017  -1.670
  175    HA   ALA  20           HA       ALA  20  12.581   1.127  -2.969
  176    HB1  ALA  20           1HB      ALA  20  11.552   3.103  -2.588
  177    HB2  ALA  20           2HB      ALA  20  11.311   2.746  -0.878
  178    HB3  ALA  20           3HB      ALA  20  10.178   2.125  -2.079
  179    H    LEU  21           H        LEU  21  11.586   0.867   0.412
  180    HA   LEU  21           HA       LEU  21  13.999   1.689   1.568
  181    HB2  LEU  21           2HB      LEU  21  11.799   1.362   2.764
  182    HB3  LEU  21           1HB      LEU  21  12.098  -0.376   2.699
  183    HG   LEU  21           HG       LEU  21  14.324   0.078   3.847
  184   HD11  LEU  21          1HD1      LEU  21  14.916   2.264   3.864
  185   HD12  LEU  21          2HD1      LEU  21  13.817   2.399   5.235
  186   HD13  LEU  21          3HD1      LEU  21  13.258   2.814   3.613
  187   HD21  LEU  21          3HD2      LEU  21  11.685   0.683   5.195
  188   HD22  LEU  21          1HD2      LEU  21  13.192   0.521   6.093
  189   HD23  LEU  21          2HD2      LEU  21  12.566  -0.845   5.172
  190    H    ALA  22           H        ALA  22  12.811  -1.501   0.696
  191    HA   ALA  22           HA       ALA  22  14.958  -3.063   1.573
  192    HB1  ALA  22           1HB      ALA  22  12.809  -3.988   0.763
  193    HB2  ALA  22           2HB      ALA  22  14.193  -4.739  -0.033
  194    HB3  ALA  22           3HB      ALA  22  13.242  -3.517  -0.880
  195    H    LEU  23           H        LEU  23  14.540  -1.144  -1.302
  196    HA   LEU  23           HA       LEU  23  16.974  -2.095  -2.556
  197    HB2  LEU  23           2HB      LEU  23  14.837  -0.117  -3.187
  198    HB3  LEU  23           1HB      LEU  23  16.419   0.142  -3.921
  199    HG   LEU  23           HG       LEU  23  15.026  -2.535  -4.019
  200   HD11  LEU  23          1HD1      LEU  23  14.157  -1.927  -6.202
  201   HD12  LEU  23          2HD1      LEU  23  14.945  -0.350  -6.120
  202   HD13  LEU  23          3HD1      LEU  23  13.606  -0.731  -5.032
  203   HD21  LEU  23          3HD2      LEU  23  16.539  -2.381  -6.234
  204   HD22  LEU  23          1HD2      LEU  23  17.202  -2.924  -4.690
  205   HD23  LEU  23          2HD2      LEU  23  17.445  -1.259  -5.220
  206    H    LYS  24           H        LYS  24  15.829   0.912  -1.162
  207    HA   LYS  24           HA       LYS  24  18.236   2.340  -1.277
  208    HB2  LYS  24           2HB      LYS  24  16.135   3.473  -0.927
  209    HB3  LYS  24           1HB      LYS  24  15.893   2.636   0.604
  210    HG2  LYS  24           2HG      LYS  24  18.445   4.154   0.290
  211    HG3  LYS  24           1HG      LYS  24  16.971   5.106   0.464
  212    HD2  LYS  24           2HD      LYS  24  16.586   4.386   2.623
  213    HD3  LYS  24           1HD      LYS  24  17.342   2.820   2.356
  214    HE2  LYS  24           2HE      LYS  24  18.787   5.468   2.667
  215    HE3  LYS  24           1HE      LYS  24  18.724   4.173   3.861
  216    HZ1  LYS  24           3HZ      LYS  24  19.601   2.956   1.561
  217    HZ2  LYS  24           1HZ      LYS  24  20.552   3.388   2.893
  218    HZ3  LYS  24           2HZ      LYS  24  20.411   4.442   1.572
  219    H    LYS  25           H        LYS  25  16.872   0.480   1.419
  220    HA   LYS  25           HA       LYS  25  18.332   0.953   3.538
  221    HB2  LYS  25           2HB      LYS  25  18.640  -1.508   3.993
  222    HB3  LYS  25           1HB      LYS  25  16.999  -1.002   3.620
  223    HG2  LYS  25           2HG      LYS  25  16.928  -2.456   1.916
  224    HG3  LYS  25           1HG      LYS  25  18.311  -1.669   1.156
  225    HD2  LYS  25           2HD      LYS  25  19.855  -3.041   2.492
  226    HD3  LYS  25           1HD      LYS  25  18.497  -3.757   3.355
  227    HE2  LYS  25           2HE      LYS  25  19.407  -5.209   1.509
  228    HE3  LYS  25           1HE      LYS  25  17.694  -4.831   1.347
  229    HZ1  LYS  25           3HZ      LYS  25  19.815  -3.233   0.014
  230    HZ2  LYS  25           1HZ      LYS  25  18.133  -3.228  -0.290
  231    HZ3  LYS  25           2HZ      LYS  25  19.073  -4.579  -0.718
  232    H    ALA  26           H        ALA  26  19.864  -1.559   1.558
  233    HA   ALA  26           HA       ALA  26  22.354  -0.124   1.361
  234    HB1  ALA  26           1HB      ALA  26  23.630  -1.277   2.886
  235    HB2  ALA  26           2HB      ALA  26  22.625  -2.724   2.793
  236    HB3  ALA  26           3HB      ALA  26  22.085  -1.338   3.740
  Start of MODEL   13
    1    H1   LYS   1           1HT      LYS   1  -1.586  17.904 -22.419
    2    H2   LYS   1           2HT      LYS   1  -2.488  17.231 -23.683
    3    H3   LYS   1           3HT      LYS   1  -0.816  17.443 -23.852
    4    HA   LYS   1           HA       LYS   1  -2.225  15.242 -22.778
    5    HB2  LYS   1           2HB      LYS   1   0.513  15.968 -23.697
    6    HB3  LYS   1           1HB      LYS   1   0.411  14.612 -22.582
    7    HG2  LYS   1           2HG      LYS   1  -1.619  14.517 -24.708
    8    HG3  LYS   1           1HG      LYS   1   0.034  14.457 -25.314
    9    HD2  LYS   1           2HD      LYS   1  -0.717  12.733 -22.972
   10    HD3  LYS   1           1HD      LYS   1  -1.201  12.228 -24.590
   11    HE2  LYS   1           2HE      LYS   1   1.647  12.962 -23.849
   12    HE3  LYS   1           1HE      LYS   1   1.033  11.313 -23.849
   13    HZ1  LYS   1           2HZ      LYS   1   0.576  11.447 -26.156
   14    HZ2  LYS   1           3HZ      LYS   1   2.164  12.006 -25.933
   15    HZ3  LYS   1           1HZ      LYS   1   0.908  13.109 -26.205
   16    H    LYS   2           H        LYS   2  -1.602  14.080 -20.840
   17    HA   LYS   2           HA       LYS   2  -0.505  15.762 -18.667
   18    HB2  LYS   2           2HB      LYS   2  -3.010  14.056 -18.594
   19    HB3  LYS   2           1HB      LYS   2  -2.209  14.686 -17.155
   20    HG2  LYS   2           2HG      LYS   2  -2.652  16.945 -17.770
   21    HG3  LYS   2           1HG      LYS   2  -3.076  16.489 -19.417
   22    HD2  LYS   2           2HD      LYS   2  -5.228  16.241 -18.825
   23    HD3  LYS   2           1HD      LYS   2  -4.768  15.022 -17.639
   24    HE2  LYS   2           2HE      LYS   2  -5.028  18.007 -17.243
   25    HE3  LYS   2           1HE      LYS   2  -5.867  16.718 -16.381
   26    HZ1  LYS   2           3HZ      LYS   2  -3.147  17.727 -16.035
   27    HZ2  LYS   2           1HZ      LYS   2  -3.384  16.063 -15.808
   28    HZ3  LYS   2           2HZ      LYS   2  -4.253  17.176 -14.875
   29    H    ALA   3           H        ALA   3   0.828  14.665 -17.273
   30    HA   ALA   3           HA       ALA   3   1.857  12.123 -18.120
   31    HB1  ALA   3           1HB      ALA   3   3.512  13.403 -17.097
   32    HB2  ALA   3           2HB      ALA   3   3.037  12.337 -15.774
   33    HB3  ALA   3           3HB      ALA   3   2.425  13.990 -15.839
   34    H    LEU   4           H        LEU   4  -0.696  11.587 -17.879
   35    HA   LEU   4           HA       LEU   4  -1.694  10.821 -15.359
   36    HB2  LEU   4           2HB      LEU   4  -2.357  10.254 -18.204
   37    HB3  LEU   4           1HB      LEU   4  -3.001   9.139 -16.998
   38    HG   LEU   4           HG       LEU   4  -3.256  12.127 -16.663
   39   HD11  LEU   4          1HD1      LEU   4  -5.440  12.036 -17.716
   40   HD12  LEU   4          2HD1      LEU   4  -5.264  10.313 -18.032
   41   HD13  LEU   4          3HD1      LEU   4  -4.233  11.474 -18.867
   42   HD21  LEU   4          3HD2      LEU   4  -4.653   9.676 -15.575
   43   HD22  LEU   4          1HD2      LEU   4  -5.299  11.305 -15.375
   44   HD23  LEU   4          2HD2      LEU   4  -3.731  10.886 -14.681
   45    H    LEU   5           H        LEU   5  -0.671   8.715 -17.961
   46    HA   LEU   5           HA       LEU   5  -0.455   6.311 -16.669
   47    HB2  LEU   5           2HB      LEU   5   0.767   7.515 -19.031
   48    HB3  LEU   5           1HB      LEU   5   1.845   6.362 -18.249
   49    HG   LEU   5           HG       LEU   5   0.316   5.338 -19.967
   50   HD11  LEU   5          1HD1      LEU   5   1.303   4.251 -17.800
   51   HD12  LEU   5          2HD1      LEU   5   0.072   3.387 -18.715
   52   HD13  LEU   5          3HD1      LEU   5  -0.374   4.259 -17.252
   53   HD21  LEU   5          3HD2      LEU   5  -1.940   5.389 -18.048
   54   HD22  LEU   5          1HD2      LEU   5  -1.959   5.504 -19.803
   55   HD23  LEU   5          2HD2      LEU   5  -1.599   6.931 -18.835
   56    H    ALA   6           H        ALA   6   2.037   8.717 -17.016
   57    HA   ALA   6           HA       ALA   6   4.026   7.592 -15.416
   58    HB1  ALA   6           1HB      ALA   6   5.108   9.472 -15.985
   59    HB2  ALA   6           2HB      ALA   6   3.975  10.448 -15.050
   60    HB3  ALA   6           3HB      ALA   6   3.621  10.053 -16.733
   61    H    LEU   7           H        LEU   7   1.505   9.903 -14.532
   62    HA   LEU   7           HA       LEU   7   2.057  10.095 -11.793
   63    HB2  LEU   7           2HB      LEU   7   0.539  11.689 -12.639
   64    HB3  LEU   7           1HB      LEU   7  -0.439  10.461 -13.433
   65    HG   LEU   7           HG       LEU   7  -1.009   9.585 -11.099
   66   HD11  LEU   7          1HD1      LEU   7   0.598  12.030 -10.449
   67   HD12  LEU   7          2HD1      LEU   7   0.520  10.486  -9.602
   68   HD13  LEU   7          3HD1      LEU   7  -0.792  11.651  -9.434
   69   HD21  LEU   7          3HD2      LEU   7  -2.229  11.453 -12.655
   70   HD22  LEU   7          1HD2      LEU   7  -1.975  12.391 -11.178
   71   HD23  LEU   7          2HD2      LEU   7  -2.892  10.881 -11.119
   72    H    ALA   8           H        ALA   8  -0.228   8.022 -13.506
   73    HA   ALA   8           HA       ALA   8  -1.264   6.570 -11.387
   74    HB1  ALA   8           1HB      ALA   8  -2.302   5.561 -13.103
   75    HB2  ALA   8           2HB      ALA   8  -0.792   4.755 -13.533
   76    HB3  ALA   8           3HB      ALA   8  -1.182   6.326 -14.232
   77    H    LEU   9           H        LEU   9   1.452   5.715 -13.437
   78    HA   LEU   9           HA       LEU   9   2.347   3.488 -11.955
   79    HB2  LEU   9           2HB      LEU   9   3.377   5.182 -14.120
   80    HB3  LEU   9           1HB      LEU   9   4.637   4.509 -13.088
   81    HG   LEU   9           HG       LEU   9   3.298   2.266 -13.372
   82   HD11  LEU   9          1HD1      LEU   9   1.683   3.966 -14.866
   83   HD12  LEU   9          2HD1      LEU   9   1.675   2.205 -14.939
   84   HD13  LEU   9          3HD1      LEU   9   2.643   3.126 -16.088
   85   HD21  LEU   9          3HD2      LEU   9   4.559   1.901 -15.564
   86   HD22  LEU   9          1HD2      LEU   9   5.529   2.468 -14.209
   87   HD23  LEU   9          2HD2      LEU   9   5.028   3.598 -15.466
   88    H    HIS  10           H        HIS  10   3.764   6.683 -12.170
   89    HA   HIS  10           HA       HIS  10   5.727   6.755 -10.380
   90    HB2  HIS  10           2HB      HIS  10   5.154   8.787 -11.443
   91    HB3  HIS  10           1HB      HIS  10   3.534   8.785 -10.751
   92    HD1  HIS  10           1HD      HIS  10   7.154   8.962  -9.579
   93    HD2  HIS  10           2HD      HIS  10   3.350  10.229  -8.426
   94    HE1  HIS  10           1HE      HIS  10   7.480  10.440  -7.546
   95    HE2  HIS  10           2HE      HIS  10   5.164  11.215  -6.818
   96    H    HIS  11           H        HIS  11   2.327   6.786  -9.422
   97    HA   HIS  11           HA       HIS  11   2.648   7.238  -6.694
   98    HB2  HIS  11           2HB      HIS  11   0.594   5.753  -8.297
   99    HB3  HIS  11           1HB      HIS  11   0.533   5.694  -6.536
  100    HD1  HIS  11           1HD      HIS  11   0.926   8.327  -5.487
  101    HD2  HIS  11           2HD      HIS  11  -0.876   7.869  -9.220
  102    HE1  HIS  11           1HE      HIS  11  -0.352  10.468  -5.935
  103    HE2  HIS  11           2HE      HIS  11  -1.463  10.202  -8.210
  104    H    LEU  12           H        LEU  12   4.012   6.218  -5.379
  105    HA   LEU  12           HA       LEU  12   5.209   3.746  -5.763
  106    HB2  LEU  12           2HB      LEU  12   4.551   5.037  -3.107
  107    HB3  LEU  12           1HB      LEU  12   5.764   3.790  -3.379
  108    HG   LEU  12           HG       LEU  12   6.026   6.161  -5.129
  109   HD11  LEU  12          1HD1      LEU  12   5.326   7.247  -3.030
  110   HD12  LEU  12          2HD1      LEU  12   7.037   7.545  -3.338
  111   HD13  LEU  12          3HD1      LEU  12   6.548   6.342  -2.145
  112   HD21  LEU  12          3HD2      LEU  12   8.413   5.864  -4.457
  113   HD22  LEU  12          1HD2      LEU  12   7.700   4.382  -5.100
  114   HD23  LEU  12          2HD2      LEU  12   7.913   4.576  -3.358
  115    H    ALA  13           H        ALA  13   2.340   4.540  -3.916
  116    HA   ALA  13           HA       ALA  13   0.424   3.295  -3.546
  117    HB1  ALA  13           1HB      ALA  13   1.009   1.945  -5.596
  118    HB2  ALA  13           2HB      ALA  13   0.152   1.056  -4.335
  119    HB3  ALA  13           3HB      ALA  13   1.890   0.848  -4.538
  120    H    HIS  14           H        HIS  14   2.163   0.367  -2.933
  121    HA   HIS  14           HA       HIS  14   2.538   1.104  -0.106
  122    HB2  HIS  14           2HB      HIS  14   0.852  -1.177  -1.131
  123    HB3  HIS  14           1HB      HIS  14   1.466  -1.113   0.521
  124    HD1  HIS  14           1HD      HIS  14   0.649   0.950   2.000
  125    HD2  HIS  14           2HD      HIS  14  -1.383   0.432  -1.607
  126    HE1  HIS  14           1HE      HIS  14  -1.472   2.321   2.165
  127    HE2  HIS  14           2HE      HIS  14  -2.723   2.015  -0.022
  128    H    LEU  15           H        LEU  15   2.681  -1.855  -2.039
  129    HA   LEU  15           HA       LEU  15   4.777  -3.081  -0.710
  130    HB2  LEU  15           2HB      LEU  15   4.104  -3.234  -3.662
  131    HB3  LEU  15           1HB      LEU  15   5.156  -4.360  -2.803
  132    HG   LEU  15           HG       LEU  15   2.279  -3.828  -2.009
  133   HD11  LEU  15          1HD1      LEU  15   1.999  -6.191  -3.011
  134   HD12  LEU  15          2HD1      LEU  15   3.504  -5.864  -3.868
  135   HD13  LEU  15          3HD1      LEU  15   2.096  -4.836  -4.134
  136   HD21  LEU  15          3HD2      LEU  15   3.393  -4.752  -0.155
  137   HD22  LEU  15          1HD2      LEU  15   4.439  -5.750  -1.162
  138   HD23  LEU  15          2HD2      LEU  15   2.737  -6.175  -0.968
  139    H    ALA  16           H        ALA  16   4.732  -0.587  -3.064
  140    HA   ALA  16           HA       ALA  16   7.331  -0.586  -3.972
  141    HB1  ALA  16           1HB      ALA  16   6.955   1.885  -4.278
  142    HB2  ALA  16           2HB      ALA  16   5.415   1.667  -3.444
  143    HB3  ALA  16           3HB      ALA  16   5.714   0.845  -4.977
  144    H    LEU  17           H        LEU  17   5.984   1.233  -1.282
  145    HA   LEU  17           HA       LEU  17   8.114   2.565  -0.268
  146    HB2  LEU  17           2HB      LEU  17   6.065   2.834   0.870
  147    HB3  LEU  17           1HB      LEU  17   5.876   1.100   1.111
  148    HG   LEU  17           HG       LEU  17   7.982   1.219   2.580
  149   HD11  LEU  17          1HD1      LEU  17   7.274   4.167   2.572
  150   HD12  LEU  17          2HD1      LEU  17   8.660   3.489   1.717
  151   HD13  LEU  17          3HD1      LEU  17   8.571   3.392   3.476
  152   HD21  LEU  17          3HD2      LEU  17   5.899   0.913   3.674
  153   HD22  LEU  17          1HD2      LEU  17   5.364   2.550   3.284
  154   HD23  LEU  17          2HD2      LEU  17   6.632   2.297   4.483
  155    H    HIS  18           H        HIS  18   7.243  -0.736   0.516
  156    HA   HIS  18           HA       HIS  18   9.509  -1.338   2.094
  157    HB2  HIS  18           2HB      HIS  18   7.991  -3.288   0.364
  158    HB3  HIS  18           1HB      HIS  18   8.902  -3.631   1.827
  159    HD1  HIS  18           1HD      HIS  18   7.561  -3.600   3.975
  160    HD2  HIS  18           2HD      HIS  18   5.712  -1.477   0.903
  161    HE1  HIS  18           1HE      HIS  18   5.334  -2.795   4.900
  162    HE2  HIS  18           2HE      HIS  18   4.190  -1.488   3.037
  163    H    LEU  19           H        LEU  19   8.729  -2.012  -1.230
  164    HA   LEU  19           HA       LEU  19  11.069  -3.256  -2.057
  165    HB2  LEU  19           2HB      LEU  19   9.508  -3.386  -3.719
  166    HB3  LEU  19           1HB      LEU  19   8.791  -1.835  -3.287
  167    HG   LEU  19           HG       LEU  19  10.814  -0.729  -4.368
  168   HD11  LEU  19          1HD1      LEU  19  12.126  -2.969  -4.249
  169   HD12  LEU  19          2HD1      LEU  19  12.292  -2.003  -5.716
  170   HD13  LEU  19          3HD1      LEU  19  11.227  -3.412  -5.696
  171   HD21  LEU  19          3HD2      LEU  19   9.997  -1.249  -6.720
  172   HD22  LEU  19          1HD2      LEU  19   8.725  -0.782  -5.587
  173   HD23  LEU  19          2HD2      LEU  19   8.953  -2.482  -6.009
  174    H    ALA  20           H        ALA  20  10.249   0.068  -1.583
  175    HA   ALA  20           HA       ALA  20  12.614   1.184  -2.786
  176    HB1  ALA  20           1HB      ALA  20  11.760   3.135  -1.098
  177    HB2  ALA  20           2HB      ALA  20  10.279   2.197  -1.288
  178    HB3  ALA  20           3HB      ALA  20  11.085   2.865  -2.706
  179    H    LEU  21           H        LEU  21  11.537   0.591   0.506
  180    HA   LEU  21           HA       LEU  21  13.798   1.486   1.871
  181    HB2  LEU  21           2HB      LEU  21  11.512  -0.237   2.453
  182    HB3  LEU  21           1HB      LEU  21  12.968  -0.726   3.318
  183    HG   LEU  21           HG       LEU  21  13.222   1.781   3.911
  184   HD11  LEU  21          1HD1      LEU  21  11.433   2.445   2.230
  185   HD12  LEU  21          2HD1      LEU  21  11.236   3.121   3.846
  186   HD13  LEU  21          3HD1      LEU  21  10.251   1.750   3.337
  187   HD21  LEU  21          3HD2      LEU  21  11.189  -0.148   5.017
  188   HD22  LEU  21          1HD2      LEU  21  11.315   1.471   5.708
  189   HD23  LEU  21          2HD2      LEU  21  12.711   0.394   5.728
  190    H    ALA  22           H        ALA  22  12.998  -1.809   0.881
  191    HA   ALA  22           HA       ALA  22  15.408  -3.030   1.560
  192    HB1  ALA  22           1HB      ALA  22  14.760  -4.516  -0.554
  193    HB2  ALA  22           2HB      ALA  22  13.240  -3.644  -0.392
  194    HB3  ALA  22           3HB      ALA  22  13.849  -4.611   0.949
  195    H    LEU  23           H        LEU  23  14.475  -1.325  -1.360
  196    HA   LEU  23           HA       LEU  23  16.822  -1.845  -2.845
  197    HB2  LEU  23           2HB      LEU  23  14.838  -1.041  -3.969
  198    HB3  LEU  23           1HB      LEU  23  14.839   0.431  -3.003
  199    HG   LEU  23           HG       LEU  23  17.008   1.079  -3.992
  200   HD11  LEU  23          1HD1      LEU  23  16.665  -1.557  -5.434
  201   HD12  LEU  23          2HD1      LEU  23  18.059  -0.992  -4.515
  202   HD13  LEU  23          3HD1      LEU  23  17.690  -0.279  -6.084
  203   HD21  LEU  23          3HD2      LEU  23  16.164   1.644  -6.198
  204   HD22  LEU  23          1HD2      LEU  23  14.824   1.722  -5.054
  205   HD23  LEU  23          2HD2      LEU  23  14.988   0.331  -6.126
  206    H    LYS  24           H        LYS  24  15.818   1.008  -1.012
  207    HA   LYS  24           HA       LYS  24  18.239   2.420  -1.227
  208    HB2  LYS  24           2HB      LYS  24  16.093   2.483   0.896
  209    HB3  LYS  24           1HB      LYS  24  17.429   3.633   0.818
  210    HG2  LYS  24           2HG      LYS  24  16.615   4.662  -1.102
  211    HG3  LYS  24           1HG      LYS  24  15.800   3.206  -1.664
  212    HD2  LYS  24           2HD      LYS  24  14.249   5.051  -0.861
  213    HD3  LYS  24           1HD      LYS  24  14.014   3.489  -0.082
  214    HE2  LYS  24           2HE      LYS  24  13.997   5.154   1.660
  215    HE3  LYS  24           1HE      LYS  24  15.526   4.289   1.788
  216    HZ1  LYS  24           3HZ      LYS  24  15.032   6.982   0.652
  217    HZ2  LYS  24           1HZ      LYS  24  16.470   6.127   0.357
  218    HZ3  LYS  24           2HZ      LYS  24  16.049   6.554   1.945
  219    H    LYS  25           H        LYS  25  17.025   0.244   1.247
  220    HA   LYS  25           HA       LYS  25  18.702   0.289   3.297
  221    HB2  LYS  25           2HB      LYS  25  16.974  -1.455   2.920
  222    HB3  LYS  25           1HB      LYS  25  18.087  -2.288   1.839
  223    HG2  LYS  25           2HG      LYS  25  19.478  -1.695   4.278
  224    HG3  LYS  25           1HG      LYS  25  17.941  -2.454   4.686
  225    HD2  LYS  25           2HD      LYS  25  19.003  -3.896   2.470
  226    HD3  LYS  25           1HD      LYS  25  20.319  -3.688   3.622
  227    HE2  LYS  25           2HE      LYS  25  17.576  -4.825   4.236
  228    HE3  LYS  25           1HE      LYS  25  19.082  -5.735   4.132
  229    HZ1  LYS  25           3HZ      LYS  25  18.080  -4.678   6.387
  230    HZ2  LYS  25           1HZ      LYS  25  19.181  -3.476   5.918
  231    HZ3  LYS  25           2HZ      LYS  25  19.714  -5.075   6.146
  232    H    ALA  26           H        ALA  26  19.663  -2.260   1.069
  233    HA   ALA  26           HA       ALA  26  22.215  -1.172   0.390
  234    HB1  ALA  26           1HB      ALA  26  23.479  -2.972   1.768
  235    HB2  ALA  26           2HB      ALA  26  22.028  -3.012   2.764
  236    HB3  ALA  26           3HB      ALA  26  22.940  -1.513   2.603
  Start of MODEL   14
    1    H1   LYS   1           1HT      LYS   1  18.354  14.667  -7.800
    2    H2   LYS   1           2HT      LYS   1  19.309  15.571  -8.864
    3    H3   LYS   1           3HT      LYS   1  19.883  14.098  -8.251
    4    HA   LYS   1           HA       LYS   1  18.439  14.532 -10.596
    5    HB2  LYS   1           2HB      LYS   1  19.044  11.905  -9.204
    6    HB3  LYS   1           1HB      LYS   1  18.822  12.163 -10.934
    7    HG2  LYS   1           2HG      LYS   1  20.812  13.716 -10.879
    8    HG3  LYS   1           1HG      LYS   1  21.093  13.200  -9.215
    9    HD2  LYS   1           2HD      LYS   1  20.697  10.980 -11.125
   10    HD3  LYS   1           1HD      LYS   1  22.140  11.945 -11.428
   11    HE2  LYS   1           2HE      LYS   1  22.508   9.999  -9.864
   12    HE3  LYS   1           1HE      LYS   1  22.960  11.561  -9.183
   13    HZ1  LYS   1           2HZ      LYS   1  21.689  10.362  -7.580
   14    HZ2  LYS   1           3HZ      LYS   1  20.446  10.054  -8.687
   15    HZ3  LYS   1           1HZ      LYS   1  20.725  11.636  -8.144
   16    H    LYS   2           H        LYS   2  16.640  12.816 -11.194
   17    HA   LYS   2           HA       LYS   2  14.510  13.132  -9.175
   18    HB2  LYS   2           2HB      LYS   2  14.453  12.718 -12.166
   19    HB3  LYS   2           1HB      LYS   2  13.015  12.544 -11.161
   20    HG2  LYS   2           2HG      LYS   2  14.744  15.038 -11.262
   21    HG3  LYS   2           1HG      LYS   2  13.228  14.833 -12.142
   22    HD2  LYS   2           2HD      LYS   2  12.198  14.263  -9.832
   23    HD3  LYS   2           1HD      LYS   2  13.652  15.000  -9.156
   24    HE2  LYS   2           2HE      LYS   2  11.692  16.330 -11.057
   25    HE3  LYS   2           1HE      LYS   2  11.869  16.673  -9.338
   26    HZ1  LYS   2           3HZ      LYS   2  14.173  16.898 -11.167
   27    HZ2  LYS   2           1HZ      LYS   2  13.941  17.616  -9.646
   28    HZ3  LYS   2           2HZ      LYS   2  13.070  18.176 -10.992
   29    H    ALA   3           H        ALA   3  13.385  11.400  -8.408
   30    HA   ALA   3           HA       ALA   3  14.717   8.886  -8.369
   31    HB1  ALA   3           1HB      ALA   3  13.448   9.542  -6.438
   32    HB2  ALA   3           2HB      ALA   3  12.639   8.141  -7.135
   33    HB3  ALA   3           3HB      ALA   3  11.985   9.755  -7.397
   34    H    LEU   4           H        LEU   4  14.273   9.451 -11.053
   35    HA   LEU   4           HA       LEU   4  11.925   8.303 -12.130
   36    HB2  LEU   4           2HB      LEU   4  14.637   8.288 -13.457
   37    HB3  LEU   4           1HB      LEU   4  13.054   8.312 -14.232
   38    HG   LEU   4           HG       LEU   4  14.398  10.545 -12.692
   39   HD11  LEU   4          1HD1      LEU   4  13.087  10.469 -15.427
   40   HD12  LEU   4          2HD1      LEU   4  14.813  10.205 -15.165
   41   HD13  LEU   4          3HD1      LEU   4  14.088  11.759 -14.755
   42   HD21  LEU   4          3HD2      LEU   4  12.179  10.609 -11.859
   43   HD22  LEU   4          1HD2      LEU   4  11.494  10.112 -13.405
   44   HD23  LEU   4          2HD2      LEU   4  12.160  11.734 -13.215
   45    H    LEU   5           H        LEU   5  15.186   6.987 -12.056
   46    HA   LEU   5           HA       LEU   5  14.714   4.389 -12.813
   47    HB2  LEU   5           2HB      LEU   5  16.595   3.859 -11.025
   48    HB3  LEU   5           1HB      LEU   5  16.968   4.770 -12.486
   49    HG   LEU   5           HG       LEU   5  16.011   6.508 -10.334
   50   HD11  LEU   5          1HD1      LEU   5  18.049   6.315  -8.944
   51   HD12  LEU   5          2HD1      LEU   5  18.553   4.910  -9.885
   52   HD13  LEU   5          3HD1      LEU   5  17.091   4.832  -8.899
   53   HD21  LEU   5          3HD2      LEU   5  17.333   6.936 -12.573
   54   HD22  LEU   5          1HD2      LEU   5  18.746   6.564 -11.583
   55   HD23  LEU   5          2HD2      LEU   5  17.693   7.912 -11.146
   56    H    ALA   6           H        ALA   6  14.514   5.743  -9.586
   57    HA   ALA   6           HA       ALA   6  13.628   3.384  -8.283
   58    HB1  ALA   6           1HB      ALA   6  13.213   6.263  -7.460
   59    HB2  ALA   6           2HB      ALA   6  14.625   5.287  -7.059
   60    HB3  ALA   6           3HB      ALA   6  13.042   4.849  -6.419
   61    H    LEU   7           H        LEU   7  11.949   6.174  -9.633
   62    HA   LEU   7           HA       LEU   7   9.328   5.571  -8.915
   63    HB2  LEU   7           2HB      LEU   7   9.761   7.676  -9.970
   64    HB3  LEU   7           1HB      LEU   7  10.444   6.890 -11.391
   65    HG   LEU   7           HG       LEU   7   8.205   5.868 -11.854
   66   HD11  LEU   7          1HD1      LEU   7   7.536   7.448  -9.380
   67   HD12  LEU   7          2HD1      LEU   7   7.085   5.793  -9.802
   68   HD13  LEU   7          3HD1      LEU   7   6.303   7.154 -10.610
   69   HD21  LEU   7          3HD2      LEU   7   8.267   8.892 -11.610
   70   HD22  LEU   7          1HD2      LEU   7   7.140   7.977 -12.611
   71   HD23  LEU   7          2HD2      LEU   7   8.865   7.951 -12.977
   72    H    ALA   8           H        ALA   8  11.141   4.624 -11.758
   73    HA   ALA   8           HA       ALA   8   9.162   2.955 -12.916
   74    HB1  ALA   8           1HB      ALA   8  12.095   2.465 -13.281
   75    HB2  ALA   8           2HB      ALA   8  11.374   3.948 -13.908
   76    HB3  ALA   8           3HB      ALA   8  10.797   2.380 -14.471
   77    H    LEU   9           H        LEU   9  12.099   2.186 -11.152
   78    HA   LEU   9           HA       LEU   9  12.147  -0.482 -10.968
   79    HB2  LEU   9           2HB      LEU   9  12.868   1.669  -9.120
   80    HB3  LEU   9           1HB      LEU   9  12.585   0.119  -8.331
   81    HG   LEU   9           HG       LEU   9  14.201   0.070 -10.836
   82   HD11  LEU   9          1HD1      LEU   9  14.875   1.930  -8.858
   83   HD12  LEU   9          2HD1      LEU   9  15.950   1.285 -10.097
   84   HD13  LEU   9          3HD1      LEU   9  15.886   0.530  -8.504
   85   HD21  LEU   9          3HD2      LEU   9  13.497  -1.776  -8.945
   86   HD22  LEU   9          1HD2      LEU   9  15.073  -1.264  -8.334
   87   HD23  LEU   9          2HD2      LEU   9  14.929  -1.920  -9.963
   88    H    HIS  10           H        HIS  10  10.622   1.132  -8.215
   89    HA   HIS  10           HA       HIS  10   8.507  -0.937  -8.298
   90    HB2  HIS  10           2HB      HIS  10   8.970  -0.115  -5.591
   91    HB3  HIS  10           1HB      HIS  10   9.072  -1.727  -6.289
   92    HD1  HIS  10           1HD      HIS  10  11.404  -2.525  -7.128
   93    HD2  HIS  10           2HD      HIS  10  11.442   1.186  -5.225
   94    HE1  HIS  10           1HE      HIS  10  13.827  -2.035  -6.567
   95    HE2  HIS  10           2HE      HIS  10  13.869   0.238  -5.415
   96    H    HIS  11           H        HIS  11   9.293   1.992  -6.500
   97    HA   HIS  11           HA       HIS  11   7.386   3.136  -5.379
   98    HB2  HIS  11           2HB      HIS  11   8.667   4.277  -7.817
   99    HB3  HIS  11           1HB      HIS  11   7.402   5.194  -6.996
  100    HD1  HIS  11           1HD      HIS  11   8.039   4.476  -4.057
  101    HD2  HIS  11           2HD      HIS  11  10.947   5.535  -6.861
  102    HE1  HIS  11           1HE      HIS  11  10.044   5.307  -2.744
  103    HE2  HIS  11           2HE      HIS  11  11.825   5.949  -4.437
  104    H    LEU  12           H        LEU  12   5.340   2.565  -5.302
  105    HA   LEU  12           HA       LEU  12   3.543   3.341  -7.419
  106    HB2  LEU  12           2HB      LEU  12   4.429   0.634  -7.288
  107    HB3  LEU  12           1HB      LEU  12   2.755   0.676  -6.735
  108    HG   LEU  12           HG       LEU  12   3.326   2.324  -9.134
  109   HD11  LEU  12          1HD1      LEU  12   4.725   0.419  -9.688
  110   HD12  LEU  12          2HD1      LEU  12   3.227   0.287 -10.609
  111   HD13  LEU  12          3HD1      LEU  12   3.464  -0.708  -9.169
  112   HD21  LEU  12          3HD2      LEU  12   1.177   1.295  -9.828
  113   HD22  LEU  12          1HD2      LEU  12   1.061   2.021  -8.234
  114   HD23  LEU  12          2HD2      LEU  12   1.217   0.273  -8.393
  115    H    ALA  13           H        ALA  13   3.649   1.193  -4.619
  116    HA   ALA  13           HA       ALA  13   2.086   3.009  -3.005
  117    HB1  ALA  13           1HB      ALA  13   0.262   1.996  -4.222
  118    HB2  ALA  13           2HB      ALA  13   0.265   1.334  -2.589
  119    HB3  ALA  13           3HB      ALA  13   0.904   0.379  -3.928
  120    H    HIS  14           H        HIS  14   1.173   0.928  -1.202
  121    HA   HIS  14           HA       HIS  14   3.326   0.721   0.524
  122    HB2  HIS  14           2HB      HIS  14   0.699  -0.607   0.279
  123    HB3  HIS  14           1HB      HIS  14   1.905  -1.483   1.217
  124    HD1  HIS  14           1HD      HIS  14   2.596  -0.515   3.488
  125    HD2  HIS  14           2HD      HIS  14   0.024   1.992   1.358
  126    HE1  HIS  14           1HE      HIS  14   1.884   1.319   5.088
  127    HE2  HIS  14           2HE      HIS  14   0.331   2.860   3.801
  128    H    LEU  15           H        LEU  15   2.443  -1.264  -2.164
  129    HA   LEU  15           HA       LEU  15   4.132  -3.491  -1.544
  130    HB2  LEU  15           2HB      LEU  15   2.654  -2.543  -3.987
  131    HB3  LEU  15           1HB      LEU  15   3.744  -3.925  -4.066
  132    HG   LEU  15           HG       LEU  15   1.395  -3.665  -2.157
  133   HD11  LEU  15          1HD1      LEU  15   1.770  -5.122  -4.771
  134   HD12  LEU  15          2HD1      LEU  15   0.488  -3.997  -4.323
  135   HD13  LEU  15          3HD1      LEU  15   0.544  -5.604  -3.599
  136   HD21  LEU  15          3HD2      LEU  15   1.937  -6.224  -2.018
  137   HD22  LEU  15          1HD2      LEU  15   2.919  -5.096  -1.086
  138   HD23  LEU  15          2HD2      LEU  15   3.528  -5.748  -2.608
  139    H    ALA  16           H        ALA  16   4.721  -0.369  -2.529
  140    HA   ALA  16           HA       ALA  16   7.216  -1.129  -3.893
  141    HB1  ALA  16           1HB      ALA  16   5.567   0.280  -5.168
  142    HB2  ALA  16           2HB      ALA  16   7.170   0.994  -4.998
  143    HB3  ALA  16           3HB      ALA  16   5.845   1.550  -3.977
  144    H    LEU  17           H        LEU  17   5.866   1.137  -1.555
  145    HA   LEU  17           HA       LEU  17   8.015   2.627  -0.819
  146    HB2  LEU  17           2HB      LEU  17   6.960   3.065   1.208
  147    HB3  LEU  17           1HB      LEU  17   5.641   2.617   0.139
  148    HG   LEU  17           HG       LEU  17   6.004   0.213   1.103
  149   HD11  LEU  17          1HD1      LEU  17   7.419  -0.034   2.858
  150   HD12  LEU  17          2HD1      LEU  17   6.733   1.367   3.677
  151   HD13  LEU  17          3HD1      LEU  17   8.031   1.584   2.503
  152   HD21  LEU  17          3HD2      LEU  17   4.939   2.018   3.205
  153   HD22  LEU  17          1HD2      LEU  17   4.193   0.620   2.437
  154   HD23  LEU  17          2HD2      LEU  17   4.215   2.175   1.604
  155    H    HIS  18           H        HIS  18   7.263  -0.559   0.392
  156    HA   HIS  18           HA       HIS  18   9.519  -0.795   2.096
  157    HB2  HIS  18           2HB      HIS  18   8.916  -3.092   2.312
  158    HB3  HIS  18           1HB      HIS  18   7.429  -2.170   2.139
  159    HD1  HIS  18           1HD      HIS  18   8.776  -5.181   0.967
  160    HD2  HIS  18           2HD      HIS  18   6.788  -2.020  -0.905
  161    HE1  HIS  18           1HE      HIS  18   7.880  -6.097  -1.223
  162    HE2  HIS  18           2HE      HIS  18   6.652  -4.189  -2.379
  163    H    LEU  19           H        LEU  19   8.868  -1.908  -1.151
  164    HA   LEU  19           HA       LEU  19  11.326  -3.149  -1.706
  165    HB2  LEU  19           2HB      LEU  19   9.005  -2.470  -3.159
  166    HB3  LEU  19           1HB      LEU  19  10.333  -1.666  -3.991
  167    HG   LEU  19           HG       LEU  19  11.532  -3.745  -4.231
  168   HD11  LEU  19          1HD1      LEU  19  11.295  -5.245  -2.563
  169   HD12  LEU  19          2HD1      LEU  19   9.798  -5.743  -3.356
  170   HD13  LEU  19          3HD1      LEU  19   9.751  -4.544  -2.065
  171   HD21  LEU  19          3HD2      LEU  19   9.987  -3.518  -5.990
  172   HD22  LEU  19          1HD2      LEU  19   8.605  -3.790  -4.929
  173   HD23  LEU  19          2HD2      LEU  19   9.654  -5.138  -5.374
  174    H    ALA  20           H        ALA  20  10.192   0.092  -1.734
  175    HA   ALA  20           HA       ALA  20  12.453   1.355  -2.926
  176    HB1  ALA  20           1HB      ALA  20  10.010   2.245  -1.999
  177    HB2  ALA  20           2HB      ALA  20  11.329   3.284  -2.532
  178    HB3  ALA  20           3HB      ALA  20  11.135   2.916  -0.819
  179    H    LEU  21           H        LEU  21  11.526   0.793   0.424
  180    HA   LEU  21           HA       LEU  21  13.871   1.787   1.633
  181    HB2  LEU  21           2HB      LEU  21  11.618   1.077   2.721
  182    HB3  LEU  21           1HB      LEU  21  12.314  -0.541   2.734
  183    HG   LEU  21           HG       LEU  21  13.986   1.708   3.794
  184   HD11  LEU  21          1HD1      LEU  21  11.708   2.016   4.793
  185   HD12  LEU  21          2HD1      LEU  21  12.937   1.576   5.979
  186   HD13  LEU  21          3HD1      LEU  21  11.796   0.361   5.404
  187   HD21  LEU  21          3HD2      LEU  21  15.210  -0.192   4.103
  188   HD22  LEU  21          1HD2      LEU  21  13.791  -1.242   3.991
  189   HD23  LEU  21          2HD2      LEU  21  14.167  -0.422   5.506
  190    H    ALA  22           H        ALA  22  12.895  -1.457   0.664
  191    HA   ALA  22           HA       ALA  22  15.186  -2.875   1.349
  192    HB1  ALA  22           1HB      ALA  22  14.560  -4.467  -0.423
  193    HB2  ALA  22           2HB      ALA  22  13.434  -3.282  -1.086
  194    HB3  ALA  22           3HB      ALA  22  13.149  -3.967   0.513
  195    H    LEU  23           H        LEU  23  14.492  -0.934  -1.501
  196    HA   LEU  23           HA       LEU  23  16.704  -1.498  -3.078
  197    HB2  LEU  23           2HB      LEU  23  14.732   0.134  -3.526
  198    HB3  LEU  23           1HB      LEU  23  15.730   1.330  -2.703
  199    HG   LEU  23           HG       LEU  23  17.603   0.653  -4.328
  200   HD11  LEU  23          1HD1      LEU  23  17.211  -0.815  -6.005
  201   HD12  LEU  23          2HD1      LEU  23  15.607  -0.157  -6.327
  202   HD13  LEU  23          3HD1      LEU  23  15.831  -1.342  -5.037
  203   HD21  LEU  23          3HD2      LEU  23  15.368   2.431  -4.608
  204   HD22  LEU  23          1HD2      LEU  23  15.788   1.800  -6.200
  205   HD23  LEU  23          2HD2      LEU  23  17.006   2.624  -5.228
  206    H    LYS  24           H        LYS  24  16.379   0.913  -0.533
  207    HA   LYS  24           HA       LYS  24  19.186   1.600  -0.532
  208    HB2  LYS  24           2HB      LYS  24  16.757   2.417   0.940
  209    HB3  LYS  24           1HB      LYS  24  18.236   2.447   1.900
  210    HG2  LYS  24           2HG      LYS  24  18.191   4.589   0.930
  211    HG3  LYS  24           1HG      LYS  24  19.274   3.693  -0.129
  212    HD2  LYS  24           2HD      LYS  24  16.339   3.707  -0.755
  213    HD3  LYS  24           1HD      LYS  24  17.297   5.135  -1.146
  214    HE2  LYS  24           2HE      LYS  24  17.931   2.306  -2.059
  215    HE3  LYS  24           1HE      LYS  24  17.204   3.559  -3.055
  216    HZ1  LYS  24           3HZ      LYS  24  19.150   4.879  -2.877
  217    HZ2  LYS  24           1HZ      LYS  24  19.649   3.322  -3.324
  218    HZ3  LYS  24           2HZ      LYS  24  19.839   3.848  -1.721
  219    H    LYS  25           H        LYS  25  17.037  -0.520   1.139
  220    HA   LYS  25           HA       LYS  25  17.409  -2.410   2.384
  221    HB2  LYS  25           2HB      LYS  25  19.577  -2.407   0.813
  222    HB3  LYS  25           1HB      LYS  25  20.366  -2.129   2.366
  223    HG2  LYS  25           2HG      LYS  25  19.067  -4.105   3.273
  224    HG3  LYS  25           1HG      LYS  25  18.545  -4.436   1.623
  225    HD2  LYS  25           2HD      LYS  25  20.430  -5.762   1.658
  226    HD3  LYS  25           1HD      LYS  25  21.184  -4.246   1.170
  227    HE2  LYS  25           2HE      LYS  25  22.385  -5.362   3.052
  228    HE3  LYS  25           1HE      LYS  25  21.801  -3.755   3.476
  229    HZ1  LYS  25           3HZ      LYS  25  19.848  -5.754   4.006
  230    HZ2  LYS  25           1HZ      LYS  25  20.520  -4.600   5.062
  231    HZ3  LYS  25           2HZ      LYS  25  21.301  -6.091   4.807
  232    H    ALA  26           H        ALA  26  18.229  -3.110   4.471
  233    HA   ALA  26           HA       ALA  26  19.217  -0.972   6.223
  234    HB1  ALA  26           1HB      ALA  26  16.642  -2.525   6.584
  235    HB2  ALA  26           2HB      ALA  26  16.855  -0.775   6.551
  236    HB3  ALA  26           3HB      ALA  26  17.452  -1.710   7.921
  Start of MODEL   15
    1    H1   LYS   1           1HT      LYS   1  -0.965  18.339  -6.224
    2    H2   LYS   1           2HT      LYS   1  -1.365  19.353  -7.522
    3    H3   LYS   1           3HT      LYS   1  -1.741  17.699  -7.583
    4    HA   LYS   1           HA       LYS   1  -2.844  19.067  -5.305
    5    HB2  LYS   1           2HB      LYS   1  -4.731  19.946  -6.874
    6    HB3  LYS   1           1HB      LYS   1  -3.260  20.904  -6.719
    7    HG2  LYS   1           2HG      LYS   1  -2.382  19.967  -8.797
    8    HG3  LYS   1           1HG      LYS   1  -3.773  18.896  -8.928
    9    HD2  LYS   1           2HD      LYS   1  -5.240  20.956  -8.966
   10    HD3  LYS   1           1HD      LYS   1  -3.769  21.919  -9.087
   11    HE2  LYS   1           2HE      LYS   1  -5.087  21.116 -11.266
   12    HE3  LYS   1           1HE      LYS   1  -3.331  21.236 -11.245
   13    HZ1  LYS   1           2HZ      LYS   1  -4.758  18.744 -10.524
   14    HZ2  LYS   1           3HZ      LYS   1  -3.115  18.936 -10.914
   15    HZ3  LYS   1           1HZ      LYS   1  -4.297  19.099 -12.116
   16    H    LYS   2           H        LYS   2  -4.458  17.768  -4.540
   17    HA   LYS   2           HA       LYS   2  -5.702  15.832  -4.310
   18    HB2  LYS   2           2HB      LYS   2  -6.315  16.384  -7.231
   19    HB3  LYS   2           1HB      LYS   2  -7.264  15.363  -6.152
   20    HG2  LYS   2           2HG      LYS   2  -6.750  18.115  -5.175
   21    HG3  LYS   2           1HG      LYS   2  -7.789  17.995  -6.593
   22    HD2  LYS   2           2HD      LYS   2  -9.370  16.646  -5.481
   23    HD3  LYS   2           1HD      LYS   2  -8.249  16.241  -4.182
   24    HE2  LYS   2           2HE      LYS   2 -10.143  18.062  -3.823
   25    HE3  LYS   2           1HE      LYS   2  -8.545  18.283  -3.112
   26    HZ1  LYS   2           3HZ      LYS   2  -9.382  20.259  -4.318
   27    HZ2  LYS   2           1HZ      LYS   2  -9.366  19.364  -5.756
   28    HZ3  LYS   2           2HZ      LYS   2  -7.913  19.679  -4.940
   29    H    ALA   3           H        ALA   3  -2.872  15.676  -5.348
   30    HA   ALA   3           HA       ALA   3  -3.059  12.993  -6.576
   31    HB1  ALA   3           1HB      ALA   3  -2.113  14.370  -8.241
   32    HB2  ALA   3           2HB      ALA   3  -0.734  13.563  -7.489
   33    HB3  ALA   3           3HB      ALA   3  -1.114  15.235  -7.078
   34    H    LEU   4           H        LEU   4  -3.201  13.064  -3.894
   35    HA   LEU   4           HA       LEU   4  -0.481  12.361  -2.977
   36    HB2  LEU   4           2HB      LEU   4  -2.871  13.376  -1.421
   37    HB3  LEU   4           1HB      LEU   4  -1.418  12.721  -0.666
   38    HG   LEU   4           HG       LEU   4  -0.423  14.557  -2.513
   39   HD11  LEU   4          1HD1      LEU   4  -1.659  16.579  -2.273
   40   HD12  LEU   4          2HD1      LEU   4  -2.696  15.890  -1.022
   41   HD13  LEU   4          3HD1      LEU   4  -2.848  15.350  -2.695
   42   HD21  LEU   4          3HD2      LEU   4  -1.010  14.817   0.450
   43   HD22  LEU   4          1HD2      LEU   4   0.006  15.941  -0.450
   44   HD23  LEU   4          2HD2      LEU   4   0.487  14.251  -0.294
   45    H    LEU   5           H        LEU   5  -3.501  11.617  -1.398
   46    HA   LEU   5           HA       LEU   5  -2.907   8.854  -1.142
   47    HB2  LEU   5           2HB      LEU   5  -5.634  10.172  -1.010
   48    HB3  LEU   5           1HB      LEU   5  -5.201   8.598  -0.353
   49    HG   LEU   5           HG       LEU   5  -5.022   9.912   1.550
   50   HD11  LEU   5          1HD1      LEU   5  -2.807   8.825   0.933
   51   HD12  LEU   5          2HD1      LEU   5  -2.719  10.155   2.086
   52   HD13  LEU   5          3HD1      LEU   5  -2.276  10.422   0.399
   53   HD21  LEU   5          3HD2      LEU   5  -5.195  12.026  -0.166
   54   HD22  LEU   5          1HD2      LEU   5  -3.539  12.206   0.414
   55   HD23  LEU   5          2HD2      LEU   5  -4.877  12.181   1.559
   56    H    ALA   6           H        ALA   6  -4.966  10.704  -3.274
   57    HA   ALA   6           HA       ALA   6  -6.050   8.641  -4.816
   58    HB1  ALA   6           1HB      ALA   6  -5.403  10.944  -6.451
   59    HB2  ALA   6           2HB      ALA   6  -6.062  11.449  -4.898
   60    HB3  ALA   6           3HB      ALA   6  -6.983  10.357  -5.934
   61    H    LEU   7           H        LEU   7  -2.931  10.210  -4.917
   62    HA   LEU   7           HA       LEU   7  -2.034   9.185  -7.400
   63    HB2  LEU   7           2HB      LEU   7  -0.938  10.761  -5.296
   64    HB3  LEU   7           1HB      LEU   7   0.141   9.394  -5.528
   65    HG   LEU   7           HG       LEU   7  -0.646  11.525  -7.515
   66   HD11  LEU   7          1HD1      LEU   7   1.402  11.655  -6.010
   67   HD12  LEU   7          2HD1      LEU   7   1.731  11.772  -7.738
   68   HD13  LEU   7          3HD1      LEU   7   2.031  10.259  -6.885
   69   HD21  LEU   7          3HD2      LEU   7  -0.856   9.872  -9.073
   70   HD22  LEU   7          1HD2      LEU   7  -0.121   8.662  -8.021
   71   HD23  LEU   7          2HD2      LEU   7   0.901   9.755  -8.956
   72    H    ALA   8           H        ALA   8  -1.289   8.204  -4.106
   73    HA   ALA   8           HA       ALA   8  -0.023   5.783  -4.565
   74    HB1  ALA   8           1HB      ALA   8  -0.045   5.918  -2.315
   75    HB2  ALA   8           2HB      ALA   8  -1.701   5.314  -2.365
   76    HB3  ALA   8           3HB      ALA   8  -1.393   7.050  -2.344
   77    H    LEU   9           H        LEU   9  -3.422   6.405  -4.038
   78    HA   LEU   9           HA       LEU   9  -4.547   3.922  -4.388
   79    HB2  LEU   9           2HB      LEU   9  -5.544   6.378  -4.028
   80    HB3  LEU   9           1HB      LEU   9  -5.889   6.199  -5.745
   81    HG   LEU   9           HG       LEU   9  -6.880   4.513  -3.442
   82   HD11  LEU   9          1HD1      LEU   9  -8.198   5.938  -5.768
   83   HD12  LEU   9          2HD1      LEU   9  -8.227   6.440  -4.077
   84   HD13  LEU   9          3HD1      LEU   9  -9.053   4.962  -4.571
   85   HD21  LEU   9          3HD2      LEU   9  -6.146   2.869  -5.061
   86   HD22  LEU   9          1HD2      LEU   9  -6.826   3.807  -6.392
   87   HD23  LEU   9          2HD2      LEU   9  -7.894   3.026  -5.228
   88    H    HIS  10           H        HIS  10  -3.863   6.311  -6.895
   89    HA   HIS  10           HA       HIS  10  -4.760   5.057  -9.148
   90    HB2  HIS  10           2HB      HIS  10  -3.781   7.265  -9.282
   91    HB3  HIS  10           1HB      HIS  10  -2.199   6.634  -8.837
   92    HD1  HIS  10           1HD      HIS  10  -4.455   4.853 -11.271
   93    HD2  HIS  10           2HD      HIS  10  -1.014   7.214 -11.333
   94    HE1  HIS  10           1HE      HIS  10  -3.537   4.730 -13.632
   95    HE2  HIS  10           2HE      HIS  10  -1.429   6.150 -13.683
   96    H    HIS  11           H        HIS  11  -1.435   4.717  -7.940
   97    HA   HIS  11           HA       HIS  11  -0.993   2.387  -9.621
   98    HB2  HIS  11           2HB      HIS  11   0.921   2.986  -7.420
   99    HB3  HIS  11           1HB      HIS  11   1.236   2.561  -9.099
  100    HD1  HIS  11           1HD      HIS  11   1.202   4.498 -10.852
  101    HD2  HIS  11           2HD      HIS  11   0.710   5.749  -6.903
  102    HE1  HIS  11           1HE      HIS  11   1.606   7.001 -10.835
  103    HE2  HIS  11           2HE      HIS  11   1.330   7.775  -8.435
  104    H    LEU  12           H        LEU  12   0.271   0.534  -8.296
  105    HA   LEU  12           HA       LEU  12  -1.710  -0.731  -6.678
  106    HB2  LEU  12           2HB      LEU  12   1.224  -1.456  -6.882
  107    HB3  LEU  12           1HB      LEU  12  -0.110  -2.514  -6.414
  108    HG   LEU  12           HG       LEU  12  -0.989  -1.609  -8.843
  109   HD11  LEU  12          1HD1      LEU  12   1.756  -2.329  -9.634
  110   HD12  LEU  12          2HD1      LEU  12   1.626  -0.755  -8.849
  111   HD13  LEU  12          3HD1      LEU  12   0.676  -1.101 -10.294
  112   HD21  LEU  12          3HD2      LEU  12   0.830  -3.999  -8.478
  113   HD22  LEU  12          1HD2      LEU  12  -0.470  -3.815  -9.654
  114   HD23  LEU  12          2HD2      LEU  12  -0.849  -3.959  -7.937
  115    H    ALA  13           H        ALA  13   1.416   0.726  -6.054
  116    HA   ALA  13           HA       ALA  13   2.391   1.639  -4.194
  117    HB1  ALA  13           1HB      ALA  13   0.206   2.976  -4.364
  118    HB2  ALA  13           2HB      ALA  13   1.029   2.981  -2.804
  119    HB3  ALA  13           3HB      ALA  13  -0.382   1.953  -3.054
  120    H    HIS  14           H        HIS  14   2.424   1.517  -1.737
  121    HA   HIS  14           HA       HIS  14   2.707   0.333   0.185
  122    HB2  HIS  14           2HB      HIS  14   0.387  -1.074  -1.050
  123    HB3  HIS  14           1HB      HIS  14   1.240  -1.890   0.258
  124    HD1  HIS  14           1HD      HIS  14   1.572  -0.355   2.507
  125    HD2  HIS  14           2HD      HIS  14  -1.375   0.890  -0.177
  126    HE1  HIS  14           1HE      HIS  14   0.096   1.286   3.760
  127    HE2  HIS  14           2HE      HIS  14  -1.695   2.064   2.134
  128    H    LEU  15           H        LEU  15   2.716  -1.321  -2.824
  129    HA   LEU  15           HA       LEU  15   4.397  -3.503  -1.962
  130    HB2  LEU  15           2HB      LEU  15   2.675  -3.194  -4.033
  131    HB3  LEU  15           1HB      LEU  15   4.206  -2.848  -4.841
  132    HG   LEU  15           HG       LEU  15   4.280  -5.192  -3.045
  133   HD11  LEU  15          1HD1      LEU  15   3.204  -6.459  -5.158
  134   HD12  LEU  15          2HD1      LEU  15   2.284  -4.956  -5.240
  135   HD13  LEU  15          3HD1      LEU  15   2.242  -5.932  -3.773
  136   HD21  LEU  15          3HD2      LEU  15   6.049  -4.361  -4.726
  137   HD22  LEU  15          1HD2      LEU  15   4.986  -4.989  -5.980
  138   HD23  LEU  15          2HD2      LEU  15   5.663  -6.078  -4.774
  139    H    ALA  16           H        ALA  16   4.883  -0.281  -2.757
  140    HA   ALA  16           HA       ALA  16   7.627  -0.773  -3.688
  141    HB1  ALA  16           1HB      ALA  16   5.914   0.736  -4.938
  142    HB2  ALA  16           2HB      ALA  16   7.580   1.289  -4.760
  143    HB3  ALA  16           3HB      ALA  16   6.325   1.922  -3.696
  144    H    LEU  17           H        LEU  17   5.864   1.256  -1.379
  145    HA   LEU  17           HA       LEU  17   7.764   2.745  -0.228
  146    HB2  LEU  17           2HB      LEU  17   6.551   2.724   1.830
  147    HB3  LEU  17           1HB      LEU  17   5.385   2.590   0.519
  148    HG   LEU  17           HG       LEU  17   5.730  -0.015   0.964
  149   HD11  LEU  17          1HD1      LEU  17   6.498  -0.602   3.052
  150   HD12  LEU  17          2HD1      LEU  17   5.892   0.874   3.798
  151   HD13  LEU  17          3HD1      LEU  17   7.406   0.903   2.899
  152   HD21  LEU  17          3HD2      LEU  17   3.718   1.701   1.353
  153   HD22  LEU  17          1HD2      LEU  17   4.101   1.366   3.042
  154   HD23  LEU  17          2HD2      LEU  17   3.656   0.045   1.962
  155    H    HIS  18           H        HIS  18   7.203  -0.596   0.596
  156    HA   HIS  18           HA       HIS  18   9.406  -0.789   2.422
  157    HB2  HIS  18           2HB      HIS  18   8.861  -3.107   2.551
  158    HB3  HIS  18           1HB      HIS  18   7.347  -2.241   2.351
  159    HD1  HIS  18           1HD      HIS  18   9.189  -4.991   0.946
  160    HD2  HIS  18           2HD      HIS  18   6.526  -2.130  -0.526
  161    HE1  HIS  18           1HE      HIS  18   8.393  -5.847  -1.308
  162    HE2  HIS  18           2HE      HIS  18   6.737  -4.130  -2.205
  163    H    LEU  19           H        LEU  19   8.823  -1.842  -0.850
  164    HA   LEU  19           HA       LEU  19  11.305  -3.012  -1.394
  165    HB2  LEU  19           2HB      LEU  19   9.275  -3.154  -2.864
  166    HB3  LEU  19           1HB      LEU  19   9.554  -1.478  -3.331
  167    HG   LEU  19           HG       LEU  19  11.989  -3.060  -3.581
  168   HD11  LEU  19          1HD1      LEU  19  11.304  -4.540  -5.353
  169   HD12  LEU  19          2HD1      LEU  19   9.666  -3.886  -5.341
  170   HD13  LEU  19          3HD1      LEU  19  10.246  -4.846  -3.977
  171   HD21  LEU  19          3HD2      LEU  19  11.889  -0.998  -4.719
  172   HD22  LEU  19          1HD2      LEU  19  10.259  -1.299  -5.320
  173   HD23  LEU  19          2HD2      LEU  19  11.628  -2.174  -6.006
  174    H    ALA  20           H        ALA  20  10.180   0.252  -1.275
  175    HA   ALA  20           HA       ALA  20  12.361   1.525  -2.573
  176    HB1  ALA  20           1HB      ALA  20  10.085   2.539  -1.847
  177    HB2  ALA  20           2HB      ALA  20  11.525   3.552  -1.711
  178    HB3  ALA  20           3HB      ALA  20  10.857   2.771  -0.278
  179    H    LEU  21           H        LEU  21  11.699   0.677   0.768
  180    HA   LEU  21           HA       LEU  21  14.151   1.678   1.829
  181    HB2  LEU  21           2HB      LEU  21  11.958  -0.094   2.796
  182    HB3  LEU  21           1HB      LEU  21  13.511  -0.207   3.620
  183    HG   LEU  21           HG       LEU  21  13.469   2.090   4.245
  184   HD11  LEU  21          1HD1      LEU  21  11.475   3.527   3.455
  185   HD12  LEU  21          2HD1      LEU  21  11.261   2.312   2.197
  186   HD13  LEU  21          3HD1      LEU  21  12.765   3.227   2.292
  187   HD21  LEU  21          3HD2      LEU  21  11.306   2.303   5.439
  188   HD22  LEU  21          1HD2      LEU  21  11.971   0.678   5.588
  189   HD23  LEU  21          2HD2      LEU  21  10.647   0.992   4.464
  190    H    ALA  22           H        ALA  22  13.008  -1.495   0.827
  191    HA   ALA  22           HA       ALA  22  15.339  -2.966   1.350
  192    HB1  ALA  22           1HB      ALA  22  14.314  -4.695   0.246
  193    HB2  ALA  22           2HB      ALA  22  13.755  -3.662  -1.070
  194    HB3  ALA  22           3HB      ALA  22  12.908  -3.658   0.477
  195    H    LEU  23           H        LEU  23  14.341  -1.171  -1.515
  196    HA   LEU  23           HA       LEU  23  16.421  -1.875  -3.236
  197    HB2  LEU  23           2HB      LEU  23  14.380   0.151  -3.152
  198    HB3  LEU  23           1HB      LEU  23  15.904   0.879  -3.657
  199    HG   LEU  23           HG       LEU  23  14.617   0.003  -5.595
  200   HD11  LEU  23          1HD1      LEU  23  17.309  -0.316  -5.038
  201   HD12  LEU  23          2HD1      LEU  23  16.558  -0.548  -6.615
  202   HD13  LEU  23          3HD1      LEU  23  16.819  -1.930  -5.555
  203   HD21  LEU  23          3HD2      LEU  23  13.896  -2.046  -3.950
  204   HD22  LEU  23          1HD2      LEU  23  15.206  -2.811  -4.847
  205   HD23  LEU  23          2HD2      LEU  23  13.818  -2.145  -5.708
  206    H    LYS  24           H        LYS  24  16.233   0.842  -0.987
  207    HA   LYS  24           HA       LYS  24  18.960   1.652  -1.409
  208    HB2  LYS  24           2HB      LYS  24  17.116   2.326   0.903
  209    HB3  LYS  24           1HB      LYS  24  18.593   3.181   0.460
  210    HG2  LYS  24           2HG      LYS  24  17.601   3.784  -1.720
  211    HG3  LYS  24           1HG      LYS  24  16.121   2.930  -1.284
  212    HD2  LYS  24           2HD      LYS  24  17.232   5.127   0.464
  213    HD3  LYS  24           1HD      LYS  24  16.192   5.493  -0.912
  214    HE2  LYS  24           2HE      LYS  24  14.350   4.333   0.003
  215    HE3  LYS  24           1HE      LYS  24  15.362   3.434   1.132
  216    HZ1  LYS  24           3HZ      LYS  24  15.740   6.134   1.665
  217    HZ2  LYS  24           1HZ      LYS  24  14.952   4.982   2.626
  218    HZ3  LYS  24           2HZ      LYS  24  14.067   5.904   1.503
  219    H    LYS  25           H        LYS  25  17.251  -0.415   0.809
  220    HA   LYS  25           HA       LYS  25  17.934  -1.923   2.374
  221    HB2  LYS  25           2HB      LYS  25  19.909  -2.055   0.369
  222    HB3  LYS  25           1HB      LYS  25  20.784  -1.989   1.896
  223    HG2  LYS  25           2HG      LYS  25  18.524  -3.900   1.235
  224    HG3  LYS  25           1HG      LYS  25  20.233  -4.318   1.309
  225    HD2  LYS  25           2HD      LYS  25  18.636  -3.219   3.647
  226    HD3  LYS  25           1HD      LYS  25  18.994  -4.924   3.404
  227    HE2  LYS  25           2HE      LYS  25  20.917  -2.674   4.019
  228    HE3  LYS  25           1HE      LYS  25  20.670  -4.177   4.905
  229    HZ1  LYS  25           3HZ      LYS  25  22.651  -4.407   3.673
  230    HZ2  LYS  25           1HZ      LYS  25  21.931  -3.837   2.249
  231    HZ3  LYS  25           2HZ      LYS  25  21.482  -5.347   2.881
  232    H    ALA  26           H        ALA  26  17.452   0.113   3.574
  233    HA   ALA  26           HA       ALA  26  19.353   0.401   5.682
  234    HB1  ALA  26           1HB      ALA  26  20.039   2.640   5.426
  235    HB2  ALA  26           2HB      ALA  26  18.842   2.961   4.171
  236    HB3  ALA  26           3HB      ALA  26  20.240   1.944   3.818
  Start of MODEL   16
    1    H1   LYS   1           1HT      LYS   1 -14.787  -5.966 -12.524
    2    H2   LYS   1           2HT      LYS   1 -14.403  -5.283 -11.018
    3    H3   LYS   1           3HT      LYS   1 -14.946  -6.888 -11.113
    4    HA   LYS   1           HA       LYS   1 -12.405  -6.273 -10.884
    5    HB2  LYS   1           2HB      LYS   1 -13.864  -8.545 -11.341
    6    HB3  LYS   1           1HB      LYS   1 -12.873  -8.489 -12.797
    7    HG2  LYS   1           2HG      LYS   1 -10.852  -8.575 -11.568
    8    HG3  LYS   1           1HG      LYS   1 -11.650  -8.117 -10.060
    9    HD2  LYS   1           2HD      LYS   1 -12.972 -10.287 -10.244
   10    HD3  LYS   1           1HD      LYS   1 -11.874 -10.747 -11.542
   11    HE2  LYS   1           2HE      LYS   1 -10.873  -9.896  -8.821
   12    HE3  LYS   1           1HE      LYS   1 -11.278 -11.571  -9.186
   13    HZ1  LYS   1           2HZ      LYS   1  -8.996 -11.341  -9.612
   14    HZ2  LYS   1           3HZ      LYS   1  -9.203  -9.884 -10.460
   15    HZ3  LYS   1           1HZ      LYS   1  -9.734 -11.344 -11.138
   16    H    LYS   2           H        LYS   2 -12.810  -4.171 -12.406
   17    HA   LYS   2           HA       LYS   2 -11.328  -4.746 -14.892
   18    HB2  LYS   2           2HB      LYS   2 -13.817  -3.116 -14.510
   19    HB3  LYS   2           1HB      LYS   2 -12.651  -2.639 -15.743
   20    HG2  LYS   2           2HG      LYS   2 -13.219  -5.518 -15.756
   21    HG3  LYS   2           1HG      LYS   2 -14.644  -4.528 -16.077
   22    HD2  LYS   2           2HD      LYS   2 -13.226  -3.261 -17.782
   23    HD3  LYS   2           1HD      LYS   2 -12.017  -4.530 -17.584
   24    HE2  LYS   2           2HE      LYS   2 -14.801  -4.740 -18.724
   25    HE3  LYS   2           1HE      LYS   2 -13.276  -5.298 -19.416
   26    HZ1  LYS   2           3HZ      LYS   2 -13.147  -6.921 -17.579
   27    HZ2  LYS   2           1HZ      LYS   2 -14.478  -7.170 -18.594
   28    HZ3  LYS   2           2HZ      LYS   2 -14.695  -6.447 -17.075
   29    H    ALA   3           H        ALA   3  -9.647  -4.255 -13.178
   30    HA   ALA   3           HA       ALA   3  -9.349  -1.593 -12.202
   31    HB1  ALA   3           1HB      ALA   3  -7.158  -2.279 -11.482
   32    HB2  ALA   3           2HB      ALA   3  -7.141  -3.628 -12.619
   33    HB3  ALA   3           3HB      ALA   3  -8.236  -3.653 -11.235
   34    H    LEU   4           H        LEU   4  -9.653  -0.226 -13.986
   35    HA   LEU   4           HA       LEU   4  -7.589  -0.352 -16.085
   36    HB2  LEU   4           2HB      LEU   4 -10.297   0.980 -15.940
   37    HB3  LEU   4           1HB      LEU   4  -9.117   1.396 -17.184
   38    HG   LEU   4           HG       LEU   4  -9.821  -1.488 -16.685
   39   HD11  LEU   4          1HD1      LEU   4 -11.969  -0.332 -17.001
   40   HD12  LEU   4          2HD1      LEU   4 -11.565  -1.294 -18.425
   41   HD13  LEU   4          3HD1      LEU   4 -11.344   0.457 -18.453
   42   HD21  LEU   4          3HD2      LEU   4  -9.160  -0.082 -19.273
   43   HD22  LEU   4          1HD2      LEU   4  -8.998  -1.789 -18.880
   44   HD23  LEU   4          2HD2      LEU   4  -7.894  -0.616 -18.168
   45    H    LEU   5           H        LEU   5  -9.398   2.423 -14.979
   46    HA   LEU   5           HA       LEU   5  -7.295   4.240 -15.007
   47    HB2  LEU   5           2HB      LEU   5  -9.483   5.144 -14.833
   48    HB3  LEU   5           1HB      LEU   5  -9.863   4.158 -13.425
   49    HG   LEU   5           HG       LEU   5  -8.188   5.418 -12.100
   50   HD11  LEU   5          1HD1      LEU   5  -6.681   6.054 -13.927
   51   HD12  LEU   5          2HD1      LEU   5  -7.236   7.491 -13.069
   52   HD13  LEU   5          3HD1      LEU   5  -7.945   7.071 -14.629
   53   HD21  LEU   5          3HD2      LEU   5 -10.011   7.400 -13.463
   54   HD22  LEU   5          1HD2      LEU   5  -9.537   7.333 -11.768
   55   HD23  LEU   5          2HD2      LEU   5 -10.653   6.135 -12.418
   56    H    ALA   6           H        ALA   6  -8.502   2.183 -12.454
   57    HA   ALA   6           HA       ALA   6  -6.908   2.997 -10.320
   58    HB1  ALA   6           1HB      ALA   6  -8.735   0.933 -10.769
   59    HB2  ALA   6           2HB      ALA   6  -7.901   1.281  -9.254
   60    HB3  ALA   6           3HB      ALA   6  -7.226   0.105 -10.381
   61    H    LEU   7           H        LEU   7  -6.258   0.530 -12.776
   62    HA   LEU   7           HA       LEU   7  -3.783  -0.362 -11.901
   63    HB2  LEU   7           2HB      LEU   7  -5.056  -1.300 -13.829
   64    HB3  LEU   7           1HB      LEU   7  -4.612   0.115 -14.776
   65    HG   LEU   7           HG       LEU   7  -3.190  -2.027 -15.043
   66   HD11  LEU   7          1HD1      LEU   7  -2.618   0.651 -15.356
   67   HD12  LEU   7          2HD1      LEU   7  -1.593  -0.674 -15.906
   68   HD13  LEU   7          3HD1      LEU   7  -1.278   0.096 -14.349
   69   HD21  LEU   7          3HD2      LEU   7  -1.804  -0.971 -12.575
   70   HD22  LEU   7          1HD2      LEU   7  -1.567  -2.513 -13.397
   71   HD23  LEU   7          2HD2      LEU   7  -3.034  -2.231 -12.465
   72    H    ALA   8           H        ALA   8  -4.579   2.413 -13.867
   73    HA   ALA   8           HA       ALA   8  -1.902   3.317 -14.270
   74    HB1  ALA   8           1HB      ALA   8  -4.431   3.977 -15.263
   75    HB2  ALA   8           2HB      ALA   8  -2.900   4.737 -15.696
   76    HB3  ALA   8           3HB      ALA   8  -3.886   5.424 -14.406
   77    H    LEU   9           H        LEU   9  -4.552   4.552 -12.322
   78    HA   LEU   9           HA       LEU   9  -3.028   6.509 -10.960
   79    HB2  LEU   9           2HB      LEU   9  -5.418   6.746 -11.068
   80    HB3  LEU   9           1HB      LEU   9  -5.656   5.184 -10.289
   81    HG   LEU   9           HG       LEU   9  -4.638   6.030  -8.222
   82   HD11  LEU   9          1HD1      LEU   9  -4.148   8.451  -9.940
   83   HD12  LEU   9          2HD1      LEU   9  -3.036   7.617  -8.856
   84   HD13  LEU   9          3HD1      LEU   9  -4.321   8.629  -8.196
   85   HD21  LEU   9          3HD2      LEU   9  -6.374   8.226  -8.244
   86   HD22  LEU   9          1HD2      LEU   9  -6.789   6.576  -7.780
   87   HD23  LEU   9          2HD2      LEU   9  -7.061   7.122  -9.433
   88    H    HIS  10           H        HIS  10  -4.108   3.299  -9.957
   89    HA   HIS  10           HA       HIS  10  -2.795   3.403  -7.416
   90    HB2  HIS  10           2HB      HIS  10  -4.795   1.920  -8.103
   91    HB3  HIS  10           1HB      HIS  10  -3.593   0.857  -8.830
   92    HD1  HIS  10           1HD      HIS  10  -3.698   2.745  -5.513
   93    HD2  HIS  10           2HD      HIS  10  -3.020  -1.100  -6.990
   94    HE1  HIS  10           1HE      HIS  10  -3.139   1.294  -3.511
   95    HE2  HIS  10           2HE      HIS  10  -2.672  -1.048  -4.399
   96    H    HIS  11           H        HIS  11  -1.444   1.096  -7.107
   97    HA   HIS  11           HA       HIS  11   0.642   0.172  -7.301
   98    HB2  HIS  11           2HB      HIS  11   0.358   0.892 -10.230
   99    HB3  HIS  11           1HB      HIS  11   1.477  -0.284  -9.545
  100    HD1  HIS  11           1HD      HIS  11   0.521  -2.569  -8.815
  101    HD2  HIS  11           2HD      HIS  11  -2.392   0.058 -10.241
  102    HE1  HIS  11           1HE      HIS  11  -1.590  -3.931  -9.133
  103    HE2  HIS  11           2HE      HIS  11  -3.381  -2.346  -9.979
  104    H    LEU  12           H        LEU  12   0.279   3.049  -6.769
  105    HA   LEU  12           HA       LEU  12   2.542   4.369  -8.018
  106    HB2  LEU  12           2HB      LEU  12   0.408   5.128  -6.084
  107    HB3  LEU  12           1HB      LEU  12   1.927   6.013  -5.986
  108    HG   LEU  12           HG       LEU  12   0.448   5.612  -8.598
  109   HD11  LEU  12          1HD1      LEU  12  -0.212   8.082  -8.181
  110   HD12  LEU  12          2HD1      LEU  12   0.154   7.757  -6.488
  111   HD13  LEU  12          3HD1      LEU  12  -1.113   6.846  -7.307
  112   HD21  LEU  12          3HD2      LEU  12   2.654   7.452  -7.631
  113   HD22  LEU  12          1HD2      LEU  12   1.800   7.692  -9.158
  114   HD23  LEU  12          2HD2      LEU  12   2.755   6.230  -8.900
  115    H    ALA  13           H        ALA  13   1.767   4.094  -4.603
  116    HA   ALA  13           HA       ALA  13   4.322   2.792  -4.074
  117    HB1  ALA  13           1HB      ALA  13   5.314   4.781  -3.647
  118    HB2  ALA  13           2HB      ALA  13   4.439   4.670  -2.122
  119    HB3  ALA  13           3HB      ALA  13   3.775   5.624  -3.445
  120    H    HIS  14           H        HIS  14   4.281   1.542  -2.369
  121    HA   HIS  14           HA       HIS  14   3.046   1.623   0.029
  122    HB2  HIS  14           2HB      HIS  14   1.010   1.240  -1.994
  123    HB3  HIS  14           1HB      HIS  14   1.109  -0.181  -0.954
  124    HD1  HIS  14           1HD      HIS  14  -0.536   0.049   0.909
  125    HD2  HIS  14           2HD      HIS  14   1.293   3.699   0.008
  126    HE1  HIS  14           1HE      HIS  14  -1.444   1.745   2.571
  127    HE2  HIS  14           2HE      HIS  14  -0.353   3.986   2.015
  128    H    LEU  15           H        LEU  15   2.671  -0.818  -2.489
  129    HA   LEU  15           HA       LEU  15   3.893  -2.879  -0.891
  130    HB2  LEU  15           2HB      LEU  15   2.906  -2.679  -3.728
  131    HB3  LEU  15           1HB      LEU  15   3.954  -4.022  -3.267
  132    HG   LEU  15           HG       LEU  15   2.357  -4.430  -1.317
  133   HD11  LEU  15          1HD1      LEU  15  -0.035  -3.509  -2.214
  134   HD12  LEU  15          2HD1      LEU  15   1.004  -2.182  -2.716
  135   HD13  LEU  15          3HD1      LEU  15   0.935  -2.651  -1.019
  136   HD21  LEU  15          3HD2      LEU  15   0.759  -5.657  -2.724
  137   HD22  LEU  15          1HD2      LEU  15   2.390  -5.814  -3.382
  138   HD23  LEU  15          2HD2      LEU  15   1.241  -4.705  -4.127
  139    H    ALA  16           H        ALA  16   4.879  -0.465  -3.100
  140    HA   ALA  16           HA       ALA  16   7.486  -1.590  -3.624
  141    HB1  ALA  16           1HB      ALA  16   7.479   1.174  -4.241
  142    HB2  ALA  16           2HB      ALA  16   5.890   0.557  -4.694
  143    HB3  ALA  16           3HB      ALA  16   7.345  -0.177  -5.370
  144    H    LEU  17           H        LEU  17   6.022   0.750  -1.490
  145    HA   LEU  17           HA       LEU  17   8.083   2.205  -0.499
  146    HB2  LEU  17           2HB      LEU  17   6.528   2.808   1.007
  147    HB3  LEU  17           1HB      LEU  17   5.491   1.537   0.374
  148    HG   LEU  17           HG       LEU  17   6.750  -0.048   1.979
  149   HD11  LEU  17          1HD1      LEU  17   7.262   2.220   3.779
  150   HD12  LEU  17          2HD1      LEU  17   8.336   2.175   2.381
  151   HD13  LEU  17          3HD1      LEU  17   8.245   0.788   3.468
  152   HD21  LEU  17          3HD2      LEU  17   4.967   2.179   2.999
  153   HD22  LEU  17          1HD2      LEU  17   5.334   0.715   3.911
  154   HD23  LEU  17          2HD2      LEU  17   4.452   0.604   2.387
  155    H    HIS  18           H        HIS  18   7.249  -1.077   0.356
  156    HA   HIS  18           HA       HIS  18   9.350  -1.536   2.205
  157    HB2  HIS  18           2HB      HIS  18   8.220  -3.657   0.396
  158    HB3  HIS  18           1HB      HIS  18   8.800  -3.815   2.045
  159    HD1  HIS  18           1HD      HIS  18   7.133  -3.347   3.931
  160    HD2  HIS  18           2HD      HIS  18   5.676  -2.332   0.162
  161    HE1  HIS  18           1HE      HIS  18   4.683  -2.757   4.240
  162    HE2  HIS  18           2HE      HIS  18   3.782  -2.116   1.946
  163    H    LEU  19           H        LEU  19   8.958  -2.475  -1.151
  164    HA   LEU  19           HA       LEU  19  11.524  -3.451  -1.650
  165    HB2  LEU  19           2HB      LEU  19   9.999  -3.883  -3.349
  166    HB3  LEU  19           1HB      LEU  19   9.357  -2.244  -3.327
  167    HG   LEU  19           HG       LEU  19  12.220  -2.630  -4.125
  168   HD11  LEU  19          1HD1      LEU  19  10.209  -4.118  -5.369
  169   HD12  LEU  19          2HD1      LEU  19  11.791  -3.728  -6.042
  170   HD13  LEU  19          3HD1      LEU  19  10.404  -2.701  -6.401
  171   HD21  LEU  19          3HD2      LEU  19  10.487  -0.468  -3.993
  172   HD22  LEU  19          1HD2      LEU  19  10.434  -0.904  -5.698
  173   HD23  LEU  19          2HD2      LEU  19  11.973  -0.521  -4.937
  174    H    ALA  20           H        ALA  20  10.268  -0.249  -1.419
  175    HA   ALA  20           HA       ALA  20  12.448   1.159  -2.585
  176    HB1  ALA  20           1HB      ALA  20  11.413   3.099  -1.850
  177    HB2  ALA  20           2HB      ALA  20  10.866   2.356  -0.345
  178    HB3  ALA  20           3HB      ALA  20  10.041   1.987  -1.860
  179    H    LEU  21           H        LEU  21  11.572   0.484   0.766
  180    HA   LEU  21           HA       LEU  21  13.953   1.478   1.927
  181    HB2  LEU  21           2HB      LEU  21  11.763  -0.355   2.801
  182    HB3  LEU  21           1HB      LEU  21  13.272  -0.385   3.717
  183    HG   LEU  21           HG       LEU  21  13.137   2.055   4.043
  184   HD11  LEU  21          1HD1      LEU  21  11.938   2.581   1.951
  185   HD12  LEU  21          2HD1      LEU  21  11.119   3.266   3.349
  186   HD13  LEU  21          3HD1      LEU  21  10.491   1.808   2.591
  187   HD21  LEU  21          3HD2      LEU  21  10.568   0.611   4.761
  188   HD22  LEU  21          1HD2      LEU  21  11.177   2.072   5.534
  189   HD23  LEU  21          2HD2      LEU  21  12.069   0.560   5.689
  190    H    ALA  22           H        ALA  22  12.995  -1.578   0.590
  191    HA   ALA  22           HA       ALA  22  15.300  -3.069   1.332
  192    HB1  ALA  22           1HB      ALA  22  14.412  -4.778   0.066
  193    HB2  ALA  22           2HB      ALA  22  13.873  -3.690  -1.213
  194    HB3  ALA  22           3HB      ALA  22  12.959  -3.809   0.290
  195    H    LEU  23           H        LEU  23  14.451  -1.073  -1.412
  196    HA   LEU  23           HA       LEU  23  16.846  -1.620  -2.907
  197    HB2  LEU  23           2HB      LEU  23  14.726  -0.981  -4.016
  198    HB3  LEU  23           1HB      LEU  23  14.800   0.589  -3.216
  199    HG   LEU  23           HG       LEU  23  17.169   0.768  -4.321
  200   HD11  LEU  23          1HD1      LEU  23  17.335  -1.524  -5.126
  201   HD12  LEU  23          2HD1      LEU  23  17.232  -0.444  -6.518
  202   HD13  LEU  23          3HD1      LEU  23  15.817  -1.366  -6.006
  203   HD21  LEU  23          3HD2      LEU  23  14.876   0.850  -6.271
  204   HD22  LEU  23          1HD2      LEU  23  16.209   1.988  -6.074
  205   HD23  LEU  23          2HD2      LEU  23  14.905   1.948  -4.890
  206    H    LYS  24           H        LYS  24  15.594   1.206  -1.183
  207    HA   LYS  24           HA       LYS  24  17.974   2.742  -1.432
  208    HB2  LYS  24           2HB      LYS  24  15.700   2.948   0.539
  209    HB3  LYS  24           1HB      LYS  24  16.961   4.164   0.327
  210    HG2  LYS  24           2HG      LYS  24  16.142   4.864  -1.714
  211    HG3  LYS  24           1HG      LYS  24  15.502   3.272  -2.123
  212    HD2  LYS  24           2HD      LYS  24  13.793   5.134  -1.578
  213    HD3  LYS  24           1HD      LYS  24  13.570   3.575  -0.787
  214    HE2  LYS  24           2HE      LYS  24  13.329   5.424   0.828
  215    HE3  LYS  24           1HE      LYS  24  14.722   4.425   1.228
  216    HZ1  LYS  24           3HZ      LYS  24  15.902   6.182  -0.335
  217    HZ2  LYS  24           1HZ      LYS  24  15.685   6.468   1.323
  218    HZ3  LYS  24           2HZ      LYS  24  14.620   7.158   0.198
  219    H    LYS  25           H        LYS  25  16.711   0.586   1.009
  220    HA   LYS  25           HA       LYS  25  17.821  -0.606   2.655
  221    HB2  LYS  25           2HB      LYS  25  19.862  -0.391   1.119
  222    HB3  LYS  25           1HB      LYS  25  20.306   1.011   2.087
  223    HG2  LYS  25           2HG      LYS  25  21.455  -0.822   3.073
  224    HG3  LYS  25           1HG      LYS  25  20.090  -0.497   4.139
  225    HD2  LYS  25           2HD      LYS  25  18.941  -2.405   3.485
  226    HD3  LYS  25           1HD      LYS  25  19.718  -2.458   1.901
  227    HE2  LYS  25           2HE      LYS  25  21.201  -2.951   4.488
  228    HE3  LYS  25           1HE      LYS  25  20.475  -4.242   3.531
  229    HZ1  LYS  25           3HZ      LYS  25  22.952  -3.076   3.153
  230    HZ2  LYS  25           1HZ      LYS  25  21.989  -2.528   1.871
  231    HZ3  LYS  25           2HZ      LYS  25  22.168  -4.192   2.138
  232    H    ALA  26           H        ALA  26  20.133   1.439   3.781
  233    HA   ALA  26           HA       ALA  26  18.322   2.512   5.816
  234    HB1  ALA  26           1HB      ALA  26  20.569   3.290   6.827
  235    HB2  ALA  26           2HB      ALA  26  21.322   2.272   5.598
  236    HB3  ALA  26           3HB      ALA  26  20.244   1.553   6.796
  Start of MODEL   17
    1    H1   LYS   1           1HT      LYS   1  -9.764   4.007 -14.423
    2    H2   LYS   1           2HT      LYS   1 -10.684   3.189 -15.590
    3    H3   LYS   1           3HT      LYS   1 -11.454   4.029 -14.334
    4    HA   LYS   1           HA       LYS   1 -10.952   4.993 -16.828
    5    HB2  LYS   1           2HB      LYS   1 -11.337   6.541 -14.237
    6    HB3  LYS   1           1HB      LYS   1 -11.658   7.151 -15.861
    7    HG2  LYS   1           2HG      LYS   1 -13.304   5.257 -16.166
    8    HG3  LYS   1           1HG      LYS   1 -13.093   4.878 -14.456
    9    HD2  LYS   1           2HD      LYS   1 -13.556   7.679 -14.620
   10    HD3  LYS   1           1HD      LYS   1 -14.753   6.905 -15.659
   11    HE2  LYS   1           2HE      LYS   1 -15.619   7.081 -13.368
   12    HE3  LYS   1           1HE      LYS   1 -15.374   5.387 -13.788
   13    HZ1  LYS   1           2HZ      LYS   1 -13.527   5.230 -12.448
   14    HZ2  LYS   1           3HZ      LYS   1 -14.501   6.286 -11.548
   15    HZ3  LYS   1           1HZ      LYS   1 -13.216   6.899 -12.468
   16    H    LYS   2           H        LYS   2  -9.718   7.016 -17.387
   17    HA   LYS   2           HA       LYS   2  -6.931   6.659 -16.881
   18    HB2  LYS   2           2HB      LYS   2  -8.361   9.058 -18.075
   19    HB3  LYS   2           1HB      LYS   2  -6.639   8.704 -18.207
   20    HG2  LYS   2           2HG      LYS   2  -6.960   7.138 -19.835
   21    HG3  LYS   2           1HG      LYS   2  -8.383   6.474 -19.036
   22    HD2  LYS   2           2HD      LYS   2  -9.129   7.449 -21.114
   23    HD3  LYS   2           1HD      LYS   2  -9.670   8.512 -19.817
   24    HE2  LYS   2           2HE      LYS   2  -8.472   9.523 -21.950
   25    HE3  LYS   2           1HE      LYS   2  -8.118  10.177 -20.351
   26    HZ1  LYS   2           3HZ      LYS   2  -6.124   9.672 -21.707
   27    HZ2  LYS   2           1HZ      LYS   2  -6.542   8.030 -21.663
   28    HZ3  LYS   2           2HZ      LYS   2  -6.152   8.847 -20.223
   29    H    ALA   3           H        ALA   3  -7.974   6.808 -14.409
   30    HA   ALA   3           HA       ALA   3  -7.554   9.547 -13.431
   31    HB1  ALA   3           1HB      ALA   3  -9.492   8.685 -12.446
   32    HB2  ALA   3           2HB      ALA   3  -8.271   8.357 -11.219
   33    HB3  ALA   3           3HB      ALA   3  -8.811   7.065 -12.289
   34    H    LEU   4           H        LEU   4  -5.400   7.739 -14.437
   35    HA   LEU   4           HA       LEU   4  -3.885   6.494 -12.539
   36    HB2  LEU   4           2HB      LEU   4  -1.887   7.603 -13.888
   37    HB3  LEU   4           1HB      LEU   4  -2.892   6.354 -14.617
   38    HG   LEU   4           HG       LEU   4  -3.914   9.128 -14.896
   39   HD11  LEU   4          1HD1      LEU   4  -1.385   8.173 -16.249
   40   HD12  LEU   4          2HD1      LEU   4  -1.585   9.616 -15.254
   41   HD13  LEU   4          3HD1      LEU   4  -2.356   9.521 -16.839
   42   HD21  LEU   4          3HD2      LEU   4  -3.443   7.257 -17.172
   43   HD22  LEU   4          1HD2      LEU   4  -4.837   8.285 -16.832
   44   HD23  LEU   4          2HD2      LEU   4  -4.630   6.767 -15.959
   45    H    LEU   5           H        LEU   5  -3.827   9.918 -13.332
   46    HA   LEU   5           HA       LEU   5  -1.968  10.844 -11.511
   47    HB2  LEU   5           2HB      LEU   5  -4.243  12.640 -11.562
   48    HB3  LEU   5           1HB      LEU   5  -2.633  12.867 -12.243
   49    HG   LEU   5           HG       LEU   5  -3.399  11.363 -14.180
   50   HD11  LEU   5          1HD1      LEU   5  -5.551  10.827 -12.613
   51   HD12  LEU   5          2HD1      LEU   5  -5.589  10.712 -14.370
   52   HD13  LEU   5          3HD1      LEU   5  -6.194  12.160 -13.573
   53   HD21  LEU   5          3HD2      LEU   5  -5.049  13.872 -13.953
   54   HD22  LEU   5          1HD2      LEU   5  -4.221  13.217 -15.368
   55   HD23  LEU   5          2HD2      LEU   5  -3.291  13.961 -14.064
   56    H    ALA   6           H        ALA   6  -5.354  10.095 -11.053
   57    HA   ALA   6           HA       ALA   6  -5.426  10.903  -8.294
   58    HB1  ALA   6           1HB      ALA   6  -7.669  10.154  -8.291
   59    HB2  ALA   6           2HB      ALA   6  -7.379   9.025  -9.613
   60    HB3  ALA   6           3HB      ALA   6  -7.420  10.757  -9.929
   61    H    LEU   7           H        LEU   7  -5.118   7.876 -10.067
   62    HA   LEU   7           HA       LEU   7  -5.191   6.097  -7.871
   63    HB2  LEU   7           2HB      LEU   7  -3.610   5.855 -10.452
   64    HB3  LEU   7           1HB      LEU   7  -3.942   4.536  -9.327
   65    HG   LEU   7           HG       LEU   7  -5.998   6.121 -10.891
   66   HD11  LEU   7          1HD1      LEU   7  -5.280   3.181 -10.982
   67   HD12  LEU   7          2HD1      LEU   7  -4.673   4.376 -12.129
   68   HD13  LEU   7          3HD1      LEU   7  -6.403   4.031 -12.045
   69   HD21  LEU   7          3HD2      LEU   7  -7.035   5.648  -8.835
   70   HD22  LEU   7          1HD2      LEU   7  -6.196   4.107  -8.661
   71   HD23  LEU   7          2HD2      LEU   7  -7.496   4.273  -9.842
   72    H    ALA   8           H        ALA   8  -2.509   7.426  -9.644
   73    HA   ALA   8           HA       ALA   8  -0.353   6.614  -8.112
   74    HB1  ALA   8           1HB      ALA   8   0.739   8.762  -8.886
   75    HB2  ALA   8           2HB      ALA   8  -0.815   9.215  -9.581
   76    HB3  ALA   8           3HB      ALA   8   0.033   7.789 -10.173
   77    H    LEU   9           H        LEU   9  -2.148   9.618  -7.838
   78    HA   LEU   9           HA       LEU   9  -0.943  10.622  -5.525
   79    HB2  LEU   9           2HB      LEU   9  -2.386  12.034  -6.853
   80    HB3  LEU   9           1HB      LEU   9  -3.765  10.976  -6.568
   81    HG   LEU   9           HG       LEU   9  -3.692  11.492  -4.163
   82   HD11  LEU   9          1HD1      LEU   9  -1.359  13.280  -4.942
   83   HD12  LEU   9          2HD1      LEU   9  -1.292  11.863  -3.891
   84   HD13  LEU   9          3HD1      LEU   9  -2.159  13.309  -3.368
   85   HD21  LEU   9          3HD2      LEU   9  -5.014  12.952  -5.676
   86   HD22  LEU   9          1HD2      LEU   9  -3.612  14.009  -5.858
   87   HD23  LEU   9          2HD2      LEU   9  -4.390  13.835  -4.286
   88    H    HIS  10           H        HIS  10  -3.871   8.691  -5.867
   89    HA   HIS  10           HA       HIS  10  -4.474   8.408  -3.145
   90    HB2  HIS  10           2HB      HIS  10  -6.022   7.826  -4.999
   91    HB3  HIS  10           1HB      HIS  10  -5.007   6.447  -5.387
   92    HD1  HIS  10           1HD      HIS  10  -7.703   5.570  -4.742
   93    HD2  HIS  10           2HD      HIS  10  -5.019   6.408  -1.656
   94    HE1  HIS  10           1HE      HIS  10  -8.549   4.339  -2.693
   95    HE2  HIS  10           2HE      HIS  10  -6.937   4.854  -0.796
   96    H    HIS  11           H        HIS  11  -2.737   6.212  -5.309
   97    HA   HIS  11           HA       HIS  11  -1.584   4.868  -2.939
   98    HB2  HIS  11           2HB      HIS  11  -1.686   3.781  -5.757
   99    HB3  HIS  11           1HB      HIS  11  -1.331   2.902  -4.270
  100    HD1  HIS  11           1HD      HIS  11  -3.292   2.065  -2.893
  101    HD2  HIS  11           2HD      HIS  11  -4.471   4.550  -6.028
  102    HE1  HIS  11           1HE      HIS  11  -5.821   1.962  -2.974
  103    HE2  HIS  11           2HE      HIS  11  -6.560   3.456  -4.899
  104    H    LEU  12           H        LEU  12  -0.185   6.928  -3.061
  105    HA   LEU  12           HA       LEU  12   1.707   7.416  -5.019
  106    HB2  LEU  12           2HB      LEU  12   3.185   8.165  -3.030
  107    HB3  LEU  12           1HB      LEU  12   1.659   8.999  -3.288
  108    HG   LEU  12           HG       LEU  12   0.988   6.815  -1.671
  109   HD11  LEU  12          1HD1      LEU  12   2.606   6.474  -0.096
  110   HD12  LEU  12          2HD1      LEU  12   3.177   8.142  -0.169
  111   HD13  LEU  12          3HD1      LEU  12   3.683   6.982  -1.398
  112   HD21  LEU  12          3HD2      LEU  12   0.140   9.177  -1.617
  113   HD22  LEU  12          1HD2      LEU  12   1.625   9.639  -0.784
  114   HD23  LEU  12          2HD2      LEU  12   0.499   8.514  -0.024
  115    H    ALA  13           H        ALA  13   2.005   5.327  -2.202
  116    HA   ALA  13           HA       ALA  13   3.597   3.415  -3.661
  117    HB1  ALA  13           1HB      ALA  13   4.842   4.989  -1.404
  118    HB2  ALA  13           2HB      ALA  13   5.375   4.947  -3.082
  119    HB3  ALA  13           3HB      ALA  13   5.513   3.507  -2.074
  120    H    HIS  14           H        HIS  14   3.480   1.456  -2.801
  121    HA   HIS  14           HA       HIS  14   2.465   1.087  -0.073
  122    HB2  HIS  14           2HB      HIS  14   1.129   0.184  -2.612
  123    HB3  HIS  14           1HB      HIS  14   0.976  -0.790  -1.152
  124    HD1  HIS  14           1HD      HIS  14  -1.041  -0.209   0.177
  125    HD2  HIS  14           2HD      HIS  14   0.426   3.108  -1.894
  126    HE1  HIS  14           1HE      HIS  14  -2.607   1.720   0.694
  127    HE2  HIS  14           2HE      HIS  14  -1.700   3.757  -0.524
  128    H    LEU  15           H        LEU  15   2.708  -1.238  -2.686
  129    HA   LEU  15           HA       LEU  15   4.229  -3.067  -1.144
  130    HB2  LEU  15           2HB      LEU  15   3.838  -2.854  -4.146
  131    HB3  LEU  15           1HB      LEU  15   4.602  -4.220  -3.334
  132    HG   LEU  15           HG       LEU  15   2.311  -4.055  -1.891
  133   HD11  LEU  15          1HD1      LEU  15   0.436  -3.679  -3.483
  134   HD12  LEU  15          2HD1      LEU  15   1.600  -3.150  -4.696
  135   HD13  LEU  15          3HD1      LEU  15   1.384  -2.214  -3.220
  136   HD21  LEU  15          3HD2      LEU  15   2.969  -6.131  -2.827
  137   HD22  LEU  15          1HD2      LEU  15   2.915  -5.500  -4.471
  138   HD23  LEU  15          2HD2      LEU  15   1.414  -5.789  -3.592
  139    H    ALA  16           H        ALA  16   4.930  -0.419  -3.216
  140    HA   ALA  16           HA       ALA  16   7.657  -0.937  -3.709
  141    HB1  ALA  16           1HB      ALA  16   6.103   1.649  -3.706
  142    HB2  ALA  16           2HB      ALA  16   6.448   0.628  -5.099
  143    HB3  ALA  16           3HB      ALA  16   7.758   1.483  -4.288
  144    H    LEU  17           H        LEU  17   6.057   1.166  -1.365
  145    HA   LEU  17           HA       LEU  17   7.984   2.454  -0.053
  146    HB2  LEU  17           2HB      LEU  17   6.038   2.747   1.093
  147    HB3  LEU  17           1HB      LEU  17   5.538   1.075   0.879
  148    HG   LEU  17           HG       LEU  17   7.204   0.388   2.600
  149   HD11  LEU  17          1HD1      LEU  17   7.465   3.132   3.646
  150   HD12  LEU  17          2HD1      LEU  17   8.366   2.830   2.161
  151   HD13  LEU  17          3HD1      LEU  17   8.657   1.836   3.585
  152   HD21  LEU  17          3HD2      LEU  17   5.464   0.542   4.000
  153   HD22  LEU  17          1HD2      LEU  17   4.736   1.768   2.964
  154   HD23  LEU  17          2HD2      LEU  17   5.821   2.252   4.271
  155    H    HIS  18           H        HIS  18   7.221  -0.906   0.518
  156    HA   HIS  18           HA       HIS  18   9.419  -1.406   2.292
  157    HB2  HIS  18           2HB      HIS  18   8.117  -3.528   0.609
  158    HB3  HIS  18           1HB      HIS  18   8.794  -3.659   2.225
  159    HD1  HIS  18           1HD      HIS  18   7.196  -3.310   4.157
  160    HD2  HIS  18           2HD      HIS  18   5.689  -1.912   0.532
  161    HE1  HIS  18           1HE      HIS  18   4.817  -2.555   4.620
  162    HE2  HIS  18           2HE      HIS  18   3.871  -1.703   2.413
  163    H    LEU  19           H        LEU  19   8.816  -2.405  -1.013
  164    HA   LEU  19           HA       LEU  19  11.289  -3.532  -1.594
  165    HB2  LEU  19           2HB      LEU  19   9.577  -3.888  -3.166
  166    HB3  LEU  19           1HB      LEU  19   9.172  -2.174  -3.242
  167    HG   LEU  19           HG       LEU  19  11.424  -1.770  -4.323
  168   HD11  LEU  19          1HD1      LEU  19  12.381  -3.961  -5.355
  169   HD12  LEU  19          2HD1      LEU  19  11.486  -4.778  -4.077
  170   HD13  LEU  19          3HD1      LEU  19  12.743  -3.613  -3.665
  171   HD21  LEU  19          3HD2      LEU  19  10.021  -1.806  -6.086
  172   HD22  LEU  19          1HD2      LEU  19   9.098  -3.154  -5.422
  173   HD23  LEU  19          2HD2      LEU  19  10.562  -3.463  -6.357
  174    H    ALA  20           H        ALA  20  10.248  -0.260  -1.371
  175    HA   ALA  20           HA       ALA  20  12.488   0.944  -2.682
  176    HB1  ALA  20           1HB      ALA  20  11.690   2.980  -1.238
  177    HB2  ALA  20           2HB      ALA  20  10.302   1.953  -0.885
  178    HB3  ALA  20           3HB      ALA  20  10.663   2.405  -2.549
  179    H    LEU  21           H        LEU  21  11.558   0.434   0.673
  180    HA   LEU  21           HA       LEU  21  13.881   1.445   1.881
  181    HB2  LEU  21           2HB      LEU  21  11.648   0.661   2.955
  182    HB3  LEU  21           1HB      LEU  21  12.383  -0.940   2.956
  183    HG   LEU  21           HG       LEU  21  13.937   1.376   4.078
  184   HD11  LEU  21          1HD1      LEU  21  12.857   1.279   6.174
  185   HD12  LEU  21          2HD1      LEU  21  12.034  -0.229   5.780
  186   HD13  LEU  21          3HD1      LEU  21  11.525   1.279   5.020
  187   HD21  LEU  21          3HD2      LEU  21  14.558  -0.594   5.677
  188   HD22  LEU  21          1HD2      LEU  21  15.203  -0.613   4.037
  189   HD23  LEU  21          2HD2      LEU  21  13.815  -1.620   4.451
  190    H    ALA  22           H        ALA  22  13.029  -1.734   0.673
  191    HA   ALA  22           HA       ALA  22  15.383  -3.091   1.436
  192    HB1  ALA  22           1HB      ALA  22  14.268  -4.044  -1.077
  193    HB2  ALA  22           2HB      ALA  22  13.018  -3.775   0.136
  194    HB3  ALA  22           3HB      ALA  22  14.365  -4.856   0.484
  195    H    LEU  23           H        LEU  23  14.553  -1.172  -1.358
  196    HA   LEU  23           HA       LEU  23  17.006  -1.761  -2.777
  197    HB2  LEU  23           2HB      LEU  23  14.619  -0.018  -3.235
  198    HB3  LEU  23           1HB      LEU  23  16.097   0.309  -4.140
  199    HG   LEU  23           HG       LEU  23  15.015  -2.498  -3.996
  200   HD11  LEU  23          1HD1      LEU  23  13.497  -2.166  -5.736
  201   HD12  LEU  23          2HD1      LEU  23  14.253  -0.654  -6.245
  202   HD13  LEU  23          3HD1      LEU  23  13.267  -0.699  -4.783
  203   HD21  LEU  23          3HD2      LEU  23  17.314  -1.826  -4.956
  204   HD22  LEU  23          1HD2      LEU  23  16.409  -1.066  -6.268
  205   HD23  LEU  23          2HD2      LEU  23  16.278  -2.802  -5.997
  206    H    LYS  24           H        LYS  24  15.556   1.105  -1.359
  207    HA   LYS  24           HA       LYS  24  17.602   2.921  -1.609
  208    HB2  LYS  24           2HB      LYS  24  15.226   3.173  -0.538
  209    HB3  LYS  24           1HB      LYS  24  16.068   2.819   0.970
  210    HG2  LYS  24           2HG      LYS  24  17.698   4.703  -0.335
  211    HG3  LYS  24           1HG      LYS  24  16.054   5.276  -0.596
  212    HD2  LYS  24           2HD      LYS  24  16.637   6.254   1.465
  213    HD3  LYS  24           1HD      LYS  24  15.715   4.833   1.938
  214    HE2  LYS  24           2HE      LYS  24  17.933   5.218   3.179
  215    HE3  LYS  24           1HE      LYS  24  17.671   3.610   2.519
  216    HZ1  LYS  24           3HZ      LYS  24  19.901   4.847   2.100
  217    HZ2  LYS  24           1HZ      LYS  24  19.032   5.627   0.873
  218    HZ3  LYS  24           2HZ      LYS  24  19.193   3.935   0.855
  219    H    LYS  25           H        LYS  25  17.426   0.173   0.461
  220    HA   LYS  25           HA       LYS  25  19.194   0.770   2.493
  221    HB2  LYS  25           2HB      LYS  25  18.140  -1.355   2.544
  222    HB3  LYS  25           1HB      LYS  25  18.725  -1.772   0.935
  223    HG2  LYS  25           2HG      LYS  25  20.796  -1.178   2.996
  224    HG3  LYS  25           1HG      LYS  25  19.904  -2.685   3.169
  225    HD2  LYS  25           2HD      LYS  25  20.703  -3.566   1.186
  226    HD3  LYS  25           1HD      LYS  25  20.949  -1.986   0.450
  227    HE2  LYS  25           2HE      LYS  25  22.643  -3.248   2.618
  228    HE3  LYS  25           1HE      LYS  25  23.111  -2.970   0.945
  229    HZ1  LYS  25           3HZ      LYS  25  23.524  -1.250   3.010
  230    HZ2  LYS  25           1HZ      LYS  25  22.166  -0.592   2.233
  231    HZ3  LYS  25           2HZ      LYS  25  23.592  -0.853   1.353
  232    H    ALA  26           H        ALA  26  19.847  -0.002  -0.877
  233    HA   ALA  26           HA       ALA  26  21.710   0.125  -2.190
  234    HB1  ALA  26           1HB      ALA  26  22.428   2.179  -0.096
  235    HB2  ALA  26           2HB      ALA  26  21.670   2.459  -1.662
  236    HB3  ALA  26           3HB      ALA  26  23.347   1.924  -1.577
  Start of MODEL   18
    1    H1   LYS   1           1HT      LYS   1  10.023   9.309  -5.878
    2    H2   LYS   1           2HT      LYS   1  11.641   9.734  -6.178
    3    H3   LYS   1           3HT      LYS   1  10.997   9.879  -4.617
    4    HA   LYS   1           HA       LYS   1  12.311   7.943  -4.592
    5    HB2  LYS   1           2HB      LYS   1   9.464   7.017  -5.075
    6    HB3  LYS   1           1HB      LYS   1  10.680   6.236  -4.072
    7    HG2  LYS   1           2HG      LYS   1  10.701   8.300  -2.616
    8    HG3  LYS   1           1HG      LYS   1   9.336   8.906  -3.553
    9    HD2  LYS   1           2HD      LYS   1   8.569   6.307  -2.884
   10    HD3  LYS   1           1HD      LYS   1   9.378   6.896  -1.432
   11    HE2  LYS   1           2HE      LYS   1   7.025   7.511  -1.297
   12    HE3  LYS   1           1HE      LYS   1   7.973   8.974  -1.563
   13    HZ1  LYS   1           2HZ      LYS   1   5.917   7.946  -3.141
   14    HZ2  LYS   1           3HZ      LYS   1   7.344   7.852  -4.048
   15    HZ3  LYS   1           1HZ      LYS   1   6.844   9.341  -3.414
   16    H    LYS   2           H        LYS   2  13.083   6.066  -5.632
   17    HA   LYS   2           HA       LYS   2  13.141   6.180  -8.477
   18    HB2  LYS   2           2HB      LYS   2  14.327   3.975  -8.279
   19    HB3  LYS   2           1HB      LYS   2  15.040   5.252  -7.293
   20    HG2  LYS   2           2HG      LYS   2  14.255   4.335  -5.295
   21    HG3  LYS   2           1HG      LYS   2  12.932   3.483  -6.084
   22    HD2  LYS   2           2HD      LYS   2  15.573   2.613  -7.031
   23    HD3  LYS   2           1HD      LYS   2  15.339   2.346  -5.304
   24    HE2  LYS   2           2HE      LYS   2  14.574   0.396  -6.624
   25    HE3  LYS   2           1HE      LYS   2  13.236   1.146  -5.755
   26    HZ1  LYS   2           3HZ      LYS   2  12.686   0.632  -8.068
   27    HZ2  LYS   2           1HZ      LYS   2  13.921   1.662  -8.598
   28    HZ3  LYS   2           2HZ      LYS   2  12.587   2.301  -7.760
   29    H    ALA   3           H        ALA   3  10.537   6.205  -8.066
   30    HA   ALA   3           HA       ALA   3   9.669   3.555  -9.007
   31    HB1  ALA   3           1HB      ALA   3   8.006   3.291  -7.425
   32    HB2  ALA   3           2HB      ALA   3   7.892   5.022  -7.097
   33    HB3  ALA   3           3HB      ALA   3   9.238   4.086  -6.444
   34    H    LEU   4           H        LEU   4  10.150   6.303 -10.175
   35    HA   LEU   4           HA       LEU   4   7.777   7.638 -10.768
   36    HB2  LEU   4           2HB      LEU   4  10.282   8.126 -11.449
   37    HB3  LEU   4           1HB      LEU   4   9.828   7.249 -12.915
   38    HG   LEU   4           HG       LEU   4   8.359   9.651 -11.787
   39   HD11  LEU   4          1HD1      LEU   4  10.558  10.236 -12.713
   40   HD12  LEU   4          2HD1      LEU   4   9.262  10.823 -13.755
   41   HD13  LEU   4          3HD1      LEU   4  10.166   9.375 -14.199
   42   HD21  LEU   4          3HD2      LEU   4   7.883   7.802 -14.111
   43   HD22  LEU   4          1HD2      LEU   4   7.426   9.501 -14.254
   44   HD23  LEU   4          2HD2      LEU   4   6.718   8.502 -12.989
   45    H    LEU   5           H        LEU   5   9.419   5.209 -12.710
   46    HA   LEU   5           HA       LEU   5   7.573   4.717 -14.682
   47    HB2  LEU   5           2HB      LEU   5   8.583   2.184 -13.656
   48    HB3  LEU   5           1HB      LEU   5   8.923   2.972 -15.193
   49    HG   LEU   5           HG       LEU   5  10.499   4.523 -13.849
   50   HD11  LEU   5          1HD1      LEU   5  11.205   3.852 -11.700
   51   HD12  LEU   5          2HD1      LEU   5  10.538   2.230 -11.882
   52   HD13  LEU   5          3HD1      LEU   5   9.463   3.603 -11.637
   53   HD21  LEU   5          3HD2      LEU   5  11.157   1.567 -14.038
   54   HD22  LEU   5          1HD2      LEU   5  12.323   2.889 -13.974
   55   HD23  LEU   5          2HD2      LEU   5  11.257   2.719 -15.370
   56    H    ALA   6           H        ALA   6   7.650   3.447 -11.421
   57    HA   ALA   6           HA       ALA   6   5.294   1.855 -11.671
   58    HB1  ALA   6           1HB      ALA   6   5.407   2.092  -9.047
   59    HB2  ALA   6           2HB      ALA   6   7.007   2.750  -9.384
   60    HB3  ALA   6           3HB      ALA   6   6.603   1.114  -9.899
   61    H    LEU   7           H        LEU   7   6.003   5.025 -10.291
   62    HA   LEU   7           HA       LEU   7   3.443   5.668  -9.376
   63    HB2  LEU   7           2HB      LEU   7   4.539   7.531  -8.759
   64    HB3  LEU   7           1HB      LEU   7   5.926   6.996  -9.691
   65    HG   LEU   7           HG       LEU   7   4.849   8.078 -11.726
   66   HD11  LEU   7          1HD1      LEU   7   2.728   8.434  -9.797
   67   HD12  LEU   7          2HD1      LEU   7   2.715   8.760 -11.530
   68   HD13  LEU   7          3HD1      LEU   7   3.261  10.002 -10.401
   69   HD21  LEU   7          3HD2      LEU   7   6.557   9.108  -9.981
   70   HD22  LEU   7          1HD2      LEU   7   5.198  10.166  -9.602
   71   HD23  LEU   7          2HD2      LEU   7   5.851  10.120 -11.243
   72    H    ALA   8           H        ALA   8   4.926   6.130 -12.508
   73    HA   ALA   8           HA       ALA   8   2.841   7.437 -13.841
   74    HB1  ALA   8           1HB      ALA   8   3.809   6.387 -15.913
   75    HB2  ALA   8           2HB      ALA   8   4.874   5.447 -14.868
   76    HB3  ALA   8           3HB      ALA   8   5.002   7.205 -14.902
   77    H    LEU   9           H        LEU   9   3.633   4.004 -13.870
   78    HA   LEU   9           HA       LEU   9   1.302   3.055 -15.105
   79    HB2  LEU   9           2HB      LEU   9   3.539   1.840 -14.377
   80    HB3  LEU   9           1HB      LEU   9   2.613   1.464 -12.928
   81    HG   LEU   9           HG       LEU   9   2.016   0.674 -15.787
   82   HD11  LEU   9          1HD1      LEU   9   2.283  -0.851 -13.180
   83   HD12  LEU   9          2HD1      LEU   9   3.446  -0.834 -14.501
   84   HD13  LEU   9          3HD1      LEU   9   1.866  -1.575 -14.733
   85   HD21  LEU   9          3HD2      LEU   9   0.162   0.710 -13.387
   86   HD22  LEU   9          1HD2      LEU   9  -0.117  -0.319 -14.791
   87   HD23  LEU   9          2HD2      LEU   9  -0.115   1.434 -14.974
   88    H    HIS  10           H        HIS  10   2.129   3.100 -11.687
   89    HA   HIS  10           HA       HIS  10  -0.267   4.171 -10.727
   90    HB2  HIS  10           2HB      HIS  10  -1.184   1.958 -11.559
   91    HB3  HIS  10           1HB      HIS  10  -0.157   1.166 -10.365
   92    HD1  HIS  10           1HD      HIS  10  -2.377   0.357  -9.148
   93    HD2  HIS  10           2HD      HIS  10  -1.789   4.490  -9.182
   94    HE1  HIS  10           1HE      HIS  10  -3.964   1.333  -7.426
   95    HE2  HIS  10           2HE      HIS  10  -3.608   3.848  -7.427
   96    H    HIS  11           H        HIS  11   0.660   5.168  -9.074
   97    HA   HIS  11           HA       HIS  11   2.992   4.285  -7.751
   98    HB2  HIS  11           2HB      HIS  11   1.997   6.031  -5.959
   99    HB3  HIS  11           1HB      HIS  11   2.780   6.547  -7.453
  100    HD1  HIS  11           1HD      HIS  11  -0.573   6.285  -5.800
  101    HD2  HIS  11           2HD      HIS  11   1.005   7.470  -9.485
  102    HE1  HIS  11           1HE      HIS  11  -2.434   7.515  -7.014
  103    HE2  HIS  11           2HE      HIS  11  -1.491   8.241  -9.269
  104    H    LEU  12           H        LEU  12   2.119   2.020  -7.422
  105    HA   LEU  12           HA       LEU  12   0.147   1.277  -5.635
  106    HB2  LEU  12           2HB      LEU  12   2.745   0.124  -6.494
  107    HB3  LEU  12           1HB      LEU  12   2.064  -0.523  -5.005
  108    HG   LEU  12           HG       LEU  12   1.302  -1.838  -6.914
  109   HD11  LEU  12          1HD1      LEU  12  -1.181  -0.335  -6.359
  110   HD12  LEU  12          2HD1      LEU  12  -0.289  -0.855  -4.928
  111   HD13  LEU  12          3HD1      LEU  12  -0.820  -2.044  -6.117
  112   HD21  LEU  12          3HD2      LEU  12  -0.002  -0.844  -8.708
  113   HD22  LEU  12          1HD2      LEU  12   1.528   0.016  -8.585
  114   HD23  LEU  12          2HD2      LEU  12   0.056   0.733  -7.929
  115    H    ALA  13           H        ALA  13   3.380   2.407  -5.048
  116    HA   ALA  13           HA       ALA  13   4.459   3.205  -3.191
  117    HB1  ALA  13           1HB      ALA  13   1.587   3.782  -2.595
  118    HB2  ALA  13           2HB      ALA  13   2.923   4.904  -2.866
  119    HB3  ALA  13           3HB      ALA  13   2.795   4.039  -1.334
  120    H    HIS  14           H        HIS  14   1.639   1.741  -1.675
  121    HA   HIS  14           HA       HIS  14   2.812   0.653   0.548
  122    HB2  HIS  14           2HB      HIS  14   0.556  -0.439  -1.136
  123    HB3  HIS  14           1HB      HIS  14   0.985  -1.073   0.449
  124    HD1  HIS  14           1HD      HIS  14   0.529   0.434   2.516
  125    HD2  HIS  14           2HD      HIS  14  -0.674   2.137  -1.100
  126    HE1  HIS  14           1HE      HIS  14  -0.918   2.427   3.107
  127    HE2  HIS  14           2HE      HIS  14  -1.652   3.492   0.917
  128    H    LEU  15           H        LEU  15   2.529  -0.819  -2.619
  129    HA   LEU  15           HA       LEU  15   3.949  -3.218  -1.831
  130    HB2  LEU  15           2HB      LEU  15   2.807  -2.160  -4.396
  131    HB3  LEU  15           1HB      LEU  15   3.871  -3.562  -4.397
  132    HG   LEU  15           HG       LEU  15   1.310  -3.302  -2.786
  133   HD11  LEU  15          1HD1      LEU  15   0.947  -3.550  -5.232
  134   HD12  LEU  15          2HD1      LEU  15   0.419  -4.977  -4.339
  135   HD13  LEU  15          3HD1      LEU  15   1.949  -5.004  -5.213
  136   HD21  LEU  15          3HD2      LEU  15   2.426  -4.856  -1.520
  137   HD22  LEU  15          1HD2      LEU  15   3.552  -5.257  -2.819
  138   HD23  LEU  15          2HD2      LEU  15   1.932  -5.950  -2.809
  139    H    ALA  16           H        ALA  16   4.903  -0.142  -2.552
  140    HA   ALA  16           HA       ALA  16   7.469  -1.046  -3.691
  141    HB1  ALA  16           1HB      ALA  16   7.199   0.564  -5.217
  142    HB2  ALA  16           2HB      ALA  16   7.264   1.762  -3.927
  143    HB3  ALA  16           3HB      ALA  16   5.714   1.095  -4.429
  144    H    LEU  17           H        LEU  17   6.058   1.229  -1.410
  145    HA   LEU  17           HA       LEU  17   8.118   2.527  -0.300
  146    HB2  LEU  17           2HB      LEU  17   6.488   3.082   1.122
  147    HB3  LEU  17           1HB      LEU  17   5.525   1.716   0.579
  148    HG   LEU  17           HG       LEU  17   7.729   1.213   2.559
  149   HD11  LEU  17          1HD1      LEU  17   5.024   2.408   3.204
  150   HD12  LEU  17          2HD1      LEU  17   6.597   3.145   3.507
  151   HD13  LEU  17          3HD1      LEU  17   6.116   1.699   4.394
  152   HD21  LEU  17          3HD2      LEU  17   5.091   0.011   2.965
  153   HD22  LEU  17          1HD2      LEU  17   6.656  -0.777   2.765
  154   HD23  LEU  17          2HD2      LEU  17   5.716  -0.311   1.348
  155    H    HIS  18           H        HIS  18   7.290  -0.794   0.368
  156    HA   HIS  18           HA       HIS  18   9.447  -1.227   2.199
  157    HB2  HIS  18           2HB      HIS  18   8.786  -3.521   2.198
  158    HB3  HIS  18           1HB      HIS  18   7.328  -2.555   2.092
  159    HD1  HIS  18           1HD      HIS  18   8.872  -5.374   0.543
  160    HD2  HIS  18           2HD      HIS  18   6.501  -2.213  -0.795
  161    HE1  HIS  18           1HE      HIS  18   7.945  -6.080  -1.711
  162    HE2  HIS  18           2HE      HIS  18   6.502  -4.154  -2.552
  163    H    LEU  19           H        LEU  19   8.870  -2.268  -1.113
  164    HA   LEU  19           HA       LEU  19  11.373  -3.437  -1.599
  165    HB2  LEU  19           2HB      LEU  19   9.098  -3.074  -3.082
  166    HB3  LEU  19           1HB      LEU  19  10.210  -1.957  -3.873
  167    HG   LEU  19           HG       LEU  19  10.351  -4.178  -4.913
  168   HD11  LEU  19          1HD1      LEU  19  12.730  -4.437  -4.847
  169   HD12  LEU  19          2HD1      LEU  19  12.831  -3.734  -3.236
  170   HD13  LEU  19          3HD1      LEU  19  12.412  -2.718  -4.618
  171   HD21  LEU  19          3HD2      LEU  19  10.718  -6.149  -3.736
  172   HD22  LEU  19          1HD2      LEU  19   9.768  -5.253  -2.553
  173   HD23  LEU  19          2HD2      LEU  19  11.523  -5.326  -2.396
  174    H    ALA  20           H        ALA  20  10.281  -0.174  -1.505
  175    HA   ALA  20           HA       ALA  20  12.482   1.080  -2.802
  176    HB1  ALA  20           1HB      ALA  20  10.322   1.987  -0.948
  177    HB2  ALA  20           2HB      ALA  20  10.712   2.556  -2.571
  178    HB3  ALA  20           3HB      ALA  20  11.711   3.043  -1.199
  179    H    LEU  21           H        LEU  21  11.695   0.900   0.646
  180    HA   LEU  21           HA       LEU  21  14.185   1.751   1.598
  181    HB2  LEU  21           2HB      LEU  21  11.802   0.873   2.756
  182    HB3  LEU  21           1HB      LEU  21  13.004  -0.293   3.306
  183    HG   LEU  21           HG       LEU  21  12.968   1.513   4.901
  184   HD11  LEU  21          1HD1      LEU  21  15.221   0.613   3.868
  185   HD12  LEU  21          2HD1      LEU  21  15.241   1.989   4.966
  186   HD13  LEU  21          3HD1      LEU  21  15.345   2.251   3.228
  187   HD21  LEU  21          3HD2      LEU  21  11.977   3.341   3.838
  188   HD22  LEU  21          1HD2      LEU  21  12.999   3.199   2.412
  189   HD23  LEU  21          2HD2      LEU  21  13.661   3.855   3.910
  190    H    ALA  22           H        ALA  22  13.018  -1.376   0.631
  191    HA   ALA  22           HA       ALA  22  15.114  -3.003   1.522
  192    HB1  ALA  22           1HB      ALA  22  13.592  -3.367  -1.059
  193    HB2  ALA  22           2HB      ALA  22  12.944  -3.795   0.524
  194    HB3  ALA  22           3HB      ALA  22  14.376  -4.617  -0.096
  195    H    LEU  23           H        LEU  23  14.686  -1.286  -1.521
  196    HA   LEU  23           HA       LEU  23  17.277  -2.038  -2.540
  197    HB2  LEU  23           2HB      LEU  23  14.939  -0.513  -3.492
  198    HB3  LEU  23           1HB      LEU  23  16.489   0.099  -4.069
  199    HG   LEU  23           HG       LEU  23  15.383  -1.696  -5.519
  200   HD11  LEU  23          1HD1      LEU  23  18.185  -1.859  -4.413
  201   HD12  LEU  23          2HD1      LEU  23  17.646  -1.263  -5.981
  202   HD13  LEU  23          3HD1      LEU  23  17.636  -2.992  -5.648
  203   HD21  LEU  23          3HD2      LEU  23  15.219  -3.884  -4.768
  204   HD22  LEU  23          1HD2      LEU  23  14.927  -3.037  -3.250
  205   HD23  LEU  23          2HD2      LEU  23  16.525  -3.700  -3.600
  206    H    LYS  24           H        LYS  24  15.824   0.753  -1.034
  207    HA   LYS  24           HA       LYS  24  17.984   2.547  -1.334
  208    HB2  LYS  24           2HB      LYS  24  16.019   3.625  -0.744
  209    HB3  LYS  24           1HB      LYS  24  15.587   2.403   0.442
  210    HG2  LYS  24           2HG      LYS  24  16.220   4.426   1.625
  211    HG3  LYS  24           1HG      LYS  24  17.468   3.213   1.891
  212    HD2  LYS  24           2HD      LYS  24  18.322   4.482  -0.429
  213    HD3  LYS  24           1HD      LYS  24  17.650   5.803   0.525
  214    HE2  LYS  24           2HE      LYS  24  19.896   3.921   1.249
  215    HE3  LYS  24           1HE      LYS  24  19.902   5.680   1.230
  216    HZ1  LYS  24           3HZ      LYS  24  18.608   3.867   3.177
  217    HZ2  LYS  24           1HZ      LYS  24  18.159   5.504   3.043
  218    HZ3  LYS  24           2HZ      LYS  24  19.756   5.090   3.466
  219    H    LYS  25           H        LYS  25  17.029   0.642   1.496
  220    HA   LYS  25           HA       LYS  25  18.253  -0.234   3.241
  221    HB2  LYS  25           2HB      LYS  25  20.706   0.278   1.537
  222    HB3  LYS  25           1HB      LYS  25  20.556  -0.850   2.885
  223    HG2  LYS  25           2HG      LYS  25  18.675  -1.960   1.524
  224    HG3  LYS  25           1HG      LYS  25  19.280  -1.024   0.155
  225    HD2  LYS  25           2HD      LYS  25  21.111  -2.752   1.832
  226    HD3  LYS  25           1HD      LYS  25  20.233  -3.404   0.448
  227    HE2  LYS  25           2HE      LYS  25  21.825  -2.582  -0.926
  228    HE3  LYS  25           1HE      LYS  25  21.417  -0.948  -0.399
  229    HZ1  LYS  25           3HZ      LYS  25  23.782  -1.636  -0.046
  230    HZ2  LYS  25           1HZ      LYS  25  23.231  -2.736   1.120
  231    HZ3  LYS  25           2HZ      LYS  25  22.985  -1.071   1.343
  232    H    ALA  26           H        ALA  26  21.133   0.740   3.656
  233    HA   ALA  26           HA       ALA  26  20.519   2.794   5.514
  234    HB1  ALA  26           1HB      ALA  26  22.476   1.205   5.659
  235    HB2  ALA  26           2HB      ALA  26  22.873   2.901   5.951
  236    HB3  ALA  26           3HB      ALA  26  23.252   2.157   4.397
  Start of MODEL   19
    1    H1   LYS   1           1HT      LYS   1   8.597  10.314   0.961
    2    H2   LYS   1           2HT      LYS   1   9.558   8.971   1.352
    3    H3   LYS   1           3HT      LYS   1   8.753   9.034  -0.139
    4    HA   LYS   1           HA       LYS   1  10.447  11.298   0.272
    5    HB2  LYS   1           2HB      LYS   1  11.636   8.505   0.230
    6    HB3  LYS   1           1HB      LYS   1  12.554   9.977  -0.089
    7    HG2  LYS   1           2HG      LYS   1  10.931   9.922   2.416
    8    HG3  LYS   1           1HG      LYS   1  12.367   8.903   2.374
    9    HD2  LYS   1           2HD      LYS   1  13.751  10.830   1.758
   10    HD3  LYS   1           1HD      LYS   1  12.329  11.871   1.736
   11    HE2  LYS   1           2HE      LYS   1  13.370  10.367   4.160
   12    HE3  LYS   1           1HE      LYS   1  13.559  12.096   3.866
   13    HZ1  LYS   1           2HZ      LYS   1  10.995  10.631   4.209
   14    HZ2  LYS   1           3HZ      LYS   1  11.123  12.276   3.799
   15    HZ3  LYS   1           1HZ      LYS   1  11.691  11.729   5.300
   16    H    LYS   2           H        LYS   2   8.782  11.483  -1.511
   17    HA   LYS   2           HA       LYS   2   8.028  11.032  -3.701
   18    HB2  LYS   2           2HB      LYS   2   9.757  12.081  -5.252
   19    HB3  LYS   2           1HB      LYS   2   9.165  13.077  -3.925
   20    HG2  LYS   2           2HG      LYS   2  11.174  12.986  -2.775
   21    HG3  LYS   2           1HG      LYS   2  11.608  11.413  -3.440
   22    HD2  LYS   2           2HD      LYS   2  11.433  13.224  -5.634
   23    HD3  LYS   2           1HD      LYS   2  12.373  14.023  -4.374
   24    HE2  LYS   2           2HE      LYS   2  12.934  11.166  -5.182
   25    HE3  LYS   2           1HE      LYS   2  13.664  12.525  -6.039
   26    HZ1  LYS   2           3HZ      LYS   2  15.057  12.902  -4.386
   27    HZ2  LYS   2           1HZ      LYS   2  14.615  11.388  -3.758
   28    HZ3  LYS   2           2HZ      LYS   2  13.847  12.804  -3.202
   29    H    ALA   3           H        ALA   3   8.338   8.571  -3.185
   30    HA   ALA   3           HA       ALA   3  10.508   7.280  -4.583
   31    HB1  ALA   3           1HB      ALA   3   9.404   6.267  -2.596
   32    HB2  ALA   3           2HB      ALA   3   9.369   5.207  -4.006
   33    HB3  ALA   3           3HB      ALA   3   7.922   6.102  -3.537
   34    H    LEU   4           H        LEU   4   9.932   8.654  -6.563
   35    HA   LEU   4           HA       LEU   4   7.695   8.341  -8.138
   36    HB2  LEU   4           2HB      LEU   4  10.546   8.367  -9.159
   37    HB3  LEU   4           1HB      LEU   4   9.108   8.753 -10.094
   38    HG   LEU   4           HG       LEU   4   9.666  10.895  -9.517
   39   HD11  LEU   4          1HD1      LEU   4   8.501  10.135  -6.829
   40   HD12  LEU   4          2HD1      LEU   4   7.527  10.337  -8.284
   41   HD13  LEU   4          3HD1      LEU   4   8.430  11.700  -7.631
   42   HD21  LEU   4          3HD2      LEU   4  11.216   9.535  -7.367
   43   HD22  LEU   4          1HD2      LEU   4  10.768  11.219  -7.091
   44   HD23  LEU   4          2HD2      LEU   4  11.720  10.778  -8.508
   45    H    LEU   5           H        LEU   5  10.538   6.290  -8.029
   46    HA   LEU   5           HA       LEU   5   9.910   4.403  -9.940
   47    HB2  LEU   5           2HB      LEU   5  12.049   4.353  -8.790
   48    HB3  LEU   5           1HB      LEU   5  11.256   3.992  -7.259
   49    HG   LEU   5           HG       LEU   5  10.475   1.842  -8.127
   50   HD11  LEU   5          1HD1      LEU   5  10.089   2.280 -10.434
   51   HD12  LEU   5          2HD1      LEU   5  11.417   1.120 -10.399
   52   HD13  LEU   5          3HD1      LEU   5  11.750   2.828 -10.686
   53   HD21  LEU   5          3HD2      LEU   5  12.922   2.267  -7.261
   54   HD22  LEU   5          1HD2      LEU   5  13.370   1.960  -8.941
   55   HD23  LEU   5          2HD2      LEU   5  12.526   0.721  -8.014
   56    H    ALA   6           H        ALA   6   9.045   4.383  -6.528
   57    HA   ALA   6           HA       ALA   6   7.504   2.048  -6.490
   58    HB1  ALA   6           1HB      ALA   6   6.925   4.550  -4.887
   59    HB2  ALA   6           2HB      ALA   6   8.206   3.408  -4.479
   60    HB3  ALA   6           3HB      ALA   6   6.523   2.889  -4.456
   61    H    LEU   7           H        LEU   7   6.620   5.382  -7.146
   62    HA   LEU   7           HA       LEU   7   3.855   4.989  -7.597
   63    HB2  LEU   7           2HB      LEU   7   5.833   7.093  -8.035
   64    HB3  LEU   7           1HB      LEU   7   4.619   7.036  -9.311
   65    HG   LEU   7           HG       LEU   7   4.006   7.147  -6.342
   66   HD11  LEU   7          1HD1      LEU   7   3.486   9.313  -8.362
   67   HD12  LEU   7          2HD1      LEU   7   5.059   9.196  -7.570
   68   HD13  LEU   7          3HD1      LEU   7   3.602   9.436  -6.608
   69   HD21  LEU   7          3HD2      LEU   7   1.900   6.605  -6.949
   70   HD22  LEU   7          1HD2      LEU   7   2.436   6.391  -8.616
   71   HD23  LEU   7          2HD2      LEU   7   1.867   7.969  -8.068
   72    H    ALA   8           H        ALA   8   6.455   5.476  -9.894
   73    HA   ALA   8           HA       ALA   8   5.230   4.914 -12.279
   74    HB1  ALA   8           1HB      ALA   8   7.934   4.931 -11.288
   75    HB2  ALA   8           2HB      ALA   8   7.363   5.225 -12.927
   76    HB3  ALA   8           3HB      ALA   8   7.716   3.583 -12.399
   77    H    LEU   9           H        LEU   9   6.857   2.635 -10.169
   78    HA   LEU   9           HA       LEU   9   6.302   0.250 -11.494
   79    HB2  LEU   9           2HB      LEU   9   6.944   1.018  -8.710
   80    HB3  LEU   9           1HB      LEU   9   6.136  -0.539  -8.894
   81    HG   LEU   9           HG       LEU   9   8.535   0.239 -10.561
   82   HD11  LEU   9          1HD1      LEU   9   8.650  -1.520  -8.117
   83   HD12  LEU   9          2HD1      LEU   9   8.911   0.220  -8.000
   84   HD13  LEU   9          3HD1      LEU   9   9.977  -0.771  -8.995
   85   HD21  LEU   9          3HD2      LEU   9   7.509  -1.600 -11.566
   86   HD22  LEU   9          1HD2      LEU   9   6.928  -2.245 -10.028
   87   HD23  LEU   9          2HD2      LEU   9   8.631  -2.395 -10.463
   88    H    HIS  10           H        HIS  10   4.583   1.347  -8.627
   89    HA   HIS  10           HA       HIS  10   2.004   0.780  -9.862
   90    HB2  HIS  10           2HB      HIS  10   2.921  -1.354  -8.732
   91    HB3  HIS  10           1HB      HIS  10   2.626  -0.508  -7.214
   92    HD1  HIS  10           1HD      HIS  10   0.850  -2.731  -7.192
   93    HD2  HIS  10           2HD      HIS  10  -0.128   0.580  -9.546
   94    HE1  HIS  10           1HE      HIS  10  -1.647  -2.867  -7.638
   95    HE2  HIS  10           2HE      HIS  10  -2.255  -0.862  -9.087
   96    H    HIS  11           H        HIS  11   0.851   2.521  -9.443
   97    HA   HIS  11           HA       HIS  11   1.391   4.616  -7.801
   98    HB2  HIS  11           2HB      HIS  11  -1.464   3.731  -8.068
   99    HB3  HIS  11           1HB      HIS  11  -0.793   5.358  -8.137
  100    HD1  HIS  11           1HD      HIS  11  -2.499   3.589 -10.378
  101    HD2  HIS  11           2HD      HIS  11   1.506   4.778 -10.488
  102    HE1  HIS  11           1HE      HIS  11  -1.788   3.528 -12.812
  103    HE2  HIS  11           2HE      HIS  11   0.642   4.264 -12.900
  104    H    LEU  12           H        LEU  12   0.286   1.502  -6.828
  105    HA   LEU  12           HA       LEU  12  -0.918   2.029  -4.371
  106    HB2  LEU  12           2HB      LEU  12  -0.340  -0.244  -5.674
  107    HB3  LEU  12           1HB      LEU  12   0.993  -0.254  -4.520
  108    HG   LEU  12           HG       LEU  12  -1.794   0.305  -3.541
  109   HD11  LEU  12          1HD1      LEU  12  -0.673  -2.317  -4.473
  110   HD12  LEU  12          2HD1      LEU  12  -2.319  -1.700  -4.602
  111   HD13  LEU  12          3HD1      LEU  12  -1.719  -2.292  -3.055
  112   HD21  LEU  12          3HD2      LEU  12  -0.771  -0.993  -1.574
  113   HD22  LEU  12          1HD2      LEU  12  -0.086   0.599  -1.909
  114   HD23  LEU  12          2HD2      LEU  12   0.767  -0.855  -2.429
  115    H    ALA  13           H        ALA  13   2.424   1.860  -5.327
  116    HA   ALA  13           HA       ALA  13   4.381   2.533  -4.378
  117    HB1  ALA  13           1HB      ALA  13   2.966   4.342  -2.488
  118    HB2  ALA  13           2HB      ALA  13   2.760   4.623  -4.213
  119    HB3  ALA  13           3HB      ALA  13   4.372   4.655  -3.504
  120    H    HIS  14           H        HIS  14   2.015   2.402  -1.746
  121    HA   HIS  14           HA       HIS  14   3.707   1.925   0.354
  122    HB2  HIS  14           2HB      HIS  14   0.887   1.519  -0.162
  123    HB3  HIS  14           1HB      HIS  14   1.533   0.290   0.926
  124    HD1  HIS  14           1HD      HIS  14   1.620   0.992   3.324
  125    HD2  HIS  14           2HD      HIS  14   1.887   4.272   0.753
  126    HE1  HIS  14           1HE      HIS  14   1.785   3.052   4.794
  127    HE2  HIS  14           2HE      HIS  14   1.953   5.061   3.242
  128    H    LEU  15           H        LEU  15   2.590  -0.403  -2.014
  129    HA   LEU  15           HA       LEU  15   3.810  -2.634  -0.617
  130    HB2  LEU  15           2HB      LEU  15   2.431  -2.307  -3.270
  131    HB3  LEU  15           1HB      LEU  15   3.359  -3.767  -2.926
  132    HG   LEU  15           HG       LEU  15   1.123  -2.703  -1.165
  133   HD11  LEU  15          1HD1      LEU  15  -0.337  -4.181  -2.192
  134   HD12  LEU  15          2HD1      LEU  15   0.955  -5.237  -2.749
  135   HD13  LEU  15          3HD1      LEU  15   0.652  -3.710  -3.572
  136   HD21  LEU  15          3HD2      LEU  15   2.495  -4.005   0.234
  137   HD22  LEU  15          1HD2      LEU  15   2.966  -5.082  -1.077
  138   HD23  LEU  15          2HD2      LEU  15   1.353  -5.202  -0.377
  139    H    ALA  16           H        ALA  16   4.749  -0.238  -2.875
  140    HA   ALA  16           HA       ALA  16   7.120  -1.717  -3.714
  141    HB1  ALA  16           1HB      ALA  16   6.339  -0.393  -5.483
  142    HB2  ALA  16           2HB      ALA  16   7.613   0.615  -4.792
  143    HB3  ALA  16           3HB      ALA  16   5.921   0.949  -4.419
  144    H    LEU  17           H        LEU  17   6.096   0.803  -1.559
  145    HA   LEU  17           HA       LEU  17   8.324   2.136  -0.787
  146    HB2  LEU  17           2HB      LEU  17   6.964   2.839   0.851
  147    HB3  LEU  17           1HB      LEU  17   5.793   1.645   0.315
  148    HG   LEU  17           HG       LEU  17   7.004  -0.030   1.829
  149   HD11  LEU  17          1HD1      LEU  17   7.947   1.964   3.673
  150   HD12  LEU  17          2HD1      LEU  17   8.759   2.196   2.124
  151   HD13  LEU  17          3HD1      LEU  17   8.844   0.636   2.941
  152   HD21  LEU  17          3HD2      LEU  17   4.932   0.655   2.631
  153   HD22  LEU  17          1HD2      LEU  17   5.411   2.346   2.733
  154   HD23  LEU  17          2HD2      LEU  17   5.994   1.191   3.929
  155    H    HIS  18           H        HIS  18   7.412  -1.093   0.190
  156    HA   HIS  18           HA       HIS  18   9.645  -1.591   1.877
  157    HB2  HIS  18           2HB      HIS  18   8.286  -3.729   0.251
  158    HB3  HIS  18           1HB      HIS  18   9.020  -3.853   1.843
  159    HD1  HIS  18           1HD      HIS  18   7.583  -3.174   3.875
  160    HD2  HIS  18           2HD      HIS  18   5.760  -2.421   0.201
  161    HE1  HIS  18           1HE      HIS  18   5.177  -2.537   4.387
  162    HE2  HIS  18           2HE      HIS  18   4.055  -2.043   2.150
  163    H    LEU  19           H        LEU  19   8.928  -2.657  -1.394
  164    HA   LEU  19           HA       LEU  19  11.398  -3.774  -2.035
  165    HB2  LEU  19           2HB      LEU  19   9.773  -4.158  -3.648
  166    HB3  LEU  19           1HB      LEU  19   9.181  -2.499  -3.595
  167    HG   LEU  19           HG       LEU  19  11.977  -2.979  -4.584
  168   HD11  LEU  19          1HD1      LEU  19  11.282  -3.629  -6.754
  169   HD12  LEU  19          2HD1      LEU  19   9.595  -3.231  -6.424
  170   HD13  LEU  19          3HD1      LEU  19  10.330  -4.647  -5.674
  171   HD21  LEU  19          3HD2      LEU  19  10.700  -1.197  -6.250
  172   HD22  LEU  19          1HD2      LEU  19  11.627  -0.737  -4.824
  173   HD23  LEU  19          2HD2      LEU  19   9.876  -0.907  -4.720
  174    H    ALA  20           H        ALA  20  10.311  -0.493  -1.890
  175    HA   ALA  20           HA       ALA  20  12.654   0.672  -3.102
  176    HB1  ALA  20           1HB      ALA  20  10.186   1.649  -2.699
  177    HB2  ALA  20           2HB      ALA  20  11.597   2.699  -2.841
  178    HB3  ALA  20           3HB      ALA  20  10.966   2.277  -1.247
  179    H    LEU  21           H        LEU  21  11.390   0.375   0.171
  180    HA   LEU  21           HA       LEU  21  13.528   1.526   1.548
  181    HB2  LEU  21           2HB      LEU  21  11.253   0.734   2.464
  182    HB3  LEU  21           1HB      LEU  21  12.002  -0.857   2.589
  183    HG   LEU  21           HG       LEU  21  13.585   1.402   3.704
  184   HD11  LEU  21          1HD1      LEU  21  11.092   1.775   4.326
  185   HD12  LEU  21          2HD1      LEU  21  12.271   1.731   5.638
  186   HD13  LEU  21          3HD1      LEU  21  11.267   0.317   5.307
  187   HD21  LEU  21          3HD2      LEU  21  12.814  -1.294   4.867
  188   HD22  LEU  21          1HD2      LEU  21  14.152  -0.259   5.366
  189   HD23  LEU  21          2HD2      LEU  21  14.196  -1.060   3.795
  190    H    ALA  22           H        ALA  22  12.995  -1.755   0.412
  191    HA   ALA  22           HA       ALA  22  15.228  -3.002   1.529
  192    HB1  ALA  22           1HB      ALA  22  13.705  -4.436   0.438
  193    HB2  ALA  22           2HB      ALA  22  15.117  -4.447  -0.620
  194    HB3  ALA  22           3HB      ALA  22  13.715  -3.463  -1.032
  195    H    LEU  23           H        LEU  23  14.896  -1.253  -1.513
  196    HA   LEU  23           HA       LEU  23  17.666  -1.500  -2.224
  197    HB2  LEU  23           2HB      LEU  23  15.502   0.354  -3.240
  198    HB3  LEU  23           1HB      LEU  23  17.108   0.208  -3.953
  199    HG   LEU  23           HG       LEU  23  15.313  -2.196  -3.572
  200   HD11  LEU  23          1HD1      LEU  23  15.483  -0.278  -5.911
  201   HD12  LEU  23          2HD1      LEU  23  14.054  -0.664  -4.951
  202   HD13  LEU  23          3HD1      LEU  23  14.763  -1.883  -6.012
  203   HD21  LEU  23          3HD2      LEU  23  17.286  -3.152  -4.201
  204   HD22  LEU  23          1HD2      LEU  23  17.960  -1.619  -4.748
  205   HD23  LEU  23          2HD2      LEU  23  16.902  -2.545  -5.807
  206    H    LYS  24           H        LYS  24  15.647   1.145  -1.074
  207    HA   LYS  24           HA       LYS  24  17.649   3.091  -0.794
  208    HB2  LYS  24           2HB      LYS  24  15.397   3.816  -0.708
  209    HB3  LYS  24           1HB      LYS  24  14.997   2.686   0.578
  210    HG2  LYS  24           2HG      LYS  24  17.135   4.703   1.125
  211    HG3  LYS  24           1HG      LYS  24  15.469   5.272   1.074
  212    HD2  LYS  24           2HD      LYS  24  14.838   4.082   2.937
  213    HD3  LYS  24           1HD      LYS  24  15.984   2.781   2.632
  214    HE2  LYS  24           2HE      LYS  24  16.424   5.418   3.993
  215    HE3  LYS  24           1HE      LYS  24  16.938   3.809   4.492
  216    HZ1  LYS  24           3HZ      LYS  24  18.173   5.645   2.576
  217    HZ2  LYS  24           1HZ      LYS  24  18.338   3.976   2.298
  218    HZ3  LYS  24           2HZ      LYS  24  18.894   4.655   3.750
  219    H    LYS  25           H        LYS  25  16.649   0.513   1.334
  220    HA   LYS  25           HA       LYS  25  18.814   1.255   3.216
  221    HB2  LYS  25           2HB      LYS  25  16.451   1.448   4.110
  222    HB3  LYS  25           1HB      LYS  25  16.296  -0.292   3.883
  223    HG2  LYS  25           2HG      LYS  25  18.533  -0.387   5.269
  224    HG3  LYS  25           1HG      LYS  25  18.040   1.219   5.808
  225    HD2  LYS  25           2HD      LYS  25  16.045   0.403   6.794
  226    HD3  LYS  25           1HD      LYS  25  16.124  -1.117   5.910
  227    HE2  LYS  25           2HE      LYS  25  18.531  -0.786   7.472
  228    HE3  LYS  25           1HE      LYS  25  17.119  -0.585   8.510
  229    HZ1  LYS  25           3HZ      LYS  25  16.239  -2.668   7.557
  230    HZ2  LYS  25           1HZ      LYS  25  17.681  -2.886   8.419
  231    HZ3  LYS  25           2HZ      LYS  25  17.703  -2.886   6.713
  232    H    ALA  26           H        ALA  26  17.494  -1.607   4.147
  233    HA   ALA  26           HA       ALA  26  18.293  -3.608   2.438
  234    HB1  ALA  26           1HB      ALA  26  20.583  -2.380   3.912
  235    HB2  ALA  26           2HB      ALA  26  20.543  -3.122   2.312
  236    HB3  ALA  26           3HB      ALA  26  20.550  -4.136   3.755
  Start of MODEL   20
    1    H1   LYS   1           1HT      LYS   1   9.982  22.575 -11.973
    2    H2   LYS   1           2HT      LYS   1   9.866  20.912 -11.665
    3    H3   LYS   1           3HT      LYS   1   9.723  22.022 -10.395
    4    HA   LYS   1           HA       LYS   1   7.713  22.928 -11.508
    5    HB2  LYS   1           2HB      LYS   1   7.923  20.327 -13.055
    6    HB3  LYS   1           1HB      LYS   1   6.658  21.545 -13.203
    7    HG2  LYS   1           2HG      LYS   1   9.568  22.172 -13.735
    8    HG3  LYS   1           1HG      LYS   1   8.482  21.597 -14.994
    9    HD2  LYS   1           2HD      LYS   1   6.920  23.535 -14.213
   10    HD3  LYS   1           1HD      LYS   1   8.375  24.184 -13.451
   11    HE2  LYS   1           2HE      LYS   1   8.038  25.079 -15.755
   12    HE3  LYS   1           1HE      LYS   1   9.550  24.183 -15.599
   13    HZ1  LYS   1           2HZ      LYS   1   7.249  22.595 -16.350
   14    HZ2  LYS   1           3HZ      LYS   1   8.834  22.573 -16.964
   15    HZ3  LYS   1           1HZ      LYS   1   7.729  23.740 -17.507
   16    H    LYS   2           H        LYS   2   7.437  22.563  -9.251
   17    HA   LYS   2           HA       LYS   2   7.100  19.993  -8.107
   18    HB2  LYS   2           2HB      LYS   2   5.918  21.347  -6.263
   19    HB3  LYS   2           1HB      LYS   2   7.613  21.710  -6.585
   20    HG2  LYS   2           2HG      LYS   2   7.140  23.804  -7.303
   21    HG3  LYS   2           1HG      LYS   2   5.773  23.254  -8.271
   22    HD2  LYS   2           2HD      LYS   2   4.302  23.282  -6.372
   23    HD3  LYS   2           1HD      LYS   2   5.649  23.490  -5.255
   24    HE2  LYS   2           2HE      LYS   2   4.148  25.560  -6.100
   25    HE3  LYS   2           1HE      LYS   2   5.852  25.733  -5.688
   26    HZ1  LYS   2           3HZ      LYS   2   5.272  26.703  -7.856
   27    HZ2  LYS   2           1HZ      LYS   2   4.833  25.168  -8.418
   28    HZ3  LYS   2           2HZ      LYS   2   6.443  25.485  -7.977
   29    H    ALA   3           H        ALA   3   5.672  19.026  -9.737
   30    HA   ALA   3           HA       ALA   3   2.965  19.923 -10.041
   31    HB1  ALA   3           1HB      ALA   3   3.807  17.051 -10.383
   32    HB2  ALA   3           2HB      ALA   3   4.340  18.272 -11.538
   33    HB3  ALA   3           3HB      ALA   3   2.620  17.976 -11.302
   34    H    LEU   4           H        LEU   4   3.168  20.222  -7.520
   35    HA   LEU   4           HA       LEU   4   2.961  18.253  -5.649
   36    HB2  LEU   4           2HB      LEU   4   2.905  20.748  -5.252
   37    HB3  LEU   4           1HB      LEU   4   1.195  20.702  -5.668
   38    HG   LEU   4           HG       LEU   4   0.711  19.198  -3.831
   39   HD11  LEU   4          1HD1      LEU   4   3.680  18.945  -3.820
   40   HD12  LEU   4          2HD1      LEU   4   2.439  17.721  -3.532
   41   HD13  LEU   4          3HD1      LEU   4   2.863  18.871  -2.262
   42   HD21  LEU   4          3HD2      LEU   4   0.959  20.724  -2.095
   43   HD22  LEU   4          1HD2      LEU   4   1.237  21.765  -3.490
   44   HD23  LEU   4          2HD2      LEU   4   2.609  21.152  -2.566
   45    H    LEU   5           H        LEU   5   0.266  19.731  -7.333
   46    HA   LEU   5           HA       LEU   5  -1.849  18.262  -6.403
   47    HB2  LEU   5           2HB      LEU   5  -2.801  18.483  -8.793
   48    HB3  LEU   5           1HB      LEU   5  -2.423  19.965  -7.921
   49    HG   LEU   5           HG       LEU   5  -0.012  19.296  -9.196
   50   HD11  LEU   5          1HD1      LEU   5  -1.256  19.337 -11.630
   51   HD12  LEU   5          2HD1      LEU   5  -2.358  18.312 -10.712
   52   HD13  LEU   5          3HD1      LEU   5  -0.657  17.874 -10.862
   53   HD21  LEU   5          3HD2      LEU   5  -1.060  21.551  -8.886
   54   HD22  LEU   5          1HD2      LEU   5  -2.186  21.169 -10.191
   55   HD23  LEU   5          2HD2      LEU   5  -0.457  21.297 -10.523
   56    H    ALA   6           H        ALA   6   0.211  17.427  -9.124
   57    HA   ALA   6           HA       ALA   6  -0.956  14.832  -9.488
   58    HB1  ALA   6           1HB      ALA   6   0.088  15.897 -11.390
   59    HB2  ALA   6           2HB      ALA   6   1.012  14.447 -10.997
   60    HB3  ALA   6           3HB      ALA   6   1.618  16.034 -10.522
   61    H    LEU   7           H        LEU   7   1.870  16.114  -7.871
   62    HA   LEU   7           HA       LEU   7   3.172  13.734  -7.183
   63    HB2  LEU   7           2HB      LEU   7   4.250  15.873  -6.826
   64    HB3  LEU   7           1HB      LEU   7   2.976  16.367  -5.715
   65    HG   LEU   7           HG       LEU   7   3.616  14.516  -4.190
   66   HD11  LEU   7          1HD1      LEU   7   5.372  13.889  -6.484
   67   HD12  LEU   7          2HD1      LEU   7   4.707  12.820  -5.251
   68   HD13  LEU   7          3HD1      LEU   7   6.147  13.775  -4.907
   69   HD21  LEU   7          3HD2      LEU   7   5.472  16.717  -4.967
   70   HD22  LEU   7          1HD2      LEU   7   6.095  15.497  -3.854
   71   HD23  LEU   7          2HD2      LEU   7   4.657  16.427  -3.431
   72    H    ALA   8           H        ALA   8   0.847  15.633  -5.335
   73    HA   ALA   8           HA       ALA   8   0.508  13.907  -3.163
   74    HB1  ALA   8           1HB      ALA   8  -0.424  16.257  -3.421
   75    HB2  ALA   8           2HB      ALA   8  -1.531  15.077  -2.718
   76    HB3  ALA   8           3HB      ALA   8  -1.701  15.544  -4.412
   77    H    LEU   9           H        LEU   9  -1.472  14.218  -6.055
   78    HA   LEU   9           HA       LEU   9  -3.231  12.117  -5.701
   79    HB2  LEU   9           2HB      LEU   9  -3.523  13.620  -7.567
   80    HB3  LEU   9           1HB      LEU   9  -1.973  13.139  -8.256
   81    HG   LEU   9           HG       LEU   9  -2.815  10.857  -8.595
   82   HD11  LEU   9          1HD1      LEU   9  -5.167  11.992  -7.110
   83   HD12  LEU   9          2HD1      LEU   9  -4.383  10.427  -6.918
   84   HD13  LEU   9          3HD1      LEU   9  -5.436  10.718  -8.297
   85   HD21  LEU   9          3HD2      LEU   9  -4.840  12.844  -9.651
   86   HD22  LEU   9          1HD2      LEU   9  -4.297  11.349 -10.414
   87   HD23  LEU   9          2HD2      LEU   9  -3.196  12.722 -10.283
   88    H    HIS  10           H        HIS  10  -0.051  12.039  -7.206
   89    HA   HIS  10           HA       HIS  10  -0.072   9.241  -7.720
   90    HB2  HIS  10           2HB      HIS  10   1.586  10.039  -9.021
   91    HB3  HIS  10           1HB      HIS  10   1.812  11.457  -8.001
   92    HD1  HIS  10           1HD      HIS  10   2.680   7.743  -8.020
   93    HD2  HIS  10           2HD      HIS  10   4.083  11.332  -6.416
   94    HE1  HIS  10           1HE      HIS  10   4.850   7.195  -6.825
   95    HE2  HIS  10           2HE      HIS  10   5.723   9.378  -5.836
   96    H    HIS  11           H        HIS  11   1.281  11.210  -5.140
   97    HA   HIS  11           HA       HIS  11   2.728   9.344  -3.733
   98    HB2  HIS  11           2HB      HIS  11   1.348  11.850  -3.048
   99    HB3  HIS  11           1HB      HIS  11   1.621  10.767  -1.686
  100    HD1  HIS  11           1HD      HIS  11   4.329   9.550  -2.908
  101    HD2  HIS  11           2HD      HIS  11   3.479  13.602  -2.337
  102    HE1  HIS  11           1HE      HIS  11   6.564  10.747  -2.782
  103    HE2  HIS  11           2HE      HIS  11   6.063  13.220  -2.455
  104    H    LEU  12           H        LEU  12   1.993   7.302  -3.505
  105    HA   LEU  12           HA       LEU  12  -0.003   6.828  -1.507
  106    HB2  LEU  12           2HB      LEU  12  -1.144   7.119  -3.914
  107    HB3  LEU  12           1HB      LEU  12  -0.660   5.430  -4.052
  108    HG   LEU  12           HG       LEU  12  -2.272   6.572  -1.750
  109   HD11  LEU  12          1HD1      LEU  12  -3.541   6.583  -3.855
  110   HD12  LEU  12          2HD1      LEU  12  -4.153   5.335  -2.770
  111   HD13  LEU  12          3HD1      LEU  12  -3.118   4.897  -4.130
  112   HD21  LEU  12          3HD2      LEU  12  -1.093   4.641  -0.990
  113   HD22  LEU  12          1HD2      LEU  12  -1.343   3.794  -2.514
  114   HD23  LEU  12          2HD2      LEU  12  -2.703   4.057  -1.417
  115    H    ALA  13           H        ALA  13   0.897   4.778  -4.218
  116    HA   ALA  13           HA       ALA  13   1.901   2.689  -4.262
  117    HB1  ALA  13           1HB      ALA  13   3.802   4.386  -4.016
  118    HB2  ALA  13           2HB      ALA  13   4.166   2.713  -3.586
  119    HB3  ALA  13           3HB      ALA  13   3.856   3.902  -2.321
  120    H    HIS  14           H        HIS  14   3.416   1.325  -2.411
  121    HA   HIS  14           HA       HIS  14   2.657   1.098   0.186
  122    HB2  HIS  14           2HB      HIS  14   0.424   0.370  -1.500
  123    HB3  HIS  14           1HB      HIS  14   0.959  -1.017  -0.552
  124    HD1  HIS  14           1HD      HIS  14  -0.843  -0.988   1.250
  125    HD2  HIS  14           2HD      HIS  14   1.077   2.695   0.825
  126    HE1  HIS  14           1HE      HIS  14  -1.577   0.431   3.218
  127    HE2  HIS  14           2HE      HIS  14  -0.420   2.677   2.978
  128    H    LEU  15           H        LEU  15   2.559  -1.179  -2.524
  129    HA   LEU  15           HA       LEU  15   4.089  -3.146  -1.123
  130    HB2  LEU  15           2HB      LEU  15   3.633  -2.873  -4.109
  131    HB3  LEU  15           1HB      LEU  15   4.186  -4.325  -3.272
  132    HG   LEU  15           HG       LEU  15   1.532  -2.960  -2.730
  133   HD11  LEU  15          1HD1      LEU  15   1.839  -5.589  -4.156
  134   HD12  LEU  15          2HD1      LEU  15   1.929  -4.078  -5.058
  135   HD13  LEU  15          3HD1      LEU  15   0.472  -4.479  -4.151
  136   HD21  LEU  15          3HD2      LEU  15   1.001  -5.075  -1.570
  137   HD22  LEU  15          1HD2      LEU  15   2.407  -4.300  -0.847
  138   HD23  LEU  15          2HD2      LEU  15   2.617  -5.681  -1.926
  139    H    ALA  16           H        ALA  16   4.763  -0.376  -3.021
  140    HA   ALA  16           HA       ALA  16   7.456  -1.044  -3.702
  141    HB1  ALA  16           1HB      ALA  16   7.631   1.298  -4.399
  142    HB2  ALA  16           2HB      ALA  16   6.083   1.647  -3.631
  143    HB3  ALA  16           3HB      ALA  16   6.153   0.571  -5.024
  144    H    LEU  17           H        LEU  17   5.997   1.138  -1.355
  145    HA   LEU  17           HA       LEU  17   7.959   2.403  -0.114
  146    HB2  LEU  17           2HB      LEU  17   6.396   2.751   1.444
  147    HB3  LEU  17           1HB      LEU  17   5.402   1.540   0.652
  148    HG   LEU  17           HG       LEU  17   6.664  -0.203   2.059
  149   HD11  LEU  17          1HD1      LEU  17   8.112   2.129   2.825
  150   HD12  LEU  17          2HD1      LEU  17   8.303   0.488   3.442
  151   HD13  LEU  17          3HD1      LEU  17   7.194   1.607   4.235
  152   HD21  LEU  17          3HD2      LEU  17   5.089   1.775   3.704
  153   HD22  LEU  17          1HD2      LEU  17   5.108   0.017   3.823
  154   HD23  LEU  17          2HD2      LEU  17   4.322   0.797   2.450
  155    H    HIS  18           H        HIS  18   7.290  -0.983   0.339
  156    HA   HIS  18           HA       HIS  18   9.496  -1.467   2.123
  157    HB2  HIS  18           2HB      HIS  18   8.330  -3.625   0.400
  158    HB3  HIS  18           1HB      HIS  18   8.914  -3.708   2.054
  159    HD1  HIS  18           1HD      HIS  18   7.230  -3.165   3.934
  160    HD2  HIS  18           2HD      HIS  18   5.751  -2.447   0.102
  161    HE1  HIS  18           1HE      HIS  18   4.755  -2.656   4.199
  162    HE2  HIS  18           2HE      HIS  18   3.843  -2.197   1.868
  163    H    LEU  19           H        LEU  19   8.919  -2.519  -1.183
  164    HA   LEU  19           HA       LEU  19  11.463  -3.458  -1.793
  165    HB2  LEU  19           2HB      LEU  19   9.633  -3.918  -3.266
  166    HB3  LEU  19           1HB      LEU  19   9.310  -2.205  -3.506
  167    HG   LEU  19           HG       LEU  19  12.030  -3.246  -4.230
  168   HD11  LEU  19          1HD1      LEU  19  10.735  -4.908  -5.336
  169   HD12  LEU  19          2HD1      LEU  19  11.059  -3.683  -6.565
  170   HD13  LEU  19          3HD1      LEU  19   9.482  -3.745  -5.775
  171   HD21  LEU  19          3HD2      LEU  19  10.717  -1.511  -6.138
  172   HD22  LEU  19          1HD2      LEU  19  12.172  -1.211  -5.189
  173   HD23  LEU  19          2HD2      LEU  19  10.590  -0.827  -4.518
  174    H    ALA  20           H        ALA  20  10.193  -0.269  -1.585
  175    HA   ALA  20           HA       ALA  20  12.336   1.056  -2.965
  176    HB1  ALA  20           1HB      ALA  20  11.385   3.112  -1.858
  177    HB2  ALA  20           2HB      ALA  20  10.210   2.065  -1.061
  178    HB3  ALA  20           3HB      ALA  20  10.216   2.207  -2.816
  179    H    LEU  21           H        LEU  21  11.410   0.635   0.417
  180    HA   LEU  21           HA       LEU  21  13.630   1.877   1.597
  181    HB2  LEU  21           2HB      LEU  21  11.529  -0.002   2.445
  182    HB3  LEU  21           1HB      LEU  21  13.039  -0.169   3.339
  183    HG   LEU  21           HG       LEU  21  11.624   2.473   2.887
  184   HD11  LEU  21          1HD1      LEU  21  10.512   2.225   4.883
  185   HD12  LEU  21          2HD1      LEU  21  11.738   1.157   5.560
  186   HD13  LEU  21          3HD1      LEU  21  10.567   0.532   4.395
  187   HD21  LEU  21          3HD2      LEU  21  14.192   1.633   4.066
  188   HD22  LEU  21          1HD2      LEU  21  13.233   2.668   5.125
  189   HD23  LEU  21          2HD2      LEU  21  13.677   3.225   3.513
  190    H    ALA  22           H        ALA  22  13.019  -1.509   0.886
  191    HA   ALA  22           HA       ALA  22  15.524  -2.565   1.564
  192    HB1  ALA  22           1HB      ALA  22  13.687  -3.509  -0.654
  193    HB2  ALA  22           2HB      ALA  22  13.520  -3.946   1.048
  194    HB3  ALA  22           3HB      ALA  22  14.941  -4.456   0.139
  195    H    LEU  23           H        LEU  23  14.446  -0.852  -1.259
  196    HA   LEU  23           HA       LEU  23  16.474  -1.514  -3.069
  197    HB2  LEU  23           2HB      LEU  23  14.308   0.117  -3.179
  198    HB3  LEU  23           1HB      LEU  23  15.588   1.315  -3.043
  199    HG   LEU  23           HG       LEU  23  15.785  -0.948  -5.030
  200   HD11  LEU  23          1HD1      LEU  23  13.659   0.233  -5.466
  201   HD12  LEU  23          2HD1      LEU  23  14.844   0.565  -6.728
  202   HD13  LEU  23          3HD1      LEU  23  14.518   1.771  -5.482
  203   HD21  LEU  23          3HD2      LEU  23  17.201   0.774  -6.194
  204   HD22  LEU  23          1HD2      LEU  23  17.831   0.296  -4.623
  205   HD23  LEU  23          2HD2      LEU  23  16.982   1.829  -4.801
  206    H    LYS  24           H        LYS  24  16.274   1.016  -0.640
  207    HA   LYS  24           HA       LYS  24  19.070   1.755  -1.070
  208    HB2  LYS  24           2HB      LYS  24  16.871   2.892   0.651
  209    HB3  LYS  24           1HB      LYS  24  18.543   3.420   0.797
  210    HG2  LYS  24           2HG      LYS  24  17.789   4.961  -0.758
  211    HG3  LYS  24           1HG      LYS  24  18.342   3.684  -1.844
  212    HD2  LYS  24           2HD      LYS  24  16.171   4.148  -2.658
  213    HD3  LYS  24           1HD      LYS  24  15.909   2.752  -1.615
  214    HE2  LYS  24           2HE      LYS  24  14.244   4.594  -1.248
  215    HE3  LYS  24           1HE      LYS  24  15.155   4.172   0.199
  216    HZ1  LYS  24           3HZ      LYS  24  14.879   6.647  -0.645
  217    HZ2  LYS  24           1HZ      LYS  24  16.282   6.243  -1.504
  218    HZ3  LYS  24           2HZ      LYS  24  16.260   6.117   0.190
  219    H    LYS  25           H        LYS  25  16.975   0.464   1.431
  220    HA   LYS  25           HA       LYS  25  19.143   0.034   3.282
  221    HB2  LYS  25           2HB      LYS  25  16.447   0.335   3.595
  222    HB3  LYS  25           1HB      LYS  25  16.608  -1.411   3.732
  223    HG2  LYS  25           2HG      LYS  25  18.728  -0.146   5.222
  224    HG3  LYS  25           1HG      LYS  25  17.185   0.546   5.704
  225    HD2  LYS  25           2HD      LYS  25  17.556  -1.368   7.111
  226    HD3  LYS  25           1HD      LYS  25  16.297  -1.806   5.962
  227    HE2  LYS  25           2HE      LYS  25  17.980  -3.609   6.210
  228    HE3  LYS  25           1HE      LYS  25  17.928  -2.981   4.568
  229    HZ1  LYS  25           3HZ      LYS  25  19.777  -1.413   5.446
  230    HZ2  LYS  25           1HZ      LYS  25  20.171  -3.001   4.983
  231    HZ3  LYS  25           2HZ      LYS  25  19.984  -2.606   6.633
  232    H    ALA  26           H        ALA  26  20.595  -1.334   2.264
  233    HA   ALA  26           HA       ALA  26  19.707  -3.847   1.113
  234    HB1  ALA  26           1HB      ALA  26  21.606  -3.432  -0.029
  235    HB2  ALA  26           2HB      ALA  26  22.460  -4.003   1.403
  236    HB3  ALA  26           3HB      ALA  26  22.172  -2.278   1.175