NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage position program type
8405 1m82 5528 cing 1-original 10 MR format nomenclature mapping





  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    G   1          H5*         G   1   8.483   0.060  16.165
    2   2H5*    G   1          2H5*        G   1   6.901  -0.738  16.180
    3    H4*    G   1           H4*        G   1   9.603  -1.855  15.828
    4    H3*    G   1           H3*        G   1   6.888  -2.397  14.694
    5    H2*    G   1          1H2*        G   1   7.455  -4.712  14.366
    6   2HO*    G   1          2HO*        G   1   9.892  -3.769  14.155
    7    H1*    G   1           H1*        G   1   8.519  -5.121  16.873
    8    H8     G   1           H8         G   1   5.951  -2.574  17.539
    9    H1     G   1           H1         G   1   3.426  -8.364  16.452
   10   1H2     G   1          1H2         G   1   6.587  -9.173  15.294
   11   2H2     G   1          2H2         G   1   4.948  -9.708  15.594
   12    H5T    G   1           H5T        G   1   8.082  -1.649  18.288
   13   1H5*    G   2          H5*         G   2   9.551  -4.197  12.106
   14   2H5*    G   2          2H5*        G   2   9.315  -3.631  10.441
   15    H4*    G   2           H4*        G   2   9.393  -5.969  10.327
   16    H3*    G   2           H3*        G   2   6.602  -4.915  10.035
   17    H2*    G   2          1H2*        G   2   5.776  -7.185   9.879
   18   2HO*    G   2          2HO*        G   2   7.076  -8.782   9.315
   19    H1*    G   2           H1*        G   2   7.089  -8.085  12.117
   20    H8     G   2           H8         G   2   6.535  -4.445  12.722
   21    H1     G   2           H1         G   2   1.322  -7.998  13.808
   22   1H2     G   2          1H2         G   2   3.092 -10.528  12.214
   23   2H2     G   2          2H2         G   2   1.604 -10.041  12.993
   24   1H5*    A   3          H5*         A   3   7.073  -7.894   7.679
   25   2H5*    A   3          2H5*        A   3   6.726  -7.674   5.952
   26    H4*    A   3           H4*        A   3   5.598  -9.621   6.588
   27    H3*    A   3           H3*        A   3   3.759  -7.283   6.253
   28    H2*    A   3          1H2*        A   3   1.888  -8.631   6.953
   29   2HO*    A   3          2HO*        A   3   3.524 -10.615   6.113
   30    H1*    A   3           H1*        A   3   3.134  -9.729   9.162
   31    H8     A   3           H8         A   3   4.581  -6.300   8.814
   32   1H6     A   3          1H6         A   3   1.266  -3.824  11.329
   33   2H6     A   3          2H6         A   3  -0.337  -4.207  11.917
   34    H2     A   3           H2         A   3  -1.144  -8.463  10.745
   35   1H5*    A   4          H5*         A   4   2.053 -10.457   4.471
   36   2H5*    A   4          2H5*        A   4   1.899 -10.286   2.711
   37    H4*    A   4           H4*        A   4  -0.129 -11.179   3.294
   38    H3*    A   4           H3*        A   4  -0.388  -8.210   3.054
   39    H2*    A   4          1H2*        A   4  -2.681  -8.322   3.805
   40   2HO*    A   4          2HO*        A   4  -3.554 -10.158   3.039
   41    H1*    A   4           H1*        A   4  -2.156  -9.849   6.023
   42    H8     A   4           H8         A   4   1.008  -7.940   5.350
   43   1H6     A   4          1H6         A   4  -0.035  -3.889   7.833
   44   2H6     A   4          2H6         A   4  -1.504  -3.275   8.557
   45    H2     A   4           H2         A   4  -4.695  -6.326   7.796
   46   1H5*    G   5          H5*         G   5  -3.497  -9.611   1.155
   47   2H5*    G   5          2H5*        G   5  -3.963  -8.893  -0.400
   48    H4*    G   5           H4*        G   5  -5.783  -8.637   1.094
   49    H3*    G   5           H3*        G   5  -4.339  -6.022   0.657
   50    H2*    G   5          1H2*        G   5  -6.114  -5.004   1.967
   51   2HO*    G   5          2HO*        G   5  -7.438  -7.211   1.165
   52    H1*    G   5           H1*        G   5  -5.946  -6.922   3.990
   53    H8     G   5           H8         G   5  -2.439  -6.595   2.979
   54    H1     G   5           H1         G   5  -4.543  -1.442   6.165
   55   1H2     G   5          1H2         G   5  -7.678  -2.747   5.601
   56   2H2     G   5          2H2         G   5  -6.720  -1.453   6.287
   57   1H5*    C   6          H5*         C   6  -8.172  -5.166   0.454
   58   2H5*    C   6          2H5*        C   6  -8.595  -4.870  -1.243
   59    H4*    C   6           H4*        C   6  -9.831  -3.282  -0.149
   60    H3*    C   6           H3*        C   6  -7.276  -1.995  -1.062
   61    H2*    C   6          1H2*        C   6  -8.013   0.075  -0.045
   62   2HO*    C   6          2HO*        C   6 -10.401  -0.948  -0.473
   63    H1*    C   6           H1*        C   6  -8.718  -1.084   2.366
   64   1H4     C   6          1H4         C   6  -2.139  -1.395   2.489
   65   2H4     C   6          2H4         C   6  -2.507   0.252   2.936
   66    H5     C   6           H5         C   6  -3.822  -2.958   1.720
   67    H6     C   6           H6         C   6  -6.193  -3.253   1.234
   68   1H5*    A   7          H5*         A   7 -10.111   0.279  -2.011
   69   2H5*    A   7          2H5*        A   7 -10.208   1.244  -3.498
   70    H4*    A   7           H4*        A   7 -10.113   2.733  -1.651
   71    H3*    A   7           H3*        A   7  -7.580   2.666  -3.270
   72    H2*    A   7          1H2*        A   7  -6.646   4.321  -1.799
   73   2HO*    A   7          2HO*        A   7  -7.904   5.671  -0.707
   74    H1*    A   7           H1*        A   7  -7.664   3.178   0.569
   75    H8     A   7           H8         A   7  -6.493   0.225  -1.237
   76   1H6     A   7          1H6         A   7  -1.741   0.456  -0.262
   77   2H6     A   7          2H6         A   7  -0.711   1.711   0.394
   78    H2     A   7           H2         A   7  -3.330   5.260   1.185
   79   1H5*    G   8          H5*         G   8  -8.163   6.169  -2.408
   80   2H5*    G   8          2H5*        G   8  -8.606   7.310  -3.692
   81    H4*    G   8           H4*        G   8  -7.061   8.489  -2.470
   82    H3*    G   8           H3*        G   8  -5.754   7.282  -4.870
   83    H2*    G   8          1H2*        G   8  -3.598   8.075  -4.141
   84   2HO*    G   8          2HO*        G   8  -4.998   9.978  -3.060
   85    H1*    G   8           H1*        G   8  -3.842   7.249  -1.515
   86    H8     G   8           H8         G   8  -5.775   4.797  -3.568
   87    H1     G   8           H1         G   8   0.548   3.719  -3.529
   88   1H2     G   8          1H2         G   8   0.762   6.857  -2.106
   89   2H2     G   8          2H2         G   8   1.607   5.437  -2.673
   90   1H5*    G   9          H5*         G   9  -4.287  10.896  -5.039
   91   2H5*    G   9          2H5*        G   9  -4.354  11.692  -6.623
   92    H4*    G   9           H4*        G   9  -2.081  11.547  -6.013
   93    H3*    G   9           H3*        G   9  -2.749   9.481  -8.111
   94    H2*    G   9          1H2*        G   9  -0.391   8.952  -8.142
   95   2HO*    G   9          2HO*        G   9  -0.232  11.484  -7.140
   96    H1*    G   9           H1*        G   9  -0.157   8.962  -5.337
   97    H8     G   9           H8         G   9  -3.409   7.346  -5.984
   98    H1     G   9           H1         G   9   1.569   3.579  -7.452
   99   1H2     G   9          1H2         G   9   3.449   6.448  -7.093
  100   2H2     G   9          2H2         G   9   3.432   4.740  -7.466
  101   1H5*    C  10          H5*         C  10   0.730  11.446  -8.709
  102   2H5*    C  10          2H5*        C  10   0.656  12.386 -10.212
  103    H4*    C  10           H4*        C  10   2.825  11.575 -10.149
  104    H3*    C  10           H3*        C  10   1.153   9.913 -11.999
  105    H2*    C  10          1H2*        C  10   3.048   8.493 -12.419
  106   2HO*    C  10          2HO*        C  10   4.922   9.498 -12.433
  107    H1*    C  10           H1*        C  10   3.865   8.309  -9.752
  108   1H4     C  10          1H4         C  10  -1.341   4.281 -10.355
  109   2H4     C  10          2H4         C  10   0.084   3.288 -10.523
  110    H5     C  10           H5         C  10  -1.230   6.701 -10.156
  111    H6     C  10           H6         C  10   0.266   8.626 -10.101
  112   1H5*    U  11          H5*         U  11   4.062  10.285 -13.913
  113   2H5*    U  11          2H5*        U  11   4.146  10.942 -15.559
  114    H4*    U  11           H4*        U  11   4.998   8.792 -15.756
  115    H3*    U  11           H3*        U  11   2.140   8.871 -16.663
  116    H2*    U  11          1H2*        U  11   2.164   6.522 -17.023
  117   2HO*    U  11          2HO*        U  11   3.994   5.429 -17.449
  118    H1*    U  11           H1*        U  11   3.943   5.893 -14.864
  119    H3     U  11           H3         U  11   0.170   3.523 -14.057
  120    H5     U  11           H5         U  11  -0.722   7.457 -12.852
  121    H6     U  11           H6         U  11   1.356   8.147 -13.846
  122   1H5*    U  12          H5*         U  12   3.433   8.737 -21.767
  123   2H5*    U  12          2H5*        U  12   1.913   7.824 -21.831
  124    H4*    U  12           H4*        U  12   3.381   6.437 -22.926
  125    H3*    U  12           H3*        U  12   2.354   5.316 -20.745
  126    H2*    U  12          1H2*        U  12   4.074   6.017 -19.187
  127   2HO*    U  12          2HO*        U  12   4.472   3.469 -20.261
  128    H1*    U  12           H1*        U  12   6.195   5.220 -21.252
  129    H3     U  12           H3         U  12   9.298   6.429 -18.250
  130    H5     U  12           H5         U  12   6.762   9.769 -18.432
  131    H6     U  12           H6         U  12   5.324   8.500 -19.883
  132   1H5*    C  13          H5*         C  13   3.376   1.622 -19.661
  133   2H5*    C  13          2H5*        C  13   2.480   0.742 -20.913
  134    H4*    C  13           H4*        C  13   1.891   0.082 -18.617
  135    H3*    C  13           H3*        C  13   0.126   0.140 -20.609
  136    H2*    C  13          1H2*        C  13  -0.547   2.469 -20.343
  137   2HO*    C  13          2HO*        C  13  -2.183   0.613 -19.060
  138    H1*    C  13           H1*        C  13  -0.689   1.985 -17.316
  139   1H4     C  13          1H4         C  13   0.058   8.481 -18.276
  140   2H4     C  13          2H4         C  13  -1.365   8.263 -17.284
  141    H5     C  13           H5         C  13   1.316   6.614 -19.177
  142    H6     C  13           H6         C  13   1.461   4.184 -19.296
  143   1H5*    G  14          H5*         G  14  -0.706  -2.975 -16.131
  144   2H5*    G  14          2H5*        G  14   0.144  -1.657 -16.954
  145    H4*    G  14           H4*        G  14   0.751  -4.526 -17.574
  146    H3*    G  14           H3*        G  14   1.703  -3.003 -15.170
  147    H2*    G  14          1H2*        G  14   3.921  -3.871 -15.507
  148   2HO*    G  14          2HO*        G  14   2.551  -5.857 -16.661
  149    H1*    G  14           H1*        G  14   3.958  -3.467 -18.266
  150    H8     G  14           H8         G  14   5.996  -2.038 -17.498
  151    H1     G  14           H1         G  14   2.000   2.359 -15.085
  152   1H2     G  14          1H2         G  14  -0.449  -0.036 -15.620
  153   2H2     G  14          2H2         G  14  -0.069   1.574 -15.054
  154   1H5*    G  15          H5*         G  15   3.784  -5.272 -14.131
  155   2H5*    G  15          2H5*        G  15   3.758  -5.553 -12.380
  156    H4*    G  15           H4*        G  15   5.711  -4.268 -13.122
  157    H3*    G  15           H3*        G  15   3.819  -3.033 -11.157
  158    H2*    G  15          1H2*        G  15   5.195  -1.054 -11.103
  159   2HO*    G  15          2HO*        G  15   7.235  -1.044 -11.862
  160    H1*    G  15           H1*        G  15   5.399  -0.811 -13.848
  161    H8     G  15           H8         G  15   2.093  -2.325 -13.459
  162    H1     G  15           H1         G  15   2.115   3.826 -11.696
  163   1H2     G  15          1H2         G  15   5.550   3.530 -11.795
  164   2H2     G  15          2H2         G  15   4.171   4.563 -11.498
  165   1H5*    C  16          H5*         C  16   7.604  -1.798 -10.198
  166   2H5*    C  16          2H5*        C  16   7.982  -2.437  -8.587
  167    H4*    C  16           H4*        C  16   8.687  -0.183  -8.635
  168    H3*    C  16           H3*        C  16   6.216  -0.625  -6.993
  169    H2*    C  16          1H2*        C  16   6.127   1.726  -6.502
  170   2HO*    C  16          2HO*        C  16   7.959   2.785  -6.382
  171    H1*    C  16           H1*        C  16   6.696   2.585  -9.103
  172   1H4     C  16          1H4         C  16   0.339   0.787  -9.150
  173   2H4     C  16          2H4         C  16   0.369   2.514  -8.889
  174    H5     C  16           H5         C  16   2.362  -0.556  -9.207
  175    H6     C  16           H6         C  16   4.796  -0.499  -9.058
  176   1H5*    C  17          H5*         C  17   8.832   1.975  -5.048
  177   2H5*    C  17          2H5*        C  17   9.246   1.303  -3.459
  178    H4*    C  17           H4*        C  17   8.812   3.654  -3.264
  179    H3*    C  17           H3*        C  17   6.797   1.861  -1.939
  180    H2*    C  17          1H2*        C  17   5.616   3.844  -1.190
  181   2HO*    C  17          2HO*        C  17   7.508   5.469  -2.533
  182    H1*    C  17           H1*        C  17   5.640   5.080  -3.660
  183   1H4     C  17          1H4         C  17   1.293   0.218  -4.553
  184   2H4     C  17          2H4         C  17   0.356   1.553  -3.930
  185    H5     C  17           H5         C  17   3.700   0.249  -4.727
  186    H6     C  17           H6         C  17   5.710   1.577  -4.348
  187   1H5*    U  18          H5*         U  18   8.094   5.168  -0.012
  188   2H5*    U  18          2H5*        U  18   8.355   5.125   1.743
  189    H4*    U  18           H4*        U  18   6.988   7.028   0.914
  190    H3*    U  18           H3*        U  18   6.695   5.776   3.288
  191    H2*    U  18          1H2*        U  18   4.866   4.335   2.816
  192   2HO*    U  18          2HO*        U  18   3.973   6.908   3.428
  193    H1*    U  18           H1*        U  18   3.578   6.328   0.911
  194    H3     U  18           H3         U  18   0.856   3.235  -0.745
  195    H5     U  18           H5         U  18   4.285   1.012   0.222
  196    H6     U  18           H6         U  18   5.295   3.047   0.983
  197   1H5*    U  19          H5*         U  19   4.593   8.444   6.562
  198   2H5*    U  19          2H5*        U  19   4.044   7.678   5.058
  199    H4*    U  19           H4*        U  19   3.567  10.570   5.761
  200    H3*    U  19           H3*        U  19   1.875   8.181   6.415
  201    H2*    U  19          1H2*        U  19  -0.092   9.349   5.721
  202   2HO*    U  19          2HO*        U  19   1.278  11.427   6.630
  203    H1*    U  19           H1*        U  19   1.082  10.686   3.523
  204    H3     U  19           H3         U  19  -1.973   7.936   1.649
  205    H5     U  19           H5         U  19   1.280   5.448   2.561
  206    H6     U  19           H6         U  19   2.261   7.292   3.755
  207   1H5*    G  20          H5*         G  20  -0.590   7.016   8.352
  208   2H5*    G  20          2H5*        G  20  -0.035   7.675   6.803
  209    H4*    G  20           H4*        G  20  -2.410   9.033   7.705
  210    H3*    G  20           H3*        G  20  -2.529   6.061   7.863
  211    H2*    G  20          1H2*        G  20  -4.547   5.989   6.544
  212   2HO*    G  20          2HO*        G  20  -5.817   7.698   6.396
  213    H1*    G  20           H1*        G  20  -3.622   7.568   4.514
  214    H8     G  20           H8         G  20  -0.391   6.312   5.561
  215    H1     G  20           H1         G  20  -3.943   1.695   2.874
  216   1H2     G  20          1H2         G  20  -6.567   3.894   3.313
  217   2H2     G  20          2H2         G  20  -6.034   2.329   2.745
  218   1H5*    U  21          H5*         U  21  -6.143   6.407   8.004
  219   2H5*    U  21          2H5*        U  21  -6.821   5.955   9.580
  220    H4*    U  21           H4*        U  21  -8.012   4.724   7.983
  221    H3*    U  21           H3*        U  21  -6.025   3.054   9.478
  222    H2*    U  21          1H2*        U  21  -6.614   1.138   8.148
  223   2HO*    U  21          2HO*        U  21  -8.936   2.334   8.029
  224    H1*    U  21           H1*        U  21  -6.586   2.458   5.702
  225    H3     U  21           H3         U  21  -2.789  -0.106   6.041
  226    H5     U  21           H5         U  21  -1.819   3.625   7.676
  227    H6     U  21           H6         U  21  -4.155   4.199   7.576
  228   1H5*    U  22          H5*         U  22  -9.524   0.878   9.437
  229   2H5*    U  22          2H5*        U  22 -10.119   0.606  11.087
  230    H4*    U  22           H4*        U  22 -10.326  -1.470  10.119
  231    H3*    U  22           H3*        U  22  -7.724  -1.405  11.627
  232    H2*    U  22          1H2*        U  22  -7.328  -3.679  10.926
  233   2HO*    U  22          2HO*        U  22  -9.056  -4.882  10.687
  234    H1*    U  22           H1*        U  22  -8.024  -3.239   8.265
  235    H3     U  22           H3         U  22  -3.522  -3.547   8.219
  236    H5     U  22           H5         U  22  -4.284   0.347   9.591
  237    H6     U  22           H6         U  22  -6.616  -0.239   9.710
  238   1H5*    U  23          H5*         U  23  -9.826  -5.103  12.449
  239   2H5*    U  23          2H5*        U  23  -9.419  -5.641  14.089
  240    H4*    U  23           H4*        U  23  -8.912  -7.289  12.301
  241    H3*    U  23           H3*        U  23  -6.705  -6.351  14.118
  242    H2*    U  23          1H2*        U  23  -5.189  -7.799  12.954
  243   2HO*    U  23          2HO*        U  23  -5.955  -9.641  12.250
  244    H1*    U  23           H1*        U  23  -6.241  -7.281  10.378
  245    H3     U  23           H3         U  23  -2.026  -5.623  10.349
  246    H5     U  23           H5         U  23  -4.329  -2.707  12.316
  247    H6     U  23           H6         U  23  -6.150  -4.278  12.342
  248   1H5*    C  24          H5*         C  24  -6.818 -10.653  13.605
  249   2H5*    C  24          2H5*        C  24  -6.423 -11.444  15.144
  250    H4*    C  24           H4*        C  24  -5.102 -12.249  13.209
  251    H3*    C  24           H3*        C  24  -3.727 -11.152  15.637
  252    H2*    C  24          1H2*        C  24  -1.592 -11.476  14.582
  253   2HO*    C  24          2HO*        C  24  -2.950 -13.397  13.306
  254    H1*    C  24           H1*        C  24  -2.345 -10.503  12.073
  255   1H4     C  24          1H4         C  24  -1.463  -5.051  15.654
  256   2H4     C  24          2H4         C  24   0.122  -5.485  15.044
  257    H5     C  24           H5         C  24  -3.399  -6.492  15.367
  258    H6     C  24           H6         C  24  -4.190  -8.603  14.437
  259   1H5*    C  25          H5*         C  25  -1.446 -14.335  14.316
  260   2H5*    C  25          2H5*        C  25  -1.566 -15.593  15.561
  261    H4*    C  25           H4*        C  25   0.679 -15.566  14.974
  262    H3*    C  25           H3*        C  25   0.212 -14.138  17.558
  263    H2*    C  25          1H2*        C  25   2.516 -13.474  17.667
  264   2HO*    C  25          2HO*        C  25   2.953 -15.703  16.467
  265    H1*    C  25           H1*        C  25   2.747 -12.686  15.014
  266   1H4     C  25          1H4         C  25  -0.745  -7.914  17.971
  267   2H4     C  25          2H4         C  25   0.894  -7.324  17.808
  268    H5     C  25           H5         C  25  -1.394 -10.161  17.329
  269    H6     C  25           H6         C  25  -0.603 -12.280  16.418
  270    H3T    C  25           H3T        C  25   0.147 -16.343  17.486
  Start of MODEL    2
    1   1H5*    G   1          H5*         G   1   7.947   1.587  15.598
    2   2H5*    G   1          2H5*        G   1   7.847   0.681  17.119
    3    H4*    G   1           H4*        G   1  10.070   0.054  15.249
    4    H3*    G   1           H3*        G   1   7.208  -0.590  14.620
    5    H2*    G   1          1H2*        G   1   7.873  -2.814  13.976
    6   2HO*    G   1          2HO*        G   1  10.148  -1.647  13.406
    7    H1*    G   1           H1*        G   1   9.419  -3.290  16.213
    8    H8     G   1           H8         G   1   6.837  -1.137  17.625
    9    H1     G   1           H1         G   1   4.527  -6.913  16.083
   10   1H2     G   1          1H2         G   1   7.496  -7.292  14.357
   11   2H2     G   1          2H2         G   1   5.963  -7.996  14.823
   12    H5T    G   1           H5T        G   1  10.158   1.227  17.344
   13   1H5*    G   2          H5*         G   2   9.720  -2.148  11.433
   14   2H5*    G   2          2H5*        G   2   9.066  -1.423   9.950
   15    H4*    G   2           H4*        G   2   9.486  -3.750   9.583
   16    H3*    G   2           H3*        G   2   6.605  -2.935   9.589
   17    H2*    G   2          1H2*        G   2   5.944  -5.231   9.262
   18   2HO*    G   2          2HO*        G   2   7.290  -6.659   8.426
   19    H1*    G   2           H1*        G   2   7.563  -6.275  11.235
   20    H8     G   2           H8         G   2   6.753  -2.906  12.524
   21    H1     G   2           H1         G   2   1.858  -6.999  13.072
   22   1H2     G   2          1H2         G   2   3.725  -9.030  10.972
   23   2H2     G   2          2H2         G   2   2.251  -8.827  11.887
   24   1H5*    A   3          H5*         A   3   7.431  -5.484   6.667
   25   2H5*    A   3          2H5*        A   3   6.754  -5.226   5.047
   26    H4*    A   3           H4*        A   3   6.248  -7.446   5.814
   27    H3*    A   3           H3*        A   3   3.930  -5.586   5.463
   28    H2*    A   3          1H2*        A   3   2.423  -7.305   6.243
   29   2HO*    A   3          2HO*        A   3   4.382  -8.898   5.380
   30    H1*    A   3           H1*        A   3   3.890  -7.956   8.479
   31    H8     A   3           H8         A   3   4.721  -4.388   8.127
   32   1H6     A   3          1H6         A   3   0.829  -2.403  10.220
   33   2H6     A   3          2H6         A   3  -0.748  -3.024  10.666
   34    H2     A   3           H2         A   3  -0.776  -7.368   9.569
   35   1H5*    A   4          H5*         A   4   2.825  -9.105   3.773
   36   2H5*    A   4          2H5*        A   4   2.683  -8.967   2.009
   37    H4*    A   4           H4*        A   4   0.843 -10.224   2.554
   38    H3*    A   4           H3*        A   4   0.047  -7.362   2.254
   39    H2*    A   4          1H2*        A   4  -2.194  -7.849   3.007
   40   2HO*    A   4          2HO*        A   4  -1.526 -10.322   2.176
   41    H1*    A   4           H1*        A   4  -1.444  -9.214   5.259
   42    H8     A   4           H8         A   4   1.416  -6.896   4.634
   43   1H6     A   4          1H6         A   4  -0.305  -2.918   6.815
   44   2H6     A   4          2H6         A   4  -1.875  -2.482   7.452
   45    H2     A   4           H2         A   4  -4.570  -5.996   6.751
   46   1H5*    G   5          H5*         G   5  -3.163  -8.655   1.138
   47   2H5*    G   5          2H5*        G   5  -3.538  -8.273  -0.553
   48    H4*    G   5           H4*        G   5  -5.367  -7.538   0.734
   49    H3*    G   5           H3*        G   5  -3.670  -5.171  -0.072
   50    H2*    G   5          1H2*        G   5  -5.372  -3.792   0.936
   51   2HO*    G   5          2HO*        G   5  -6.917  -5.881   0.283
   52    H1*    G   5           H1*        G   5  -5.702  -5.501   3.177
   53    H8     G   5           H8         G   5  -2.061  -5.182   2.539
   54    H1     G   5           H1         G   5  -4.616  -0.035   5.389
   55   1H2     G   5          1H2         G   5  -7.637  -1.465   4.571
   56   2H2     G   5          2H2         G   5  -6.794  -0.128   5.322
   57   1H5*    C   6          H5*         C   6  -7.940  -4.654  -0.864
   58   2H5*    C   6          2H5*        C   6  -8.022  -4.280  -2.596
   59    H4*    C   6           H4*        C   6  -9.584  -2.899  -1.463
   60    H3*    C   6           H3*        C   6  -7.219  -1.490  -2.608
   61    H2*    C   6          1H2*        C   6  -7.874   0.593  -1.617
   62   2HO*    C   6          2HO*        C   6 -10.261  -0.258  -2.012
   63    H1*    C   6           H1*        C   6  -8.577  -0.409   0.878
   64   1H4     C   6          1H4         C   6  -1.993  -0.535   1.027
   65   2H4     C   6          2H4         C   6  -2.461   0.997   1.725
   66    H5     C   6           H5         C   6  -3.581  -2.053   0.013
   67    H6     C   6           H6         C   6  -5.933  -2.422  -0.509
   68   1H5*    A   7          H5*         A   7  -9.043   2.608  -5.214
   69   2H5*    A   7          2H5*        A   7  -7.615   2.006  -4.350
   70    H4*    A   7           H4*        A   7 -10.011   3.343  -3.099
   71    H3*    A   7           H3*        A   7  -7.380   4.481  -3.951
   72    H2*    A   7          1H2*        A   7  -7.198   5.713  -1.895
   73   2HO*    A   7          2HO*        A   7  -9.877   5.525  -2.006
   74    H1*    A   7           H1*        A   7  -7.996   3.651  -0.213
   75    H8     A   7           H8         A   7  -6.101   1.639  -2.551
   76   1H6     A   7          1H6         A   7  -1.542   2.670  -1.145
   77   2H6     A   7          2H6         A   7  -0.881   3.947  -0.136
   78    H2     A   7           H2         A   7  -4.281   6.472   1.260
   79   1H5*    G   8          H5*         G   8  -7.779   7.806  -2.001
   80   2H5*    G   8          2H5*        G   8  -8.070   8.968  -3.310
   81    H4*    G   8           H4*        G   8  -6.193   9.778  -2.226
   82    H3*    G   8           H3*        G   8  -5.416   8.353  -4.740
   83    H2*    G   8          1H2*        G   8  -3.086   8.713  -4.235
   84   2HO*    G   8          2HO*        G   8  -4.010  10.247  -2.008
   85    H1*    G   8           H1*        G   8  -3.236   7.939  -1.580
   86    H8     G   8           H8         G   8  -5.739   5.921  -3.504
   87    H1     G   8           H1         G   8   0.265   3.677  -3.844
   88   1H2     G   8          1H2         G   8   1.145   6.672  -2.407
   89   2H2     G   8          2H2         G   8   1.673   5.128  -3.036
   90   1H5*    G   9          H5*         G   9  -2.821  11.127  -4.273
   91   2H5*    G   9          2H5*        G   9  -2.939  12.393  -5.510
   92    H4*    G   9           H4*        G   9  -0.679  11.999  -5.410
   93    H3*    G   9           H3*        G   9  -1.780  10.338  -7.668
   94    H2*    G   9          1H2*        G   9   0.472   9.587  -8.096
   95   2HO*    G   9          2HO*        G   9   1.883  11.164  -7.762
   96    H1*    G   9           H1*        G   9   1.084   9.135  -5.399
   97    H8     G   9           H8         G   9  -2.483   8.249  -6.390
   98    H1     G   9           H1         G   9   1.789   3.522  -7.136
   99   1H2     G   9          1H2         G   9   4.141   5.941  -6.389
  100   2H2     G   9          2H2         G   9   3.822   4.268  -6.796
  101   1H5*    C  10          H5*         C  10   1.526  12.922  -9.170
  102   2H5*    C  10          2H5*        C  10   1.376  13.071 -10.932
  103    H4*    C  10           H4*        C  10   3.518  12.104 -10.211
  104    H3*    C  10           H3*        C  10   1.732  10.475 -11.992
  105    H2*    C  10          1H2*        C  10   3.388   8.720 -11.975
  106   2HO*    C  10          2HO*        C  10   5.424   9.290 -11.752
  107    H1*    C  10           H1*        C  10   3.823   8.803  -9.224
  108   1H4     C  10          1H4         C  10  -1.971   5.755 -10.206
  109   2H4     C  10          2H4         C  10  -0.799   4.544  -9.782
  110    H5     C  10           H5         C  10  -1.377   8.112 -10.415
  111    H6     C  10           H6         C  10   0.459   9.713 -10.347
  112   1H5*    U  11          H5*         U  11   4.954   9.293 -13.442
  113   2H5*    U  11          2H5*        U  11   5.087   9.760 -15.148
  114    H4*    U  11           H4*        U  11   5.430   7.459 -15.132
  115    H3*    U  11           H3*        U  11   2.604   8.070 -15.967
  116    H2*    U  11          1H2*        U  11   2.254   5.699 -16.256
  117   2HO*    U  11          2HO*        U  11   4.065   4.271 -15.893
  118    H1*    U  11           H1*        U  11   3.506   4.992 -13.848
  119    H3     U  11           H3         U  11  -0.789   4.277 -12.797
  120    H5     U  11           H5         U  11  -0.485   8.480 -12.983
  121    H6     U  11           H6         U  11   1.766   8.194 -13.781
  122   1H5*    U  12          H5*         U  12   3.347   7.646 -21.159
  123   2H5*    U  12          2H5*        U  12   1.780   6.834 -20.967
  124    H4*    U  12           H4*        U  12   3.068   5.443 -22.338
  125    H3*    U  12           H3*        U  12   2.037   4.336 -20.117
  126    H2*    U  12          1H2*        U  12   3.973   4.560 -18.698
  127   2HO*    U  12          2HO*        U  12   4.133   2.159 -20.197
  128    H1*    U  12           H1*        U  12   5.747   3.764 -21.070
  129    H3     U  12           H3         U  12   9.267   4.096 -18.311
  130    H5     U  12           H5         U  12   7.270   7.750 -17.791
  131    H6     U  12           H6         U  12   5.513   6.902 -19.198
  132   1H5*    C  13          H5*         C  13   2.915   1.063 -19.409
  133   2H5*    C  13          2H5*        C  13   1.842  -0.064 -20.262
  134    H4*    C  13           H4*        C  13   1.802  -0.471 -17.886
  135    H3*    C  13           H3*        C  13  -0.460  -0.475 -19.314
  136    H2*    C  13          1H2*        C  13  -1.047   1.855 -18.978
  137   2HO*    C  13          2HO*        C  13  -2.078   0.353 -16.782
  138    H1*    C  13           H1*        C  13  -0.250   1.537 -16.035
  139   1H4     C  13          1H4         C  13   0.197   7.975 -17.409
  140   2H4     C  13          2H4         C  13  -0.864   7.811 -16.026
  141    H5     C  13           H5         C  13   1.090   6.059 -18.596
  142    H6     C  13           H6         C  13   1.171   3.624 -18.670
  143   1H5*    G  14          H5*         G  14   0.950  -2.148 -19.049
  144   2H5*    G  14          2H5*        G  14   0.907  -3.793 -19.709
  145    H4*    G  14           H4*        G  14   2.532  -4.500 -18.379
  146    H3*    G  14           H3*        G  14   1.069  -3.178 -16.116
  147    H2*    G  14          1H2*        G  14   3.071  -2.945 -14.893
  148   2HO*    G  14          2HO*        G  14   3.739  -5.051 -14.874
  149    H1*    G  14           H1*        G  14   4.847  -2.969 -17.212
  150    H8     G  14           H8         G  14   6.211  -0.888 -16.957
  151    H1     G  14           H1         G  14   1.439   2.198 -13.975
  152   1H2     G  14          1H2         G  14  -0.379  -0.705 -14.609
  153   2H2     G  14          2H2         G  14  -0.369   0.902 -13.914
  154   1H5*    G  15          H5*         G  15   1.177  -4.088 -12.146
  155   2H5*    G  15          2H5*        G  15   1.272  -3.120 -13.630
  156    H4*    G  15           H4*        G  15   3.891  -4.003 -12.859
  157    H3*    G  15           H3*        G  15   2.268  -2.940 -10.605
  158    H2*    G  15          1H2*        G  15   3.951  -1.320 -10.029
  159   2HO*    G  15          2HO*        G  15   5.954  -1.910 -10.407
  160    H1*    G  15           H1*        G  15   4.333  -0.352 -12.566
  161    H8     G  15           H8         G  15   0.805  -1.650 -12.390
  162    H1     G  15           H1         G  15   1.500   4.281 -10.090
  163   1H2     G  15          1H2         G  15   4.886   3.678 -10.375
  164   2H2     G  15          2H2         G  15   3.622   4.803  -9.928
  165   1H5*    C  16          H5*         C  16   5.935  -3.657  -8.943
  166   2H5*    C  16          2H5*        C  16   5.880  -4.408  -7.336
  167    H4*    C  16           H4*        C  16   7.063  -2.351  -7.169
  168    H3*    C  16           H3*        C  16   4.358  -2.321  -5.870
  169    H2*    C  16          1H2*        C  16   4.710  -0.022  -5.239
  170   2HO*    C  16          2HO*        C  16   7.277  -0.773  -5.384
  171    H1*    C  16           H1*        C  16   5.711   0.793  -7.709
  172   1H4     C  16          1H4         C  16  -0.821   0.199  -8.539
  173   2H4     C  16          2H4         C  16  -0.477   1.903  -8.317
  174    H5     C  16           H5         C  16   0.900  -1.505  -8.337
  175    H6     C  16           H6         C  16   3.265  -1.906  -7.902
  176   1H5*    C  17          H5*         C  17   7.647  -0.887  -3.551
  177   2H5*    C  17          2H5*        C  17   7.614  -1.396  -1.852
  178    H4*    C  17           H4*        C  17   8.163   0.932  -1.995
  179    H3*    C  17           H3*        C  17   5.514   0.295  -0.746
  180    H2*    C  17          1H2*        C  17   5.082   2.644  -0.464
  181   2HO*    C  17          2HO*        C  17   7.744   2.724  -0.457
  182    H1*    C  17           H1*        C  17   5.837   3.378  -3.030
  183   1H4     C  17          1H4         C  17   0.116   0.247  -4.000
  184   2H4     C  17          2H4         C  17  -0.309   1.928  -3.818
  185    H5     C  17           H5         C  17   2.347  -0.601  -3.673
  186    H6     C  17           H6         C  17   4.646  -0.008  -3.130
  187   1H5*    U  18          H5*         U  18   7.501   3.398   1.310
  188   2H5*    U  18          2H5*        U  18   8.302   2.455   2.580
  189    H4*    U  18           H4*        U  18   7.703   3.865   4.173
  190    H3*    U  18           H3*        U  18   5.194   3.098   3.847
  191    H2*    U  18          1H2*        U  18   4.623   4.386   1.910
  192   2HO*    U  18          2HO*        U  18   4.140   5.936   4.238
  193    H1*    U  18           H1*        U  18   6.028   6.862   2.989
  194    H3     U  18           H3         U  18   6.454   8.898  -0.941
  195    H5     U  18           H5         U  18   5.464   4.969  -2.027
  196    H6     U  18           H6         U  18   5.570   4.372   0.287
  197   1H5*    U  19          H5*         U  19   4.562   7.255   5.302
  198   2H5*    U  19          2H5*        U  19   4.398   6.944   7.041
  199    H4*    U  19           H4*        U  19   2.984   8.676   6.929
  200    H3*    U  19           H3*        U  19   1.258   6.344   6.158
  201    H2*    U  19          1H2*        U  19  -0.557   7.867   5.706
  202   2HO*    U  19          2HO*        U  19   0.703   9.337   7.516
  203    H1*    U  19           H1*        U  19   0.980   9.707   4.286
  204    H3     U  19           H3         U  19  -1.147   7.709   0.875
  205    H5     U  19           H5         U  19   1.514   4.764   2.236
  206    H6     U  19           H6         U  19   2.081   6.224   4.060
  207   1H5*    G  20          H5*         G  20  -1.068   8.694   7.801
  208   2H5*    G  20          2H5*        G  20  -1.676   8.176   9.385
  209    H4*    G  20           H4*        G  20  -3.502   9.064   8.193
  210    H3*    G  20           H3*        G  20  -3.555   6.113   8.558
  211    H2*    G  20          1H2*        G  20  -5.474   5.863   7.147
  212   2HO*    G  20          2HO*        G  20  -6.096   8.189   8.086
  213    H1*    G  20           H1*        G  20  -4.674   7.601   5.135
  214    H8     G  20           H8         G  20  -1.557   5.993   6.363
  215    H1     G  20           H1         G  20  -4.913   2.302   2.335
  216   1H2     G  20          1H2         G  20  -7.446   4.609   2.814
  217   2H2     G  20          2H2         G  20  -6.928   3.132   2.032
  218   1H5*    U  21          H5*         U  21  -7.058   6.508   9.917
  219   2H5*    U  21          2H5*        U  21  -7.460   5.542  11.350
  220    H4*    U  21           H4*        U  21  -8.516   4.577   9.441
  221    H3*    U  21           H3*        U  21  -6.260   2.952  10.578
  222    H2*    U  21          1H2*        U  21  -6.626   1.297   8.872
  223   2HO*    U  21          2HO*        U  21  -8.919   2.824   8.109
  224    H1*    U  21           H1*        U  21  -6.956   3.125   6.775
  225    H3     U  21           H3         U  21  -2.931   1.133   6.056
  226    H5     U  21           H5         U  21  -2.175   4.091   8.924
  227    H6     U  21           H6         U  21  -4.550   4.448   9.080
  228   1H5*    U  22          H5*         U  22  -9.798   0.609   9.592
  229   2H5*    U  22          2H5*        U  22 -10.318  -0.067  11.148
  230    H4*    U  22           H4*        U  22 -10.684  -1.816   9.717
  231    H3*    U  22           H3*        U  22  -8.000  -2.191  11.000
  232    H2*    U  22          1H2*        U  22  -7.667  -4.188   9.690
  233   2HO*    U  22          2HO*        U  22 -10.297  -4.272   9.749
  234    H1*    U  22           H1*        U  22  -8.477  -3.066   7.285
  235    H3     U  22           H3         U  22  -3.993  -3.053   6.833
  236    H5     U  22           H5         U  22  -4.766   0.145   9.435
  237    H6     U  22           H6         U  22  -7.057  -0.586   9.529
  238   1H5*    U  23          H5*         U  23  -9.628  -5.691  11.287
  239   2H5*    U  23          2H5*        U  23  -9.558  -6.519  12.855
  240    H4*    U  23           H4*        U  23  -8.533  -7.951  11.305
  241    H3*    U  23           H3*        U  23  -6.477  -6.555  13.006
  242    H2*    U  23          1H2*        U  23  -4.778  -7.812  11.846
  243   2HO*    U  23          2HO*        U  23  -5.375  -9.781  11.300
  244    H1*    U  23           H1*        U  23  -5.884  -7.409   9.301
  245    H3     U  23           H3         U  23  -2.121  -4.888   9.421
  246    H5     U  23           H5         U  23  -5.004  -2.606  11.450
  247    H6     U  23           H6         U  23  -6.467  -4.514  11.355
  248   1H5*    C  24          H5*         C  24  -5.916 -10.746  12.939
  249   2H5*    C  24          2H5*        C  24  -5.241 -11.405  14.442
  250    H4*    C  24           H4*        C  24  -3.962 -11.971  12.388
  251    H3*    C  24           H3*        C  24  -2.588 -10.564  14.663
  252    H2*    C  24          1H2*        C  24  -0.541 -10.603  13.389
  253   2HO*    C  24          2HO*        C  24  -1.708 -12.743  12.294
  254    H1*    C  24           H1*        C  24  -1.717  -9.808  10.980
  255   1H4     C  24          1H4         C  24  -1.292  -4.228  14.440
  256   2H4     C  24          2H4         C  24   0.324  -4.497  13.814
  257    H5     C  24           H5         C  24  -3.059  -5.878  14.229
  258    H6     C  24           H6         C  24  -3.626  -8.091  13.371
  259   1H5*    C  25          H5*         C  25   0.011 -13.513  13.113
  260   2H5*    C  25          2H5*        C  25   0.263 -14.667  14.438
  261    H4*    C  25           H4*        C  25   2.358 -14.330  13.424
  262    H3*    C  25           H3*        C  25   2.115 -12.968  16.081
  263    H2*    C  25          1H2*        C  25   4.323 -12.056  15.834
  264   2HO*    C  25          2HO*        C  25   5.779 -12.996  14.555
  265    H1*    C  25           H1*        C  25   4.034 -11.290  13.167
  266   1H4     C  25          1H4         C  25   0.731  -6.764  16.662
  267   2H4     C  25          2H4         C  25   2.314  -6.090  16.356
  268    H5     C  25           H5         C  25   0.124  -9.028  16.042
  269    H6     C  25           H6         C  25   0.911 -11.088  15.002
  270    H3T    C  25           H3T        C  25   3.920 -14.938  15.331
  Start of MODEL    3
    1   1H5*    G   1          H5*         G   1   7.234   0.363  14.774
    2   2H5*    G   1          2H5*        G   1   6.104  -0.104  16.058
    3    H4*    G   1           H4*        G   1   8.663  -1.554  15.399
    4    H3*    G   1           H3*        G   1   5.882  -2.046  14.385
    5    H2*    G   1          1H2*        G   1   6.204  -4.408  14.662
    6   2HO*    G   1          2HO*        G   1   8.194  -4.976  14.107
    7    H1*    G   1           H1*        G   1   7.474  -4.246  17.152
    8    H8     G   1           H8         G   1   4.790  -1.680  17.193
    9    H1     G   1           H1         G   1   2.603  -7.645  18.064
   10   1H2     G   1          1H2         G   1   5.777  -8.616  17.081
   11   2H2     G   1          2H2         G   1   4.181  -9.111  17.599
   12    H5T    G   1           H5T        G   1   8.211  -0.059  17.372
   13   1H5*    G   2          H5*         G   2   8.639  -4.551  12.280
   14   2H5*    G   2          2H5*        G   2   8.560  -4.105  10.565
   15    H4*    G   2           H4*        G   2   8.694  -6.418  10.552
   16    H3*    G   2           H3*        G   2   5.892  -5.499  10.071
   17    H2*    G   2          1H2*        G   2   5.106  -7.786  10.084
   18   2HO*    G   2          2HO*        G   2   7.544  -8.297   9.284
   19    H1*    G   2           H1*        G   2   6.363  -8.507  12.414
   20    H8     G   2           H8         G   2   5.829  -4.866  12.845
   21    H1     G   2           H1         G   2   0.503  -8.273  13.856
   22   1H2     G   2          1H2         G   2   2.269 -10.891  12.413
   23   2H2     G   2          2H2         G   2   0.766 -10.344  13.121
   24   1H5*    A   3          H5*         A   3   6.424  -8.499   7.760
   25   2H5*    A   3          2H5*        A   3   5.992  -8.373   6.043
   26    H4*    A   3           H4*        A   3   4.836 -10.232   6.906
   27    H3*    A   3           H3*        A   3   3.046  -7.873   6.428
   28    H2*    A   3          1H2*        A   3   1.173  -9.163   7.240
   29   2HO*    A   3          2HO*        A   3   2.732 -11.199   6.459
   30    H1*    A   3           H1*        A   3   2.472 -10.118   9.496
   31    H8     A   3           H8         A   3   3.927  -6.746   9.073
   32   1H6     A   3          1H6         A   3   0.506  -4.100  11.243
   33   2H6     A   3          2H6         A   3  -1.142  -4.421  11.739
   34    H2     A   3           H2         A   3  -1.950  -8.722  10.733
   35   1H5*    A   4          H5*         A   4   1.147 -11.124   4.794
   36   2H5*    A   4          2H5*        A   4   1.076 -10.968   3.027
   37    H4*    A   4           H4*        A   4  -1.017 -11.752   3.526
   38    H3*    A   4           H3*        A   4  -1.092  -8.792   3.198
   39    H2*    A   4          1H2*        A   4  -3.375  -8.675   3.951
   40   2HO*    A   4          2HO*        A   4  -3.460 -11.133   3.003
   41    H1*    A   4           H1*        A   4  -3.054 -10.236   6.187
   42    H8     A   4           H8         A   4   0.274  -8.603   5.545
   43   1H6     A   4          1H6         A   4  -0.432  -4.496   8.034
   44   2H6     A   4          2H6         A   4  -1.843  -3.763   8.766
   45    H2     A   4           H2         A   4  -5.275  -6.548   8.018
   46   1H5*    G   5          H5*         G   5  -4.553  -9.834   1.361
   47   2H5*    G   5          2H5*        G   5  -4.784  -8.932  -0.149
   48    H4*    G   5           H4*        G   5  -6.592  -8.519   1.410
   49    H3*    G   5           H3*        G   5  -4.845  -6.109   0.889
   50    H2*    G   5          1H2*        G   5  -6.507  -4.867   2.159
   51   2HO*    G   5          2HO*        G   5  -8.070  -6.906   1.400
   52    H1*    G   5           H1*        G   5  -6.535  -6.747   4.229
   53    H8     G   5           H8         G   5  -3.016  -6.815   3.278
   54    H1     G   5           H1         G   5  -4.609  -1.318   6.173
   55   1H2     G   5          1H2         G   5  -7.852  -2.301   5.590
   56   2H2     G   5          2H2         G   5  -6.769  -1.087   6.238
   57   1H5*    C   6          H5*         C   6  -8.893  -4.985   0.530
   58   2H5*    C   6          2H5*        C   6  -9.058  -4.041  -0.963
   59    H4*    C   6           H4*        C   6 -10.068  -2.954   1.000
   60    H3*    C   6           H3*        C   6  -7.862  -1.527  -0.462
   61    H2*    C   6          1H2*        C   6  -8.064   0.299   1.084
   62   2HO*    C   6          2HO*        C   6 -10.585  -0.539   1.163
   63    H1*    C   6           H1*        C   6  -8.413  -1.311   3.377
   64   1H4     C   6          1H4         C   6  -1.906  -1.191   2.587
   65   2H4     C   6          2H4         C   6  -2.281   0.400   3.220
   66    H5     C   6           H5         C   6  -3.611  -2.753   1.877
   67    H6     C   6           H6         C   6  -6.013  -3.116   1.665
   68   1H5*    A   7          H5*         A   7 -10.175   1.491   0.794
   69   2H5*    A   7          2H5*        A   7 -11.107   1.916  -0.655
   70    H4*    A   7           H4*        A   7 -10.586   3.980   0.156
   71    H3*    A   7           H3*        A   7  -8.474   3.261  -1.850
   72    H2*    A   7          1H2*        A   7  -7.332   5.334  -1.353
   73   2HO*    A   7          2HO*        A   7  -9.736   6.161  -0.760
   74    H1*    A   7           H1*        A   7  -7.450   5.042   1.393
   75    H8     A   7           H8         A   7  -7.212   1.671  -0.356
   76   1H6     A   7          1H6         A   7  -2.372   1.223  -0.298
   77   2H6     A   7          2H6         A   7  -1.072   2.312   0.144
   78    H2     A   7           H2         A   7  -2.978   6.160   1.406
   79   1H5*    G   8          H5*         G   8  -6.876   4.746  -4.804
   80   2H5*    G   8          2H5*        G   8  -7.161   4.525  -3.067
   81    H4*    G   8           H4*        G   8  -7.280   7.283  -3.520
   82    H3*    G   8           H3*        G   8  -5.187   6.070  -5.265
   83    H2*    G   8          1H2*        G   8  -3.536   7.617  -4.460
   84   2HO*    G   8          2HO*        G   8  -4.241   9.551  -3.929
   85    H1*    G   8           H1*        G   8  -4.077   7.310  -1.792
   86    H8     G   8           H8         G   8  -4.975   3.992  -2.865
   87    H1     G   8           H1         G   8   1.341   4.938  -3.424
   88   1H2     G   8          1H2         G   8   0.552   8.281  -3.036
   89   2H2     G   8          2H2         G   8   1.807   7.085  -3.291
   90   1H5*    G   9          H5*         G   9  -4.688   9.884  -5.686
   91   2H5*    G   9          2H5*        G   9  -5.030  10.530  -7.303
   92    H4*    G   9           H4*        G   9  -3.016  11.511  -6.666
   93    H3*    G   9           H3*        G   9  -2.576   9.271  -8.610
   94    H2*    G   9          1H2*        G   9  -0.188   9.639  -8.468
   95   2HO*    G   9          2HO*        G   9  -0.942  12.084  -7.806
   96    H1*    G   9           H1*        G   9  -0.107   9.645  -5.712
   97    H8     G   9           H8         G   9  -2.943   7.404  -6.208
   98    H1     G   9           H1         G   9   2.581   4.619  -7.877
   99   1H2     G   9          1H2         G   9   3.890   7.815  -7.750
  100   2H2     G   9          2H2         G   9   4.177   6.119  -8.068
  101   1H5*    C  10          H5*         C  10  -0.194  11.815  -9.614
  102   2H5*    C  10          2H5*        C  10  -0.391  12.694 -11.142
  103    H4*    C  10           H4*        C  10   1.849  12.162 -11.116
  104    H3*    C  10           H3*        C  10   0.385  10.168 -12.809
  105    H2*    C  10          1H2*        C  10   2.455   9.002 -13.191
  106   2HO*    C  10          2HO*        C  10   3.455  11.460 -12.663
  107    H1*    C  10           H1*        C  10   3.345   9.132 -10.541
  108   1H4     C  10          1H4         C  10  -1.153   4.303 -10.654
  109   2H4     C  10          2H4         C  10   0.386   3.546 -10.970
  110    H5     C  10           H5         C  10  -1.408   6.717 -10.473
  111    H6     C  10           H6         C  10  -0.238   8.854 -10.579
  112   1H5*    U  11          H5*         U  11   3.272  10.873 -14.674
  113   2H5*    U  11          2H5*        U  11   3.368  11.305 -16.393
  114    H4*    U  11           H4*        U  11   4.558   9.283 -16.104
  115    H3*    U  11           H3*        U  11   1.972   9.047 -17.560
  116    H2*    U  11          1H2*        U  11   1.946   6.705 -17.449
  117   2HO*    U  11          2HO*        U  11   3.795   5.513 -17.525
  118    H1*    U  11           H1*        U  11   3.725   6.425 -15.147
  119    H3     U  11           H3         U  11   0.297   3.578 -14.298
  120    H5     U  11           H5         U  11  -1.210   7.434 -13.497
  121    H6     U  11           H6         U  11   0.788   8.329 -14.487
  122   1H5*    U  12          H5*         U  12   1.698   7.230 -20.504
  123   2H5*    U  12          2H5*        U  12   3.144   7.068 -19.489
  124    H4*    U  12           H4*        U  12   2.793   6.444 -22.403
  125    H3*    U  12           H3*        U  12   2.538   4.668 -20.472
  126    H2*    U  12          1H2*        U  12   4.566   5.131 -19.250
  127   2HO*    U  12          2HO*        U  12   4.695   3.018 -20.977
  128    H1*    U  12           H1*        U  12   6.184   5.277 -21.830
  129    H3     U  12           H3         U  12   9.638   6.386 -19.193
  130    H5     U  12           H5         U  12   6.681   9.180 -18.164
  131    H6     U  12           H6         U  12   5.158   7.974 -19.582
  132   1H5*    C  13          H5*         C  13   3.595   1.355 -20.063
  133   2H5*    C  13          2H5*        C  13   2.666   0.488 -21.300
  134    H4*    C  13           H4*        C  13   2.351  -0.283 -18.939
  135    H3*    C  13           H3*        C  13   0.532  -0.536 -20.842
  136    H2*    C  13          1H2*        C  13  -0.381   1.737 -20.615
  137   2HO*    C  13          2HO*        C  13  -2.209   1.080 -18.838
  138    H1*    C  13           H1*        C  13  -0.465   1.216 -17.588
  139   1H4     C  13          1H4         C  13  -0.511   7.775 -18.268
  140   2H4     C  13          2H4         C  13  -1.992   7.348 -17.443
  141    H5     C  13           H5         C  13   1.025   6.113 -19.128
  142    H6     C  13           H6         C  13   1.467   3.726 -19.333
  143   1H5*    G  14          H5*         G  14   0.288  -3.573 -16.173
  144   2H5*    G  14          2H5*        G  14   0.749  -2.076 -16.999
  145    H4*    G  14           H4*        G  14   2.047  -4.726 -17.584
  146    H3*    G  14           H3*        G  14   2.728  -2.792 -15.385
  147    H2*    G  14          1H2*        G  14   5.061  -3.126 -15.848
  148   2HO*    G  14          2HO*        G  14   4.185  -5.504 -16.641
  149    H1*    G  14           H1*        G  14   4.789  -3.071 -18.641
  150    H8     G  14           H8         G  14   6.469  -1.144 -18.460
  151    H1     G  14           H1         G  14   2.120   2.505 -15.479
  152   1H2     G  14          1H2         G  14   0.227  -0.399 -15.368
  153   2H2     G  14          2H2         G  14   0.331   1.301 -14.969
  154   1H5*    G  15          H5*         G  15   5.495  -4.480 -14.411
  155   2H5*    G  15          2H5*        G  15   5.649  -4.564 -12.646
  156    H4*    G  15           H4*        G  15   7.215  -2.987 -13.734
  157    H3*    G  15           H3*        G  15   5.329  -2.010 -11.621
  158    H2*    G  15          1H2*        G  15   6.263   0.202 -11.851
  159   2HO*    G  15          2HO*        G  15   8.346   0.172 -12.335
  160    H1*    G  15           H1*        G  15   6.075   0.260 -14.604
  161    H8     G  15           H8         G  15   3.242  -1.872 -13.713
  162    H1     G  15           H1         G  15   2.181   4.257 -12.213
  163   1H2     G  15          1H2         G  15   5.555   4.660 -12.774
  164   2H2     G  15          2H2         G  15   4.040   5.402 -12.322
  165   1H5*    C  16          H5*         C  16   9.223  -0.196 -10.681
  166   2H5*    C  16          2H5*        C  16   9.373  -0.388  -8.924
  167    H4*    C  16           H4*        C  16   9.692   1.933  -9.740
  168    H3*    C  16           H3*        C  16   7.560   1.357  -7.699
  169    H2*    C  16          1H2*        C  16   7.010   3.704  -7.682
  170   2HO*    C  16          2HO*        C  16   9.580   3.885  -8.564
  171    H1*    C  16           H1*        C  16   7.116   4.021 -10.464
  172   1H4     C  16          1H4         C  16   1.272   1.176  -9.433
  173   2H4     C  16          2H4         C  16   1.019   2.890  -9.171
  174    H5     C  16           H5         C  16   3.487   0.235  -9.759
  175    H6     C  16           H6         C  16   5.863   0.752  -9.953
  176   1H5*    C  17          H5*         C  17   8.826   5.038  -6.991
  177   2H5*    C  17          2H5*        C  17  10.064   4.793  -5.744
  178    H4*    C  17           H4*        C  17   9.152   6.793  -5.124
  179    H3*    C  17           H3*        C  17   7.830   4.625  -3.536
  180    H2*    C  17          1H2*        C  17   6.397   6.259  -2.500
  181   2HO*    C  17          2HO*        C  17   8.426   7.876  -3.143
  182    H1*    C  17           H1*        C  17   5.672   7.508  -4.856
  183   1H4     C  17          1H4         C  17   2.666   1.637  -5.263
  184   2H4     C  17          2H4         C  17   1.467   2.752  -4.659
  185    H5     C  17           H5         C  17   4.978   2.250  -5.610
  186    H6     C  17           H6         C  17   6.606   4.058  -5.468
  187   1H5*    U  18          H5*         U  18   8.366   7.244  -0.600
  188   2H5*    U  18          2H5*        U  18  10.034   6.920  -0.096
  189    H4*    U  18           H4*        U  18   9.444   6.395   2.054
  190    H3*    U  18           H3*        U  18   7.445   4.834   1.373
  191    H2*    U  18          1H2*        U  18   5.930   6.453   0.452
  192   2HO*    U  18          2HO*        U  18   5.283   6.925   3.174
  193    H1*    U  18           H1*        U  18   6.403   8.458   2.674
  194    H3     U  18           H3         U  18   5.184  12.021   0.328
  195    H5     U  18           H5         U  18   5.803   9.130  -2.653
  196    H6     U  18           H6         U  18   6.536   7.621  -0.940
  197   1H5*    U  19          H5*         U  19   3.757   4.751   5.342
  198   2H5*    U  19          2H5*        U  19   4.065   5.555   3.789
  199    H4*    U  19           H4*        U  19   4.678   7.085   6.247
  200    H3*    U  19           H3*        U  19   1.876   6.250   5.641
  201    H2*    U  19          1H2*        U  19   1.084   8.500   5.814
  202   2HO*    U  19          2HO*        U  19   3.014   8.658   7.593
  203    H1*    U  19           H1*        U  19   3.243   9.752   4.543
  204    H3     U  19           H3         U  19  -0.370  10.163   1.799
  205    H5     U  19           H5         U  19   1.268   6.397   0.937
  206    H6     U  19           H6         U  19   2.714   6.673   2.840
  207   1H5*    G  20          H5*         G  20   0.151   8.767   7.446
  208   2H5*    G  20          2H5*        G  20  -0.234   8.057   9.025
  209    H4*    G  20           H4*        G  20  -2.226   8.978   8.165
  210    H3*    G  20           H3*        G  20  -2.137   5.992   8.153
  211    H2*    G  20          1H2*        G  20  -4.310   5.903   7.098
  212   2HO*    G  20          2HO*        G  20  -4.551   8.316   8.217
  213    H1*    G  20           H1*        G  20  -3.698   7.669   5.090
  214    H8     G  20           H8         G  20  -0.345   6.409   5.662
  215    H1     G  20           H1         G  20  -4.071   1.971   2.922
  216   1H2     G  20          1H2         G  20  -6.680   4.046   3.842
  217   2H2     G  20          2H2         G  20  -6.194   2.547   3.084
  218   1H5*    U  21          H5*         U  21  -5.534   6.263   9.547
  219   2H5*    U  21          2H5*        U  21  -5.881   5.547  11.134
  220    H4*    U  21           H4*        U  21  -7.345   4.588   9.511
  221    H3*    U  21           H3*        U  21  -5.256   2.740  10.609
  222    H2*    U  21          1H2*        U  21  -6.049   0.981   9.184
  223   2HO*    U  21          2HO*        U  21  -8.132   0.939   8.790
  224    H1*    U  21           H1*        U  21  -6.366   2.563   6.897
  225    H3     U  21           H3         U  21  -2.764  -0.256   6.361
  226    H5     U  21           H5         U  21  -1.273   3.258   8.085
  227    H6     U  21           H6         U  21  -3.545   3.964   8.449
  228   1H5*    U  22          H5*         U  22  -9.059   1.014  10.502
  229   2H5*    U  22          2H5*        U  22  -9.588   0.547  12.130
  230    H4*    U  22           H4*        U  22 -10.298  -1.222  10.857
  231    H3*    U  22           H3*        U  22  -7.641  -1.939  12.056
  232    H2*    U  22          1H2*        U  22  -7.733  -4.061  10.904
  233   2HO*    U  22          2HO*        U  22 -10.313  -3.716  11.098
  234    H1*    U  22           H1*        U  22  -8.443  -2.986   8.452
  235    H3     U  22           H3         U  22  -4.035  -3.823   7.945
  236    H5     U  22           H5         U  22  -4.163  -0.273  10.173
  237    H6     U  22           H6         U  22  -6.542  -0.581  10.382
  238   1H5*    U  23          H5*         U  23 -10.106  -5.023  12.661
  239   2H5*    U  23          2H5*        U  23 -10.135  -5.756  14.277
  240    H4*    U  23           H4*        U  23  -9.713  -7.504  12.771
  241    H3*    U  23           H3*        U  23  -7.236  -6.678  14.253
  242    H2*    U  23          1H2*        U  23  -5.991  -8.353  13.047
  243   2HO*    U  23          2HO*        U  23  -6.983 -10.071  12.280
  244    H1*    U  23           H1*        U  23  -7.040  -7.715  10.553
  245    H3     U  23           H3         U  23  -2.874  -5.975  10.470
  246    H5     U  23           H5         U  23  -5.128  -3.199  12.677
  247    H6     U  23           H6         U  23  -6.941  -4.780  12.658
  248   1H5*    C  24          H5*         C  24  -7.487 -10.634  13.916
  249   2H5*    C  24          2H5*        C  24  -7.329 -11.545  15.430
  250    H4*    C  24           H4*        C  24  -5.929 -12.568  13.816
  251    H3*    C  24           H3*        C  24  -4.427 -11.069  15.939
  252    H2*    C  24          1H2*        C  24  -2.352 -11.704  14.876
  253   2HO*    C  24          2HO*        C  24  -3.932 -13.674  13.898
  254    H1*    C  24           H1*        C  24  -3.153 -10.998  12.320
  255   1H4     C  24          1H4         C  24  -2.310  -5.213  15.375
  256   2H4     C  24          2H4         C  24  -0.743  -5.646  14.720
  257    H5     C  24           H5         C  24  -4.209  -6.715  15.295
  258    H6     C  24           H6         C  24  -4.981  -8.914  14.581
  259   1H5*    C  25          H5*         C  25  -2.028 -14.125  15.401
  260   2H5*    C  25          2H5*        C  25  -2.111 -15.154  16.846
  261    H4*    C  25           H4*        C  25   0.165 -14.933  16.314
  262    H3*    C  25           H3*        C  25  -0.643 -13.313  18.699
  263    H2*    C  25          1H2*        C  25   1.571 -12.410  18.877
  264   2HO*    C  25          2HO*        C  25   2.380 -14.653  18.113
  265    H1*    C  25           H1*        C  25   1.932 -11.935  16.149
  266   1H4     C  25          1H4         C  25  -1.968  -7.016  18.172
  267   2H4     C  25          2H4         C  25  -0.323  -6.466  18.427
  268    H5     C  25           H5         C  25  -2.485  -9.278  17.446
  269    H6     C  25           H6         C  25  -1.536 -11.441  16.840
  270    H3T    C  25           H3T        C  25  -0.082 -15.758  18.274
  Start of MODEL    4
    1   1H5*    G   1          H5*         G   1   6.817   0.564  15.599
    2   2H5*    G   1          2H5*        G   1   6.689  -0.482  17.026
    3    H4*    G   1           H4*        G   1   9.141  -0.842  15.461
    4    H3*    G   1           H3*        G   1   6.500  -1.259  14.106
    5    H2*    G   1          1H2*        G   1   7.291  -3.381  13.253
    6   2HO*    G   1          2HO*        G   1   9.663  -2.239  13.547
    7    H1*    G   1           H1*        G   1   8.193  -4.301  15.683
    8    H8     G   1           H8         G   1   5.296  -1.828  15.973
    9    H1     G   1           H1         G   1   3.578  -7.981  15.477
   10   1H2     G   1          1H2         G   1   6.926  -8.565  14.883
   11   2H2     G   1          2H2         G   1   5.314  -9.232  15.047
   12    H5T    G   1           H5T        G   1   8.810   0.234  17.609
   13   1H5*    G   2          H5*         G   2   9.359  -2.095  11.348
   14   2H5*    G   2          2H5*        G   2   9.046  -1.455   9.723
   15    H4*    G   2           H4*        G   2   9.394  -3.798   9.553
   16    H3*    G   2           H3*        G   2   6.547  -2.964   9.089
   17    H2*    G   2          1H2*        G   2   5.981  -5.289   8.715
   18   2HO*    G   2          2HO*        G   2   8.783  -5.786   9.016
   19    H1*    G   2           H1*        G   2   7.275  -6.222  10.973
   20    H8     G   2           H8         G   2   6.067  -2.765  11.764
   21    H1     G   2           H1         G   2   1.522  -7.252  12.279
   22   1H2     G   2          1H2         G   2   3.822  -9.316  10.705
   23   2H2     G   2          2H2         G   2   2.223  -9.153  11.401
   24   1H5*    A   3          H5*         A   3   7.582  -5.456   6.173
   25   2H5*    A   3          2H5*        A   3   7.327  -4.913   4.503
   26    H4*    A   3           H4*        A   3   6.364  -7.020   4.572
   27    H3*    A   3           H3*        A   3   4.280  -4.883   4.737
   28    H2*    A   3          1H2*        A   3   2.558  -6.529   5.060
   29   2HO*    A   3          2HO*        A   3   2.831  -8.407   4.136
   30    H1*    A   3           H1*        A   3   3.890  -8.012   6.968
   31    H8     A   3           H8         A   3   4.873  -4.375   7.278
   32   1H6     A   3          1H6         A   3   1.423  -2.967  10.376
   33   2H6     A   3          2H6         A   3  -0.034  -3.717  10.983
   34    H2     A   3           H2         A   3  -0.239  -7.793   9.107
   35   1H5*    A   4          H5*         A   4   3.201  -7.987   2.451
   36   2H5*    A   4          2H5*        A   4   2.529  -7.664   0.841
   37    H4*    A   4           H4*        A   4   1.094  -9.205   1.905
   38    H3*    A   4           H3*        A   4  -0.047  -6.446   1.681
   39    H2*    A   4          1H2*        A   4  -2.033  -7.166   2.856
   40   2HO*    A   4          2HO*        A   4  -1.492  -9.470   1.825
   41    H1*    A   4           H1*        A   4  -0.687  -8.406   4.917
   42    H8     A   4           H8         A   4   1.529  -5.608   3.772
   43   1H6     A   4          1H6         A   4  -0.262  -2.057   6.538
   44   2H6     A   4          2H6         A   4  -1.693  -1.896   7.531
   45    H2     A   4           H2         A   4  -3.872  -5.814   7.226
   46   1H5*    G   5          H5*         G   5  -3.061  -8.573   0.582
   47   2H5*    G   5          2H5*        G   5  -3.864  -8.112  -0.931
   48    H4*    G   5           H4*        G   5  -5.510  -8.019   0.736
   49    H3*    G   5           H3*        G   5  -4.564  -5.243   0.036
   50    H2*    G   5          1H2*        G   5  -6.233  -4.405   1.575
   51   2HO*    G   5          2HO*        G   5  -7.974  -5.575   1.955
   52    H1*    G   5           H1*        G   5  -5.593  -6.238   3.594
   53    H8     G   5           H8         G   5  -2.321  -5.425   2.118
   54    H1     G   5           H1         G   5  -4.675  -0.656   5.702
   55   1H2     G   5          1H2         G   5  -7.642  -2.396   5.515
   56   2H2     G   5          2H2         G   5  -6.797  -0.982   6.106
   57   1H5*    C   6          H5*         C   6  -8.422  -4.797   0.450
   58   2H5*    C   6          2H5*        C   6  -9.148  -4.555  -1.151
   59    H4*    C   6           H4*        C   6 -10.241  -2.991   0.116
   60    H3*    C   6           H3*        C   6  -7.972  -1.691  -1.326
   61    H2*    C   6          1H2*        C   6  -8.345   0.380  -0.180
   62   2HO*    C   6          2HO*        C   6 -10.817  -0.348  -0.267
   63    H1*    C   6           H1*        C   6  -8.812  -0.712   2.350
   64   1H4     C   6          1H4         C   6  -2.265  -0.957   1.700
   65   2H4     C   6          2H4         C   6  -2.599   0.488   2.624
   66    H5     C   6           H5         C   6  -3.984  -2.335   0.723
   67    H6     C   6           H6         C   6  -6.389  -2.630   0.452
   68   1H5*    A   7          H5*         A   7  -7.586   1.288  -3.835
   69   2H5*    A   7          2H5*        A   7  -7.556   0.475  -2.258
   70    H4*    A   7           H4*        A   7  -9.413   2.715  -2.359
   71    H3*    A   7           H3*        A   7  -6.603   3.260  -3.203
   72    H2*    A   7          1H2*        A   7  -6.390   5.047  -1.612
   73   2HO*    A   7          2HO*        A   7  -8.970   5.276  -2.019
   74    H1*    A   7           H1*        A   7  -7.543   3.733   0.532
   75    H8     A   7           H8         A   7  -5.914   0.847  -0.910
   76   1H6     A   7          1H6         A   7  -1.333   1.579   0.529
   77   2H6     A   7          2H6         A   7  -0.488   2.970   1.179
   78    H2     A   7           H2         A   7  -3.457   6.314   1.389
   79   1H5*    G   8          H5*         G   8  -7.243   6.734  -2.429
   80   2H5*    G   8          2H5*        G   8  -7.435   7.692  -3.910
   81    H4*    G   8           H4*        G   8  -5.908   8.822  -2.497
   82    H3*    G   8           H3*        G   8  -4.753   7.643  -4.974
   83    H2*    G   8          1H2*        G   8  -2.512   8.179  -4.303
   84   2HO*    G   8          2HO*        G   8  -3.751  10.147  -3.043
   85    H1*    G   8           H1*        G   8  -2.711   7.347  -1.676
   86    H8     G   8           H8         G   8  -4.942   5.056  -3.545
   87    H1     G   8           H1         G   8   1.259   3.521  -4.104
   88   1H2     G   8          1H2         G   8   1.858   6.617  -2.713
   89   2H2     G   8          2H2         G   8   2.528   5.136  -3.359
   90   1H5*    G   9          H5*         G   9  -2.874  10.930  -4.615
   91   2H5*    G   9          2H5*        G   9  -3.054  12.133  -5.906
   92    H4*    G   9           H4*        G   9  -0.776  11.975  -5.698
   93    H3*    G   9           H3*        G   9  -1.607  10.110  -7.909
   94    H2*    G   9          1H2*        G   9   0.721   9.565  -8.215
   95   2HO*    G   9          2HO*        G   9   2.000  11.240  -7.887
   96    H1*    G   9           H1*        G   9   1.255   9.294  -5.477
   97    H8     G   9           H8         G   9  -2.164   8.037  -6.610
   98    H1     G   9           H1         G   9   2.544   3.686  -6.810
   99   1H2     G   9          1H2         G   9   4.619   6.368  -6.065
  100   2H2     G   9          2H2         G   9   4.488   4.656  -6.391
  101   1H5*    C  10          H5*         C  10   1.413  12.550  -9.222
  102   2H5*    C  10          2H5*        C  10   1.344  13.012 -10.934
  103    H4*    C  10           H4*        C  10   3.420  11.942 -10.556
  104    H3*    C  10           H3*        C  10   1.497  10.245 -12.117
  105    H2*    C  10          1H2*        C  10   3.200   8.535 -12.248
  106   2HO*    C  10          2HO*        C  10   4.803  10.678 -11.825
  107    H1*    C  10           H1*        C  10   3.878   8.661  -9.551
  108   1H4     C  10          1H4         C  10  -1.934   5.524  -9.992
  109   2H4     C  10          2H4         C  10  -0.719   4.332  -9.629
  110    H5     C  10           H5         C  10  -1.397   7.877 -10.297
  111    H6     C  10           H6         C  10   0.414   9.503 -10.404
  112   1H5*    U  11          H5*         U  11   4.546   9.677 -13.780
  113   2H5*    U  11          2H5*        U  11   4.784  10.014 -15.505
  114    H4*    U  11           H4*        U  11   5.396   7.809 -15.342
  115    H3*    U  11           H3*        U  11   2.530   7.933 -16.228
  116    H2*    U  11          1H2*        U  11   2.457   5.528 -16.238
  117   2HO*    U  11          2HO*        U  11   4.288   4.315 -16.174
  118    H1*    U  11           H1*        U  11   3.831   5.208 -13.809
  119    H3     U  11           H3         U  11  -0.310   4.051 -12.554
  120    H5     U  11           H5         U  11  -0.586   8.210 -13.196
  121    H6     U  11           H6         U  11   1.666   8.142 -14.036
  122   1H5*    U  12          H5*         U  12   3.589   7.466 -21.276
  123   2H5*    U  12          2H5*        U  12   1.867   7.039 -21.282
  124    H4*    U  12           H4*        U  12   2.830   5.256 -22.358
  125    H3*    U  12           H3*        U  12   1.591   4.556 -20.104
  126    H2*    U  12          1H2*        U  12   3.493   4.703 -18.619
  127   2HO*    U  12          2HO*        U  12   4.438   2.288 -19.053
  128    H1*    U  12           H1*        U  12   5.204   3.299 -20.737
  129    H3     U  12           H3         U  12   8.607   3.537 -17.827
  130    H5     U  12           H5         U  12   7.212   7.491 -18.031
  131    H6     U  12           H6         U  12   5.406   6.702 -19.409
  132   1H5*    C  13          H5*         C  13   2.346   0.978 -19.414
  133   2H5*    C  13          2H5*        C  13   1.082  -0.073 -20.084
  134    H4*    C  13           H4*        C  13   1.359  -0.465 -17.719
  135    H3*    C  13           H3*        C  13  -1.071  -0.336 -18.801
  136    H2*    C  13          1H2*        C  13  -1.421   2.046 -18.506
  137   2HO*    C  13          2HO*        C  13  -2.372   1.947 -16.071
  138    H1*    C  13           H1*        C  13  -0.294   1.781 -15.669
  139   1H4     C  13          1H4         C  13   0.470   8.094 -17.444
  140   2H4     C  13          2H4         C  13  -0.449   8.081 -15.955
  141    H5     C  13           H5         C  13   1.102   6.057 -18.602
  142    H6     C  13           H6         C  13   0.995   3.619 -18.549
  143   1H5*    G  14          H5*         G  14   0.263  -2.169 -18.565
  144   2H5*    G  14          2H5*        G  14   0.008  -3.841 -19.096
  145    H4*    G  14           H4*        G  14   1.625  -4.657 -17.791
  146    H3*    G  14           H3*        G  14   0.749  -2.755 -15.630
  147    H2*    G  14          1H2*        G  14   2.927  -2.870 -14.671
  148   2HO*    G  14          2HO*        G  14   2.758  -5.347 -15.327
  149    H1*    G  14           H1*        G  14   4.319  -3.189 -17.169
  150    H8     G  14           H8         G  14   5.666  -1.094 -17.533
  151    H1     G  14           H1         G  14   1.654   2.375 -13.917
  152   1H2     G  14          1H2         G  14  -0.285  -0.498 -13.878
  153   2H2     G  14          2H2         G  14  -0.103   1.167 -13.366
  154   1H5*    G  15          H5*         G  15   2.544  -5.374 -12.561
  155   2H5*    G  15          2H5*        G  15   1.882  -4.369 -11.258
  156    H4*    G  15           H4*        G  15   4.330  -4.097 -12.728
  157    H3*    G  15           H3*        G  15   3.204  -2.960 -10.213
  158    H2*    G  15          1H2*        G  15   4.660  -1.056 -10.342
  159   2HO*    G  15          2HO*        G  15   6.300  -2.678 -11.466
  160    H1*    G  15           H1*        G  15   4.233  -0.497 -13.009
  161    H8     G  15           H8         G  15   1.009  -1.924 -11.935
  162    H1     G  15           H1         G  15   1.826   4.096  -9.912
  163   1H2     G  15          1H2         G  15   5.112   3.651 -10.875
  164   2H2     G  15          2H2         G  15   3.906   4.721 -10.195
  165   1H5*    C  16          H5*         C  16   7.419  -2.338  -9.513
  166   2H5*    C  16          2H5*        C  16   7.703  -3.312  -8.057
  167    H4*    C  16           H4*        C  16   8.633  -1.201  -7.630
  168    H3*    C  16           H3*        C  16   6.050  -1.647  -6.181
  169    H2*    C  16          1H2*        C  16   6.164   0.581  -5.273
  170   2HO*    C  16          2HO*        C  16   8.173   1.189  -4.867
  171    H1*    C  16           H1*        C  16   6.751   1.827  -7.666
  172   1H4     C  16          1H4         C  16   0.429  -0.008  -8.246
  173   2H4     C  16          2H4         C  16   0.430   1.653  -7.678
  174    H5     C  16           H5         C  16   2.478  -1.285  -8.506
  175    H6     C  16           H6         C  16   4.902  -1.230  -8.265
  176   1H5*    C  17          H5*         C  17   9.148  -0.477  -2.978
  177   2H5*    C  17          2H5*        C  17   8.449  -1.052  -1.452
  178    H4*    C  17           H4*        C  17   8.920   1.377  -1.518
  179    H3*    C  17           H3*        C  17   6.106   0.465  -0.961
  180    H2*    C  17          1H2*        C  17   5.519   2.790  -0.651
  181   2HO*    C  17          2HO*        C  17   8.223   2.967  -0.310
  182    H1*    C  17           H1*        C  17   6.695   3.601  -3.023
  183   1H4     C  17          1H4         C  17   1.461   0.067  -4.960
  184   2H4     C  17          2H4         C  17   0.982   1.740  -5.095
  185    H5     C  17           H5         C  17   3.564  -0.644  -4.034
  186    H6     C  17           H6         C  17   5.672   0.106  -3.073
  187   1H5*    U  18          H5*         U  18   8.008   3.585   1.437
  188   2H5*    U  18          2H5*        U  18   8.389   2.562   2.835
  189    H4*    U  18           H4*        U  18   7.973   4.222   4.206
  190    H3*    U  18           H3*        U  18   5.438   3.534   3.891
  191    H2*    U  18          1H2*        U  18   4.932   4.737   1.884
  192   2HO*    U  18          2HO*        U  18   4.403   6.284   4.171
  193    H1*    U  18           H1*        U  18   6.442   7.203   2.834
  194    H3     U  18           H3         U  18   6.990   9.010  -1.183
  195    H5     U  18           H5         U  18   5.830   5.078  -2.085
  196    H6     U  18           H6         U  18   5.907   4.586   0.255
  197   1H5*    U  19          H5*         U  19   4.724   7.773   5.072
  198   2H5*    U  19          2H5*        U  19   4.644   7.523   6.826
  199    H4*    U  19           H4*        U  19   3.101   9.123   6.760
  200    H3*    U  19           H3*        U  19   1.507   6.717   5.939
  201    H2*    U  19          1H2*        U  19  -0.383   8.148   5.494
  202   2HO*    U  19          2HO*        U  19   0.920   9.729   7.264
  203    H1*    U  19           H1*        U  19   1.063  10.090   4.117
  204    H3     U  19           H3         U  19  -0.943   8.032   0.671
  205    H5     U  19           H5         U  19   1.902   5.233   1.973
  206    H6     U  19           H6         U  19   2.378   6.692   3.824
  207   1H5*    G  20          H5*         G  20  -0.815   8.891   7.638
  208   2H5*    G  20          2H5*        G  20  -1.416   8.422   9.239
  209    H4*    G  20           H4*        G  20  -3.269   9.254   8.096
  210    H3*    G  20           H3*        G  20  -3.285   6.265   8.240
  211    H2*    G  20          1H2*        G  20  -5.334   6.216   6.951
  212   2HO*    G  20          2HO*        G  20  -5.457   8.795   7.828
  213    H1*    G  20           H1*        G  20  -4.406   7.857   4.954
  214    H8     G  20           H8         G  20  -1.228   6.416   6.001
  215    H1     G  20           H1         G  20  -4.862   2.127   2.921
  216   1H2     G  20          1H2         G  20  -7.420   4.408   3.417
  217   2H2     G  20          2H2         G  20  -6.943   2.852   2.778
  218   1H5*    U  21          H5*         U  21  -6.725   6.637   8.914
  219   2H5*    U  21          2H5*        U  21  -7.464   5.833  10.312
  220    H4*    U  21           H4*        U  21  -8.450   4.905   8.386
  221    H3*    U  21           H3*        U  21  -6.505   3.055   9.721
  222    H2*    U  21          1H2*        U  21  -6.905   1.411   8.005
  223   2HO*    U  21          2HO*        U  21  -9.257   2.569   7.909
  224    H1*    U  21           H1*        U  21  -6.747   3.184   5.870
  225    H3     U  21           H3         U  21  -2.882   0.710   5.989
  226    H5     U  21           H5         U  21  -2.181   4.084   8.368
  227    H6     U  21           H6         U  21  -4.530   4.591   8.215
  228   1H5*    U  22          H5*         U  22 -10.229   0.477   9.921
  229   2H5*    U  22          2H5*        U  22 -10.167  -0.122  11.589
  230    H4*    U  22           H4*        U  22 -10.339  -1.965  10.053
  231    H3*    U  22           H3*        U  22  -7.708  -1.773  11.501
  232    H2*    U  22          1H2*        U  22  -7.013  -3.785  10.376
  233   2HO*    U  22          2HO*        U  22  -8.444  -5.187   9.660
  234    H1*    U  22           H1*        U  22  -7.954  -3.004   7.863
  235    H3     U  22           H3         U  22  -3.382  -2.885   7.961
  236    H5     U  22           H5         U  22  -4.673   0.915   9.199
  237    H6     U  22           H6         U  22  -6.901   0.013   9.350
  238   1H5*    U  23          H5*         U  23  -9.227  -5.642  11.293
  239   2H5*    U  23          2H5*        U  23  -9.047  -6.528  12.820
  240    H4*    U  23           H4*        U  23  -8.232  -7.843  10.966
  241    H3*    U  23           H3*        U  23  -6.152  -6.953  12.948
  242    H2*    U  23          1H2*        U  23  -4.500  -8.160  11.668
  243   2HO*    U  23          2HO*        U  23  -5.163  -9.920  10.687
  244    H1*    U  23           H1*        U  23  -5.428  -7.278   9.171
  245    H3     U  23           H3         U  23  -1.479  -5.141   9.831
  246    H5     U  23           H5         U  23  -4.319  -2.882  11.950
  247    H6     U  23           H6         U  23  -5.895  -4.659  11.570
  248   1H5*    C  24          H5*         C  24  -5.848 -10.857  12.117
  249   2H5*    C  24          2H5*        C  24  -5.876 -11.964  13.504
  250    H4*    C  24           H4*        C  24  -4.128 -12.709  12.154
  251    H3*    C  24           H3*        C  24  -3.117 -11.185  14.529
  252    H2*    C  24          1H2*        C  24  -0.855 -11.466  13.743
  253   2HO*    C  24          2HO*        C  24  -1.839 -13.647  12.691
  254    H1*    C  24           H1*        C  24  -1.388 -10.753  11.116
  255   1H4     C  24          1H4         C  24  -1.675  -5.076  14.480
  256   2H4     C  24          2H4         C  24  -0.076  -5.169  13.779
  257    H5     C  24           H5         C  24  -3.274  -6.893  14.316
  258    H6     C  24           H6         C  24  -3.657  -9.138  13.447
  259   1H5*    C  25          H5*         C  25  -1.021 -14.776  14.548
  260   2H5*    C  25          2H5*        C  25  -0.849 -15.514  16.153
  261    H4*    C  25           H4*        C  25   1.319 -15.237  15.230
  262    H3*    C  25           H3*        C  25   0.699 -13.390  17.507
  263    H2*    C  25          1H2*        C  25   2.847 -12.347  17.269
  264   2HO*    C  25          2HO*        C  25   4.305 -13.274  15.600
  265    H1*    C  25           H1*        C  25   2.798 -12.186  14.481
  266   1H4     C  25          1H4         C  25  -1.118  -7.307  16.598
  267   2H4     C  25          2H4         C  25   0.455  -6.603  16.291
  268    H5     C  25           H5         C  25  -1.525  -9.698  16.427
  269    H6     C  25           H6         C  25  -0.512 -11.861  15.929
  270    H3T    C  25           H3T        C  25   2.740 -15.246  17.406
  Start of MODEL    5
    1   1H5*    G   1          H5*         G   1   3.467   1.974  16.096
    2   2H5*    G   1          2H5*        G   1   4.305   2.888  17.362
    3    H4*    G   1           H4*        G   1   6.399   1.669  16.725
    4    H3*    G   1           H3*        G   1   4.556   0.195  14.886
    5    H2*    G   1          1H2*        G   1   5.554  -1.898  15.514
    6   2HO*    G   1          2HO*        G   1   7.687  -0.468  15.834
    7    H1*    G   1           H1*        G   1   5.576  -1.433  18.243
    8    H8     G   1           H8         G   1   2.504   0.281  17.242
    9    H1     G   1           H1         G   1   1.872  -6.094  17.048
   10   1H2     G   1          1H2         G   1   5.326  -6.130  17.273
   11   2H2     G   1          2H2         G   1   3.850  -7.059  17.146
   12    H5T    G   1           H5T        G   1   4.384   4.097  15.505
   13   1H5*    G   2          H5*         G   2   8.531  -1.319  13.490
   14   2H5*    G   2          2H5*        G   2   8.403  -1.108  11.733
   15    H4*    G   2           H4*        G   2   9.061  -3.353  12.216
   16    H3*    G   2           H3*        G   2   6.301  -3.063  11.078
   17    H2*    G   2          1H2*        G   2   6.021  -5.460  11.216
   18   2HO*    G   2          2HO*        G   2   8.575  -5.528  10.906
   19    H1*    G   2           H1*        G   2   6.876  -5.665  13.828
   20    H8     G   2           H8         G   2   5.389  -2.270  13.630
   21    H1     G   2           H1         G   2   0.971  -6.892  13.974
   22   1H2     G   2          1H2         G   2   3.631  -9.045  13.339
   23   2H2     G   2          2H2         G   2   1.910  -8.874  13.607
   24   1H5*    A   3          H5*         A   3   7.959  -6.023   8.212
   25   2H5*    A   3          2H5*        A   3   7.997  -5.037   6.737
   26    H4*    A   3           H4*        A   3   7.062  -7.033   6.044
   27    H3*    A   3           H3*        A   3   4.940  -4.972   6.476
   28    H2*    A   3          1H2*        A   3   3.225  -6.610   5.991
   29   2HO*    A   3          2HO*        A   3   3.698  -8.341   4.841
   30    H1*    A   3           H1*        A   3   4.153  -8.479   7.752
   31    H8     A   3           H8         A   3   5.451  -5.477   9.406
   32   1H6     A   3          1H6         A   3   1.454  -3.898  11.645
   33   2H6     A   3          2H6         A   3  -0.250  -4.274  11.495
   34    H2     A   3           H2         A   3  -0.559  -7.463   8.346
   35   1H5*    A   4          H5*         A   4   4.153  -7.101   3.198
   36   2H5*    A   4          2H5*        A   4   3.728  -6.215   1.721
   37    H4*    A   4           H4*        A   4   2.094  -7.904   2.098
   38    H3*    A   4           H3*        A   4   1.124  -5.097   2.490
   39    H2*    A   4          1H2*        A   4  -1.051  -5.936   3.125
   40   2HO*    A   4          2HO*        A   4  -0.202  -8.079   1.715
   41    H1*    A   4           H1*        A   4  -0.109  -7.796   4.925
   42    H8     A   4           H8         A   4   2.468  -5.166   5.178
   43   1H6     A   4          1H6         A   4   0.259  -2.151   8.255
   44   2H6     A   4          2H6         A   4  -1.392  -1.996   8.810
   45    H2     A   4           H2         A   4  -3.730  -5.272   6.833
   46   1H5*    G   5          H5*         G   5  -1.623  -7.280   0.623
   47   2H5*    G   5          2H5*        G   5  -2.058  -6.721  -1.004
   48    H4*    G   5           H4*        G   5  -4.056  -7.341   0.083
   49    H3*    G   5           H3*        G   5  -3.704  -4.416  -0.335
   50    H2*    G   5          1H2*        G   5  -5.652  -3.888   0.963
   51   2HO*    G   5          2HO*        G   5  -7.248  -5.291   1.144
   52    H1*    G   5           H1*        G   5  -5.147  -5.593   3.075
   53    H8     G   5           H8         G   5  -1.760  -4.607   1.976
   54    H1     G   5           H1         G   5  -4.727  -0.034   5.344
   55   1H2     G   5          1H2         G   5  -7.553  -1.925   4.802
   56   2H2     G   5          2H2         G   5  -6.873  -0.480   5.522
   57   1H5*    C   6          H5*         C   6  -7.591  -4.714  -0.568
   58   2H5*    C   6          2H5*        C   6  -8.108  -4.485  -2.250
   59    H4*    C   6           H4*        C   6  -9.571  -3.145  -1.112
   60    H3*    C   6           H3*        C   6  -7.340  -1.515  -2.211
   61    H2*    C   6          1H2*        C   6  -8.032   0.447  -1.021
   62   2HO*    C   6          2HO*        C   6 -10.403  -0.597  -1.331
   63    H1*    C   6           H1*        C   6  -8.552  -0.767   1.414
   64   1H4     C   6          1H4         C   6  -1.982  -0.781   1.063
   65   2H4     C   6          2H4         C   6  -2.396   0.552   2.111
   66    H5     C   6           H5         C   6  -3.590  -2.086  -0.135
   67    H6     C   6           H6         C   6  -5.965  -2.441  -0.538
   68   1H5*    A   7          H5*         A   7  -8.682   2.508  -4.679
   69   2H5*    A   7          2H5*        A   7  -7.519   1.725  -3.592
   70    H4*    A   7           H4*        A   7  -9.966   3.226  -2.676
   71    H3*    A   7           H3*        A   7  -7.247   4.294  -3.276
   72    H2*    A   7          1H2*        A   7  -7.162   5.480  -1.186
   73   2HO*    A   7          2HO*        A   7  -9.761   5.548  -1.496
   74    H1*    A   7           H1*        A   7  -8.057   3.417   0.406
   75    H8     A   7           H8         A   7  -6.297   1.341  -1.973
   76   1H6     A   7          1H6         A   7  -1.696   2.057  -0.606
   77   2H6     A   7          2H6         A   7  -0.920   3.251   0.419
   78    H2     A   7           H2         A   7  -4.144   5.961   1.930
   79   1H5*    G   8          H5*         G   8  -7.669   7.569  -1.386
   80   2H5*    G   8          2H5*        G   8  -7.897   8.761  -2.681
   81    H4*    G   8           H4*        G   8  -6.098   9.558  -1.449
   82    H3*    G   8           H3*        G   8  -5.225   8.290  -4.004
   83    H2*    G   8          1H2*        G   8  -2.907   8.519  -3.409
   84   2HO*    G   8          2HO*        G   8  -3.693  10.634  -2.178
   85    H1*    G   8           H1*        G   8  -3.134   7.613  -0.810
   86    H8     G   8           H8         G   8  -5.717   5.756  -2.748
   87    H1     G   8           H1         G   8   0.194   3.350  -3.403
   88   1H2     G   8          1H2         G   8   1.226   6.276  -1.902
   89   2H2     G   8          2H2         G   8   1.685   4.740  -2.599
   90   1H5*    G   9          H5*         G   9  -2.990  11.656  -4.214
   91   2H5*    G   9          2H5*        G   9  -3.016  12.378  -5.834
   92    H4*    G   9           H4*        G   9  -0.775  11.734  -5.259
   93    H3*    G   9           H3*        G   9  -1.995  10.040  -7.438
   94    H2*    G   9          1H2*        G   9   0.143   8.951  -7.632
   95   2HO*    G   9          2HO*        G   9   1.913  10.013  -7.136
   96    H1*    G   9           H1*        G   9   0.543   8.775  -4.839
   97    H8     G   9           H8         G   9  -3.005   7.924  -5.365
   98    H1     G   9           H1         G   9   0.968   3.237  -7.206
   99   1H2     G   9          1H2         G   9   3.443   5.615  -6.872
  100   2H2     G   9          2H2         G   9   3.031   3.968  -7.287
  101   1H5*    C  10          H5*         C  10   1.901  11.382  -8.158
  102   2H5*    C  10          2H5*        C  10   1.896  12.327  -9.659
  103    H4*    C  10           H4*        C  10   3.863  11.122  -9.775
  104    H3*    C  10           H3*        C  10   1.761   9.716 -11.399
  105    H2*    C  10          1H2*        C  10   3.417   8.061 -11.986
  106   2HO*    C  10          2HO*        C  10   5.471   8.601 -11.983
  107    H1*    C  10           H1*        C  10   4.332   7.721  -9.379
  108   1H4     C  10          1H4         C  10  -1.557   4.721  -9.946
  109   2H4     C  10          2H4         C  10  -0.331   3.488 -10.008
  110    H5     C  10           H5         C  10  -1.003   7.095  -9.764
  111    H6     C  10           H6         C  10   0.823   8.710  -9.712
  112   1H5*    U  11          H5*         U  11   4.496   9.219 -13.625
  113   2H5*    U  11          2H5*        U  11   4.390   9.967 -15.231
  114    H4*    U  11           H4*        U  11   4.874   7.719 -15.628
  115    H3*    U  11           H3*        U  11   1.965   8.296 -16.102
  116    H2*    U  11          1H2*        U  11   1.629   5.990 -16.681
  117   2HO*    U  11          2HO*        U  11   3.434   4.589 -16.893
  118    H1*    U  11           H1*        U  11   3.235   4.954 -14.615
  119    H3     U  11           H3         U  11  -1.018   3.821 -13.534
  120    H5     U  11           H5         U  11  -0.573   7.811 -12.250
  121    H6     U  11           H6         U  11   1.536   7.857 -13.404
  122   1H5*    U  12          H5*         U  12   2.459   8.280 -21.413
  123   2H5*    U  12          2H5*        U  12   1.041   7.224 -21.257
  124    H4*    U  12           H4*        U  12   2.446   6.126 -22.746
  125    H3*    U  12           H3*        U  12   1.772   4.738 -20.548
  126    H2*    U  12          1H2*        U  12   3.730   5.228 -19.226
  127   2HO*    U  12          2HO*        U  12   4.100   2.945 -20.837
  128    H1*    U  12           H1*        U  12   5.457   4.879 -21.736
  129    H3     U  12           H3         U  12   9.040   5.701 -19.167
  130    H5     U  12           H5         U  12   6.460   8.901 -18.303
  131    H6     U  12           H6         U  12   4.798   7.827 -19.668
  132   1H5*    C  13          H5*         C  13   2.962   1.387 -19.898
  133   2H5*    C  13          2H5*        C  13   1.992   0.366 -20.977
  134    H4*    C  13           H4*        C  13   1.815  -0.298 -18.630
  135    H3*    C  13           H3*        C  13  -0.260  -0.378 -20.305
  136    H2*    C  13          1H2*        C  13  -1.079   1.869 -19.887
  137   2HO*    C  13          2HO*        C  13  -2.699   1.492 -18.031
  138    H1*    C  13           H1*        C  13  -0.641   1.377 -16.895
  139   1H4     C  13          1H4         C  13  -0.606   7.921 -17.756
  140   2H4     C  13          2H4         C  13  -1.832   7.562 -16.560
  141    H5     C  13           H5         C  13   0.636   6.183 -18.908
  142    H6     C  13           H6         C  13   0.944   3.777 -19.141
  143   1H5*    G  14          H5*         G  14   1.193  -1.933 -19.959
  144   2H5*    G  14          2H5*        G  14   1.273  -3.438 -20.893
  145    H4*    G  14           H4*        G  14   2.754  -4.368 -19.521
  146    H3*    G  14           H3*        G  14   1.121  -3.324 -17.228
  147    H2*    G  14          1H2*        G  14   3.030  -3.333 -15.825
  148   2HO*    G  14          2HO*        G  14   3.434  -5.607 -16.893
  149    H1*    G  14           H1*        G  14   4.966  -2.974 -17.965
  150    H8     G  14           H8         G  14   6.276  -1.013 -17.189
  151    H1     G  14           H1         G  14   1.106   1.850 -14.697
  152   1H2     G  14          1H2         G  14  -0.602  -0.951 -15.868
  153   2H2     G  14          2H2         G  14  -0.690   0.579 -15.021
  154   1H5*    G  15          H5*         G  15   0.954  -5.155 -13.253
  155   2H5*    G  15          2H5*        G  15   0.813  -3.845 -14.443
  156    H4*    G  15           H4*        G  15   3.550  -4.668 -13.685
  157    H3*    G  15           H3*        G  15   1.697  -3.444 -11.673
  158    H2*    G  15          1H2*        G  15   3.461  -1.929 -11.000
  159   2HO*    G  15          2HO*        G  15   5.522  -2.270 -11.547
  160    H1*    G  15           H1*        G  15   4.003  -1.082 -13.552
  161    H8     G  15           H8         G  15   0.408  -2.175 -13.528
  162    H1     G  15           H1         G  15   1.349   3.689 -11.150
  163   1H2     G  15          1H2         G  15   4.690   2.890 -11.289
  164   2H2     G  15          2H2         G  15   3.474   4.081 -10.893
  165   1H5*    C  16          H5*         C  16   5.498  -3.575 -10.184
  166   2H5*    C  16          2H5*        C  16   5.527  -4.272  -8.553
  167    H4*    C  16           H4*        C  16   6.744  -2.183  -8.629
  168    H3*    C  16           H3*        C  16   4.259  -2.223  -6.941
  169    H2*    C  16          1H2*        C  16   4.663   0.069  -6.344
  170   2HO*    C  16          2HO*        C  16   7.133  -0.585  -6.499
  171    H1*    C  16           H1*        C  16   5.423   0.898  -8.924
  172   1H4     C  16          1H4         C  16  -1.185   0.781  -8.875
  173   2H4     C  16          2H4         C  16  -0.702   2.438  -8.586
  174    H5     C  16           H5         C  16   0.429  -1.031  -9.026
  175    H6     C  16           H6         C  16   2.797  -1.603  -8.923
  176   1H5*    C  17          H5*         C  17   7.816  -1.192  -4.395
  177   2H5*    C  17          2H5*        C  17   7.526  -1.794  -2.751
  178    H4*    C  17           H4*        C  17   8.155   0.602  -2.884
  179    H3*    C  17           H3*        C  17   5.583  -0.183  -1.546
  180    H2*    C  17          1H2*        C  17   5.165   2.143  -1.078
  181   2HO*    C  17          2HO*        C  17   7.822   2.257  -1.270
  182    H1*    C  17           H1*        C  17   5.720   3.009  -3.652
  183   1H4     C  17          1H4         C  17  -0.010  -0.130  -4.456
  184   2H4     C  17          2H4         C  17  -0.459   1.449  -3.864
  185    H5     C  17           H5         C  17   2.279  -0.892  -4.584
  186    H6     C  17           H6         C  17   4.607  -0.291  -4.182
  187   1H5*    U  18          H5*         U  18   7.849   2.793   0.482
  188   2H5*    U  18          2H5*        U  18   8.629   1.816   1.741
  189    H4*    U  18           H4*        U  18   8.237   3.332   3.285
  190    H3*    U  18           H3*        U  18   5.687   2.556   3.180
  191    H2*    U  18          1H2*        U  18   4.911   3.915   1.378
  192   2HO*    U  18          2HO*        U  18   4.736   5.357   3.806
  193    H1*    U  18           H1*        U  18   6.534   6.312   2.327
  194    H3     U  18           H3         U  18   6.323   8.496  -1.535
  195    H5     U  18           H5         U  18   5.317   4.577  -2.640
  196    H6     U  18           H6         U  18   5.744   3.899  -0.383
  197   1H5*    U  19          H5*         U  19   5.292   6.627   5.077
  198   2H5*    U  19          2H5*        U  19   5.040   6.204   6.780
  199    H4*    U  19           H4*        U  19   3.696   8.023   6.614
  200    H3*    U  19           H3*        U  19   1.931   5.676   5.965
  201    H2*    U  19          1H2*        U  19   0.111   7.225   5.604
  202   2HO*    U  19          2HO*        U  19   1.421   8.683   7.336
  203    H1*    U  19           H1*        U  19   1.603   8.998   4.057
  204    H3     U  19           H3         U  19  -0.772   6.962   0.838
  205    H5     U  19           H5         U  19   1.888   3.984   2.134
  206    H6     U  19           H6         U  19   2.607   5.485   3.866
  207   1H5*    G  20          H5*         G  20  -0.295   8.054   7.712
  208   2H5*    G  20          2H5*        G  20  -0.541   7.655   9.423
  209    H4*    G  20           H4*        G  20  -2.589   8.478   8.759
  210    H3*    G  20           H3*        G  20  -2.572   5.529   8.952
  211    H2*    G  20          1H2*        G  20  -4.664   5.255   7.826
  212   2HO*    G  20          2HO*        G  20  -5.156   7.586   8.948
  213    H1*    G  20           H1*        G  20  -4.296   7.105   5.809
  214    H8     G  20           H8         G  20  -0.905   5.721   6.456
  215    H1     G  20           H1         G  20  -4.533   1.942   2.761
  216   1H2     G  20          1H2         G  20  -7.143   3.966   3.780
  217   2H2     G  20          2H2         G  20  -6.633   2.587   2.828
  218   1H5*    U  21          H5*         U  21  -5.973   6.140  11.173
  219   2H5*    U  21          2H5*        U  21  -6.106   4.995  12.523
  220    H4*    U  21           H4*        U  21  -7.742   4.484  10.840
  221    H3*    U  21           H3*        U  21  -5.574   2.447  11.224
  222    H2*    U  21          1H2*        U  21  -6.559   1.101   9.478
  223   2HO*    U  21          2HO*        U  21  -8.760   2.522  10.183
  224    H1*    U  21           H1*        U  21  -6.906   3.188   7.685
  225    H3     U  21           H3         U  21  -3.242   1.000   6.126
  226    H5     U  21           H5         U  21  -1.799   3.422   9.213
  227    H6     U  21           H6         U  21  -4.079   3.959   9.762
  228   1H5*    U  22          H5*         U  22  -9.174   0.606  10.572
  229   2H5*    U  22          2H5*        U  22  -9.656  -0.267  12.040
  230    H4*    U  22           H4*        U  22 -10.220  -1.751  10.387
  231    H3*    U  22           H3*        U  22  -7.557  -2.474  11.520
  232    H2*    U  22          1H2*        U  22  -7.239  -4.189   9.862
  233   2HO*    U  22          2HO*        U  22  -8.951  -5.141   9.039
  234    H1*    U  22           H1*        U  22  -7.967  -2.663   7.688
  235    H3     U  22           H3         U  22  -3.501  -2.316   7.335
  236    H5     U  22           H5         U  22  -4.420   0.079  10.654
  237    H6     U  22           H6         U  22  -6.678  -0.727  10.514
  238   1H5*    U  23          H5*         U  23  -9.385  -5.743  10.784
  239   2H5*    U  23          2H5*        U  23  -9.415  -7.042  11.993
  240    H4*    U  23           H4*        U  23  -8.494  -7.920   9.991
  241    H3*    U  23           H3*        U  23  -6.440  -7.519  12.155
  242    H2*    U  23          1H2*        U  23  -4.802  -8.487  10.665
  243   2HO*    U  23          2HO*        U  23  -6.853  -9.779   9.720
  244    H1*    U  23           H1*        U  23  -5.611  -6.996   8.444
  245    H3     U  23           H3         U  23  -1.651  -5.223   9.827
  246    H5     U  23           H5         U  23  -4.581  -3.367  12.185
  247    H6     U  23           H6         U  23  -6.176  -4.942  11.309
  248   1H5*    C  24          H5*         C  24  -5.675 -11.264  11.264
  249   2H5*    C  24          2H5*        C  24  -5.692 -12.346  12.671
  250    H4*    C  24           H4*        C  24  -3.592 -12.590  11.620
  251    H3*    C  24           H3*        C  24  -3.439 -11.044  14.192
  252    H2*    C  24          1H2*        C  24  -1.062 -10.820  13.877
  253   2HO*    C  24          2HO*        C  24  -1.404 -12.569  11.640
  254    H1*    C  24           H1*        C  24  -1.210 -10.183  11.157
  255   1H4     C  24          1H4         C  24  -2.842  -4.538  14.114
  256   2H4     C  24          2H4         C  24  -1.089  -4.612  14.163
  257    H5     C  24           H5         C  24  -4.187  -6.426  13.358
  258    H6     C  24           H6         C  24  -4.110  -8.708  12.496
  259   1H5*    C  25          H5*         C  25  -0.121 -13.525  14.127
  260   2H5*    C  25          2H5*        C  25  -0.338 -14.676  15.460
  261    H4*    C  25           H4*        C  25   1.882 -14.046  15.622
  262    H3*    C  25           H3*        C  25   0.216 -12.584  17.628
  263    H2*    C  25          1H2*        C  25   2.103 -11.270  18.316
  264   2HO*    C  25          2HO*        C  25   3.479 -13.337  17.840
  265    H1*    C  25           H1*        C  25   3.045 -10.699  15.766
  266   1H4     C  25          1H4         C  25  -2.297  -6.892  16.538
  267   2H4     C  25          2H4         C  25  -0.898  -5.865  16.763
  268    H5     C  25           H5         C  25  -2.121  -9.284  16.197
  269    H6     C  25           H6         C  25  -0.575 -11.159  15.996
  270    H3T    C  25           H3T        C  25   0.874 -14.807  17.747
  Start of MODEL    6
    1   1H5*    G   1          H5*         G   1   5.269   0.704  17.317
    2   2H5*    G   1          2H5*        G   1   5.456   0.046  18.952
    3    H4*    G   1           H4*        G   1   7.813  -0.353  17.297
    4    H3*    G   1           H3*        G   1   5.204  -1.329  16.192
    5    H2*    G   1          1H2*        G   1   6.196  -3.481  15.749
    6   2HO*    G   1          2HO*        G   1   8.266  -3.483  15.292
    7    H1*    G   1           H1*        G   1   7.336  -3.780  18.237
    8    H8     G   1           H8         G   1   4.378  -1.782  19.052
    9    H1     G   1           H1         G   1   2.851  -7.820  17.543
   10   1H2     G   1          1H2         G   1   6.103  -8.019  16.384
   11   2H2     G   1          2H2         G   1   4.574  -8.835  16.624
   12    H5T    G   1           H5T        G   1   7.490   1.177  19.033
   13   1H5*    G   2          H5*         G   2   8.195  -2.377  13.743
   14   2H5*    G   2          2H5*        G   2   7.901  -2.297  11.995
   15    H4*    G   2           H4*        G   2   8.603  -4.520  12.742
   16    H3*    G   2           H3*        G   2   5.954  -4.187  11.391
   17    H2*    G   2          1H2*        G   2   5.454  -6.517  11.725
   18   2HO*    G   2          2HO*        G   2   8.058  -6.762  11.616
   19    H1*    G   2           H1*        G   2   6.223  -6.622  14.374
   20    H8     G   2           H8         G   2   4.943  -3.247  14.424
   21    H1     G   2           H1         G   2   0.220  -7.492  13.608
   22   1H2     G   2          1H2         G   2   2.773  -9.706  12.830
   23   2H2     G   2          2H2         G   2   1.048  -9.448  12.988
   24   1H5*    A   3          H5*         A   3   7.453  -7.589   9.319
   25   2H5*    A   3          2H5*        A   3   7.858  -6.950   7.713
   26    H4*    A   3           H4*        A   3   6.799  -8.913   7.200
   27    H3*    A   3           H3*        A   3   4.845  -6.662   7.001
   28    H2*    A   3          1H2*        A   3   3.050  -8.221   6.558
   29   2HO*    A   3          2HO*        A   3   5.023  -9.736   5.682
   30    H1*    A   3           H1*        A   3   3.573  -9.834   8.701
   31    H8     A   3           H8         A   3   4.951  -6.684   9.987
   32   1H6     A   3          1H6         A   3   0.890  -4.472  11.437
   33   2H6     A   3          2H6         A   3  -0.815  -4.754  11.146
   34    H2     A   3           H2         A   3  -1.061  -8.420   8.564
   35   1H5*    A   4          H5*         A   4   4.332  -8.964   3.661
   36   2H5*    A   4          2H5*        A   4   4.394  -8.080   2.124
   37    H4*    A   4           H4*        A   4   2.447  -9.386   2.055
   38    H3*    A   4           H3*        A   4   1.872  -6.484   2.528
   39    H2*    A   4          1H2*        A   4  -0.493  -6.986   2.673
   40   2HO*    A   4          2HO*        A   4   0.101  -8.974   1.127
   41    H1*    A   4           H1*        A   4  -0.200  -9.002   4.507
   42    H8     A   4           H8         A   4   2.746  -6.866   5.235
   43   1H6     A   4          1H6         A   4   0.645  -3.520   8.054
   44   2H6     A   4          2H6         A   4  -1.025  -3.118   8.393
   45    H2     A   4           H2         A   4  -3.552  -6.001   6.077
   46   1H5*    G   5          H5*         G   5  -0.537  -7.799  -0.454
   47   2H5*    G   5          2H5*        G   5  -0.704  -6.783  -1.899
   48    H4*    G   5           H4*        G   5  -2.876  -7.293  -1.060
   49    H3*    G   5           H3*        G   5  -2.038  -4.431  -0.737
   50    H2*    G   5          1H2*        G   5  -4.157  -3.954   0.328
   51   2HO*    G   5          2HO*        G   5  -5.845  -5.280   0.131
   52    H1*    G   5           H1*        G   5  -4.034  -6.074   2.087
   53    H8     G   5           H8         G   5  -0.468  -5.354   1.714
   54    H1     G   5           H1         G   5  -3.486  -0.866   5.156
   55   1H2     G   5          1H2         G   5  -6.360  -2.252   3.883
   56   2H2     G   5          2H2         G   5  -5.639  -1.007   4.883
   57   1H5*    C   6          H5*         C   6  -5.767  -4.269  -1.391
   58   2H5*    C   6          2H5*        C   6  -6.185  -3.505  -2.936
   59    H4*    C   6           H4*        C   6  -7.638  -2.523  -1.436
   60    H3*    C   6           H3*        C   6  -5.296  -0.684  -1.859
   61    H2*    C   6          1H2*        C   6  -6.366   0.889  -0.352
   62   2HO*    C   6          2HO*        C   6  -8.557  -0.339  -1.131
   63    H1*    C   6           H1*        C   6  -6.819  -0.997   1.617
   64   1H4     C   6          1H4         C   6  -0.276  -0.233   1.708
   65   2H4     C   6          2H4         C   6  -0.892   1.014   2.770
   66    H5     C   6           H5         C   6  -1.689  -1.643   0.365
   67    H6     C   6           H6         C   6  -3.992  -2.164  -0.234
   68   1H5*    A   7          H5*         A   7  -8.599   1.394  -2.512
   69   2H5*    A   7          2H5*        A   7  -8.635   2.681  -3.734
   70    H4*    A   7           H4*        A   7  -9.082   3.555  -1.520
   71    H3*    A   7           H3*        A   7  -6.597   4.495  -2.908
   72    H2*    A   7          1H2*        A   7  -6.029   5.835  -0.991
   73   2HO*    A   7          2HO*        A   7  -8.605   5.985  -0.713
   74    H1*    A   7           H1*        A   7  -6.639   3.892   0.916
   75    H8     A   7           H8         A   7  -5.147   1.712  -1.556
   76   1H6     A   7          1H6         A   7  -0.431   2.566  -0.768
   77   2H6     A   7          2H6         A   7   0.432   3.834   0.078
   78    H2     A   7           H2         A   7  -2.653   6.642   1.704
   79   1H5*    G   8          H5*         G   8  -7.619   7.857  -1.978
   80   2H5*    G   8          2H5*        G   8  -8.072   8.994  -3.263
   81    H4*    G   8           H4*        G   8  -6.406  10.161  -2.268
   82    H3*    G   8           H3*        G   8  -5.160   8.602  -4.489
   83    H2*    G   8          1H2*        G   8  -2.952   9.258  -3.774
   84   2HO*    G   8          2HO*        G   8  -4.235  11.359  -2.866
   85    H1*    G   8           H1*        G   8  -3.303   8.690  -1.109
   86    H8     G   8           H8         G   8  -5.531   6.285  -2.862
   87    H1     G   8           H1         G   8   0.644   4.573  -2.985
   88   1H2     G   8          1H2         G   8   1.233   7.793  -1.893
   89   2H2     G   8          2H2         G   8   1.917   6.255  -2.368
   90   1H5*    G   9          H5*         G   9  -3.029  11.983  -4.998
   91   2H5*    G   9          2H5*        G   9  -3.203  12.557  -6.668
   92    H4*    G   9           H4*        G   9  -0.897  12.301  -6.268
   93    H3*    G   9           H3*        G   9  -1.967  10.069  -7.984
   94    H2*    G   9          1H2*        G   9   0.283   9.214  -8.131
   95   2HO*    G   9          2HO*        G   9   1.954  10.517  -7.883
   96    H1*    G   9           H1*        G   9   0.827   9.526  -5.403
   97    H8     G   9           H8         G   9  -2.680   8.435  -5.435
   98    H1     G   9           H1         G   9   1.367   3.705  -6.964
   99   1H2     G   9          1H2         G   9   3.709   6.216  -7.269
  100   2H2     G   9          2H2         G   9   3.362   4.505  -7.381
  101   1H5*    C  10          H5*         C  10   1.716  11.592  -9.177
  102   2H5*    C  10          2H5*        C  10   1.526  12.289 -10.797
  103    H4*    C  10           H4*        C  10   3.625  11.280 -10.808
  104    H3*    C  10           H3*        C  10   1.601   9.598 -12.245
  105    H2*    C  10          1H2*        C  10   3.300   7.941 -12.669
  106   2HO*    C  10          2HO*        C  10   4.907   9.909 -12.744
  107    H1*    C  10           H1*        C  10   4.309   7.923 -10.079
  108   1H4     C  10          1H4         C  10  -1.466   4.750  -9.658
  109   2H4     C  10          2H4         C  10  -0.252   3.522  -9.884
  110    H5     C  10           H5         C  10  -0.969   7.125  -9.752
  111    H6     C  10           H6         C  10   0.794   8.777 -10.078
  112   1H5*    U  11          H5*         U  11   4.337   9.809 -14.702
  113   2H5*    U  11          2H5*        U  11   4.153  10.167 -16.430
  114    H4*    U  11           H4*        U  11   4.959   7.973 -16.314
  115    H3*    U  11           H3*        U  11   2.007   8.014 -16.894
  116    H2*    U  11          1H2*        U  11   2.022   5.626 -16.955
  117   2HO*    U  11          2HO*        U  11   3.912   4.467 -17.123
  118    H1*    U  11           H1*        U  11   3.901   5.311 -14.835
  119    H3     U  11           H3         U  11   0.082   3.310 -13.405
  120    H5     U  11           H5         U  11  -0.531   7.423 -12.794
  121    H6     U  11           H6         U  11   1.494   7.835 -14.029
  122   1H5*    U  12          H5*         U  12   2.097   6.978 -21.945
  123   2H5*    U  12          2H5*        U  12   0.519   6.406 -21.370
  124    H4*    U  12           H4*        U  12   1.418   4.593 -22.507
  125    H3*    U  12           H3*        U  12   0.759   4.094 -19.987
  126    H2*    U  12          1H2*        U  12   2.887   4.657 -18.974
  127   2HO*    U  12          2HO*        U  12   2.677   1.924 -19.618
  128    H1*    U  12           H1*        U  12   4.314   3.092 -21.187
  129    H3     U  12           H3         U  12   8.169   4.164 -19.154
  130    H5     U  12           H5         U  12   6.248   7.864 -19.636
  131    H6     U  12           H6         U  12   4.331   6.673 -20.464
  132   1H5*    C  13          H5*         C  13   1.409   0.259 -18.625
  133   2H5*    C  13          2H5*        C  13  -0.029  -0.483 -19.353
  134    H4*    C  13           H4*        C  13   0.137  -0.721 -16.888
  135    H3*    C  13           H3*        C  13  -2.162  -0.538 -18.213
  136    H2*    C  13          1H2*        C  13  -2.341   1.880 -18.221
  137   2HO*    C  13          2HO*        C  13  -3.586   2.255 -16.034
  138    H1*    C  13           H1*        C  13  -1.507   1.899 -15.274
  139   1H4     C  13          1H4         C  13   0.102   7.800 -17.735
  140   2H4     C  13          2H4         C  13  -0.938   8.084 -16.359
  141    H5     C  13           H5         C  13   0.597   5.581 -18.558
  142    H6     C  13           H6         C  13   0.221   3.200 -18.214
  143   1H5*    G  14          H5*         G  14  -0.526  -2.598 -17.500
  144   2H5*    G  14          2H5*        G  14  -1.342  -4.080 -18.034
  145    H4*    G  14           H4*        G  14  -0.016  -5.423 -16.831
  146    H3*    G  14           H3*        G  14  -0.036  -3.364 -14.640
  147    H2*    G  14          1H2*        G  14   2.045  -4.232 -13.834
  148   2HO*    G  14          2HO*        G  14   1.035  -6.481 -14.792
  149    H1*    G  14           H1*        G  14   3.167  -4.725 -16.391
  150    H8     G  14           H8         G  14   5.111  -3.173 -16.169
  151    H1     G  14           H1         G  14   1.402   1.622 -14.068
  152   1H2     G  14          1H2         G  14  -1.171  -0.681 -14.347
  153   2H2     G  14          2H2         G  14  -0.698   0.949 -13.921
  154   1H5*    G  15          H5*         G  15   1.052  -6.149 -12.171
  155   2H5*    G  15          2H5*        G  15   0.615  -5.556 -10.557
  156    H4*    G  15           H4*        G  15   3.048  -5.295 -11.567
  157    H3*    G  15           H3*        G  15   1.605  -3.520  -9.648
  158    H2*    G  15          1H2*        G  15   3.325  -1.846  -9.823
  159   2HO*    G  15          2HO*        G  15   4.929  -3.756 -10.139
  160    H1*    G  15           H1*        G  15   3.488  -1.846 -12.569
  161    H8     G  15           H8         G  15  -0.050  -2.717 -11.892
  162    H1     G  15           H1         G  15   1.190   3.512 -11.137
  163   1H2     G  15          1H2         G  15   4.491   2.568 -11.333
  164   2H2     G  15          2H2         G  15   3.351   3.881 -11.154
  165   1H5*    C  16          H5*         C  16   5.880  -3.485  -8.615
  166   2H5*    C  16          2H5*        C  16   5.958  -3.462  -6.842
  167    H4*    C  16           H4*        C  16   7.193  -1.619  -7.956
  168    H3*    C  16           H3*        C  16   5.060  -1.006  -5.935
  169    H2*    C  16          1H2*        C  16   5.428   1.347  -6.279
  170   2HO*    C  16          2HO*        C  16   7.867   0.521  -6.860
  171    H1*    C  16           H1*        C  16   5.579   1.216  -9.065
  172   1H4     C  16          1H4         C  16  -0.877   0.806  -7.804
  173   2H4     C  16          2H4         C  16  -0.505   2.513  -7.899
  174    H5     C  16           H5         C  16   0.863  -0.895  -7.836
  175    H6     C  16           H6         C  16   3.264  -1.284  -7.999
  176   1H5*    C  17          H5*         C  17   8.002   1.941  -5.580
  177   2H5*    C  17          2H5*        C  17   8.877   1.385  -4.141
  178    H4*    C  17           H4*        C  17   8.872   3.651  -3.850
  179    H3*    C  17           H3*        C  17   6.606   2.501  -2.274
  180    H2*    C  17          1H2*        C  17   5.876   4.713  -1.665
  181   2HO*    C  17          2HO*        C  17   8.444   5.258  -2.117
  182    H1*    C  17           H1*        C  17   5.961   5.749  -4.216
  183   1H4     C  17          1H4         C  17   0.969   1.485  -4.732
  184   2H4     C  17          2H4         C  17   0.237   3.000  -4.268
  185    H5     C  17           H5         C  17   3.352   1.144  -4.819
  186    H6     C  17           H6         C  17   5.529   2.197  -4.523
  187   1H5*    U  18          H5*         U  18   7.823   5.194   0.336
  188   2H5*    U  18          2H5*        U  18   9.079   4.379   1.285
  189    H4*    U  18           H4*        U  18   7.888   4.533   3.258
  190    H3*    U  18           H3*        U  18   5.574   3.897   2.166
  191    H2*    U  18          1H2*        U  18   5.146   5.828   0.822
  192   2HO*    U  18          2HO*        U  18   4.355   6.751   3.413
  193    H1*    U  18           H1*        U  18   6.136   7.795   2.894
  194    H3     U  18           H3         U  18   7.264  10.980   0.011
  195    H5     U  18           H5         U  18   6.790   7.624  -2.462
  196    H6     U  18           H6         U  18   6.428   6.305  -0.490
  197   1H5*    U  19          H5*         U  19   5.105   6.297   5.974
  198   2H5*    U  19          2H5*        U  19   3.774   5.826   7.048
  199    H4*    U  19           H4*        U  19   4.161   8.285   6.828
  200    H3*    U  19           H3*        U  19   1.452   7.112   6.249
  201    H2*    U  19          1H2*        U  19   0.643   9.330   5.797
  202   2HO*    U  19          2HO*        U  19   2.281  10.045   7.618
  203    H1*    U  19           H1*        U  19   2.922  10.151   4.356
  204    H3     U  19           H3         U  19  -0.518   9.888   1.385
  205    H5     U  19           H5         U  19   0.945   5.973   1.738
  206    H6     U  19           H6         U  19   2.316   6.728   3.564
  207   1H5*    G  20          H5*         G  20  -0.419   9.197   7.753
  208   2H5*    G  20          2H5*        G  20  -0.882   8.834   9.427
  209    H4*    G  20           H4*        G  20  -2.908   9.321   8.503
  210    H3*    G  20           H3*        G  20  -2.525   6.363   8.434
  211    H2*    G  20          1H2*        G  20  -4.541   6.071   7.138
  212   2HO*    G  20          2HO*        G  20  -5.135   8.450   8.260
  213    H1*    G  20           H1*        G  20  -3.955   7.972   5.251
  214    H8     G  20           H8         G  20  -0.552   7.038   6.191
  215    H1     G  20           H1         G  20  -3.424   2.442   2.770
  216   1H2     G  20          1H2         G  20  -6.328   4.203   3.422
  217   2H2     G  20          2H2         G  20  -5.594   2.807   2.663
  218   1H5*    U  21          H5*         U  21  -6.143   6.199   8.722
  219   2H5*    U  21          2H5*        U  21  -6.740   5.322  10.144
  220    H4*    U  21           H4*        U  21  -7.647   4.287   8.215
  221    H3*    U  21           H3*        U  21  -5.511   2.655   9.558
  222    H2*    U  21          1H2*        U  21  -5.822   0.945   7.893
  223   2HO*    U  21          2HO*        U  21  -7.805   0.725   7.146
  224    H1*    U  21           H1*        U  21  -5.895   2.698   5.721
  225    H3     U  21           H3         U  21  -1.894   0.473   5.654
  226    H5     U  21           H5         U  21  -1.298   3.820   8.101
  227    H6     U  21           H6         U  21  -3.670   4.212   8.020
  228   1H5*    U  22          H5*         U  22  -9.019   0.572   8.572
  229   2H5*    U  22          2H5*        U  22  -9.780  -0.088  10.034
  230    H4*    U  22           H4*        U  22 -10.138  -1.749   8.489
  231    H3*    U  22           H3*        U  22  -7.733  -2.423  10.136
  232    H2*    U  22          1H2*        U  22  -7.329  -4.381   8.798
  233   2HO*    U  22          2HO*        U  22  -9.054  -5.333   8.023
  234    H1*    U  22           H1*        U  22  -7.641  -3.134   6.350
  235    H3     U  22           H3         U  22  -3.154  -3.455   6.760
  236    H5     U  22           H5         U  22  -4.179  -0.175   9.160
  237    H6     U  22           H6         U  22  -6.493  -0.745   8.818
  238   1H5*    U  23          H5*         U  23  -9.912  -5.941   9.862
  239   2H5*    U  23          2H5*        U  23  -9.765  -6.941  11.320
  240    H4*    U  23           H4*        U  23  -8.929  -8.050   9.293
  241    H3*    U  23           H3*        U  23  -7.013  -7.587  11.564
  242    H2*    U  23          1H2*        U  23  -5.291  -8.666  10.273
  243   2HO*    U  23          2HO*        U  23  -7.280 -10.026   9.318
  244    H1*    U  23           H1*        U  23  -5.935  -7.398   7.855
  245    H3     U  23           H3         U  23  -1.966  -5.683   9.246
  246    H5     U  23           H5         U  23  -4.907  -3.457  11.261
  247    H6     U  23           H6         U  23  -6.534  -5.043  10.467
  248   1H5*    C  24          H5*         C  24  -6.672 -11.889  11.238
  249   2H5*    C  24          2H5*        C  24  -6.393 -12.503  12.879
  250    H4*    C  24           H4*        C  24  -4.546 -12.943  11.276
  251    H3*    C  24           H3*        C  24  -3.993 -11.446  13.824
  252    H2*    C  24          1H2*        C  24  -1.674 -11.288  13.179
  253   2HO*    C  24          2HO*        C  24  -0.859 -12.457  11.454
  254    H1*    C  24           H1*        C  24  -2.189 -10.529  10.546
  255   1H4     C  24          1H4         C  24  -3.412  -5.047  13.974
  256   2H4     C  24          2H4         C  24  -1.666  -5.124  13.856
  257    H5     C  24           H5         C  24  -4.846  -6.863  13.240
  258    H6     C  24           H6         C  24  -4.890  -9.090  12.247
  259   1H5*    C  25          H5*         C  25  -0.894 -14.010  12.960
  260   2H5*    C  25          2H5*        C  25  -0.935 -15.306  14.172
  261    H4*    C  25           H4*        C  25   1.332 -14.842  13.763
  262    H3*    C  25           H3*        C  25   0.382 -13.782  16.399
  263    H2*    C  25          1H2*        C  25   2.537 -12.816  16.814
  264   2HO*    C  25          2HO*        C  25   3.415 -14.848  15.501
  265    H1*    C  25           H1*        C  25   2.928 -11.810  14.232
  266   1H4     C  25          1H4         C  25  -1.193  -7.527  17.078
  267   2H4     C  25          2H4         C  25   0.414  -6.974  17.486
  268    H5     C  25           H5         C  25  -1.607  -9.611  15.911
  269    H6     C  25           H6         C  25  -0.563 -11.584  14.926
  270    H3T    C  25           H3T        C  25   0.642 -15.948  16.174
  Start of MODEL    7
    1   1H5*    G   1          H5*         G   1   6.913  -1.704  17.919
    2   2H5*    G   1          2H5*        G   1   8.529  -1.142  18.385
    3    H4*    G   1           H4*        G   1   9.560  -2.589  16.770
    4    H3*    G   1           H3*        G   1   6.778  -3.174  15.806
    5    H2*    G   1          1H2*        G   1   7.443  -5.454  15.383
    6   2HO*    G   1          2HO*        G   1   9.484  -5.648  14.777
    7    H1*    G   1           H1*        G   1   8.631  -5.833  17.842
    8    H8     G   1           H8         G   1   6.020  -3.517  18.811
    9    H1     G   1           H1         G   1   3.571  -9.201  17.154
   10   1H2     G   1          1H2         G   1   6.699  -9.806  15.805
   11   2H2     G   1          2H2         G   1   5.078 -10.400  16.091
   12    H5T    G   1           H5T        G   1   8.130  -0.962  15.701
   13   1H5*    G   2          H5*         G   2   9.344  -4.642  13.150
   14   2H5*    G   2          2H5*        G   2   9.096  -4.231  11.442
   15    H4*    G   2           H4*        G   2   9.358  -6.589  11.630
   16    H3*    G   2           H3*        G   2   6.594  -5.681  10.910
   17    H2*    G   2          1H2*        G   2   5.858  -7.984  10.885
   18   2HO*    G   2          2HO*        G   2   8.411  -8.438  10.356
   19    H1*    G   2           H1*        G   2   6.966  -8.637  13.321
   20    H8     G   2           H8         G   2   6.255  -5.165  14.052
   21    H1     G   2           H1         G   2   0.846  -8.549  13.516
   22   1H2     G   2          1H2         G   2   2.854 -10.949  12.027
   23   2H2     G   2          2H2         G   2   1.242 -10.483  12.522
   24   1H5*    A   3          H5*         A   3   7.251  -8.822   8.528
   25   2H5*    A   3          2H5*        A   3   7.512  -8.274   6.860
   26    H4*    A   3           H4*        A   3   6.197 -10.126   6.562
   27    H3*    A   3           H3*        A   3   4.473  -7.683   6.530
   28    H2*    A   3          1H2*        A   3   2.493  -9.063   6.343
   29   2HO*    A   3          2HO*        A   3   2.846 -10.891   5.288
   30    H1*    A   3           H1*        A   3   3.101 -10.640   8.487
   31    H8     A   3           H8         A   3   4.962  -7.576   9.353
   32   1H6     A   3          1H6         A   3   1.395  -4.912  11.272
   33   2H6     A   3          2H6         A   3  -0.350  -5.058  11.277
   34    H2     A   3           H2         A   3  -1.327  -8.795   8.998
   35   1H5*    A   4          H5*         A   4   3.227 -10.040   3.654
   36   2H5*    A   4          2H5*        A   4   2.875  -9.335   2.065
   37    H4*    A   4           H4*        A   4   0.951 -10.515   2.827
   38    H3*    A   4           H3*        A   4   0.647  -7.527   2.787
   39    H2*    A   4          1H2*        A   4  -1.620  -7.789   3.579
   40   2HO*    A   4          2HO*        A   4  -1.505 -10.060   2.348
   41    H1*    A   4           H1*        A   4  -0.959  -9.545   5.616
   42    H8     A   4           H8         A   4   2.055  -7.451   5.565
   43   1H6     A   4          1H6         A   4   0.434  -3.583   8.026
   44   2H6     A   4          2H6         A   4  -1.170  -3.027   8.459
   45    H2     A   4           H2         A   4  -4.062  -6.089   6.940
   46   1H5*    G   5          H5*         G   5  -2.292  -8.133  -0.498
   47   2H5*    G   5          2H5*        G   5  -2.153  -6.623  -1.419
   48    H4*    G   5           H4*        G   5  -4.279  -7.182   0.023
   49    H3*    G   5           H3*        G   5  -3.030  -4.444  -0.241
   50    H2*    G   5          1H2*        G   5  -4.904  -3.647   1.079
   51   2HO*    G   5          2HO*        G   5  -6.689  -4.857   1.384
   52    H1*    G   5           H1*        G   5  -4.652  -5.699   2.973
   53    H8     G   5           H8         G   5  -1.161  -4.982   2.178
   54    H1     G   5           H1         G   5  -3.897  -0.247   5.532
   55   1H2     G   5          1H2         G   5  -6.858  -1.801   4.734
   56   2H2     G   5          2H2         G   5  -6.060  -0.470   5.542
   57   1H5*    C   6          H5*         C   6  -6.928  -4.112  -0.242
   58   2H5*    C   6          2H5*        C   6  -7.492  -3.645  -1.858
   59    H4*    C   6           H4*        C   6  -8.838  -2.456  -0.380
   60    H3*    C   6           H3*        C   6  -6.708  -0.704  -1.553
   61    H2*    C   6          1H2*        C   6  -7.512   1.142  -0.233
   62   2HO*    C   6          2HO*        C   6  -9.803   0.058  -0.550
   63    H1*    C   6           H1*        C   6  -7.844  -0.314   2.129
   64   1H4     C   6          1H4         C   6  -1.351   0.708   1.780
   65   2H4     C   6          2H4         C   6  -1.983   2.118   2.594
   66    H5     C   6           H5         C   6  -2.747  -1.009   0.819
   67    H6     C   6           H6         C   6  -5.045  -1.730   0.441
   68   1H5*    A   7          H5*         A   7  -6.619   2.581  -3.433
   69   2H5*    A   7          2H5*        A   7  -6.695   1.535  -2.002
   70    H4*    A   7           H4*        A   7  -8.881   3.344  -1.909
   71    H3*    A   7           H3*        A   7  -6.390   4.672  -2.840
   72    H2*    A   7          1H2*        A   7  -6.464   6.306  -1.077
   73   2HO*    A   7          2HO*        A   7  -9.051   5.879  -1.243
   74    H1*    A   7           H1*        A   7  -6.953   4.567   0.987
   75    H8     A   7           H8         A   7  -5.057   2.207  -0.964
   76   1H6     A   7          1H6         A   7  -0.518   3.744  -0.165
   77   2H6     A   7          2H6         A   7   0.145   5.220   0.507
   78    H2     A   7           H2         A   7  -3.322   7.863   1.527
   79   1H5*    G   8          H5*         G   8  -7.503   7.870  -2.150
   80   2H5*    G   8          2H5*        G   8  -8.241   8.646  -3.565
   81    H4*    G   8           H4*        G   8  -6.859  10.318  -3.026
   82    H3*    G   8           H3*        G   8  -5.165   8.510  -4.702
   83    H2*    G   8          1H2*        G   8  -3.213   9.840  -4.201
   84   2HO*    G   8          2HO*        G   8  -4.932  11.772  -3.930
   85    H1*    G   8           H1*        G   8  -3.588   9.859  -1.487
   86    H8     G   8           H8         G   8  -5.225   6.712  -2.565
   87    H1     G   8           H1         G   8   1.162   6.270  -2.490
   88   1H2     G   8          1H2         G   8   1.100   9.708  -2.115
   89   2H2     G   8          2H2         G   8   2.071   8.258  -2.257
   90   1H5*    G   9          H5*         G   9  -3.863  11.853  -5.764
   91   2H5*    G   9          2H5*        G   9  -4.119  12.328  -7.455
   92    H4*    G   9           H4*        G   9  -1.857  12.714  -7.041
   93    H3*    G   9           H3*        G   9  -2.257  10.182  -8.603
   94    H2*    G   9          1H2*        G   9   0.129   9.831  -8.597
   95   2HO*    G   9          2HO*        G   9   0.117  12.511  -8.227
   96    H1*    G   9           H1*        G   9   0.473  10.382  -5.895
   97    H8     G   9           H8         G   9  -2.767   8.740  -5.749
   98    H1     G   9           H1         G   9   1.910   4.619  -7.245
   99   1H2     G   9          1H2         G   9   3.804   7.451  -7.813
  100   2H2     G   9          2H2         G   9   3.736   5.704  -7.809
  101   1H5*    C  10          H5*         C  10   1.071  12.185  -9.858
  102   2H5*    C  10          2H5*        C  10   0.815  12.733 -11.526
  103    H4*    C  10           H4*        C  10   3.030  12.010 -11.441
  104    H3*    C  10           H3*        C  10   1.277   9.985 -12.788
  105    H2*    C  10          1H2*        C  10   3.195   8.549 -13.077
  106   2HO*    C  10          2HO*        C  10   4.491  10.920 -12.843
  107    H1*    C  10           H1*        C  10   4.122   8.819 -10.473
  108   1H4     C  10          1H4         C  10  -1.240   4.995  -9.974
  109   2H4     C  10          2H4         C  10   0.104   3.909 -10.202
  110    H5     C  10           H5         C  10  -1.008   7.408 -10.089
  111    H6     C  10           H6         C  10   0.553   9.240 -10.470
  112   1H5*    U  11          H5*         U  11   3.871   9.797 -15.161
  113   2H5*    U  11          2H5*        U  11   3.587  10.182 -16.870
  114    H4*    U  11           H4*        U  11   4.357   7.981 -16.863
  115    H3*    U  11           H3*        U  11   1.367   8.037 -17.174
  116    H2*    U  11          1H2*        U  11   1.360   5.649 -17.246
  117   2HO*    U  11          2HO*        U  11   3.270   4.479 -17.535
  118    H1*    U  11           H1*        U  11   3.405   5.308 -15.295
  119    H3     U  11           H3         U  11  -0.327   3.374 -13.577
  120    H5     U  11           H5         U  11  -0.777   7.502 -12.867
  121    H6     U  11           H6         U  11   1.152   7.870 -14.255
  122   1H5*    U  12          H5*         U  12   1.297   6.819 -22.354
  123   2H5*    U  12          2H5*        U  12  -0.087   5.974 -21.636
  124    H4*    U  12           H4*        U  12   0.993   4.389 -22.974
  125    H3*    U  12           H3*        U  12   0.603   3.673 -20.459
  126    H2*    U  12          1H2*        U  12   2.659   4.578 -19.545
  127   2HO*    U  12          2HO*        U  12   4.180   2.523 -19.852
  128    H1*    U  12           H1*        U  12   4.202   3.344 -21.884
  129    H3     U  12           H3         U  12   7.916   5.024 -20.017
  130    H5     U  12           H5         U  12   5.352   8.341 -20.258
  131    H6     U  12           H6         U  12   3.629   6.854 -21.034
  132   1H5*    C  13          H5*         C  13   2.251   0.607 -19.299
  133   2H5*    C  13          2H5*        C  13   1.269  -0.758 -19.869
  134    H4*    C  13           H4*        C  13   1.656  -0.890 -17.482
  135    H3*    C  13           H3*        C  13  -0.704  -1.513 -18.486
  136    H2*    C  13          1H2*        C  13  -1.637   0.735 -18.512
  137   2HO*    C  13          2HO*        C  13  -2.962  -0.734 -17.192
  138    H1*    C  13           H1*        C  13  -0.618   1.139 -15.656
  139   1H4     C  13          1H4         C  13  -1.109   7.137 -18.356
  140   2H4     C  13          2H4         C  13  -2.134   7.130 -16.939
  141    H5     C  13           H5         C  13   0.047   5.155 -19.135
  142    H6     C  13           H6         C  13   0.450   2.789 -18.719
  143   1H5*    G  14          H5*         G  14   0.577  -3.364 -17.807
  144   2H5*    G  14          2H5*        G  14   0.184  -5.077 -18.049
  145    H4*    G  14           H4*        G  14   1.825  -5.773 -16.727
  146    H3*    G  14           H3*        G  14   0.993  -3.654 -14.765
  147    H2*    G  14          1H2*        G  14   3.162  -3.704 -13.783
  148   2HO*    G  14          2HO*        G  14   3.488  -5.868 -13.538
  149    H1*    G  14           H1*        G  14   4.579  -4.252 -16.213
  150    H8     G  14           H8         G  14   6.074  -2.265 -16.379
  151    H1     G  14           H1         G  14   1.491   1.719 -14.325
  152   1H2     G  14          1H2         G  14  -0.475  -1.144 -14.174
  153   2H2     G  14          2H2         G  14  -0.376   0.583 -13.917
  154   1H5*    G  15          H5*         G  15   2.667  -5.362 -10.272
  155   2H5*    G  15          2H5*        G  15   1.710  -3.987 -10.858
  156    H4*    G  15           H4*        G  15   4.658  -4.476 -11.243
  157    H3*    G  15           H3*        G  15   3.143  -2.650  -9.447
  158    H2*    G  15          1H2*        G  15   4.575  -0.797  -9.957
  159   2HO*    G  15          2HO*        G  15   6.460  -2.377 -10.083
  160    H1*    G  15           H1*        G  15   4.597  -1.129 -12.690
  161    H8     G  15           H8         G  15   1.253  -2.368 -11.810
  162    H1     G  15           H1         G  15   1.655   4.007 -11.459
  163   1H2     G  15          1H2         G  15   5.050   3.505 -11.689
  164   2H2     G  15          2H2         G  15   3.740   4.652 -11.540
  165   1H5*    C  16          H5*         C  16   7.363  -1.834  -8.550
  166   2H5*    C  16          2H5*        C  16   7.429  -1.732  -6.780
  167    H4*    C  16           H4*        C  16   8.340   0.252  -7.935
  168    H3*    C  16           H3*        C  16   6.056   0.579  -6.012
  169    H2*    C  16          1H2*        C  16   6.070   2.949  -6.443
  170   2HO*    C  16          2HO*        C  16   8.641   2.383  -7.137
  171    H1*    C  16           H1*        C  16   6.330   2.720  -9.216
  172   1H4     C  16          1H4         C  16  -0.022   1.390  -8.002
  173   2H4     C  16          2H4         C  16   0.092   3.126  -8.232
  174    H5     C  16           H5         C  16   1.959  -0.027  -7.906
  175    H6     C  16           H6         C  16   4.396  -0.055  -8.028
  176   1H5*    C  17          H5*         C  17   8.341   3.977  -5.486
  177   2H5*    C  17          2H5*        C  17   9.290   3.511  -4.061
  178    H4*    C  17           H4*        C  17   8.895   5.726  -3.667
  179    H3*    C  17           H3*        C  17   6.831   4.135  -2.194
  180    H2*    C  17          1H2*        C  17   5.775   6.179  -1.466
  181   2HO*    C  17          2HO*        C  17   8.250   7.163  -2.069
  182    H1*    C  17           H1*        C  17   5.723   7.354  -3.963
  183   1H4     C  17          1H4         C  17   1.372   2.426  -4.560
  184   2H4     C  17          2H4         C  17   0.438   3.836  -4.109
  185    H5     C  17           H5         C  17   3.783   2.419  -4.640
  186    H6     C  17           H6         C  17   5.792   3.762  -4.330
  187   1H5*    U  18          H5*         U  18   8.437   6.406   1.306
  188   2H5*    U  18          2H5*        U  18   9.148   5.065   2.220
  189    H4*    U  18           H4*        U  18   7.542   5.081   3.805
  190    H3*    U  18           H3*        U  18   5.542   4.881   2.126
  191    H2*    U  18          1H2*        U  18   5.595   7.033   1.067
  192   2HO*    U  18          2HO*        U  18   3.563   7.014   2.084
  193    H1*    U  18           H1*        U  18   6.109   8.593   3.590
  194    H3     U  18           H3         U  18   8.446  11.870   1.711
  195    H5     U  18           H5         U  18   8.302   8.980  -1.329
  196    H6     U  18           H6         U  18   7.199   7.506   0.216
  197   1H5*    U  19          H5*         U  19   4.724   6.557   6.002
  198   2H5*    U  19          2H5*        U  19   3.326   6.117   7.002
  199    H4*    U  19           H4*        U  19   4.061   8.484   7.205
  200    H3*    U  19           H3*        U  19   1.238   7.797   6.475
  201    H2*    U  19          1H2*        U  19   0.711  10.133   6.279
  202   2HO*    U  19          2HO*        U  19   2.540  10.372   8.123
  203    H1*    U  19           H1*        U  19   3.032  10.854   4.901
  204    H3     U  19           H3         U  19  -0.634  10.943   2.105
  205    H5     U  19           H5         U  19   1.062   7.122   1.758
  206    H6     U  19           H6         U  19   2.456   7.651   3.649
  207   1H5*    G  20          H5*         G  20  -0.763  10.077   7.744
  208   2H5*    G  20          2H5*        G  20  -1.171   9.571   9.395
  209    H4*    G  20           H4*        G  20  -3.227  10.046   8.493
  210    H3*    G  20           H3*        G  20  -2.710   7.113   8.408
  211    H2*    G  20          1H2*        G  20  -4.711   6.714   7.130
  212   2HO*    G  20          2HO*        G  20  -6.337   8.099   7.186
  213    H1*    G  20           H1*        G  20  -4.286   8.683   5.262
  214    H8     G  20           H8         G  20  -0.820   7.893   6.084
  215    H1     G  20           H1         G  20  -3.591   3.242   2.645
  216   1H2     G  20          1H2         G  20  -6.543   4.819   3.475
  217   2H2     G  20          2H2         G  20  -5.774   3.482   2.651
  218   1H5*    U  21          H5*         U  21  -6.428   6.896   8.620
  219   2H5*    U  21          2H5*        U  21  -6.967   6.189  10.156
  220    H4*    U  21           H4*        U  21  -8.055   4.999   8.444
  221    H3*    U  21           H3*        U  21  -5.859   3.465   9.772
  222    H2*    U  21          1H2*        U  21  -6.137   1.637   8.250
  223   2HO*    U  21          2HO*        U  21  -8.620   2.350   8.318
  224    H1*    U  21           H1*        U  21  -6.478   3.172   5.935
  225    H3     U  21           H3         U  21  -2.383   1.239   5.516
  226    H5     U  21           H5         U  21  -1.763   4.586   7.961
  227    H6     U  21           H6         U  21  -4.151   4.858   8.077
  228   1H5*    U  22          H5*         U  22  -9.558   0.941   9.381
  229   2H5*    U  22          2H5*        U  22  -9.827   0.337  11.027
  230    H4*    U  22           H4*        U  22 -10.160  -1.471   9.539
  231    H3*    U  22           H3*        U  22  -7.564  -1.707  11.048
  232    H2*    U  22          1H2*        U  22  -7.194  -3.813   9.934
  233   2HO*    U  22          2HO*        U  22  -9.830  -3.870   9.902
  234    H1*    U  22           H1*        U  22  -7.996  -2.895   7.404
  235    H3     U  22           H3         U  22  -3.504  -3.479   7.132
  236    H5     U  22           H5         U  22  -3.992   0.230   9.030
  237    H6     U  22           H6         U  22  -6.348  -0.242   9.181
  238   1H5*    U  23          H5*         U  23  -9.788  -5.404  11.107
  239   2H5*    U  23          2H5*        U  23  -9.552  -6.213  12.668
  240    H4*    U  23           H4*        U  23  -9.046  -7.617  10.683
  241    H3*    U  23           H3*        U  23  -6.921  -7.170  12.766
  242    H2*    U  23          1H2*        U  23  -5.450  -8.588  11.488
  243   2HO*    U  23          2HO*        U  23  -7.483  -9.911  10.883
  244    H1*    U  23           H1*        U  23  -6.104  -7.469   9.005
  245    H3     U  23           H3         U  23  -1.894  -6.050   9.899
  246    H5     U  23           H5         U  23  -4.375  -3.498  12.119
  247    H6     U  23           H6         U  23  -6.230  -4.918  11.534
  248   1H5*    C  24          H5*         C  24  -7.068 -11.489  12.070
  249   2H5*    C  24          2H5*        C  24  -6.729 -12.262  13.631
  250    H4*    C  24           H4*        C  24  -5.201 -12.925  11.790
  251    H3*    C  24           H3*        C  24  -4.067 -11.743  14.312
  252    H2*    C  24          1H2*        C  24  -1.855 -12.003  13.377
  253   2HO*    C  24          2HO*        C  24  -3.164 -13.871  11.888
  254    H1*    C  24           H1*        C  24  -2.516 -10.972  10.872
  255   1H4     C  24          1H4         C  24  -2.179  -5.643  14.729
  256   2H4     C  24          2H4         C  24  -0.530  -5.963  14.236
  257    H5     C  24           H5         C  24  -4.009  -7.151  14.225
  258    H6     C  24           H6         C  24  -4.620  -9.253  13.151
  259   1H5*    C  25          H5*         C  25  -1.516 -14.608  13.058
  260   2H5*    C  25          2H5*        C  25  -1.566 -15.941  14.228
  261    H4*    C  25           H4*        C  25   0.692 -15.638  13.649
  262    H3*    C  25           H3*        C  25   0.055 -14.586  16.385
  263    H2*    C  25          1H2*        C  25   2.331 -13.862  16.634
  264   2HO*    C  25          2HO*        C  25   2.891 -15.918  15.221
  265    H1*    C  25           H1*        C  25   2.582 -12.801  14.055
  266   1H4     C  25          1H4         C  25  -0.795  -8.282  17.483
  267   2H4     C  25          2H4         C  25   0.890  -7.830  17.608
  268    H5     C  25           H5         C  25  -1.523 -10.336  16.415
  269    H6     C  25           H6         C  25  -0.780 -12.356  15.265
  270    H3T    C  25           H3T        C  25   0.079 -16.779  16.026
  Start of MODEL    8
    1   1H5*    G   1          H5*         G   1   6.959   0.988  17.234
    2   2H5*    G   1          2H5*        G   1   5.380   0.203  17.414
    3    H4*    G   1           H4*        G   1   8.099  -0.778  18.107
    4    H3*    G   1           H3*        G   1   5.741  -1.886  16.637
    5    H2*    G   1          1H2*        G   1   6.271  -4.103  17.406
    6   2HO*    G   1          2HO*        G   1   8.705  -3.285  17.397
    7    H1*    G   1           H1*        G   1   6.583  -3.432  20.048
    8    H8     G   1           H8         G   1   4.124  -0.933  19.163
    9    H1     G   1           H1         G   1   1.580  -6.811  19.024
   10   1H2     G   1          1H2         G   1   4.865  -7.893  19.098
   11   2H2     G   1          2H2         G   1   3.171  -8.330  19.032
   12    H5T    G   1           H5T        G   1   6.280   0.425  19.834
   13   1H5*    G   2          H5*         G   2   8.876  -4.579  15.641
   14   2H5*    G   2          2H5*        G   2   8.987  -4.573  13.870
   15    H4*    G   2           H4*        G   2   8.975  -6.829  14.688
   16    H3*    G   2           H3*        G   2   6.578  -6.003  13.088
   17    H2*    G   2          1H2*        G   2   5.626  -8.201  13.410
   18   2HO*    G   2          2HO*        G   2   8.096  -8.960  13.565
   19    H1*    G   2           H1*        G   2   6.027  -8.257  16.134
   20    H8     G   2           H8         G   2   5.586  -4.682  15.822
   21    H1     G   2           H1         G   2   0.100  -7.776  14.679
   22   1H2     G   2          1H2         G   2   2.111 -10.592  14.389
   23   2H2     G   2          2H2         G   2   0.494  -9.929  14.314
   24   1H5*    A   3          H5*         A   3   7.595  -9.651  11.009
   25   2H5*    A   3          2H5*        A   3   8.253  -9.036   9.480
   26    H4*    A   3           H4*        A   3   6.883 -10.739   8.780
   27    H3*    A   3           H3*        A   3   5.443  -8.131   8.539
   28    H2*    A   3          1H2*        A   3   3.417  -9.263   7.881
   29   2HO*    A   3          2HO*        A   3   3.687 -11.085   6.825
   30    H1*    A   3           H1*        A   3   3.428 -11.065   9.946
   31    H8     A   3           H8         A   3   5.217  -8.262  11.533
   32   1H6     A   3          1H6         A   3   1.465  -5.419  12.731
   33   2H6     A   3          2H6         A   3  -0.226  -5.408  12.272
   34    H2     A   3           H2         A   3  -0.844  -8.876   9.513
   35   1H5*    A   4          H5*         A   4   4.531 -10.396   5.211
   36   2H5*    A   4          2H5*        A   4   4.438  -9.450   3.713
   37    H4*    A   4           H4*        A   4   2.386 -10.724   4.229
   38    H3*    A   4           H3*        A   4   2.264  -7.751   3.878
   39    H2*    A   4          1H2*        A   4  -0.091  -7.778   4.370
   40   2HO*    A   4          2HO*        A   4   0.143 -10.291   3.447
   41    H1*    A   4           H1*        A   4   0.078  -9.510   6.547
   42    H8     A   4           H8         A   4   3.134  -7.554   7.004
   43   1H6     A   4          1H6         A   4   1.293  -3.566   9.074
   44   2H6     A   4          2H6         A   4  -0.328  -2.928   9.237
   45    H2     A   4           H2         A   4  -3.057  -5.879   7.242
   46   1H5*    G   5          H5*         G   5  -1.204  -9.131   2.512
   47   2H5*    G   5          2H5*        G   5  -1.274  -8.867   0.760
   48    H4*    G   5           H4*        G   5  -3.369  -8.249   1.699
   49    H3*    G   5           H3*        G   5  -1.757  -5.851   0.832
   50    H2*    G   5          1H2*        G   5  -3.670  -4.499   1.427
   51   2HO*    G   5          2HO*        G   5  -4.940  -6.927   1.125
   52    H1*    G   5           H1*        G   5  -4.138  -5.861   3.846
   53    H8     G   5           H8         G   5  -0.469  -5.591   3.616
   54    H1     G   5           H1         G   5  -3.286  -0.045   5.178
   55   1H2     G   5          1H2         G   5  -6.193  -1.612   4.190
   56   2H2     G   5          2H2         G   5  -5.443  -0.158   4.818
   57   1H5*    C   6          H5*         C   6  -5.776  -5.705  -0.154
   58   2H5*    C   6          2H5*        C   6  -5.943  -5.529  -1.912
   59    H4*    C   6           H4*        C   6  -7.549  -4.131  -0.855
   60    H3*    C   6           H3*        C   6  -5.329  -2.720  -2.264
   61    H2*    C   6          1H2*        C   6  -6.068  -0.588  -1.475
   62   2HO*    C   6          2HO*        C   6  -8.215  -0.533  -1.648
   63    H1*    C   6           H1*        C   6  -6.747  -1.377   1.126
   64   1H4     C   6          1H4         C   6  -0.201  -0.642   1.208
   65   2H4     C   6          2H4         C   6  -0.858   0.799   1.947
   66    H5     C   6           H5         C   6  -1.558  -2.361   0.203
   67    H6     C   6           H6         C   6  -3.840  -3.073  -0.276
   68   1H5*    A   7          H5*         A   7  -7.910   0.791  -5.354
   69   2H5*    A   7          2H5*        A   7  -6.360   0.608  -4.510
   70    H4*    A   7           H4*        A   7  -8.924   1.733  -3.396
   71    H3*    A   7           H3*        A   7  -6.437   3.063  -4.374
   72    H2*    A   7          1H2*        A   7  -6.397   4.536  -2.471
   73   2HO*    A   7          2HO*        A   7  -9.027   4.057  -2.538
   74    H1*    A   7           H1*        A   7  -6.891   2.611  -0.553
   75    H8     A   7           H8         A   7  -4.929   0.655  -2.979
   76   1H6     A   7          1H6         A   7  -0.435   2.077  -1.756
   77   2H6     A   7          2H6         A   7   0.171   3.376  -0.746
   78    H2     A   7           H2         A   7  -3.382   5.587   0.828
   79   1H5*    G   8          H5*         G   8  -7.572   6.305  -2.589
   80   2H5*    G   8          2H5*        G   8  -7.987   7.425  -3.901
   81    H4*    G   8           H4*        G   8  -6.413   8.532  -2.564
   82    H3*    G   8           H3*        G   8  -5.317   7.592  -5.172
   83    H2*    G   8          1H2*        G   8  -3.091   8.274  -4.568
   84   2HO*    G   8          2HO*        G   8  -2.767   9.805  -3.104
   85    H1*    G   8           H1*        G   8  -3.090   7.191  -2.031
   86    H8     G   8           H8         G   8  -5.301   5.017  -4.127
   87    H1     G   8           H1         G   8   0.948   3.774  -4.829
   88   1H2     G   8          1H2         G   8   1.423   6.700  -3.064
   89   2H2     G   8          2H2         G   8   2.161   5.340  -3.882
   90   1H5*    G   9          H5*         G   9  -3.345  10.712  -4.538
   91   2H5*    G   9          2H5*        G   9  -3.666  12.045  -5.664
   92    H4*    G   9           H4*        G   9  -1.374  11.961  -5.643
   93    H3*    G   9           H3*        G   9  -2.317  10.337  -7.993
   94    H2*    G   9          1H2*        G   9  -0.006   9.911  -8.532
   95   2HO*    G   9          2HO*        G   9   1.290  11.534  -8.089
   96    H1*    G   9           H1*        G   9   0.746   9.322  -5.903
   97    H8     G   9           H8         G   9  -2.742   8.108  -6.775
   98    H1     G   9           H1         G   9   1.967   3.995  -8.216
   99   1H2     G   9          1H2         G   9   4.081   6.609  -7.412
  100   2H2     G   9          2H2         G   9   3.925   4.950  -7.951
  101   1H5*    C  10          H5*         C  10   0.528  13.132  -9.244
  102   2H5*    C  10          2H5*        C  10   0.284  13.747 -10.891
  103    H4*    C  10           H4*        C  10   2.456  12.802 -10.766
  104    H3*    C  10           H3*        C  10   0.533  11.144 -12.371
  105    H2*    C  10          1H2*        C  10   2.338   9.600 -12.821
  106   2HO*    C  10          2HO*        C  10   3.817  11.792 -12.325
  107    H1*    C  10           H1*        C  10   3.203   9.476 -10.178
  108   1H4     C  10          1H4         C  10  -2.408   5.975 -10.588
  109   2H4     C  10          2H4         C  10  -1.086   4.850 -10.477
  110    H5     C  10           H5         C  10  -2.051   8.388 -10.636
  111    H6     C  10           H6         C  10  -0.364  10.147 -10.685
  112   1H5*    U  11          H5*         U  11   3.286  10.815 -14.444
  113   2H5*    U  11          2H5*        U  11   3.264  11.449 -16.101
  114    H4*    U  11           H4*        U  11   3.846   9.260 -16.439
  115    H3*    U  11           H3*        U  11   0.856   9.435 -16.742
  116    H2*    U  11          1H2*        U  11   0.840   7.071 -17.221
  117   2HO*    U  11          2HO*        U  11   2.968   5.980 -17.196
  118    H1*    U  11           H1*        U  11   2.603   6.403 -15.145
  119    H3     U  11           H3         U  11  -1.317   4.845 -13.599
  120    H5     U  11           H5         U  11  -1.648   9.033 -13.204
  121    H6     U  11           H6         U  11   0.444   9.220 -14.374
  122   1H5*    U  12          H5*         U  12   0.839   9.515 -22.014
  123   2H5*    U  12          2H5*        U  12  -0.548   8.451 -21.704
  124    H4*    U  12           H4*        U  12   0.712   7.347 -23.323
  125    H3*    U  12           H3*        U  12   0.254   5.961 -21.084
  126    H2*    U  12          1H2*        U  12   2.287   6.563 -19.918
  127   2HO*    U  12          2HO*        U  12   2.140   4.135 -20.766
  128    H1*    U  12           H1*        U  12   3.829   6.132 -22.536
  129    H3     U  12           H3         U  12   7.601   7.068 -20.307
  130    H5     U  12           H5         U  12   5.073  10.268 -19.318
  131    H6     U  12           H6         U  12   3.306   9.135 -20.494
  132   1H5*    C  13          H5*         C  13   1.776   2.315 -20.847
  133   2H5*    C  13          2H5*        C  13   0.454   1.393 -21.589
  134    H4*    C  13           H4*        C  13   1.001   0.823 -19.210
  135    H3*    C  13           H3*        C  13  -1.412   0.580 -20.350
  136    H2*    C  13          1H2*        C  13  -2.219   2.809 -19.809
  137   2HO*    C  13          2HO*        C  13  -2.799   1.042 -17.649
  138    H1*    C  13           H1*        C  13  -1.014   2.427 -17.014
  139   1H4     C  13          1H4         C  13  -1.607   8.946 -17.859
  140   2H4     C  13          2H4         C  13  -2.452   8.535 -16.383
  141    H5     C  13           H5         C  13  -0.628   7.263 -19.310
  142    H6     C  13           H6         C  13  -0.239   4.874 -19.610
  143   1H5*    G  14          H5*         G  14   0.124  -0.961 -20.372
  144   2H5*    G  14          2H5*        G  14   0.179  -2.586 -21.080
  145    H4*    G  14           H4*        G  14   2.053  -3.090 -20.025
  146    H3*    G  14           H3*        G  14   0.693  -2.179 -17.512
  147    H2*    G  14          1H2*        G  14   2.764  -1.699 -16.499
  148   2HO*    G  14          2HO*        G  14   3.627  -3.760 -16.716
  149    H1*    G  14           H1*        G  14   4.248  -1.435 -19.030
  150    H8     G  14           H8         G  14   5.503   0.704 -18.784
  151    H1     G  14           H1         G  14   0.955   3.289 -15.063
  152   1H2     G  14          1H2         G  14  -0.738   0.303 -15.624
  153   2H2     G  14          2H2         G  14  -0.737   1.872 -14.851
  154   1H5*    G  15          H5*         G  15   1.677  -3.533 -13.607
  155   2H5*    G  15          2H5*        G  15   1.308  -2.389 -14.911
  156    H4*    G  15           H4*        G  15   4.147  -2.953 -14.708
  157    H3*    G  15           H3*        G  15   2.784  -2.176 -12.177
  158    H2*    G  15          1H2*        G  15   4.329  -0.371 -11.797
  159   2HO*    G  15          2HO*        G  15   6.046  -1.837 -12.933
  160    H1*    G  15           H1*        G  15   4.212   0.687 -14.332
  161    H8     G  15           H8         G  15   0.880  -0.912 -13.752
  162    H1     G  15           H1         G  15   1.409   4.898 -11.128
  163   1H2     G  15          1H2         G  15   4.770   4.590 -11.851
  164   2H2     G  15          2H2         G  15   3.492   5.588 -11.191
  165   1H5*    C  16          H5*         C  16   6.680  -2.589 -10.937
  166   2H5*    C  16          2H5*        C  16   6.840  -3.468  -9.404
  167    H4*    C  16           H4*        C  16   7.797  -1.322  -9.111
  168    H3*    C  16           H3*        C  16   5.168  -1.646  -7.693
  169    H2*    C  16          1H2*        C  16   5.369   0.612  -6.886
  170   2HO*    C  16          2HO*        C  16   7.404   1.116  -6.436
  171    H1*    C  16           H1*        C  16   6.134   1.704  -9.330
  172   1H4     C  16          1H4         C  16  -0.359   0.524  -9.749
  173   2H4     C  16          2H4         C  16  -0.179   2.218  -9.335
  174    H5     C  16           H5         C  16   1.529  -0.984  -9.907
  175    H6     C  16           H6         C  16   3.950  -1.176  -9.692
  176   1H5*    C  17          H5*         C  17   8.607  -0.017  -4.970
  177   2H5*    C  17          2H5*        C  17   8.232  -0.786  -3.415
  178    H4*    C  17           H4*        C  17   8.705   1.555  -3.108
  179    H3*    C  17           H3*        C  17   5.879   0.720  -2.526
  180    H2*    C  17          1H2*        C  17   5.387   3.005  -1.910
  181   2HO*    C  17          2HO*        C  17   8.005   3.076  -1.484
  182    H1*    C  17           H1*        C  17   6.413   4.068  -4.230
  183   1H4     C  17          1H4         C  17   1.231   0.609  -6.407
  184   2H4     C  17          2H4         C  17   0.670   2.256  -6.272
  185    H5     C  17           H5         C  17   3.386  -0.121  -5.655
  186    H6     C  17           H6         C  17   5.500   0.582  -4.680
  187   1H5*    U  18          H5*         U  18   8.266   3.238   0.365
  188   2H5*    U  18          2H5*        U  18   8.211   2.225   1.821
  189    H4*    U  18           H4*        U  18   7.995   4.091   2.964
  190    H3*    U  18           H3*        U  18   5.416   3.370   2.541
  191    H2*    U  18          1H2*        U  18   4.859   4.794   0.727
  192   2HO*    U  18          2HO*        U  18   4.848   6.530   3.000
  193    H1*    U  18           H1*        U  18   6.670   7.023   1.743
  194    H3     U  18           H3         U  18   7.016   9.144  -2.143
  195    H5     U  18           H5         U  18   5.426   5.423  -3.257
  196    H6     U  18           H6         U  18   5.680   4.709  -0.985
  197   1H5*    U  19          H5*         U  19   5.615   7.346   4.761
  198   2H5*    U  19          2H5*        U  19   4.982   6.960   6.373
  199    H4*    U  19           H4*        U  19   4.428   9.206   5.941
  200    H3*    U  19           H3*        U  19   2.093   7.344   5.807
  201    H2*    U  19          1H2*        U  19   0.647   9.106   5.081
  202   2HO*    U  19          2HO*        U  19   2.337  10.572   6.532
  203    H1*    U  19           H1*        U  19   2.456  10.349   3.336
  204    H3     U  19           H3         U  19  -0.418   8.615   0.376
  205    H5     U  19           H5         U  19   1.562   5.247   1.912
  206    H6     U  19           H6         U  19   2.641   6.700   3.496
  207   1H5*    G  20          H5*         G  20  -0.453   9.968   6.443
  208   2H5*    G  20          2H5*        G  20  -0.876   9.772   8.154
  209    H4*    G  20           H4*        G  20  -2.895   9.687   7.000
  210    H3*    G  20           H3*        G  20  -1.980   7.008   7.931
  211    H2*    G  20          1H2*        G  20  -3.780   5.911   6.796
  212   2HO*    G  20          2HO*        G  20  -5.621   6.933   6.678
  213    H1*    G  20           H1*        G  20  -3.665   7.389   4.435
  214    H8     G  20           H8         G  20  -0.158   6.942   5.596
  215    H1     G  20           H1         G  20  -2.534   1.832   2.526
  216   1H2     G  20          1H2         G  20  -5.577   3.421   2.901
  217   2H2     G  20          2H2         G  20  -4.708   2.029   2.300
  218   1H5*    U  21          H5*         U  21  -5.692   6.996   8.652
  219   2H5*    U  21          2H5*        U  21  -6.307   6.336  10.180
  220    H4*    U  21           H4*        U  21  -7.170   4.990   8.448
  221    H3*    U  21           H3*        U  21  -4.992   3.657  10.018
  222    H2*    U  21          1H2*        U  21  -5.135   1.728   8.605
  223   2HO*    U  21          2HO*        U  21  -7.232   1.343   8.224
  224    H1*    U  21           H1*        U  21  -5.419   3.136   6.190
  225    H3     U  21           H3         U  21  -1.290   1.401   5.758
  226    H5     U  21           H5         U  21  -0.815   4.430   8.622
  227    H6     U  21           H6         U  21  -3.205   4.702   8.626
  228   1H5*    U  22          H5*         U  22  -8.584   1.382   9.599
  229   2H5*    U  22          2H5*        U  22  -9.074   0.508  11.063
  230    H4*    U  22           H4*        U  22  -9.192  -0.938   9.139
  231    H3*    U  22           H3*        U  22  -7.085  -1.647  11.166
  232    H2*    U  22          1H2*        U  22  -6.499  -3.549   9.812
  233   2HO*    U  22          2HO*        U  22  -7.844  -4.358   8.307
  234    H1*    U  22           H1*        U  22  -6.601  -2.167   7.369
  235    H3     U  22           H3         U  22  -2.235  -3.142   8.247
  236    H5     U  22           H5         U  22  -3.020   0.438  10.293
  237    H6     U  22           H6         U  22  -5.354   0.120   9.794
  238   1H5*    U  23          H5*         U  23  -8.936  -4.923   9.663
  239   2H5*    U  23          2H5*        U  23  -9.838  -5.742  10.953
  240    H4*    U  23           H4*        U  23  -8.915  -7.500   9.803
  241    H3*    U  23           H3*        U  23  -7.098  -6.863  12.113
  242    H2*    U  23          1H2*        U  23  -5.674  -8.684  11.404
  243   2HO*    U  23          2HO*        U  23  -7.306 -10.142  10.738
  244    H1*    U  23           H1*        U  23  -5.674  -7.938   8.721
  245    H3     U  23           H3         U  23  -1.605  -6.555  10.072
  246    H5     U  23           H5         U  23  -4.227  -3.715  11.694
  247    H6     U  23           H6         U  23  -6.057  -5.096  10.960
  248   1H5*    C  24          H5*         C  24  -7.527 -10.806  12.462
  249   2H5*    C  24          2H5*        C  24  -7.623 -11.371  14.141
  250    H4*    C  24           H4*        C  24  -5.690 -12.296  13.018
  251    H3*    C  24           H3*        C  24  -5.066 -10.373  15.256
  252    H2*    C  24          1H2*        C  24  -2.733 -10.919  14.909
  253   2HO*    C  24          2HO*        C  24  -3.797 -13.172  13.931
  254    H1*    C  24           H1*        C  24  -2.881 -10.658  12.129
  255   1H4     C  24          1H4         C  24  -2.822  -4.479  14.450
  256   2H4     C  24          2H4         C  24  -1.146  -5.000  14.442
  257    H5     C  24           H5         C  24  -4.649  -6.006  13.937
  258    H6     C  24           H6         C  24  -5.216  -8.304  13.340
  259   1H5*    C  25          H5*         C  25  -2.529 -13.371  15.675
  260   2H5*    C  25          2H5*        C  25  -3.023 -14.331  17.084
  261    H4*    C  25           H4*        C  25  -0.714 -14.296  17.216
  262    H3*    C  25           H3*        C  25  -1.886 -12.273  19.091
  263    H2*    C  25          1H2*        C  25   0.320 -11.554  19.713
  264   2HO*    C  25          2HO*        C  25   1.429 -13.571  18.041
  265    H1*    C  25           H1*        C  25   1.359 -11.506  17.124
  266   1H4     C  25          1H4         C  25  -2.341  -6.060  17.553
  267   2H4     C  25          2H4         C  25  -0.733  -5.594  18.060
  268    H5     C  25           H5         C  25  -2.944  -8.361  17.071
  269    H6     C  25           H6         C  25  -2.127 -10.658  16.978
  270    H3T    C  25           H3T        C  25  -0.255 -14.288  19.915
  Start of MODEL    9
    1   1H5*    G   1          H5*         G   1   7.317   0.982  12.054
    2   2H5*    G   1          2H5*        G   1   6.531   0.218  13.448
    3    H4*    G   1           H4*        G   1   9.115  -0.821  12.337
    4    H3*    G   1           H3*        G   1   6.387  -1.322  11.192
    5    H2*    G   1          1H2*        G   1   6.938  -3.662  10.961
    6   2HO*    G   1          2HO*        G   1   9.404  -2.707  10.814
    7    H1*    G   1           H1*        G   1   7.998  -3.939  13.510
    8    H8     G   1           H8         G   1   5.141  -1.416  13.239
    9    H1     G   1           H1         G   1   3.365  -7.429  14.589
   10   1H2     G   1          1H2         G   1   6.678  -8.209  13.993
   11   2H2     G   1          2H2         G   1   5.086  -8.787  14.432
   12    H5T    G   1           H5T        G   1   8.776   0.400  14.400
   13   1H5*    G   2          H5*         G   2   8.963  -3.484   9.070
   14   2H5*    G   2          2H5*        G   2   9.009  -2.991   7.365
   15    H4*    G   2           H4*        G   2   8.910  -5.276   7.213
   16    H3*    G   2           H3*        G   2   6.127  -4.192   6.929
   17    H2*    G   2          1H2*        G   2   5.297  -6.457   6.754
   18   2HO*    G   2          2HO*        G   2   7.732  -6.926   5.856
   19    H1*    G   2           H1*        G   2   6.677  -7.401   8.954
   20    H8     G   2           H8         G   2   5.708  -3.716   9.195
   21    H1     G   2           H1         G   2   1.377  -7.818  11.541
   22   1H2     G   2          1H2         G   2   3.414 -10.269  10.170
   23   2H2     G   2          2H2         G   2   1.952  -9.892  11.055
   24   1H5*    A   3          H5*         A   3   6.653  -6.963   4.158
   25   2H5*    A   3          2H5*        A   3   6.360  -6.484   2.475
   26    H4*    A   3           H4*        A   3   5.164  -8.433   2.645
   27    H3*    A   3           H3*        A   3   3.298  -6.129   3.092
   28    H2*    A   3          1H2*        A   3   1.495  -7.689   3.486
   29   2HO*    A   3          2HO*        A   3   1.597  -9.628   2.632
   30    H1*    A   3           H1*        A   3   2.889  -9.229   5.292
   31    H8     A   3           H8         A   3   4.070  -5.608   5.329
   32   1H6     A   3          1H6         A   3   1.152  -3.982   8.848
   33   2H6     A   3          2H6         A   3  -0.219  -4.676   9.687
   34    H2     A   3           H2         A   3  -0.795  -8.799   8.033
   35   1H5*    A   4          H5*         A   4   1.466  -8.815   0.962
   36   2H5*    A   4          2H5*        A   4   0.919  -8.306  -0.647
   37    H4*    A   4           H4*        A   4  -0.913  -9.414   0.187
   38    H3*    A   4           H3*        A   4  -1.268  -6.467   0.596
   39    H2*    A   4          1H2*        A   4  -3.363  -6.883   1.727
   40   2HO*    A   4          2HO*        A   4  -3.393  -9.027   0.230
   41    H1*    A   4           H1*        A   4  -2.372  -8.842   3.399
   42    H8     A   4           H8         A   4   0.414  -6.418   2.610
   43   1H6     A   4          1H6         A   4  -0.308  -3.289   6.242
   44   2H6     A   4          2H6         A   4  -1.588  -3.068   7.411
   45    H2     A   4           H2         A   4  -4.621  -6.272   6.584
   46   1H5*    G   5          H5*         G   5  -4.657  -7.779  -0.585
   47   2H5*    G   5          2H5*        G   5  -5.529  -6.927  -1.874
   48    H4*    G   5           H4*        G   5  -6.962  -7.039   0.002
   49    H3*    G   5           H3*        G   5  -5.828  -4.268  -0.367
   50    H2*    G   5          1H2*        G   5  -7.254  -3.577   1.465
   51   2HO*    G   5          2HO*        G   5  -8.685  -5.681   0.658
   52    H1*    G   5           H1*        G   5  -6.550  -5.749   3.084
   53    H8     G   5           H8         G   5  -3.401  -4.952   1.358
   54    H1     G   5           H1         G   5  -4.922  -0.632   5.843
   55   1H2     G   5          1H2         G   5  -8.032  -2.105   5.783
   56   2H2     G   5          2H2         G   5  -6.998  -0.866   6.458
   57   1H5*    C   6          H5*         C   6  -9.590  -3.627   0.477
   58   2H5*    C   6          2H5*        C   6 -10.432  -3.165  -1.015
   59    H4*    C   6           H4*        C   6 -11.365  -1.752   0.529
   60    H3*    C   6           H3*        C   6  -9.155  -0.317  -0.894
   61    H2*    C   6          1H2*        C   6  -9.461   1.603   0.513
   62   2HO*    C   6          2HO*        C   6 -11.933   0.859   0.506
   63    H1*    C   6           H1*        C   6  -9.751   0.187   2.907
   64   1H4     C   6          1H4         C   6  -3.263   0.148   1.740
   65   2H4     C   6          2H4         C   6  -3.550   1.552   2.739
   66    H5     C   6           H5         C   6  -5.039  -1.237   0.859
   67    H6     C   6           H6         C   6  -7.455  -1.557   0.757
   68   1H5*    A   7          H5*         A   7  -9.016   3.185  -2.954
   69   2H5*    A   7          2H5*        A   7  -8.707   2.047  -1.628
   70    H4*    A   7           H4*        A   7 -10.562   4.206  -0.954
   71    H3*    A   7           H3*        A   7  -7.865   4.956  -1.989
   72    H2*    A   7          1H2*        A   7  -7.447   6.350  -0.060
   73   2HO*    A   7          2HO*        A   7 -10.219   6.014   0.265
   74    H1*    A   7           H1*        A   7  -8.157   4.490   1.806
   75    H8     A   7           H8         A   7  -7.033   2.032  -0.562
   76   1H6     A   7          1H6         A   7  -2.210   2.433  -0.101
   77   2H6     A   7          2H6         A   7  -1.176   3.665   0.599
   78    H2     A   7           H2         A   7  -3.845   6.890   2.166
   79   1H5*    G   8          H5*         G   8  -6.777   6.612  -1.797
   80   2H5*    G   8          2H5*        G   8  -7.781   7.893  -1.094
   81    H4*    G   8           H4*        G   8  -6.309   9.561  -1.658
   82    H3*    G   8           H3*        G   8  -5.281   7.811  -3.858
   83    H2*    G   8          1H2*        G   8  -3.074   8.751  -3.590
   84   2HO*    G   8          2HO*        G   8  -4.419  10.841  -2.740
   85    H1*    G   8           H1*        G   8  -2.986   8.515  -0.843
   86    H8     G   8           H8         G   8  -5.109   5.684  -1.991
   87    H1     G   8           H1         G   8   1.164   4.640  -2.818
   88   1H2     G   8          1H2         G   8   1.506   7.999  -2.095
   89   2H2     G   8          2H2         G   8   2.296   6.499  -2.528
   90   1H5*    G   9          H5*         G   9  -3.446  10.978  -4.445
   91   2H5*    G   9          2H5*        G   9  -3.691  11.770  -6.013
   92    H4*    G   9           H4*        G   9  -1.381  11.602  -5.773
   93    H3*    G   9           H3*        G   9  -2.323   9.366  -7.570
   94    H2*    G   9          1H2*        G   9   0.004   8.797  -7.861
   95   2HO*    G   9          2HO*        G   9   0.297  11.422  -7.164
   96    H1*    G   9           H1*        G   9   0.642   9.156  -5.127
   97    H8     G   9           H8         G   9  -2.612   7.391  -5.220
   98    H1     G   9           H1         G   9   2.350   3.573  -6.603
   99   1H2     G   9          1H2         G   9   4.154   6.516  -6.807
  100   2H2     G   9          2H2         G   9   4.168   4.771  -6.923
  101   1H5*    C  10          H5*         C  10   1.041  11.371  -8.868
  102   2H5*    C  10          2H5*        C  10   0.709  12.106 -10.449
  103    H4*    C  10           H4*        C  10   2.870  11.344 -10.665
  104    H3*    C  10           H3*        C  10   1.010   9.334 -11.887
  105    H2*    C  10          1H2*        C  10   2.900   7.933 -12.397
  106   2HO*    C  10          2HO*        C  10   4.609   9.082 -12.967
  107    H1*    C  10           H1*        C  10   4.156   8.249  -9.917
  108   1H4     C  10          1H4         C  10  -0.797   3.943  -9.058
  109   2H4     C  10          2H4         C  10   0.677   3.024  -9.138
  110    H5     C  10           H5         C  10  -0.850   6.360  -9.379
  111    H6     C  10           H6         C  10   0.500   8.329  -9.879
  112   1H5*    U  11          H5*         U  11   3.559   9.853 -14.477
  113   2H5*    U  11          2H5*        U  11   3.266  10.085 -16.212
  114    H4*    U  11           H4*        U  11   4.459   8.055 -15.944
  115    H3*    U  11           H3*        U  11   1.587   7.697 -16.716
  116    H2*    U  11          1H2*        U  11   1.761   5.349 -16.508
  117   2HO*    U  11          2HO*        U  11   3.949   4.408 -16.388
  118    H1*    U  11           H1*        U  11   3.851   5.364 -14.496
  119    H3     U  11           H3         U  11   0.567   2.649 -12.888
  120    H5     U  11           H5         U  11  -0.668   6.586 -12.057
  121    H6     U  11           H6         U  11   1.126   7.363 -13.453
  122   1H5*    U  12          H5*         U  12   1.371   5.081 -19.133
  123   2H5*    U  12          2H5*        U  12   3.049   5.519 -18.766
  124    H4*    U  12           H4*        U  12   2.029   4.526 -21.429
  125    H3*    U  12           H3*        U  12   2.236   2.787 -19.477
  126    H2*    U  12          1H2*        U  12   4.362   3.519 -18.575
  127   2HO*    U  12          2HO*        U  12   5.955   2.045 -19.907
  128    H1*    U  12           H1*        U  12   5.568   3.617 -21.376
  129    H3     U  12           H3         U  12   9.260   5.033 -19.220
  130    H5     U  12           H5         U  12   6.332   7.855 -18.188
  131    H6     U  12           H6         U  12   4.709   6.457 -19.283
  132   1H5*    C  13          H5*         C  13   3.856   0.178 -19.269
  133   2H5*    C  13          2H5*        C  13   3.025  -1.227 -19.966
  134    H4*    C  13           H4*        C  13   3.477  -1.469 -17.569
  135    H3*    C  13           H3*        C  13   1.214  -2.342 -18.739
  136    H2*    C  13          1H2*        C  13  -0.119  -0.359 -18.287
  137   2HO*    C  13          2HO*        C  13  -0.323  -1.838 -15.851
  138    H1*    C  13           H1*        C  13   1.151  -0.343 -15.492
  139   1H4     C  13          1H4         C  13  -1.176   5.759 -16.464
  140   2H4     C  13          2H4         C  13  -1.872   5.180 -14.967
  141    H5     C  13           H5         C  13   0.213   4.369 -17.878
  142    H6     C  13           H6         C  13   1.208   2.162 -18.146
  143   1H5*    G  14          H5*         G  14   3.142  -4.511 -17.948
  144   2H5*    G  14          2H5*        G  14   3.139  -6.284 -17.864
  145    H4*    G  14           H4*        G  14   4.877  -6.181 -16.518
  146    H3*    G  14           H3*        G  14   2.934  -4.893 -14.618
  147    H2*    G  14          1H2*        G  14   4.730  -4.132 -13.285
  148   2HO*    G  14          2HO*        G  14   5.747  -6.083 -12.959
  149    H1*    G  14           H1*        G  14   6.684  -4.104 -15.471
  150    H8     G  14           H8         G  14   7.662  -1.814 -15.304
  151    H1     G  14           H1         G  14   2.098   0.735 -13.388
  152   1H2     G  14          1H2         G  14   0.859  -2.485 -13.770
  153   2H2     G  14          2H2         G  14   0.527  -0.822 -13.333
  154   1H5*    G  15          H5*         G  15   3.716  -5.863 -10.063
  155   2H5*    G  15          2H5*        G  15   3.020  -4.840 -11.335
  156    H4*    G  15           H4*        G  15   5.972  -4.868 -10.939
  157    H3*    G  15           H3*        G  15   4.083  -3.647  -8.975
  158    H2*    G  15          1H2*        G  15   5.335  -1.593  -8.976
  159   2HO*    G  15          2HO*        G  15   7.368  -3.067  -9.354
  160    H1*    G  15           H1*        G  15   5.622  -1.394 -11.717
  161    H8     G  15           H8         G  15   2.330  -3.049 -11.180
  162    H1     G  15           H1         G  15   2.164   3.297 -10.383
  163   1H2     G  15          1H2         G  15   5.590   3.096 -10.471
  164   2H2     G  15          2H2         G  15   4.176   4.121 -10.351
  165   1H5*    C  16          H5*         C  16   8.189  -2.516  -7.889
  166   2H5*    C  16          2H5*        C  16   8.282  -2.810  -6.142
  167    H4*    C  16           H4*        C  16   9.036  -0.580  -6.675
  168    H3*    C  16           H3*        C  16   6.518  -0.790  -5.053
  169    H2*    C  16          1H2*        C  16   6.385   1.619  -4.999
  170   2HO*    C  16          2HO*        C  16   8.985   1.459  -5.201
  171    H1*    C  16           H1*        C  16   6.890   1.970  -7.710
  172   1H4     C  16          1H4         C  16   0.689  -0.290  -7.278
  173   2H4     C  16          2H4         C  16   0.599   1.455  -7.436
  174    H5     C  16           H5         C  16   2.810  -1.456  -7.072
  175    H6     C  16           H6         C  16   5.230  -1.185  -6.971
  176   1H5*    C  17          H5*         C  17   9.113   2.302  -3.644
  177   2H5*    C  17          2H5*        C  17   9.523   1.858  -1.976
  178    H4*    C  17           H4*        C  17   9.189   4.145  -1.886
  179    H3*    C  17           H3*        C  17   6.721   2.746  -0.899
  180    H2*    C  17          1H2*        C  17   5.697   4.904  -0.546
  181   2HO*    C  17          2HO*        C  17   8.317   5.672  -0.589
  182    H1*    C  17           H1*        C  17   6.329   5.874  -3.051
  183   1H4     C  17          1H4         C  17   1.752   1.199  -4.091
  184   2H4     C  17          2H4         C  17   0.924   2.731  -4.204
  185    H5     C  17           H5         C  17   4.086   1.001  -3.495
  186    H6     C  17           H6         C  17   6.097   2.229  -2.876
  187   1H5*    U  18          H5*         U  18   8.353   6.362   1.013
  188   2H5*    U  18          2H5*        U  18   9.090   5.529   2.396
  189    H4*    U  18           H4*        U  18   8.682   7.327   3.592
  190    H3*    U  18           H3*        U  18   6.463   5.910   4.021
  191    H2*    U  18          1H2*        U  18   5.051   6.759   2.305
  192   2HO*    U  18          2HO*        U  18   4.947   8.601   4.471
  193    H1*    U  18           H1*        U  18   6.083   9.601   2.633
  194    H3     U  18           H3         U  18   4.527  10.938  -1.304
  195    H5     U  18           H5         U  18   4.879   6.794  -1.828
  196    H6     U  18           H6         U  18   5.792   6.655   0.382
  197   1H5*    U  19          H5*         U  19   3.309   6.599   6.642
  198   2H5*    U  19          2H5*        U  19   4.019   7.358   5.204
  199    H4*    U  19           H4*        U  19   3.471   9.268   7.323
  200    H3*    U  19           H3*        U  19   1.195   7.518   6.468
  201    H2*    U  19          1H2*        U  19  -0.210   9.464   6.223
  202   2HO*    U  19          2HO*        U  19   1.376  10.439   8.067
  203    H1*    U  19           H1*        U  19   1.634  10.958   4.801
  204    H3     U  19           H3         U  19  -1.205   9.480   1.601
  205    H5     U  19           H5         U  19   1.288   6.197   2.382
  206    H6     U  19           H6         U  19   2.220   7.437   4.220
  207   1H5*    G  20          H5*         G  20  -0.873   9.416   8.092
  208   2H5*    G  20          2H5*        G  20  -1.267   9.019   9.775
  209    H4*    G  20           H4*        G  20  -3.311   9.596   8.943
  210    H3*    G  20           H3*        G  20  -3.053   6.617   8.742
  211    H2*    G  20          1H2*        G  20  -5.246   6.529   7.715
  212   2HO*    G  20          2HO*        G  20  -5.525   8.875   8.971
  213    H1*    G  20           H1*        G  20  -4.671   8.429   5.815
  214    H8     G  20           H8         G  20  -1.297   7.174   6.308
  215    H1     G  20           H1         G  20  -5.017   2.869   3.340
  216   1H2     G  20          1H2         G  20  -7.625   4.875   4.372
  217   2H2     G  20          2H2         G  20  -7.118   3.432   3.527
  218   1H5*    U  21          H5*         U  21  -6.594   6.453   9.925
  219   2H5*    U  21          2H5*        U  21  -6.800   5.479  11.394
  220    H4*    U  21           H4*        U  21  -8.160   4.579   9.643
  221    H3*    U  21           H3*        U  21  -5.837   2.861  10.461
  222    H2*    U  21          1H2*        U  21  -6.511   1.225   8.826
  223   2HO*    U  21          2HO*        U  21  -8.880   2.011   9.343
  224    H1*    U  21           H1*        U  21  -6.990   3.067   6.783
  225    H3     U  21           H3         U  21  -3.122   0.713   5.932
  226    H5     U  21           H5         U  21  -1.990   4.149   8.045
  227    H6     U  21           H6         U  21  -4.319   4.556   8.496
  228   1H5*    U  22          H5*         U  22  -9.581   0.251  11.291
  229   2H5*    U  22          2H5*        U  22  -9.089  -0.681  12.718
  230    H4*    U  22           H4*        U  22  -9.911  -2.052  10.818
  231    H3*    U  22           H3*        U  22  -7.150  -2.538  11.910
  232    H2*    U  22          1H2*        U  22  -6.879  -4.307  10.308
  233   2HO*    U  22          2HO*        U  22  -8.565  -5.301   9.406
  234    H1*    U  22           H1*        U  22  -8.066  -2.913   8.168
  235    H3     U  22           H3         U  22  -3.592  -3.496   7.404
  236    H5     U  22           H5         U  22  -3.959   0.120   9.512
  237    H6     U  22           H6         U  22  -6.263  -0.450   9.919
  238   1H5*    U  23          H5*         U  23  -9.023  -6.022  10.876
  239   2H5*    U  23          2H5*        U  23  -9.312  -6.954  12.358
  240    H4*    U  23           H4*        U  23  -8.659  -8.577  10.876
  241    H3*    U  23           H3*        U  23  -6.268  -7.736  12.481
  242    H2*    U  23          1H2*        U  23  -4.904  -9.274  11.217
  243   2HO*    U  23          2HO*        U  23  -7.355 -10.085   9.988
  244    H1*    U  23           H1*        U  23  -5.883  -8.510   8.734
  245    H3     U  23           H3         U  23  -1.959  -6.331   8.708
  246    H5     U  23           H5         U  23  -4.255  -4.192  11.494
  247    H6     U  23           H6         U  23  -5.952  -5.883  11.278
  248   1H5*    C  24          H5*         C  24  -6.154 -11.595  12.482
  249   2H5*    C  24          2H5*        C  24  -5.898 -12.450  14.017
  250    H4*    C  24           H4*        C  24  -4.203 -13.150  12.530
  251    H3*    C  24           H3*        C  24  -3.171 -11.276  14.644
  252    H2*    C  24          1H2*        C  24  -0.968 -11.506  13.696
  253   2HO*    C  24          2HO*        C  24  -1.972 -13.862  12.917
  254    H1*    C  24           H1*        C  24  -1.812 -11.288  11.029
  255   1H4     C  24          1H4         C  24  -1.735  -5.075  13.233
  256   2H4     C  24          2H4         C  24  -0.133  -5.404  12.602
  257    H5     C  24           H5         C  24  -3.427  -6.825  13.423
  258    H6     C  24           H6         C  24  -3.902  -9.187  13.032
  259   1H5*    C  25          H5*         C  25  -0.457 -14.426  14.275
  260   2H5*    C  25          2H5*        C  25  -0.597 -15.358  15.778
  261    H4*    C  25           H4*        C  25   1.664 -15.376  15.389
  262    H3*    C  25           H3*        C  25   1.006 -13.237  17.365
  263    H2*    C  25          1H2*        C  25   3.268 -12.432  17.350
  264   2HO*    C  25          2HO*        C  25   3.925 -14.611  15.623
  265    H1*    C  25           H1*        C  25   3.616 -12.482  14.602
  266   1H4     C  25          1H4         C  25  -0.364  -7.328  15.720
  267   2H4     C  25          2H4         C  25   1.244  -6.681  15.497
  268    H5     C  25           H5         C  25  -0.828  -9.702  15.757
  269    H6     C  25           H6         C  25   0.152 -11.927  15.595
  270    H3T    C  25           H3T        C  25   2.859 -15.172  17.840
  Start of MODEL   10
    1   1H5*    G   1          H5*         G   1   7.095  -1.546  15.630
    2   2H5*    G   1          2H5*        G   1   6.716  -2.327  17.176
    3    H4*    G   1           H4*        G   1   9.217  -3.248  15.997
    4    H3*    G   1           H3*        G   1   6.754  -3.442  14.306
    5    H2*    G   1          1H2*        G   1   7.233  -5.762  13.855
    6   2HO*    G   1          2HO*        G   1   9.720  -4.978  14.277
    7    H1*    G   1           H1*        G   1   7.764  -6.460  16.477
    8    H8     G   1           H8         G   1   5.198  -3.735  16.584
    9    H1     G   1           H1         G   1   2.751  -9.535  15.375
   10   1H2     G   1          1H2         G   1   6.042 -10.506  14.957
   11   2H2     G   1          2H2         G   1   4.352 -10.969  14.944
   12    H5T    G   1           H5T        G   1   9.328  -1.404  16.670
   13   1H5*    G   2          H5*         G   2   9.786  -5.068  12.044
   14   2H5*    G   2          2H5*        G   2  10.083  -4.103  10.583
   15    H4*    G   2           H4*        G   2  10.107  -6.245   9.770
   16    H3*    G   2           H3*        G   2   7.392  -5.070   9.326
   17    H2*    G   2          1H2*        G   2   6.605  -7.184   8.453
   18   2HO*    G   2          2HO*        G   2   9.222  -7.530   7.976
   19    H1*    G   2           H1*        G   2   7.560  -8.709  10.526
   20    H8     G   2           H8         G   2   6.889  -5.282  11.903
   21    H1     G   2           H1         G   2   1.671  -8.986  11.576
   22   1H2     G   2          1H2         G   2   3.674 -11.116   9.705
   23   2H2     G   2          2H2         G   2   2.100 -10.810  10.402
   24   1H5*    A   3          H5*         A   3   8.212  -7.337   6.360
   25   2H5*    A   3          2H5*        A   3   8.261  -6.597   4.748
   26    H4*    A   3           H4*        A   3   6.985  -8.474   4.405
   27    H3*    A   3           H3*        A   3   5.166  -6.125   4.811
   28    H2*    A   3          1H2*        A   3   3.257  -7.598   4.614
   29   2HO*    A   3          2HO*        A   3   5.102  -9.149   3.358
   30    H1*    A   3           H1*        A   3   4.200  -9.468   6.405
   31    H8     A   3           H8         A   3   5.554  -6.071   7.368
   32   1H6     A   3          1H6         A   3   1.980  -4.703  10.346
   33   2H6     A   3          2H6         A   3   0.380  -5.334  10.674
   34    H2     A   3           H2         A   3  -0.106  -8.996   8.137
   35   1H5*    A   4          H5*         A   4   3.882  -8.551   1.980
   36   2H5*    A   4          2H5*        A   4   3.629  -7.842   0.373
   37    H4*    A   4           H4*        A   4   1.768  -9.200   0.778
   38    H3*    A   4           H3*        A   4   1.200  -6.283   1.007
   39    H2*    A   4          1H2*        A   4  -1.039  -6.693   1.773
   40   2HO*    A   4          2HO*        A   4  -2.038  -8.578   1.434
   41    H1*    A   4           H1*        A   4  -0.404  -8.646   3.620
   42    H8     A   4           H8         A   4   2.492  -6.247   3.439
   43   1H6     A   4          1H6         A   4   1.020  -3.068   6.797
   44   2H6     A   4          2H6         A   4  -0.483  -2.833   7.659
   45    H2     A   4           H2         A   4  -3.277  -6.040   6.235
   46   1H5*    G   5          H5*         G   5  -1.872  -7.539  -0.522
   47   2H5*    G   5          2H5*        G   5  -2.520  -6.785  -1.991
   48    H4*    G   5           H4*        G   5  -4.206  -6.585  -0.389
   49    H3*    G   5           H3*        G   5  -2.748  -3.939  -0.532
   50    H2*    G   5          1H2*        G   5  -4.518  -3.123   0.914
   51   2HO*    G   5          2HO*        G   5  -6.189  -4.662   1.552
   52    H1*    G   5           H1*        G   5  -4.323  -5.350   2.620
   53    H8     G   5           H8         G   5  -0.824  -4.655   1.753
   54    H1     G   5           H1         G   5  -3.332  -0.203   5.633
   55   1H2     G   5          1H2         G   5  -6.348  -1.647   4.832
   56   2H2     G   5          2H2         G   5  -5.499  -0.399   5.717
   57   1H5*    C   6          H5*         C   6  -6.793  -3.407  -0.711
   58   2H5*    C   6          2H5*        C   6  -7.169  -2.851  -2.353
   59    H4*    C   6           H4*        C   6  -8.665  -1.667  -1.082
   60    H3*    C   6           H3*        C   6  -6.261   0.086  -1.518
   61    H2*    C   6          1H2*        C   6  -7.398   1.817  -0.250
   62   2HO*    C   6          2HO*        C   6  -9.556   0.585  -1.067
   63    H1*    C   6           H1*        C   6  -8.014   0.142   1.860
   64   1H4     C   6          1H4         C   6  -1.472   0.810   2.345
   65   2H4     C   6          2H4         C   6  -2.131   2.271   3.055
   66    H5     C   6           H5         C   6  -2.854  -0.822   1.201
   67    H6     C   6           H6         C   6  -5.130  -1.379   0.524
   68   1H5*    A   7          H5*         A   7  -9.476   2.071  -2.316
   69   2H5*    A   7          2H5*        A   7  -9.572   3.259  -3.631
   70    H4*    A   7           H4*        A   7 -10.058   4.296  -1.508
   71    H3*    A   7           H3*        A   7  -7.546   5.198  -2.885
   72    H2*    A   7          1H2*        A   7  -7.144   6.732  -1.067
   73   2HO*    A   7          2HO*        A   7  -9.741   6.740  -0.900
   74    H1*    A   7           H1*        A   7  -7.715   4.897   0.953
   75    H8     A   7           H8         A   7  -6.036   2.641  -1.333
   76   1H6     A   7          1H6         A   7  -1.404   3.832  -0.525
   77   2H6     A   7          2H6         A   7  -0.628   5.193   0.263
   78    H2     A   7           H2         A   7  -3.909   7.889   1.684
   79   1H5*    G   8          H5*         G   8  -8.506   8.666  -2.032
   80   2H5*    G   8          2H5*        G   8  -8.935   9.633  -3.457
   81    H4*    G   8           H4*        G   8  -7.336  10.931  -2.468
   82    H3*    G   8           H3*        G   8  -6.060   9.310  -4.623
   83    H2*    G   8          1H2*        G   8  -3.868  10.059  -3.977
   84   2HO*    G   8          2HO*        G   8  -5.141  12.202  -3.250
   85    H1*    G   8           H1*        G   8  -4.178   9.692  -1.260
   86    H8     G   8           H8         G   8  -6.266   7.046  -2.828
   87    H1     G   8           H1         G   8  -0.001   5.677  -2.810
   88   1H2     G   8          1H2         G   8   0.401   8.990  -1.960
   89   2H2     G   8          2H2         G   8   1.173   7.457  -2.305
   90   1H5*    G   9          H5*         G   9  -4.119  12.758  -5.686
   91   2H5*    G   9          2H5*        G   9  -4.307  12.951  -7.439
   92    H4*    G   9           H4*        G   9  -1.978  12.756  -6.872
   93    H3*    G   9           H3*        G   9  -3.062  10.375  -8.375
   94    H2*    G   9          1H2*        G   9  -0.804   9.526  -8.414
   95   2HO*    G   9          2HO*        G   9   0.832  10.881  -8.340
   96    H1*    G   9           H1*        G   9  -0.304  10.156  -5.716
   97    H8     G   9           H8         G   9  -3.784   8.907  -5.821
   98    H1     G   9           H1         G   9   0.566   4.233  -6.453
   99   1H2     G   9          1H2         G   9   2.828   6.806  -6.847
  100   2H2     G   9          2H2         G   9   2.555   5.080  -6.791
  101   1H5*    C  10          H5*         C  10   0.475  11.972  -9.659
  102   2H5*    C  10          2H5*        C  10   0.459  12.416 -11.377
  103    H4*    C  10           H4*        C  10   2.568  11.513 -11.017
  104    H3*    C  10           H3*        C  10   0.786   9.490 -12.337
  105    H2*    C  10          1H2*        C  10   2.624   7.929 -12.324
  106   2HO*    C  10          2HO*        C  10   4.045  10.215 -12.263
  107    H1*    C  10           H1*        C  10   3.376   8.439  -9.686
  108   1H4     C  10          1H4         C  10  -2.083   4.698  -9.427
  109   2H4     C  10          2H4         C  10  -0.721   3.637  -9.223
  110    H5     C  10           H5         C  10  -1.811   7.086  -9.872
  111    H6     C  10           H6         C  10  -0.187   8.862 -10.265
  112   1H5*    U  11          H5*         U  11   3.808   8.622 -14.041
  113   2H5*    U  11          2H5*        U  11   3.794   8.839 -15.801
  114    H4*    U  11           H4*        U  11   4.449   6.627 -15.463
  115    H3*    U  11           H3*        U  11   1.555   6.775 -16.256
  116    H2*    U  11          1H2*        U  11   1.420   4.387 -16.114
  117   2HO*    U  11          2HO*        U  11   3.161   3.126 -16.253
  118    H1*    U  11           H1*        U  11   3.007   4.156 -13.784
  119    H3     U  11           H3         U  11  -1.156   2.822 -12.584
  120    H5     U  11           H5         U  11  -1.276   7.035 -12.500
  121    H6     U  11           H6         U  11   0.896   7.033 -13.531
  122   1H5*    U  12          H5*         U  12   2.312   5.154 -21.267
  123   2H5*    U  12          2H5*        U  12   1.003   4.073 -20.753
  124    H4*    U  12           H4*        U  12   2.550   2.716 -21.854
  125    H3*    U  12           H3*        U  12   1.914   2.004 -19.343
  126    H2*    U  12          1H2*        U  12   3.780   3.027 -18.211
  127   2HO*    U  12          2HO*        U  12   4.789   1.272 -17.519
  128    H1*    U  12           H1*        U  12   5.623   2.116 -20.485
  129    H3     U  12           H3         U  12   9.005   4.013 -18.226
  130    H5     U  12           H5         U  12   6.113   7.053 -18.400
  131    H6     U  12           H6         U  12   4.620   5.467 -19.416
  132   1H5*    C  13          H5*         C  13   3.118  -0.795 -17.541
  133   2H5*    C  13          2H5*        C  13   2.274  -2.168 -18.285
  134    H4*    C  13           H4*        C  13   1.862  -1.999 -15.886
  135    H3*    C  13           H3*        C  13  -0.048  -2.695 -17.636
  136    H2*    C  13          1H2*        C  13  -0.961  -0.477 -17.989
  137   2HO*    C  13          2HO*        C  13  -2.614  -1.880 -17.065
  138    H1*    C  13           H1*        C  13  -0.710  -0.005 -14.967
  139   1H4     C  13          1H4         C  13  -0.935   5.933 -17.851
  140   2H4     C  13          2H4         C  13  -2.210   5.895 -16.654
  141    H5     C  13           H5         C  13   0.455   4.008 -18.338
  142    H6     C  13           H6         C  13   0.891   1.676 -17.785
  143   1H5*    G  14          H5*         G  14   1.075  -4.380 -16.716
  144   2H5*    G  14          2H5*        G  14   0.963  -6.127 -17.003
  145    H4*    G  14           H4*        G  14   2.144  -6.653 -15.178
  146    H3*    G  14           H3*        G  14   0.769  -4.408 -13.716
  147    H2*    G  14          1H2*        G  14   2.603  -4.319 -12.193
  148   2HO*    G  14          2HO*        G  14   2.565  -6.870 -12.448
  149    H1*    G  14           H1*        G  14   4.607  -4.987 -14.139
  150    H8     G  14           H8         G  14   6.041  -2.942 -14.295
  151    H1     G  14           H1         G  14   1.079   0.958 -13.133
  152   1H2     G  14          1H2         G  14  -0.801  -1.968 -13.153
  153   2H2     G  14          2H2         G  14  -0.790  -0.229 -12.969
  154   1H5*    G  15          H5*         G  15   1.517  -6.302  -9.802
  155   2H5*    G  15          2H5*        G  15   0.552  -5.045  -9.004
  156    H4*    G  15           H4*        G  15   3.323  -5.054  -9.658
  157    H3*    G  15           H3*        G  15   1.530  -3.242  -8.092
  158    H2*    G  15          1H2*        G  15   3.156  -1.464  -8.267
  159   2HO*    G  15          2HO*        G  15   4.886  -2.985  -9.868
  160    H1*    G  15           H1*        G  15   3.540  -1.705 -10.979
  161    H8     G  15           H8         G  15   0.033  -2.834 -10.398
  162    H1     G  15           H1         G  15   0.698   3.531 -10.434
  163   1H2     G  15          1H2         G  15   4.071   2.886 -10.352
  164   2H2     G  15          2H2         G  15   2.803   4.088 -10.381
  165   1H5*    C  16          H5*         C  16   5.514  -2.693  -7.023
  166   2H5*    C  16          2H5*        C  16   5.705  -2.674  -5.259
  167    H4*    C  16           H4*        C  16   6.789  -0.764  -6.264
  168    H3*    C  16           H3*        C  16   4.462  -0.214  -4.460
  169    H2*    C  16          1H2*        C  16   4.651   2.140  -4.905
  170   2HO*    C  16          2HO*        C  16   7.215   1.403  -5.421
  171    H1*    C  16           H1*        C  16   5.100   1.907  -7.657
  172   1H4     C  16          1H4         C  16  -1.398   1.051  -6.897
  173   2H4     C  16          2H4         C  16  -1.159   2.731  -7.323
  174    H5     C  16           H5         C  16   0.450  -0.456  -6.464
  175    H6     C  16           H6         C  16   2.878  -0.658  -6.381
  176   1H5*    C  17          H5*         C  17   7.300   2.564  -4.115
  177   2H5*    C  17          2H5*        C  17   8.206   2.302  -2.612
  178    H4*    C  17           H4*        C  17   8.192   4.596  -2.850
  179    H3*    C  17           H3*        C  17   6.101   3.751  -0.885
  180    H2*    C  17          1H2*        C  17   5.356   6.030  -0.663
  181   2HO*    C  17          2HO*        C  17   7.836   6.559  -1.321
  182    H1*    C  17           H1*        C  17   5.189   6.531  -3.366
  183   1H4     C  17          1H4         C  17   0.306   2.187  -2.479
  184   2H4     C  17          2H4         C  17  -0.420   3.764  -2.284
  185    H5     C  17           H5         C  17   2.681   1.864  -2.777
  186    H6     C  17           H6         C  17   4.840   2.982  -2.940
  187   1H5*    U  18          H5*         U  18   7.808   7.159   0.846
  188   2H5*    U  18          2H5*        U  18   9.034   6.425   1.898
  189    H4*    U  18           H4*        U  18   8.260   7.415   3.747
  190    H3*    U  18           H3*        U  18   5.909   6.261   3.449
  191    H2*    U  18          1H2*        U  18   5.002   7.595   1.678
  192   2HO*    U  18          2HO*        U  18   4.408   8.794   4.176
  193    H1*    U  18           H1*        U  18   6.014  10.187   2.897
  194    H3     U  18           H3         U  18   5.870  12.530  -0.870
  195    H5     U  18           H5         U  18   5.746   8.566  -2.248
  196    H6     U  18           H6         U  18   5.987   7.841   0.023
  197   1H5*    U  19          H5*         U  19   4.769  10.045   5.306
  198   2H5*    U  19          2H5*        U  19   4.905   9.616   7.021
  199    H4*    U  19           H4*        U  19   3.264  11.064   7.345
  200    H3*    U  19           H3*        U  19   1.695   8.752   6.246
  201    H2*    U  19          1H2*        U  19  -0.266  10.153   6.167
  202   2HO*    U  19          2HO*        U  19   0.945  11.375   8.165
  203    H1*    U  19           H1*        U  19   1.015  12.354   5.038
  204    H3     U  19           H3         U  19  -1.169  10.803   1.440
  205    H5     U  19           H5         U  19   1.809   7.921   2.100
  206    H6     U  19           H6         U  19   2.385   9.088   4.120
  207   1H5*    G  20          H5*         G  20  -0.897  10.399   8.189
  208   2H5*    G  20          2H5*        G  20  -1.290   9.546   9.693
  209    H4*    G  20           H4*        G  20  -3.334  10.178   8.743
  210    H3*    G  20           H3*        G  20  -2.772   7.255   8.416
  211    H2*    G  20          1H2*        G  20  -4.861   7.001   7.220
  212   2HO*    G  20          2HO*        G  20  -5.443   9.282   8.544
  213    H1*    G  20           H1*        G  20  -4.390   9.070   5.473
  214    H8     G  20           H8         G  20  -0.942   8.131   6.133
  215    H1     G  20           H1         G  20  -3.966   3.663   2.667
  216   1H2     G  20          1H2         G  20  -6.841   5.333   3.586
  217   2H2     G  20          2H2         G  20  -6.134   3.996   2.711
  218   1H5*    U  21          H5*         U  21  -6.257   6.782   8.800
  219   2H5*    U  21          2H5*        U  21  -6.739   5.840  10.224
  220    H4*    U  21           H4*        U  21  -7.686   4.801   8.322
  221    H3*    U  21           H3*        U  21  -5.402   3.269   9.523
  222    H2*    U  21          1H2*        U  21  -5.648   1.590   7.820
  223   2HO*    U  21          2HO*        U  21  -8.128   2.142   7.950
  224    H1*    U  21           H1*        U  21  -5.978   3.383   5.698
  225    H3     U  21           H3         U  21  -1.843   1.359   5.446
  226    H5     U  21           H5         U  21  -1.332   4.856   7.708
  227    H6     U  21           H6         U  21  -3.726   5.070   7.792
  228   1H5*    U  22          H5*         U  22  -9.111   0.521   9.488
  229   2H5*    U  22          2H5*        U  22  -8.967  -0.387  11.005
  230    H4*    U  22           H4*        U  22  -9.381  -1.782   8.990
  231    H3*    U  22           H3*        U  22  -6.957  -2.314  10.690
  232    H2*    U  22          1H2*        U  22  -6.376  -4.123   9.212
  233   2HO*    U  22          2HO*        U  22  -7.825  -5.040   7.885
  234    H1*    U  22           H1*        U  22  -6.919  -2.718   6.849
  235    H3     U  22           H3         U  22  -2.407  -3.442   7.597
  236    H5     U  22           H5         U  22  -3.307   0.428   8.960
  237    H6     U  22           H6         U  22  -5.640  -0.130   8.743
  238   1H5*    U  23          H5*         U  23  -8.734  -5.827   9.354
  239   2H5*    U  23          2H5*        U  23  -9.102  -6.867  10.744
  240    H4*    U  23           H4*        U  23  -8.118  -8.236   9.098
  241    H3*    U  23           H3*        U  23  -6.219  -7.658  11.359
  242    H2*    U  23          1H2*        U  23  -4.589  -9.063  10.258
  243   2HO*    U  23          2HO*        U  23  -6.851 -10.078   9.122
  244    H1*    U  23           H1*        U  23  -5.019  -7.984   7.714
  245    H3     U  23           H3         U  23  -1.026  -6.248   8.881
  246    H5     U  23           H5         U  23  -3.813  -3.992  11.066
  247    H6     U  23           H6         U  23  -5.514  -5.527  10.332
  248   1H5*    C  24          H5*         C  24  -6.169 -11.455  10.249
  249   2H5*    C  24          2H5*        C  24  -6.442 -12.656  11.527
  250    H4*    C  24           H4*        C  24  -4.621 -13.444  10.289
  251    H3*    C  24           H3*        C  24  -3.732 -12.222  12.886
  252    H2*    C  24          1H2*        C  24  -1.450 -12.753  12.303
  253   2HO*    C  24          2HO*        C  24  -2.584 -14.692  10.946
  254    H1*    C  24           H1*        C  24  -1.633 -11.788   9.699
  255   1H4     C  24          1H4         C  24  -1.402  -6.407  13.518
  256   2H4     C  24          2H4         C  24   0.232  -6.702  12.960
  257    H5     C  24           H5         C  24  -3.232  -7.926  13.046
  258    H6     C  24           H6         C  24  -3.854 -10.018  11.957
  259   1H5*    C  25          H5*         C  25  -2.046 -15.826  12.842
  260   2H5*    C  25          2H5*        C  25  -2.224 -16.837  14.289
  261    H4*    C  25           H4*        C  25   0.077 -16.696  13.874
  262    H3*    C  25           H3*        C  25  -0.769 -14.973  16.176
  263    H2*    C  25          1H2*        C  25   1.483 -14.176  16.424
  264   2HO*    C  25          2HO*        C  25   2.119 -16.532  15.573
  265    H1*    C  25           H1*        C  25   1.966 -13.794  13.698
  266   1H4     C  25          1H4         C  25  -1.761  -8.671  15.565
  267   2H4     C  25          2H4         C  25  -0.096  -8.134  15.651
  268    H5     C  25           H5         C  25  -2.367 -10.962  15.044
  269    H6     C  25           H6         C  25  -1.503 -13.180  14.514
  270    H3T    C  25           H3T        C  25  -0.738 -17.161  16.443
  Start of MODEL   11
    1   1H5*    G   1          H5*         G   1   5.391   0.341  15.291
    2   2H5*    G   1          2H5*        G   1   5.989   0.171  16.951
    3    H4*    G   1           H4*        G   1   7.839  -1.234  15.490
    4    H3*    G   1           H3*        G   1   5.216  -1.513  14.070
    5    H2*    G   1          1H2*        G   1   5.503  -3.898  13.987
    6   2HO*    G   1          2HO*        G   1   7.533  -4.470  13.687
    7    H1*    G   1           H1*        G   1   6.342  -4.194  16.621
    8    H8     G   1           H8         G   1   3.775  -1.429  16.285
    9    H1     G   1           H1         G   1   1.307  -7.302  17.001
   10   1H2     G   1          1H2         G   1   4.560  -8.387  16.569
   11   2H2     G   1          2H2         G   1   2.887  -8.822  16.848
   12    H5T    G   1           H5T        G   1   8.059   0.603  15.312
   13   1H5*    G   2          H5*         G   2   8.391  -3.443  11.478
   14   2H5*    G   2          2H5*        G   2   7.768  -3.449   9.817
   15    H4*    G   2           H4*        G   2   8.324  -5.690  10.711
   16    H3*    G   2           H3*        G   2   5.562  -5.114   9.697
   17    H2*    G   2          1H2*        G   2   4.895  -7.358  10.273
   18   2HO*    G   2          2HO*        G   2   7.375  -7.924   9.787
   19    H1*    G   2           H1*        G   2   6.048  -7.356  12.796
   20    H8     G   2           H8         G   2   4.812  -3.896  11.938
   21    H1     G   2           H1         G   2   0.326  -7.767  14.380
   22   1H2     G   2          1H2         G   2   2.672 -10.275  13.914
   23   2H2     G   2          2H2         G   2   1.056  -9.843  14.436
   24   1H5*    A   3          H5*         A   3   6.469  -8.738   7.498
   25   2H5*    A   3          2H5*        A   3   6.460  -8.214   5.802
   26    H4*    A   3           H4*        A   3   5.157 -10.096   5.735
   27    H3*    A   3           H3*        A   3   3.385  -7.695   5.927
   28    H2*    A   3          1H2*        A   3   1.438  -9.119   6.073
   29   2HO*    A   3          2HO*        A   3   1.624 -10.955   5.006
   30    H1*    A   3           H1*        A   3   2.426 -10.711   8.072
   31    H8     A   3           H8         A   3   4.139  -7.402   8.457
   32   1H6     A   3          1H6         A   3   0.846  -5.125  11.194
   33   2H6     A   3          2H6         A   3  -0.799  -5.502  11.658
   34    H2     A   3           H2         A   3  -1.791  -9.457   9.804
   35   1H5*    A   4          H5*         A   4   1.941 -10.290   3.246
   36   2H5*    A   4          2H5*        A   4   1.346  -9.677   1.691
   37    H4*    A   4           H4*        A   4  -0.338 -11.038   2.694
   38    H3*    A   4           H3*        A   4  -0.954  -8.119   2.506
   39    H2*    A   4          1H2*        A   4  -3.042  -8.453   3.668
   40   2HO*    A   4          2HO*        A   4  -2.963 -10.789   2.577
   41    H1*    A   4           H1*        A   4  -2.004 -10.007   5.700
   42    H8     A   4           H8         A   4   0.817  -7.758   4.871
   43   1H6     A   4          1H6         A   4  -0.380  -3.932   7.574
   44   2H6     A   4          2H6         A   4  -1.829  -3.446   8.425
   45    H2     A   4           H2         A   4  -4.836  -6.714   7.724
   46   1H5*    G   5          H5*         G   5  -4.267  -9.661   1.054
   47   2H5*    G   5          2H5*        G   5  -4.869  -8.970  -0.465
   48    H4*    G   5           H4*        G   5  -6.562  -8.651   1.132
   49    H3*    G   5           H3*        G   5  -5.078  -6.066   0.658
   50    H2*    G   5          1H2*        G   5  -6.695  -5.026   2.132
   51   2HO*    G   5          2HO*        G   5  -8.601  -5.939   2.507
   52    H1*    G   5           H1*        G   5  -6.492  -7.028   4.074
   53    H8     G   5           H8         G   5  -3.045  -6.758   2.848
   54    H1     G   5           H1         G   5  -4.775  -1.728   6.431
   55   1H2     G   5          1H2         G   5  -7.984  -2.883   5.962
   56   2H2     G   5          2H2         G   5  -6.944  -1.663   6.661
   57   1H5*    C   6          H5*         C   6  -8.876  -5.032   0.862
   58   2H5*    C   6          2H5*        C   6  -9.421  -4.555  -0.758
   59    H4*    C   6           H4*        C   6 -10.381  -2.953   0.571
   60    H3*    C   6           H3*        C   6  -7.814  -1.864  -0.530
   61    H2*    C   6          1H2*        C   6  -8.162   0.175   0.718
   62   2HO*    C   6          2HO*        C   6 -10.689  -0.486   0.475
   63    H1*    C   6           H1*        C   6  -8.779  -1.083   3.107
   64   1H4     C   6          1H4         C   6  -2.312  -2.180   2.492
   65   2H4     C   6          2H4         C   6  -2.446  -0.648   3.322
   66    H5     C   6           H5         C   6  -4.217  -3.350   1.577
   67    H6     C   6           H6         C   6  -6.637  -3.304   1.294
   68   1H5*    A   7          H5*         A   7 -10.422   0.943  -0.890
   69   2H5*    A   7          2H5*        A   7 -10.372   2.025  -2.295
   70    H4*    A   7           H4*        A   7  -9.984   3.231  -0.224
   71    H3*    A   7           H3*        A   7  -7.674   3.142  -2.156
   72    H2*    A   7          1H2*        A   7  -6.451   4.550  -0.635
   73   2HO*    A   7          2HO*        A   7  -7.439   5.666   0.981
   74    H1*    A   7           H1*        A   7  -7.252   3.168   1.673
   75    H8     A   7           H8         A   7  -6.570   0.332  -0.461
   76   1H6     A   7          1H6         A   7  -1.707   0.281  -0.353
   77   2H6     A   7          2H6         A   7  -0.513   1.463   0.148
   78    H2     A   7           H2         A   7  -2.741   5.088   1.522
   79   1H5*    G   8          H5*         G   8  -6.035   5.343  -2.297
   80   2H5*    G   8          2H5*        G   8  -7.098   6.288  -1.236
   81    H4*    G   8           H4*        G   8  -6.228   8.348  -2.144
   82    H3*    G   8           H3*        G   8  -4.726   6.621  -4.069
   83    H2*    G   8          1H2*        G   8  -2.793   8.038  -3.864
   84   2HO*    G   8          2HO*        G   8  -4.671   9.835  -3.120
   85    H1*    G   8           H1*        G   8  -2.787   8.147  -1.118
   86    H8     G   8           H8         G   8  -4.183   4.816  -1.686
   87    H1     G   8           H1         G   8   2.049   5.100  -3.169
   88   1H2     G   8          1H2         G   8   1.626   8.517  -2.949
   89   2H2     G   8          2H2         G   8   2.710   7.179  -3.256
   90   1H5*    G   9          H5*         G   9  -3.642  10.367  -4.744
   91   2H5*    G   9          2H5*        G   9  -4.265  10.911  -6.314
   92    H4*    G   9           H4*        G   9  -2.091  11.750  -6.181
   93    H3*    G   9           H3*        G   9  -2.202   9.326  -7.953
   94    H2*    G   9          1H2*        G   9   0.174   9.580  -8.354
   95   2HO*    G   9          2HO*        G   9  -0.377  12.114  -7.548
   96    H1*    G   9           H1*        G   9   0.821   9.811  -5.677
   97    H8     G   9           H8         G   9  -2.192   7.641  -5.695
   98    H1     G   9           H1         G   9   3.125   4.564  -7.523
   99   1H2     G   9          1H2         G   9   4.538   7.709  -7.657
  100   2H2     G   9          2H2         G   9   4.756   5.989  -7.875
  101   1H5*    C  10          H5*         C  10   0.304  11.851  -9.432
  102   2H5*    C  10          2H5*        C  10  -0.253  12.575 -10.953
  103    H4*    C  10           H4*        C  10   2.010  12.200 -11.281
  104    H3*    C  10           H3*        C  10   0.413  10.036 -12.612
  105    H2*    C  10          1H2*        C  10   2.469   9.007 -13.327
  106   2HO*    C  10          2HO*        C  10   3.340  11.543 -13.107
  107    H1*    C  10           H1*        C  10   3.799   9.325 -10.881
  108   1H4     C  10          1H4         C  10  -0.267   4.181 -10.100
  109   2H4     C  10          2H4         C  10   1.271   3.514 -10.583
  110    H5     C  10           H5         C  10  -0.695   6.566 -10.010
  111    H6     C  10           H6         C  10   0.263   8.776 -10.389
  112   1H5*    U  11          H5*         U  11   2.620  10.848 -15.220
  113   2H5*    U  11          2H5*        U  11   2.186  11.344 -16.868
  114    H4*    U  11           H4*        U  11   3.400   9.388 -17.162
  115    H3*    U  11           H3*        U  11   0.458   8.817 -17.332
  116    H2*    U  11          1H2*        U  11   0.896   6.495 -17.550
  117   2HO*    U  11          2HO*        U  11   2.946   5.738 -18.175
  118    H1*    U  11           H1*        U  11   3.291   6.486 -15.943
  119    H3     U  11           H3         U  11   0.585   3.361 -14.085
  120    H5     U  11           H5         U  11  -0.919   7.067 -12.761
  121    H6     U  11           H6         U  11   0.580   8.137 -14.308
  122   1H5*    U  12          H5*         U  12   0.536   8.329 -22.610
  123   2H5*    U  12          2H5*        U  12  -0.583   7.013 -22.205
  124    H4*    U  12           H4*        U  12   0.951   6.020 -23.623
  125    H3*    U  12           H3*        U  12   0.803   4.877 -21.222
  126    H2*    U  12          1H2*        U  12   2.550   6.182 -20.156
  127   2HO*    U  12          2HO*        U  12   3.413   3.739 -21.201
  128    H1*    U  12           H1*        U  12   4.268   5.770 -22.665
  129    H3     U  12           H3         U  12   7.558   7.991 -20.582
  130    H5     U  12           H5         U  12   4.248  10.541 -20.171
  131    H6     U  12           H6         U  12   2.899   8.824 -21.182
  132   1H5*    C  13          H5*         C  13   3.047   1.750 -20.272
  133   2H5*    C  13          2H5*        C  13   2.214   0.534 -21.259
  134    H4*    C  13           H4*        C  13   2.335  -0.024 -18.858
  135    H3*    C  13           H3*        C  13   0.302  -0.720 -20.403
  136    H2*    C  13          1H2*        C  13  -0.941   1.378 -20.187
  137   2HO*    C  13          2HO*        C  13  -1.762  -0.677 -18.474
  138    H1*    C  13           H1*        C  13  -0.459   1.205 -17.160
  139   1H4     C  13          1H4         C  13  -1.741   7.535 -18.548
  140   2H4     C  13          2H4         C  13  -2.892   7.029 -17.333
  141    H5     C  13           H5         C  13  -0.145   6.006 -19.550
  142    H6     C  13           H6         C  13   0.654   3.702 -19.583
  143   1H5*    G  14          H5*         G  14   1.183  -3.243 -15.593
  144   2H5*    G  14          2H5*        G  14   1.498  -1.908 -16.714
  145    H4*    G  14           H4*        G  14   2.748  -4.568 -17.218
  146    H3*    G  14           H3*        G  14   3.569  -2.723 -15.000
  147    H2*    G  14          1H2*        G  14   5.875  -3.014 -15.608
  148   2HO*    G  14          2HO*        G  14   4.970  -5.358 -16.464
  149    H1*    G  14           H1*        G  14   5.473  -2.793 -18.361
  150    H8     G  14           H8         G  14   7.193  -0.884 -17.827
  151    H1     G  14           H1         G  14   2.442   2.609 -15.309
  152   1H2     G  14          1H2         G  14   0.621  -0.339 -15.459
  153   2H2     G  14          2H2         G  14   0.640   1.357 -15.027
  154   1H5*    G  15          H5*         G  15   6.129  -4.392 -14.160
  155   2H5*    G  15          2H5*        G  15   6.447  -4.560 -12.424
  156    H4*    G  15           H4*        G  15   7.879  -2.889 -13.471
  157    H3*    G  15           H3*        G  15   5.998  -1.979 -11.324
  158    H2*    G  15          1H2*        G  15   6.850   0.265 -11.571
  159   2HO*    G  15          2HO*        G  15   9.011  -0.993 -12.386
  160    H1*    G  15           H1*        G  15   6.661   0.304 -14.332
  161    H8     G  15           H8         G  15   3.871  -1.871 -13.340
  162    H1     G  15           H1         G  15   2.678   4.301 -12.149
  163   1H2     G  15          1H2         G  15   6.036   4.755 -12.761
  164   2H2     G  15          2H2         G  15   4.498   5.484 -12.358
  165   1H5*    C  16          H5*         C  16   9.813  -0.182 -10.448
  166   2H5*    C  16          2H5*        C  16  10.090  -0.378  -8.707
  167    H4*    C  16           H4*        C  16  10.353   1.940  -9.471
  168    H3*    C  16           H3*        C  16   8.202   1.381  -7.437
  169    H2*    C  16          1H2*        C  16   7.738   3.750  -7.400
  170   2HO*    C  16          2HO*        C  16  10.311   3.837  -8.290
  171    H1*    C  16           H1*        C  16   7.859   4.060 -10.189
  172   1H4     C  16          1H4         C  16   1.909   1.475  -9.014
  173   2H4     C  16          2H4         C  16   1.722   3.204  -8.809
  174    H5     C  16           H5         C  16   4.074   0.435  -9.361
  175    H6     C  16           H6         C  16   6.467   0.847  -9.601
  176   1H5*    C  17          H5*         C  17   9.760   4.987  -6.703
  177   2H5*    C  17          2H5*        C  17  10.830   4.760  -5.307
  178    H4*    C  17           H4*        C  17   9.877   6.837  -4.954
  179    H3*    C  17           H3*        C  17   8.459   4.779  -3.293
  180    H2*    C  17          1H2*        C  17   6.989   6.498  -2.464
  181   2HO*    C  17          2HO*        C  17   8.733   8.268  -3.876
  182    H1*    C  17           H1*        C  17   6.482   7.631  -4.953
  183   1H4     C  17          1H4         C  17   3.060   1.981  -4.931
  184   2H4     C  17          2H4         C  17   1.933   3.233  -4.472
  185    H5     C  17           H5         C  17   5.424   2.388  -5.259
  186    H6     C  17           H6         C  17   7.181   4.079  -5.219
  187   1H5*    U  18          H5*         U  18   9.744   7.188   0.215
  188   2H5*    U  18          2H5*        U  18  10.905   6.052   0.925
  189    H4*    U  18           H4*        U  18   9.533   5.454   2.609
  190    H3*    U  18           H3*        U  18   7.566   4.755   1.020
  191    H2*    U  18          1H2*        U  18   6.787   6.877   0.231
  192   2HO*    U  18          2HO*        U  18   5.586   6.675   2.820
  193    H1*    U  18           H1*        U  18   7.049   8.316   2.859
  194    H3     U  18           H3         U  18   8.053  12.306   1.171
  195    H5     U  18           H5         U  18   8.471   9.767  -2.143
  196    H6     U  18           H6         U  18   8.065   7.903  -0.677
  197   1H5*    U  19          H5*         U  19   6.395   5.858   4.898
  198   2H5*    U  19          2H5*        U  19   5.569   4.770   6.029
  199    H4*    U  19           H4*        U  19   4.944   7.100   6.370
  200    H3*    U  19           H3*        U  19   2.800   5.163   5.570
  201    H2*    U  19          1H2*        U  19   1.189   6.952   5.581
  202   2HO*    U  19          2HO*        U  19   2.870   7.956   7.378
  203    H1*    U  19           H1*        U  19   2.799   8.804   4.252
  204    H3     U  19           H3         U  19  -0.534   7.260   1.469
  205    H5     U  19           H5         U  19   2.799   4.788   0.850
  206    H6     U  19           H6         U  19   3.819   5.811   2.775
  207   1H5*    G  20          H5*         G  20   1.064   7.373   7.761
  208   2H5*    G  20          2H5*        G  20   0.474   6.757   9.315
  209    H4*    G  20           H4*        G  20  -1.291   7.961   8.322
  210    H3*    G  20           H3*        G  20  -1.688   4.995   8.294
  211    H2*    G  20          1H2*        G  20  -3.804   5.304   7.149
  212   2HO*    G  20          2HO*        G  20  -3.648   7.718   8.263
  213    H1*    G  20           H1*        G  20  -2.762   6.886   5.169
  214    H8     G  20           H8         G  20   0.281   5.084   5.911
  215    H1     G  20           H1         G  20  -4.042   1.257   3.127
  216   1H2     G  20          1H2         G  20  -6.294   3.759   3.913
  217   2H2     G  20          2H2         G  20  -6.044   2.177   3.209
  218   1H5*    U  21          H5*         U  21  -5.083   5.964   9.270
  219   2H5*    U  21          2H5*        U  21  -5.711   5.415  10.837
  220    H4*    U  21           H4*        U  21  -7.284   4.727   9.256
  221    H3*    U  21           H3*        U  21  -5.589   2.484  10.256
  222    H2*    U  21          1H2*        U  21  -6.582   0.948   8.697
  223   2HO*    U  21          2HO*        U  21  -8.680   2.377   9.024
  224    H1*    U  21           H1*        U  21  -6.488   2.612   6.484
  225    H3     U  21           H3         U  21  -3.115  -0.470   6.077
  226    H5     U  21           H5         U  21  -1.471   2.792   8.120
  227    H6     U  21           H6         U  21  -3.696   3.678   8.350
  228   1H5*    U  22          H5*         U  22  -9.700   0.854  11.279
  229   2H5*    U  22          2H5*        U  22  -9.422  -0.010  12.803
  230    H4*    U  22           H4*        U  22 -10.320  -1.412  10.959
  231    H3*    U  22           H3*        U  22  -7.732  -2.177  12.288
  232    H2*    U  22          1H2*        U  22  -7.640  -4.117  10.858
  233   2HO*    U  22          2HO*        U  22  -9.387  -4.830   9.751
  234    H1*    U  22           H1*        U  22  -8.333  -2.741   8.526
  235    H3     U  22           H3         U  22  -3.886  -3.925   8.523
  236    H5     U  22           H5         U  22  -4.108  -0.047  10.137
  237    H6     U  22           H6         U  22  -6.495  -0.326  10.260
  238   1H5*    U  23          H5*         U  23  -9.826  -5.453  11.307
  239   2H5*    U  23          2H5*        U  23 -10.346  -6.273  12.792
  240    H4*    U  23           H4*        U  23  -9.669  -8.007  11.428
  241    H3*    U  23           H3*        U  23  -7.456  -7.318  13.337
  242    H2*    U  23          1H2*        U  23  -6.105  -9.051  12.341
  243   2HO*    U  23          2HO*        U  23  -7.181 -10.739  11.617
  244    H1*    U  23           H1*        U  23  -6.672  -8.334   9.711
  245    H3     U  23           H3         U  23  -2.502  -6.715  10.203
  246    H5     U  23           H5         U  23  -4.896  -4.016  12.348
  247    H6     U  23           H6         U  23  -6.752  -5.507  12.001
  248   1H5*    C  24          H5*         C  24  -7.431 -11.040  13.408
  249   2H5*    C  24          2H5*        C  24  -7.767 -11.841  14.955
  250    H4*    C  24           H4*        C  24  -5.814 -12.839  14.208
  251    H3*    C  24           H3*        C  24  -5.194 -10.746  16.268
  252    H2*    C  24          1H2*        C  24  -2.848 -11.219  16.013
  253   2HO*    C  24          2HO*        C  24  -2.396 -13.253  15.614
  254    H1*    C  24           H1*        C  24  -2.887 -11.301  13.223
  255   1H4     C  24          1H4         C  24  -3.123  -4.857  14.563
  256   2H4     C  24          2H4         C  24  -1.426  -5.289  14.553
  257    H5     C  24           H5         C  24  -4.882  -6.532  14.396
  258    H6     C  24           H6         C  24  -5.349  -8.915  14.170
  259   1H5*    C  25          H5*         C  25  -3.261 -14.160  17.317
  260   2H5*    C  25          2H5*        C  25  -3.254 -14.573  19.043
  261    H4*    C  25           H4*        C  25  -1.004 -14.474  18.331
  262    H3*    C  25           H3*        C  25  -1.825 -12.166  20.056
  263    H2*    C  25          1H2*        C  25   0.346 -11.173  19.802
  264   2HO*    C  25          2HO*        C  25   1.130 -13.642  19.661
  265    H1*    C  25           H1*        C  25   0.595 -11.681  17.062
  266   1H4     C  25          1H4         C  25  -3.371  -6.419  17.600
  267   2H4     C  25          2H4         C  25  -1.789  -5.836  17.124
  268    H5     C  25           H5         C  25  -3.796  -8.760  18.107
  269    H6     C  25           H6         C  25  -2.796 -10.982  18.245
  270    H3T    C  25           H3T        C  25  -1.564 -14.117  21.009
  Start of MODEL   12
    1   1H5*    G   1          H5*         G   1   6.760   0.016  16.203
    2   2H5*    G   1          2H5*        G   1   8.406   0.286  16.805
    3    H4*    G   1           H4*        G   1   9.253  -1.222  15.036
    4    H3*    G   1           H3*        G   1   6.347  -1.557  14.352
    5    H2*    G   1          1H2*        G   1   6.746  -3.899  13.959
    6   2HO*    G   1          2HO*        G   1   8.659  -4.307  13.116
    7    H1*    G   1           H1*        G   1   8.277  -4.293  16.258
    8    H8     G   1           H8         G   1   5.575  -1.805  17.027
    9    H1     G   1           H1         G   1   3.599  -7.904  17.127
   10   1H2     G   1          1H2         G   1   6.699  -8.603  15.769
   11   2H2     G   1          2H2         G   1   5.162  -9.228  16.323
   12    H5T    G   1           H5T        G   1   7.352   1.733  15.064
   13   1H5*    G   2          H5*         G   2   8.972  -3.139  11.535
   14   2H5*    G   2          2H5*        G   2   8.601  -2.788   9.836
   15    H4*    G   2           H4*        G   2   9.140  -5.102  10.064
   16    H3*    G   2           H3*        G   2   6.291  -4.501   9.369
   17    H2*    G   2          1H2*        G   2   5.765  -6.854   9.445
   18   2HO*    G   2          2HO*        G   2   8.347  -7.085   8.868
   19    H1*    G   2           H1*        G   2   6.995  -7.348  11.860
   20    H8     G   2           H8         G   2   5.907  -3.826  12.165
   21    H1     G   2           H1         G   2   1.074  -7.952  12.927
   22   1H2     G   2          1H2         G   2   3.296 -10.318  11.675
   23   2H2     G   2          2H2         G   2   1.682  -9.982  12.265
   24   1H5*    A   3          H5*         A   3   7.412  -7.457   6.391
   25   2H5*    A   3          2H5*        A   3   7.361  -6.560   4.861
   26    H4*    A   3           H4*        A   3   6.286  -8.515   4.330
   27    H3*    A   3           H3*        A   3   4.252  -6.414   4.958
   28    H2*    A   3          1H2*        A   3   2.475  -8.045   4.719
   29   2HO*    A   3          2HO*        A   3   4.337  -9.307   3.260
   30    H1*    A   3           H1*        A   3   3.586  -9.874   6.416
   31    H8     A   3           H8         A   3   5.086  -6.758   7.710
   32   1H6     A   3          1H6         A   3   1.467  -5.178  10.522
   33   2H6     A   3          2H6         A   3  -0.223  -5.609  10.669
   34    H2     A   3           H2         A   3  -0.946  -8.950   7.768
   35   1H5*    A   4          H5*         A   4   3.016  -8.609   2.012
   36   2H5*    A   4          2H5*        A   4   2.246  -7.863   0.598
   37    H4*    A   4           H4*        A   4   0.797  -9.527   1.547
   38    H3*    A   4           H3*        A   4  -0.138  -6.689   1.709
   39    H2*    A   4          1H2*        A   4  -2.101  -7.387   2.925
   40   2HO*    A   4          2HO*        A   4  -1.768  -9.600   1.584
   41    H1*    A   4           H1*        A   4  -0.772  -9.036   4.704
   42    H8     A   4           H8         A   4   1.758  -6.428   4.168
   43   1H6     A   4          1H6         A   4   0.169  -3.071   7.278
   44   2H6     A   4          2H6         A   4  -1.338  -2.830   8.131
   45    H2     A   4           H2         A   4  -4.002  -6.259   6.989
   46   1H5*    G   5          H5*         G   5  -3.323  -8.428   0.469
   47   2H5*    G   5          2H5*        G   5  -4.007  -7.891  -1.078
   48    H4*    G   5           H4*        G   5  -5.779  -7.707   0.388
   49    H3*    G   5           H3*        G   5  -4.503  -4.990   0.125
   50    H2*    G   5          1H2*        G   5  -6.244  -4.154   1.590
   51   2HO*    G   5          2HO*        G   5  -8.091  -5.215   1.776
   52    H1*    G   5           H1*        G   5  -5.918  -6.190   3.458
   53    H8     G   5           H8         G   5  -2.481  -5.687   2.241
   54    H1     G   5           H1         G   5  -4.460  -0.938   6.068
   55   1H2     G   5          1H2         G   5  -7.601  -2.266   5.596
   56   2H2     G   5          2H2         G   5  -6.618  -1.022   6.338
   57   1H5*    C   6          H5*         C   6  -8.303  -4.266   0.207
   58   2H5*    C   6          2H5*        C   6  -8.866  -3.738  -1.391
   59    H4*    C   6           H4*        C   6  -9.962  -2.299   0.016
   60    H3*    C   6           H3*        C   6  -7.469  -0.946  -0.966
   61    H2*    C   6          1H2*        C   6  -8.038   0.987   0.373
   62   2HO*    C   6          2HO*        C   6 -10.494   0.069   0.054
   63    H1*    C   6           H1*        C   6  -8.572  -0.460   2.673
   64   1H4     C   6          1H4         C   6  -2.018  -0.862   2.123
   65   2H4     C   6          2H4         C   6  -2.315   0.626   2.994
   66    H5     C   6           H5         C   6  -3.784  -2.200   1.163
   67    H6     C   6           H6         C   6  -6.193  -2.389   0.843
   68   1H5*    A   7          H5*         A   7 -10.457   1.632  -1.665
   69   2H5*    A   7          2H5*        A   7 -10.326   2.696  -3.078
   70    H4*    A   7           H4*        A   7 -10.334   3.971  -1.022
   71    H3*    A   7           H3*        A   7  -7.733   4.052  -2.549
   72    H2*    A   7          1H2*        A   7  -6.995   5.688  -0.914
   73   2HO*    A   7          2HO*        A   7  -9.534   6.223  -0.720
   74    H1*    A   7           H1*        A   7  -7.851   4.160   1.258
   75    H8     A   7           H8         A   7  -6.716   1.482  -0.928
   76   1H6     A   7          1H6         A   7  -1.907   1.811  -0.346
   77   2H6     A   7          2H6         A   7  -0.863   3.036   0.347
   78    H2     A   7           H2         A   7  -3.514   6.355   1.759
   79   1H5*    G   8          H5*         G   8  -7.916   7.487  -1.801
   80   2H5*    G   8          2H5*        G   8  -8.486   8.552  -3.101
   81    H4*    G   8           H4*        G   8  -6.765   9.818  -2.442
   82    H3*    G   8           H3*        G   8  -5.524   7.870  -4.347
   83    H2*    G   8          1H2*        G   8  -3.332   8.721  -3.802
   84   2HO*    G   8          2HO*        G   8  -4.718  10.898  -3.176
   85    H1*    G   8           H1*        G   8  -3.661   8.566  -1.079
   86    H8     G   8           H8         G   8  -5.865   5.887  -2.398
   87    H1     G   8           H1         G   8   0.349   4.317  -2.514
   88   1H2     G   8          1H2         G   8   0.882   7.662  -1.867
   89   2H2     G   8          2H2         G   8   1.593   6.092  -2.165
   90   1H5*    G   9          H5*         G   9  -3.776  11.278  -5.109
   91   2H5*    G   9          2H5*        G   9  -3.916  11.899  -6.765
   92    H4*    G   9           H4*        G   9  -1.646  12.038  -6.228
   93    H3*    G   9           H3*        G   9  -2.182   9.667  -8.001
   94    H2*    G   9          1H2*        G   9   0.191   9.194  -7.966
   95   2HO*    G   9          2HO*        G   9   0.298  11.821  -7.326
   96    H1*    G   9           H1*        G   9   0.424   9.435  -5.209
   97    H8     G   9           H8         G   9  -2.981   8.066  -5.663
   98    H1     G   9           H1         G   9   1.608   3.708  -6.689
   99   1H2     G   9          1H2         G   9   3.755   6.411  -6.640
  100   2H2     G   9          2H2         G   9   3.572   4.680  -6.810
  101   1H5*    C  10          H5*         C  10   1.105  11.331  -8.989
  102   2H5*    C  10          2H5*        C  10   1.119  12.105 -10.586
  103    H4*    C  10           H4*        C  10   3.192  11.075 -10.411
  104    H3*    C  10           H3*        C  10   1.337   9.443 -12.107
  105    H2*    C  10          1H2*        C  10   3.045   7.780 -12.371
  106   2HO*    C  10          2HO*        C  10   5.036   8.493 -12.478
  107    H1*    C  10           H1*        C  10   3.926   7.835  -9.702
  108   1H4     C  10          1H4         C  10  -1.511   4.080  -9.839
  109   2H4     C  10          2H4         C  10  -0.150   2.992  -9.881
  110    H5     C  10           H5         C  10  -1.259   6.497  -9.919
  111    H6     C  10           H6         C  10   0.346   8.327 -10.083
  112   1H5*    U  11          H5*         U  11   4.266   9.528 -14.126
  113   2H5*    U  11          2H5*        U  11   4.370   9.990 -15.836
  114    H4*    U  11           H4*        U  11   5.030   7.762 -15.793
  115    H3*    U  11           H3*        U  11   2.171   7.989 -16.683
  116    H2*    U  11          1H2*        U  11   1.998   5.624 -16.784
  117   2HO*    U  11          2HO*        U  11   3.756   4.325 -17.053
  118    H1*    U  11           H1*        U  11   3.837   5.100 -14.624
  119    H3     U  11           H3         U  11   0.027   2.943 -13.485
  120    H5     U  11           H5         U  11  -0.716   7.003 -12.648
  121    H6     U  11           H6         U  11   1.350   7.527 -13.761
  122   1H5*    U  12          H5*         U  12   3.463   7.160 -21.758
  123   2H5*    U  12          2H5*        U  12   1.950   6.234 -21.717
  124    H4*    U  12           H4*        U  12   3.457   4.758 -22.651
  125    H3*    U  12           H3*        U  12   2.372   3.869 -20.384
  126    H2*    U  12          1H2*        U  12   4.077   4.712 -18.878
  127   2HO*    U  12          2HO*        U  12   5.679   2.604 -19.118
  128    H1*    U  12           H1*        U  12   6.201   3.688 -20.842
  129    H3     U  12           H3         U  12   9.325   5.065 -17.938
  130    H5     U  12           H5         U  12   6.870   8.439 -18.403
  131    H6     U  12           H6         U  12   5.402   7.089 -19.748
  132   1H5*    C  13          H5*         C  13   3.263   0.395 -18.854
  133   2H5*    C  13          2H5*        C  13   2.426  -0.643 -20.024
  134    H4*    C  13           H4*        C  13   1.705  -1.008 -17.708
  135    H3*    C  13           H3*        C  13   0.039  -1.158 -19.780
  136    H2*    C  13          1H2*        C  13  -0.598   1.195 -19.817
  137   2HO*    C  13          2HO*        C  13  -2.334  -0.465 -18.387
  138    H1*    C  13           H1*        C  13  -0.896   1.055 -16.765
  139   1H4     C  13          1H4         C  13  -0.024   7.404 -18.381
  140   2H4     C  13          2H4         C  13  -1.506   7.300 -17.458
  141    H5     C  13           H5         C  13   1.264   5.441 -18.999
  142    H6     C  13           H6         C  13   1.382   3.010 -18.851
  143   1H5*    G  14          H5*         G  14  -0.926  -3.832 -15.037
  144   2H5*    G  14          2H5*        G  14  -0.115  -2.542 -15.942
  145    H4*    G  14           H4*        G  14   0.593  -5.417 -16.396
  146    H3*    G  14           H3*        G  14   1.481  -3.748 -14.061
  147    H2*    G  14          1H2*        G  14   3.709  -4.611 -14.327
  148   2HO*    G  14          2HO*        G  14   2.403  -6.692 -15.315
  149    H1*    G  14           H1*        G  14   3.751  -4.372 -17.115
  150    H8     G  14           H8         G  14   5.816  -2.945 -16.371
  151    H1     G  14           H1         G  14   1.848   1.670 -14.350
  152   1H2     G  14          1H2         G  14  -0.632  -0.714 -14.776
  153   2H2     G  14          2H2         G  14  -0.231   0.923 -14.307
  154   1H5*    G  15          H5*         G  15   3.364  -5.972 -12.846
  155   2H5*    G  15          2H5*        G  15   3.387  -6.164 -11.083
  156    H4*    G  15           H4*        G  15   5.321  -4.928 -11.899
  157    H3*    G  15           H3*        G  15   3.433  -3.496 -10.062
  158    H2*    G  15          1H2*        G  15   4.875  -1.563 -10.161
  159   2HO*    G  15          2HO*        G  15   6.791  -1.823 -11.653
  160    H1*    G  15           H1*        G  15   5.079  -1.565 -12.919
  161    H8     G  15           H8         G  15   1.724  -2.927 -12.393
  162    H1     G  15           H1         G  15   1.975   3.347 -11.156
  163   1H2     G  15          1H2         G  15   5.398   2.915 -11.256
  164   2H2     G  15          2H2         G  15   4.059   4.018 -11.048
  165   1H5*    C  16          H5*         C  16   7.488  -2.648  -8.452
  166   2H5*    C  16          2H5*        C  16   7.278  -2.904  -6.709
  167    H4*    C  16           H4*        C  16   8.311  -0.738  -7.289
  168    H3*    C  16           H3*        C  16   5.710  -0.696  -5.764
  169    H2*    C  16          1H2*        C  16   5.940   1.713  -5.662
  170   2HO*    C  16          2HO*        C  16   8.538   1.083  -5.996
  171    H1*    C  16           H1*        C  16   6.610   1.973  -8.365
  172   1H4     C  16          1H4         C  16   0.097   0.925  -8.327
  173   2H4     C  16          2H4         C  16   0.292   2.642  -8.049
  174    H5     C  16           H5         C  16   1.975  -0.609  -8.387
  175    H6     C  16           H6         C  16   4.401  -0.797  -8.208
  176   1H5*    C  17          H5*         C  17   8.214   2.068  -4.542
  177   2H5*    C  17          2H5*        C  17   8.762   1.784  -2.879
  178    H4*    C  17           H4*        C  17   8.470   4.088  -3.055
  179    H3*    C  17           H3*        C  17   6.143   2.873  -1.589
  180    H2*    C  17          1H2*        C  17   5.261   5.106  -1.310
  181   2HO*    C  17          2HO*        C  17   7.664   5.933  -2.625
  182    H1*    C  17           H1*        C  17   5.549   5.771  -3.979
  183   1H4     C  17          1H4         C  17   0.678   1.334  -4.177
  184   2H4     C  17          2H4         C  17  -0.117   2.867  -3.937
  185    H5     C  17           H5         C  17   3.078   1.058  -4.124
  186    H6     C  17           H6         C  17   5.212   2.208  -3.856
  187   1H5*    U  18          H5*         U  18   7.920   6.587  -0.065
  188   2H5*    U  18          2H5*        U  18   8.945   5.748   1.115
  189    H4*    U  18           H4*        U  18   8.648   7.340   2.593
  190    H3*    U  18           H3*        U  18   6.293   6.207   3.029
  191    H2*    U  18          1H2*        U  18   4.952   7.242   1.354
  192   2HO*    U  18          2HO*        U  18   5.054   8.845   3.663
  193    H1*    U  18           H1*        U  18   6.245   9.960   1.667
  194    H3     U  18           H3         U  18   5.143  11.391  -2.372
  195    H5     U  18           H5         U  18   4.875   7.225  -2.793
  196    H6     U  18           H6         U  18   5.663   7.011  -0.537
  197   1H5*    U  19          H5*         U  19   3.733   6.378   5.820
  198   2H5*    U  19          2H5*        U  19   4.241   7.454   4.503
  199    H4*    U  19           H4*        U  19   3.729   8.904   6.959
  200    H3*    U  19           H3*        U  19   1.532   7.089   6.024
  201    H2*    U  19          1H2*        U  19  -0.048   8.888   6.255
  202   2HO*    U  19          2HO*        U  19   1.635   9.657   8.130
  203    H1*    U  19           H1*        U  19   1.566  10.845   5.088
  204    H3     U  19           H3         U  19  -1.855   9.707   2.235
  205    H5     U  19           H5         U  19   1.364   7.182   1.300
  206    H6     U  19           H6         U  19   2.460   7.966   3.294
  207   1H5*    G  20          H5*         G  20  -0.474   9.057   8.255
  208   2H5*    G  20          2H5*        G  20  -1.060   8.156   9.666
  209    H4*    G  20           H4*        G  20  -2.876   9.307   8.585
  210    H3*    G  20           H3*        G  20  -2.934   6.321   8.584
  211    H2*    G  20          1H2*        G  20  -4.965   6.328   7.275
  212   2HO*    G  20          2HO*        G  20  -5.206   8.768   8.358
  213    H1*    G  20           H1*        G  20  -4.054   8.080   5.364
  214    H8     G  20           H8         G  20  -0.861   6.624   6.305
  215    H1     G  20           H1         G  20  -4.472   2.452   3.043
  216   1H2     G  20          1H2         G  20  -7.053   4.665   3.694
  217   2H2     G  20          2H2         G  20  -6.563   3.152   2.966
  218   1H5*    U  21          H5*         U  21  -6.555   6.390   9.295
  219   2H5*    U  21          2H5*        U  21  -6.967   5.553  10.804
  220    H4*    U  21           H4*        U  21  -8.101   4.483   9.007
  221    H3*    U  21           H3*        U  21  -5.858   2.855  10.171
  222    H2*    U  21          1H2*        U  21  -6.388   1.098   8.608
  223   2HO*    U  21          2HO*        U  21  -8.800   2.075   8.815
  224    H1*    U  21           H1*        U  21  -6.673   2.792   6.403
  225    H3     U  21           H3         U  21  -2.764   0.472   5.906
  226    H5     U  21           H5         U  21  -1.801   3.830   8.222
  227    H6     U  21           H6         U  21  -4.157   4.285   8.413
  228   1H5*    U  22          H5*         U  22  -9.709   0.336  10.912
  229   2H5*    U  22          2H5*        U  22  -9.309  -0.574  12.381
  230    H4*    U  22           H4*        U  22 -10.052  -1.968  10.465
  231    H3*    U  22           H3*        U  22  -7.364  -2.495  11.711
  232    H2*    U  22          1H2*        U  22  -7.085  -4.327  10.156
  233   2HO*    U  22          2HO*        U  22  -9.798  -4.160  10.105
  234    H1*    U  22           H1*        U  22  -7.909  -2.874   7.929
  235    H3     U  22           H3         U  22  -3.348  -3.426   7.892
  236    H5     U  22           H5         U  22  -4.092   0.200   9.883
  237    H6     U  22           H6         U  22  -6.423  -0.396   9.924
  238   1H5*    U  23          H5*         U  23  -9.211  -5.856  10.542
  239   2H5*    U  23          2H5*        U  23  -9.646  -6.832  11.958
  240    H4*    U  23           H4*        U  23  -8.955  -8.402  10.415
  241    H3*    U  23           H3*        U  23  -6.673  -7.815  12.281
  242    H2*    U  23          1H2*        U  23  -5.341  -9.423  11.057
  243   2HO*    U  23          2HO*        U  23  -6.400 -11.027  10.144
  244    H1*    U  23           H1*        U  23  -5.994  -8.407   8.562
  245    H3     U  23           H3         U  23  -1.860  -6.733   9.285
  246    H5     U  23           H5         U  23  -4.373  -4.314  11.611
  247    H6     U  23           H6         U  23  -6.176  -5.819  11.093
  248   1H5*    C  24          H5*         C  24  -6.498 -11.519  11.841
  249   2H5*    C  24          2H5*        C  24  -6.370 -12.526  13.295
  250    H4*    C  24           H4*        C  24  -4.517 -13.044  11.938
  251    H3*    C  24           H3*        C  24  -3.721 -11.317  14.274
  252    H2*    C  24          1H2*        C  24  -1.434 -11.516  13.522
  253   2HO*    C  24          2HO*        C  24  -1.167 -12.818  11.473
  254    H1*    C  24           H1*        C  24  -2.043 -11.002  10.841
  255   1H4     C  24          1H4         C  24  -2.293  -5.108  13.787
  256   2H4     C  24          2H4         C  24  -0.596  -5.409  13.442
  257    H5     C  24           H5         C  24  -3.994  -6.813  13.424
  258    H6     C  24           H6         C  24  -4.391  -9.101  12.682
  259   1H5*    C  25          H5*         C  25  -0.940 -14.211  13.691
  260   2H5*    C  25          2H5*        C  25  -1.020 -15.328  15.068
  261    H4*    C  25           H4*        C  25   1.247 -15.124  14.596
  262    H3*    C  25           H3*        C  25   0.490 -13.462  16.973
  263    H2*    C  25          1H2*        C  25   2.743 -12.643  17.131
  264   2HO*    C  25          2HO*        C  25   3.388 -14.962  16.241
  265    H1*    C  25           H1*        C  25   3.086 -12.191  14.396
  266   1H4     C  25          1H4         C  25  -0.612  -7.156  16.542
  267   2H4     C  25          2H4         C  25   1.051  -6.617  16.617
  268    H5     C  25           H5         C  25  -1.218  -9.439  15.968
  269    H6     C  25           H6         C  25  -0.352 -11.635  15.351
  270    H3T    C  25           H3T        C  25   0.575 -15.698  17.103
  Start of MODEL   13
    1   1H5*    G   1          H5*         G   1   5.400   1.431  15.595
    2   2H5*    G   1          2H5*        G   1   4.470   0.984  17.037
    3    H4*    G   1           H4*        G   1   7.048  -0.402  16.674
    4    H3*    G   1           H3*        G   1   4.852  -0.738  14.656
    5    H2*    G   1          1H2*        G   1   5.134  -3.119  14.755
    6   2HO*    G   1          2HO*        G   1   7.225  -3.596  14.897
    7    H1*    G   1           H1*        G   1   5.381  -3.268  17.539
    8    H8     G   1           H8         G   1   2.821  -0.694  16.469
    9    H1     G   1           H1         G   1   0.593  -6.696  16.864
   10   1H2     G   1          1H2         G   1   3.914  -7.566  17.266
   11   2H2     G   1          2H2         G   1   2.253  -8.103  17.161
   12    H5T    G   1           H5T        G   1   5.795   2.246  18.052
   13   1H5*    G   2          H5*         G   2   8.672  -2.737  13.245
   14   2H5*    G   2          2H5*        G   2   8.688  -2.649  11.472
   15    H4*    G   2           H4*        G   2   9.093  -4.907  12.242
   16    H3*    G   2           H3*        G   2   6.585  -4.427  10.670
   17    H2*    G   2          1H2*        G   2   6.012  -6.765  10.913
   18   2HO*    G   2          2HO*        G   2   8.576  -7.105  11.029
   19    H1*    G   2           H1*        G   2   6.466  -6.864  13.632
   20    H8     G   2           H8         G   2   5.339  -3.412  12.517
   21    H1     G   2           H1         G   2   0.571  -7.446  13.961
   22   1H2     G   2          1H2         G   2   3.057  -9.850  14.111
   23   2H2     G   2          2H2         G   2   1.350  -9.481  14.245
   24   1H5*    A   3          H5*         A   3   8.254  -7.666   8.828
   25   2H5*    A   3          2H5*        A   3   8.600  -7.358   7.115
   26    H4*    A   3           H4*        A   3   7.486  -9.359   7.037
   27    H3*    A   3           H3*        A   3   5.516  -7.164   6.503
   28    H2*    A   3          1H2*        A   3   3.748  -8.810   6.371
   29   2HO*    A   3          2HO*        A   3   5.713 -10.408   5.679
   30    H1*    A   3           H1*        A   3   4.400 -10.062   8.731
   31    H8     A   3           H8         A   3   5.503  -6.505   9.124
   32   1H6     A   3          1H6         A   3   1.360  -4.602  10.764
   33   2H6     A   3          2H6         A   3  -0.292  -5.182  10.830
   34    H2     A   3           H2         A   3  -0.254  -9.341   9.146
   35   1H5*    A   4          H5*         A   4   4.555 -10.248   3.442
   36   2H5*    A   4          2H5*        A   4   4.743  -9.303   1.952
   37    H4*    A   4           H4*        A   4   2.706 -10.492   1.790
   38    H3*    A   4           H3*        A   4   2.401  -7.547   2.190
   39    H2*    A   4          1H2*        A   4   0.005  -7.764   2.321
   40   2HO*    A   4          2HO*        A   4   0.218  -9.646   0.694
   41    H1*    A   4           H1*        A   4  -0.002  -9.848   4.122
   42    H8     A   4           H8         A   4   3.108  -7.860   4.827
   43   1H6     A   4          1H6         A   4   1.214  -4.564   7.833
   44   2H6     A   4          2H6         A   4  -0.422  -4.122   8.268
   45    H2     A   4           H2         A   4  -3.125  -6.910   6.009
   46   1H5*    G   5          H5*         G   5  -0.290  -8.126  -1.275
   47   2H5*    G   5          2H5*        G   5  -0.328  -6.540  -2.070
   48    H4*    G   5           H4*        G   5  -2.445  -7.540  -0.884
   49    H3*    G   5           H3*        G   5  -1.613  -4.648  -0.906
   50    H2*    G   5          1H2*        G   5  -3.571  -4.162   0.435
   51   2HO*    G   5          2HO*        G   5  -4.422  -6.466  -0.676
   52    H1*    G   5           H1*        G   5  -3.108  -6.215   2.247
   53    H8     G   5           H8         G   5   0.321  -5.254   1.427
   54    H1     G   5           H1         G   5  -2.649  -0.816   4.979
   55   1H2     G   5          1H2         G   5  -5.528  -2.514   4.154
   56   2H2     G   5          2H2         G   5  -4.795  -1.162   4.993
   57   1H5*    C   6          H5*         C   6  -5.752  -4.666  -1.296
   58   2H5*    C   6          2H5*        C   6  -6.097  -3.985  -2.898
   59    H4*    C   6           H4*        C   6  -7.628  -3.024  -1.380
   60    H3*    C   6           H3*        C   6  -5.502  -1.132  -2.309
   61    H2*    C   6          1H2*        C   6  -6.381   0.591  -0.872
   62   2HO*    C   6          2HO*        C   6  -8.642  -0.632  -1.286
   63    H1*    C   6           H1*        C   6  -6.683  -1.013   1.371
   64   1H4     C   6          1H4         C   6  -0.164  -0.168   1.019
   65   2H4     C   6          2H4         C   6  -0.755   1.220   1.907
   66    H5     C   6           H5         C   6  -1.623  -1.787  -0.017
   67    H6     C   6           H6         C   6  -3.945  -2.415  -0.412
   68   1H5*    A   7          H5*         A   7  -9.155   1.290  -2.988
   69   2H5*    A   7          2H5*        A   7  -8.668   2.447  -4.242
   70    H4*    A   7           H4*        A   7  -9.245   3.323  -1.902
   71    H3*    A   7           H3*        A   7  -6.818   4.190  -3.456
   72    H2*    A   7          1H2*        A   7  -6.248   5.649  -1.620
   73   2HO*    A   7          2HO*        A   7  -8.844   5.700  -1.283
   74    H1*    A   7           H1*        A   7  -6.796   3.760   0.379
   75    H8     A   7           H8         A   7  -5.195   1.593  -2.050
   76   1H6     A   7          1H6         A   7  -0.523   2.735  -1.340
   77   2H6     A   7          2H6         A   7   0.273   4.055  -0.508
   78    H2     A   7           H2         A   7  -2.949   6.681   1.153
   79   1H5*    G   8          H5*         G   8  -7.212   7.578  -1.819
   80   2H5*    G   8          2H5*        G   8  -7.883   8.648  -3.065
   81    H4*    G   8           H4*        G   8  -6.128   9.893  -2.339
   82    H3*    G   8           H3*        G   8  -5.188   8.319  -4.699
   83    H2*    G   8          1H2*        G   8  -2.933   9.114  -4.371
   84   2HO*    G   8          2HO*        G   8  -4.228  11.130  -3.175
   85    H1*    G   8           H1*        G   8  -2.830   8.599  -1.667
   86    H8     G   8           H8         G   8  -5.169   6.086  -3.181
   87    H1     G   8           H1         G   8   1.032   4.547  -3.740
   88   1H2     G   8          1H2         G   8   1.619   7.779  -2.706
   89   2H2     G   8          2H2         G   8   2.298   6.249  -3.215
   90   1H5*    G   9          H5*         G   9  -3.349  11.579  -4.864
   91   2H5*    G   9          2H5*        G   9  -3.564  12.603  -6.297
   92    H4*    G   9           H4*        G   9  -1.274  12.481  -6.067
   93    H3*    G   9           H3*        G   9  -2.133  10.445  -8.108
   94    H2*    G   9          1H2*        G   9   0.200   9.863  -8.388
   95   2HO*    G   9          2HO*        G   9   0.523  12.356  -7.372
   96    H1*    G   9           H1*        G   9   0.718   9.700  -5.659
   97    H8     G   9           H8         G   9  -2.818   8.598  -6.381
   98    H1     G   9           H1         G   9   1.592   3.998  -7.138
   99   1H2     G   9          1H2         G   9   3.879   6.557  -6.800
  100   2H2     G   9          2H2         G   9   3.602   4.849  -7.064
  101   1H5*    C  10          H5*         C  10   0.893  12.551  -9.416
  102   2H5*    C  10          2H5*        C  10   0.903  13.184 -11.074
  103    H4*    C  10           H4*        C  10   2.906  12.021 -10.854
  104    H3*    C  10           H3*        C  10   0.898  10.436 -12.404
  105    H2*    C  10          1H2*        C  10   2.442   8.604 -12.557
  106   2HO*    C  10          2HO*        C  10   4.440   9.325 -12.859
  107    H1*    C  10           H1*        C  10   3.321   8.722  -9.905
  108   1H4     C  10          1H4         C  10  -2.582   5.748  -9.806
  109   2H4     C  10          2H4         C  10  -1.375   4.518  -9.572
  110    H5     C  10           H5         C  10  -2.008   8.080 -10.206
  111    H6     C  10           H6         C  10  -0.168   9.650 -10.510
  112   1H5*    U  11          H5*         U  11   3.849  10.157 -14.433
  113   2H5*    U  11          2H5*        U  11   3.958  10.367 -16.192
  114    H4*    U  11           H4*        U  11   4.445   8.103 -15.726
  115    H3*    U  11           H3*        U  11   1.771   8.559 -16.983
  116    H2*    U  11          1H2*        U  11   1.125   6.323 -16.660
  117   2HO*    U  11          2HO*        U  11   2.763   4.696 -16.331
  118    H1*    U  11           H1*        U  11   2.931   5.781 -14.424
  119    H3     U  11           H3         U  11  -1.007   4.038 -13.043
  120    H5     U  11           H5         U  11  -1.489   8.219 -12.767
  121    H6     U  11           H6         U  11   0.605   8.455 -13.919
  122   1H5*    U  12          H5*         U  12   0.561   6.860 -19.740
  123   2H5*    U  12          2H5*        U  12   1.908   6.290 -18.737
  124    H4*    U  12           H4*        U  12   1.042   5.438 -21.452
  125    H3*    U  12           H3*        U  12   0.748   4.103 -19.183
  126    H2*    U  12          1H2*        U  12   3.041   4.100 -18.442
  127   2HO*    U  12          2HO*        U  12   2.425   1.858 -20.019
  128    H1*    U  12           H1*        U  12   4.007   3.449 -21.265
  129    H3     U  12           H3         U  12   8.153   3.716 -19.571
  130    H5     U  12           H5         U  12   6.402   7.367 -18.468
  131    H6     U  12           H6         U  12   4.319   6.543 -19.344
  132   1H5*    C  13          H5*         C  13   1.009   0.683 -18.416
  133   2H5*    C  13          2H5*        C  13  -0.404  -0.017 -19.229
  134    H4*    C  13           H4*        C  13  -0.241  -0.336 -16.730
  135    H3*    C  13           H3*        C  13  -2.492  -0.343 -18.149
  136    H2*    C  13          1H2*        C  13  -2.878   2.057 -18.123
  137   2HO*    C  13          2HO*        C  13  -4.142   0.753 -15.952
  138    H1*    C  13           H1*        C  13  -2.186   2.050 -15.134
  139   1H4     C  13          1H4         C  13  -1.053   8.170 -17.320
  140   2H4     C  13          2H4         C  13  -2.161   8.299 -15.971
  141    H5     C  13           H5         C  13  -0.338   6.037 -18.209
  142    H6     C  13           H6         C  13  -0.501   3.620 -17.959
  143   1H5*    G  14          H5*         G  14  -0.804  -2.078 -17.538
  144   2H5*    G  14          2H5*        G  14  -1.277  -3.687 -18.114
  145    H4*    G  14           H4*        G  14   0.265  -4.750 -16.878
  146    H3*    G  14           H3*        G  14  -0.126  -2.705 -14.696
  147    H2*    G  14          1H2*        G  14   2.050  -3.280 -13.874
  148   2HO*    G  14          2HO*        G  14   1.410  -5.649 -14.668
  149    H1*    G  14           H1*        G  14   3.211  -3.599 -16.458
  150    H8     G  14           H8         G  14   4.922  -1.782 -16.372
  151    H1     G  14           H1         G  14   0.838   2.329 -13.613
  152   1H2     G  14          1H2         G  14  -1.439  -0.271 -13.860
  153   2H2     G  14          2H2         G  14  -1.137   1.376 -13.352
  154   1H5*    G  15          H5*         G  15   1.282  -5.415 -12.385
  155   2H5*    G  15          2H5*        G  15   0.886  -4.995 -10.709
  156    H4*    G  15           H4*        G  15   3.197  -4.372 -11.915
  157    H3*    G  15           H3*        G  15   1.807  -3.103  -9.603
  158    H2*    G  15          1H2*        G  15   3.297  -1.225  -9.656
  159   2HO*    G  15          2HO*        G  15   5.278  -1.461 -10.374
  160    H1*    G  15           H1*        G  15   3.298  -0.859 -12.407
  161    H8     G  15           H8         G  15  -0.133  -1.976 -11.639
  162    H1     G  15           H1         G  15   0.861   4.172 -10.161
  163   1H2     G  15          1H2         G  15   4.194   3.433 -10.668
  164   2H2     G  15          2H2         G  15   3.000   4.652 -10.284
  165   1H5*    C  16          H5*         C  16   5.815  -2.972  -9.083
  166   2H5*    C  16          2H5*        C  16   6.429  -3.479  -7.497
  167    H4*    C  16           H4*        C  16   7.373  -1.370  -7.968
  168    H3*    C  16           H3*        C  16   5.240  -1.274  -5.866
  169    H2*    C  16          1H2*        C  16   5.493   1.111  -5.709
  170   2HO*    C  16          2HO*        C  16   7.346   2.031  -6.206
  171    H1*    C  16           H1*        C  16   5.560   1.584  -8.447
  172   1H4     C  16          1H4         C  16  -0.788   0.332  -7.173
  173   2H4     C  16          2H4         C  16  -0.604   2.074  -7.226
  174    H5     C  16           H5         C  16   1.111  -1.172  -7.326
  175    H6     C  16           H6         C  16   3.532  -1.303  -7.585
  176   1H5*    C  17          H5*         C  17   8.441   1.210  -5.028
  177   2H5*    C  17          2H5*        C  17   9.218   0.700  -3.516
  178    H4*    C  17           H4*        C  17   9.230   2.982  -3.326
  179    H3*    C  17           H3*        C  17   6.838   1.936  -1.853
  180    H2*    C  17          1H2*        C  17   6.199   4.203  -1.325
  181   2HO*    C  17          2HO*        C  17   8.796   4.623  -1.693
  182    H1*    C  17           H1*        C  17   6.383   5.102  -3.918
  183   1H4     C  17          1H4         C  17   1.322   0.849  -4.153
  184   2H4     C  17          2H4         C  17   0.625   2.447  -4.129
  185    H5     C  17           H5         C  17   3.690   0.448  -3.927
  186    H6     C  17           H6         C  17   5.873   1.492  -3.672
  187   1H5*    U  18          H5*         U  18   8.392   4.833   0.490
  188   2H5*    U  18          2H5*        U  18   9.390   3.997   1.696
  189    H4*    U  18           H4*        U  18   8.230   4.811   3.456
  190    H3*    U  18           H3*        U  18   5.908   4.052   2.382
  191    H2*    U  18          1H2*        U  18   5.537   5.784   0.793
  192   2HO*    U  18          2HO*        U  18   4.810   6.970   3.288
  193    H1*    U  18           H1*        U  18   6.693   7.956   2.564
  194    H3     U  18           H3         U  18   7.650  10.735  -0.757
  195    H5     U  18           H5         U  18   7.162   7.071  -2.746
  196    H6     U  18           H6         U  18   6.872   6.023  -0.604
  197   1H5*    U  19          H5*         U  19   5.443   7.441   4.986
  198   2H5*    U  19          2H5*        U  19   4.882   6.831   6.555
  199    H4*    U  19           H4*        U  19   4.187   9.011   6.614
  200    H3*    U  19           H3*        U  19   1.896   7.319   5.680
  201    H2*    U  19          1H2*        U  19   0.558   9.297   5.371
  202   2HO*    U  19          2HO*        U  19   1.990  10.222   7.327
  203    H1*    U  19           H1*        U  19   2.534  10.785   4.095
  204    H3     U  19           H3         U  19  -0.112   9.668   0.634
  205    H5     U  19           H5         U  19   1.933   6.113   1.529
  206    H6     U  19           H6         U  19   2.848   7.216   3.460
  207   1H5*    G  20          H5*         G  20  -0.183   9.160   7.377
  208   2H5*    G  20          2H5*        G  20  -0.686   8.720   9.021
  209    H4*    G  20           H4*        G  20  -2.673   9.319   8.059
  210    H3*    G  20           H3*        G  20  -2.368   6.355   7.954
  211    H2*    G  20          1H2*        G  20  -4.363   6.129   6.614
  212   2HO*    G  20          2HO*        G  20  -4.950   8.470   7.777
  213    H1*    G  20           H1*        G  20  -3.693   8.038   4.765
  214    H8     G  20           H8         G  20  -0.327   7.029   5.732
  215    H1     G  20           H1         G  20  -3.265   2.492   2.289
  216   1H2     G  20          1H2         G  20  -6.141   4.295   2.953
  217   2H2     G  20          2H2         G  20  -5.431   2.892   2.189
  218   1H5*    U  21          H5*         U  21  -5.863   5.971   8.161
  219   2H5*    U  21          2H5*        U  21  -6.430   5.192   9.652
  220    H4*    U  21           H4*        U  21  -7.257   3.894   7.881
  221    H3*    U  21           H3*        U  21  -4.936   2.607   9.273
  222    H2*    U  21          1H2*        U  21  -4.988   0.782   7.727
  223   2HO*    U  21          2HO*        U  21  -6.968   0.194   7.191
  224    H1*    U  21           H1*        U  21  -5.447   2.324   5.429
  225    H3     U  21           H3         U  21  -1.206   0.813   4.938
  226    H5     U  21           H5         U  21  -0.893   3.942   7.705
  227    H6     U  21           H6         U  21  -3.295   4.046   7.760
  228   1H5*    U  22          H5*         U  22  -8.419   0.223   8.485
  229   2H5*    U  22          2H5*        U  22  -8.963  -0.644   9.935
  230    H4*    U  22           H4*        U  22  -9.224  -2.085   8.066
  231    H3*    U  22           H3*        U  22  -7.019  -2.871   9.937
  232    H2*    U  22          1H2*        U  22  -6.442  -4.711   8.510
  233   2HO*    U  22          2HO*        U  22  -7.893  -5.605   7.210
  234    H1*    U  22           H1*        U  22  -6.703  -3.322   6.090
  235    H3     U  22           H3         U  22  -2.261  -4.157   6.791
  236    H5     U  22           H5         U  22  -3.070  -0.513   8.705
  237    H6     U  22           H6         U  22  -5.416  -0.951   8.377
  238   1H5*    U  23          H5*         U  23  -8.756  -6.327   8.585
  239   2H5*    U  23          2H5*        U  23  -9.574  -7.076   9.971
  240    H4*    U  23           H4*        U  23  -8.544  -8.869   8.980
  241    H3*    U  23           H3*        U  23  -6.816  -7.873  11.216
  242    H2*    U  23          1H2*        U  23  -5.143  -9.522  10.661
  243   2HO*    U  23          2HO*        U  23  -7.219 -10.861   9.790
  244    H1*    U  23           H1*        U  23  -5.165  -9.028   7.934
  245    H3     U  23           H3         U  23  -1.448  -6.792   9.105
  246    H5     U  23           H5         U  23  -4.557  -4.398  10.594
  247    H6     U  23           H6         U  23  -6.093  -6.140   9.970
  248   1H5*    C  24          H5*         C  24  -6.311 -11.471  11.438
  249   2H5*    C  24          2H5*        C  24  -6.903 -12.305  12.888
  250    H4*    C  24           H4*        C  24  -4.720 -13.058  12.624
  251    H3*    C  24           H3*        C  24  -4.864 -10.935  14.743
  252    H2*    C  24          1H2*        C  24  -2.488 -11.121  15.059
  253   2HO*    C  24          2HO*        C  24  -1.794 -13.128  14.872
  254    H1*    C  24           H1*        C  24  -1.854 -11.216  12.336
  255   1H4     C  24          1H4         C  24  -2.978  -4.825  13.412
  256   2H4     C  24          2H4         C  24  -1.301  -5.088  13.842
  257    H5     C  24           H5         C  24  -4.479  -6.651  12.850
  258    H6     C  24           H6         C  24  -4.661  -9.068  12.577
  259   1H5*    C  25          H5*         C  25  -2.997 -14.374  16.236
  260   2H5*    C  25          2H5*        C  25  -3.405 -14.808  17.908
  261    H4*    C  25           H4*        C  25  -1.051 -14.705  17.761
  262    H3*    C  25           H3*        C  25  -2.267 -12.421  19.269
  263    H2*    C  25          1H2*        C  25  -0.106 -11.420  19.554
  264   2HO*    C  25          2HO*        C  25   0.733 -13.841  19.636
  265    H1*    C  25           H1*        C  25   0.784 -11.857  16.944
  266   1H4     C  25          1H4         C  25  -3.351  -6.713  16.623
  267   2H4     C  25          2H4         C  25  -1.729  -6.066  16.531
  268    H5     C  25           H5         C  25  -3.811  -9.064  16.979
  269    H6     C  25           H6         C  25  -2.809 -11.264  17.301
  270    H3T    C  25           H3T        C  25  -2.211 -14.433  20.188
  Start of MODEL   14
    1   1H5*    G   1          H5*         G   1   6.911  -0.049  17.794
    2   2H5*    G   1          2H5*        G   1   8.422   0.026  18.718
    3    H4*    G   1           H4*        G   1   9.367  -1.726  17.272
    4    H3*    G   1           H3*        G   1   6.708  -1.625  15.892
    5    H2*    G   1          1H2*        G   1   6.667  -4.017  15.751
    6   2HO*    G   1          2HO*        G   1   8.512  -5.022  15.508
    7    H1*    G   1           H1*        G   1   7.630  -4.502  18.336
    8    H8     G   1           H8         G   1   5.247  -1.560  18.190
    9    H1     G   1           H1         G   1   2.420  -7.280  18.846
   10   1H2     G   1          1H2         G   1   5.576  -8.561  18.260
   11   2H2     G   1          2H2         G   1   3.891  -8.891  18.598
   12    H5T    G   1           H5T        G   1   8.377   1.594  17.065
   13   1H5*    G   2          H5*         G   2   9.543  -4.368  14.286
   14   2H5*    G   2          2H5*        G   2   9.924  -3.799  12.649
   15    H4*    G   2           H4*        G   2   9.953  -6.130  12.525
   16    H3*    G   2           H3*        G   2   7.510  -4.926  11.306
   17    H2*    G   2          1H2*        G   2   6.553  -7.100  10.910
   18   2HO*    G   2          2HO*        G   2   9.051  -7.835  10.759
   19    H1*    G   2           H1*        G   2   7.048  -8.121  13.420
   20    H8     G   2           H8         G   2   6.585  -4.404  13.753
   21    H1     G   2           H1         G   2   1.093  -7.697  13.651
   22   1H2     G   2          1H2         G   2   3.080 -10.385  12.710
   23   2H2     G   2          2H2         G   2   1.470  -9.802  13.067
   24   1H5*    A   3          H5*         A   3   8.394  -7.538   8.474
   25   2H5*    A   3          2H5*        A   3   8.281  -6.887   6.828
   26    H4*    A   3           H4*        A   3   6.708  -8.648   7.032
   27    H3*    A   3           H3*        A   3   5.315  -5.967   7.047
   28    H2*    A   3          1H2*        A   3   3.253  -7.247   6.963
   29   2HO*    A   3          2HO*        A   3   4.686  -9.000   5.723
   30    H1*    A   3           H1*        A   3   4.066  -8.989   8.996
   31    H8     A   3           H8         A   3   5.428  -5.711  10.031
   32   1H6     A   3          1H6         A   3   1.455  -3.749  12.020
   33   2H6     A   3          2H6         A   3  -0.242  -4.180  11.998
   34    H2     A   3           H2         A   3  -0.578  -7.938   9.575
   35   1H5*    A   4          H5*         A   4   4.132  -8.472   3.625
   36   2H5*    A   4          2H5*        A   4   3.464  -7.512   2.292
   37    H4*    A   4           H4*        A   4   1.985  -9.333   3.111
   38    H3*    A   4           H3*        A   4   1.005  -6.498   3.051
   39    H2*    A   4          1H2*        A   4  -1.103  -7.237   3.979
   40   2HO*    A   4          2HO*        A   4  -1.381  -9.223   2.972
   41    H1*    A   4           H1*        A   4   0.023  -8.714   6.014
   42    H8     A   4           H8         A   4   2.558  -6.093   5.788
   43   1H6     A   4          1H6         A   4   0.302  -2.489   8.124
   44   2H6     A   4          2H6         A   4  -1.361  -2.211   8.594
   45    H2     A   4           H2         A   4  -3.682  -5.813   7.253
   46   1H5*    G   5          H5*         G   5  -1.911  -8.840   1.346
   47   2H5*    G   5          2H5*        G   5  -2.272  -8.374  -0.327
   48    H4*    G   5           H4*        G   5  -4.346  -8.705   0.691
   49    H3*    G   5           H3*        G   5  -3.695  -5.810   0.339
   50    H2*    G   5          1H2*        G   5  -5.711  -5.173   1.504
   51   2HO*    G   5          2HO*        G   5  -6.530  -7.564   0.675
   52    H1*    G   5           H1*        G   5  -5.318  -6.823   3.664
   53    H8     G   5           H8         G   5  -1.836  -6.224   2.668
   54    H1     G   5           H1         G   5  -4.499  -1.108   5.453
   55   1H2     G   5          1H2         G   5  -7.475  -2.743   4.900
   56   2H2     G   5          2H2         G   5  -6.677  -1.315   5.523
   57   1H5*    C   6          H5*         C   6  -7.354  -5.466  -0.139
   58   2H5*    C   6          2H5*        C   6  -7.780  -5.231  -1.845
   59    H4*    C   6           H4*        C   6  -9.038  -3.637  -0.748
   60    H3*    C   6           H3*        C   6  -6.560  -2.360  -1.863
   61    H2*    C   6          1H2*        C   6  -7.226  -0.261  -0.906
   62   2HO*    C   6          2HO*        C   6  -9.622  -1.160  -1.364
   63    H1*    C   6           H1*        C   6  -8.115  -1.330   1.541
   64   1H4     C   6          1H4         C   6  -1.579  -0.894   2.192
   65   2H4     C   6          2H4         C   6  -2.197   0.688   2.619
   66    H5     C   6           H5         C   6  -2.990  -2.643   1.277
   67    H6     C   6           H6         C   6  -5.265  -3.225   0.615
   68   1H5*    A   7          H5*         A   7  -8.479   1.565  -4.892
   69   2H5*    A   7          2H5*        A   7  -6.990   1.311  -3.960
   70    H4*    A   7           H4*        A   7  -9.534   2.641  -3.047
   71    H3*    A   7           H3*        A   7  -6.869   3.725  -3.835
   72    H2*    A   7          1H2*        A   7  -6.831   5.222  -1.957
   73   2HO*    A   7          2HO*        A   7  -9.443   5.111  -2.257
   74    H1*    A   7           H1*        A   7  -7.681   3.405  -0.053
   75    H8     A   7           H8         A   7  -5.757   1.092  -2.067
   76   1H6     A   7          1H6         A   7  -1.236   2.217  -0.698
   77   2H6     A   7          2H6         A   7  -0.552   3.564   0.190
   78    H2     A   7           H2         A   7  -3.939   6.305   1.206
   79   1H5*    G   8          H5*         G   8  -7.744   7.062  -2.395
   80   2H5*    G   8          2H5*        G   8  -7.937   8.184  -3.756
   81    H4*    G   8           H4*        G   8  -6.348   9.157  -2.351
   82    H3*    G   8           H3*        G   8  -5.146   7.973  -4.812
   83    H2*    G   8          1H2*        G   8  -2.922   8.454  -4.031
   84   2HO*    G   8          2HO*        G   8  -4.077  10.459  -2.867
   85    H1*    G   8           H1*        G   8  -3.279   7.545  -1.441
   86    H8     G   8           H8         G   8  -5.443   5.411  -3.609
   87    H1     G   8           H1         G   8   0.726   3.652  -3.601
   88   1H2     G   8          1H2         G   8   1.264   6.669  -2.011
   89   2H2     G   8          2H2         G   8   1.965   5.198  -2.649
   90   1H5*    G   9          H5*         G   9  -3.159  11.325  -4.788
   91   2H5*    G   9          2H5*        G   9  -3.243  12.241  -6.305
   92    H4*    G   9           H4*        G   9  -0.971  11.829  -5.932
   93    H3*    G   9           H3*        G   9  -2.013   9.901  -8.005
   94    H2*    G   9          1H2*        G   9   0.252   9.102  -8.227
   95   2HO*    G   9          2HO*        G   9   1.039  11.122  -6.374
   96    H1*    G   9           H1*        G   9   0.728   9.052  -5.451
   97    H8     G   9           H8         G   9  -2.726   7.795  -5.887
   98    H1     G   9           H1         G   9   1.742   3.530  -7.608
   99   1H2     G   9          1H2         G   9   3.928   6.184  -7.365
  100   2H2     G   9          2H2         G   9   3.703   4.485  -7.713
  101   1H5*    C  10          H5*         C  10   1.658  11.621  -8.862
  102   2H5*    C  10          2H5*        C  10   1.506  12.549 -10.368
  103    H4*    C  10           H4*        C  10   3.604  11.581 -10.505
  104    H3*    C  10           H3*        C  10   1.650   9.993 -12.139
  105    H2*    C  10          1H2*        C  10   3.425   8.469 -12.717
  106   2HO*    C  10          2HO*        C  10   4.910  10.619 -12.366
  107    H1*    C  10           H1*        C  10   4.462   8.271 -10.130
  108   1H4     C  10          1H4         C  10  -1.006   4.557 -10.291
  109   2H4     C  10          2H4         C  10   0.339   3.475 -10.530
  110    H5     C  10           H5         C  10  -0.741   6.966 -10.117
  111    H6     C  10           H6         C  10   0.864   8.800 -10.200
  112   1H5*    U  11          H5*         U  11   4.203  10.423 -14.603
  113   2H5*    U  11          2H5*        U  11   3.972  11.008 -16.262
  114    H4*    U  11           H4*        U  11   4.652   8.784 -16.478
  115    H3*    U  11           H3*        U  11   1.675   9.013 -16.859
  116    H2*    U  11          1H2*        U  11   1.568   6.655 -17.189
  117   2HO*    U  11          2HO*        U  11   3.383   5.445 -17.657
  118    H1*    U  11           H1*        U  11   3.629   6.020 -15.304
  119    H3     U  11           H3         U  11  -0.082   3.834 -13.898
  120    H5     U  11           H5         U  11  -0.634   7.832 -12.688
  121    H6     U  11           H6         U  11   1.306   8.408 -13.987
  122   1H5*    U  12          H5*         U  12   1.521   8.779 -22.093
  123   2H5*    U  12          2H5*        U  12   0.026   8.009 -21.528
  124    H4*    U  12           H4*        U  12   0.933   6.562 -23.131
  125    H3*    U  12           H3*        U  12   0.373   5.481 -20.776
  126    H2*    U  12          1H2*        U  12   2.520   5.876 -19.720
  127   2HO*    U  12          2HO*        U  12   3.733   3.723 -20.391
  128    H1*    U  12           H1*        U  12   3.903   4.888 -22.270
  129    H3     U  12           H3         U  12   7.796   5.563 -20.146
  130    H5     U  12           H5         U  12   5.798   9.229 -19.720
  131    H6     U  12           H6         U  12   3.876   8.212 -20.746
  132   1H5*    C  13          H5*         C  13   1.745   1.942 -20.166
  133   2H5*    C  13          2H5*        C  13   0.452   0.895 -20.786
  134    H4*    C  13           H4*        C  13   1.014   0.449 -18.441
  135    H3*    C  13           H3*        C  13  -1.472   0.292 -19.363
  136    H2*    C  13          1H2*        C  13  -2.077   2.621 -19.019
  137   2HO*    C  13          2HO*        C  13  -2.992   2.515 -16.655
  138    H1*    C  13           H1*        C  13  -0.789   2.465 -16.244
  139   1H4     C  13          1H4         C  13  -0.709   8.836 -17.929
  140   2H4     C  13          2H4         C  13  -1.594   8.707 -16.426
  141    H5     C  13           H5         C  13   0.087   6.886 -19.136
  142    H6     C  13           H6         C  13   0.216   4.453 -19.123
  143   1H5*    G  14          H5*         G  14   0.245  -1.361 -19.103
  144   2H5*    G  14          2H5*        G  14  -0.269  -2.851 -19.918
  145    H4*    G  14           H4*        G  14   1.383  -4.098 -19.019
  146    H3*    G  14           H3*        G  14   1.229  -2.405 -16.536
  147    H2*    G  14          1H2*        G  14   3.511  -2.943 -16.062
  148   2HO*    G  14          2HO*        G  14   2.851  -5.226 -17.121
  149    H1*    G  14           H1*        G  14   4.379  -2.909 -18.776
  150    H8     G  14           H8         G  14   6.082  -1.096 -18.556
  151    H1     G  14           H1         G  14   2.058   2.670 -15.268
  152   1H2     G  14          1H2         G  14  -0.155   0.021 -15.584
  153   2H2     G  14          2H2         G  14   0.133   1.630 -14.960
  154   1H5*    G  15          H5*         G  15   3.017  -5.198 -14.968
  155   2H5*    G  15          2H5*        G  15   2.703  -5.364 -13.230
  156    H4*    G  15           H4*        G  15   4.900  -4.303 -13.954
  157    H3*    G  15           H3*        G  15   3.111  -3.138 -11.850
  158    H2*    G  15          1H2*        G  15   4.657  -1.296 -11.594
  159   2HO*    G  15          2HO*        G  15   6.529  -2.761 -12.062
  160    H1*    G  15           H1*        G  15   4.811  -0.740 -14.285
  161    H8     G  15           H8         G  15   1.421  -2.186 -13.848
  162    H1     G  15           H1         G  15   1.851   3.858 -11.799
  163   1H2     G  15          1H2         G  15   5.243   3.431 -12.184
  164   2H2     G  15          2H2         G  15   3.936   4.500 -11.735
  165   1H5*    C  16          H5*         C  16   7.227  -2.823 -10.208
  166   2H5*    C  16          2H5*        C  16   7.030  -3.362  -8.529
  167    H4*    C  16           H4*        C  16   8.171  -1.172  -8.786
  168    H3*    C  16           H3*        C  16   5.680  -1.376  -7.117
  169    H2*    C  16          1H2*        C  16   5.817   0.978  -6.662
  170   2HO*    C  16          2HO*        C  16   8.289   0.688  -6.603
  171    H1*    C  16           H1*        C  16   6.526   1.738  -9.275
  172   1H4     C  16          1H4         C  16  -0.019   0.890  -9.315
  173   2H4     C  16          2H4         C  16   0.248   2.571  -8.905
  174    H5     C  16           H5         C  16   1.797  -0.705  -9.532
  175    H6     C  16           H6         C  16   4.214  -1.001  -9.397
  176   1H5*    C  17          H5*         C  17   8.979   0.709  -4.625
  177   2H5*    C  17          2H5*        C  17   8.756  -0.081  -3.052
  178    H4*    C  17           H4*        C  17   8.926   2.380  -2.933
  179    H3*    C  17           H3*        C  17   6.460   1.046  -1.851
  180    H2*    C  17          1H2*        C  17   5.633   3.223  -1.211
  181   2HO*    C  17          2HO*        C  17   8.271   3.802  -1.335
  182    H1*    C  17           H1*        C  17   6.125   4.383  -3.673
  183   1H4     C  17          1H4         C  17   1.139   0.301  -5.051
  184   2H4     C  17          2H4         C  17   0.375   1.715  -4.371
  185    H5     C  17           H5         C  17   3.539  -0.004  -5.100
  186    H6     C  17           H6         C  17   5.688   0.988  -4.518
  187   1H5*    U  18          H5*         U  18   8.051   4.320   0.488
  188   2H5*    U  18          2H5*        U  18   9.008   3.294   1.574
  189    H4*    U  18           H4*        U  18   8.503   4.532   3.317
  190    H3*    U  18           H3*        U  18   6.116   3.391   3.272
  191    H2*    U  18          1H2*        U  18   5.008   4.739   1.636
  192   2HO*    U  18          2HO*        U  18   4.835   6.346   4.002
  193    H1*    U  18           H1*        U  18   6.222   7.323   2.660
  194    H3     U  18           H3         U  18   5.609   9.577  -1.106
  195    H5     U  18           H5         U  18   5.343   5.591  -2.383
  196    H6     U  18           H6         U  18   5.880   4.906  -0.149
  197   1H5*    U  19          H5*         U  19   3.011   5.537   7.349
  198   2H5*    U  19          2H5*        U  19   2.809   5.420   5.590
  199    H4*    U  19           H4*        U  19   3.561   7.900   7.132
  200    H3*    U  19           H3*        U  19   0.899   6.974   6.120
  201    H2*    U  19          1H2*        U  19   0.392   9.203   5.369
  202   2HO*    U  19          2HO*        U  19   1.910   9.903   7.361
  203    H1*    U  19           H1*        U  19   2.855   9.683   4.179
  204    H3     U  19           H3         U  19  -0.267   8.854   0.915
  205    H5     U  19           H5         U  19   1.439   5.144   1.887
  206    H6     U  19           H6         U  19   2.505   6.211   3.760
  207   1H5*    G  20          H5*         G  20  -0.880   8.338   6.652
  208   2H5*    G  20          2H5*        G  20  -1.331   9.485   7.926
  209    H4*    G  20           H4*        G  20  -3.495   9.203   7.576
  210    H3*    G  20           H3*        G  20  -2.971   6.259   7.649
  211    H2*    G  20          1H2*        G  20  -5.016   5.850   6.426
  212   2HO*    G  20          2HO*        G  20  -6.575   7.317   6.344
  213    H1*    G  20           H1*        G  20  -4.501   7.671   4.439
  214    H8     G  20           H8         G  20  -1.069   6.809   5.362
  215    H1     G  20           H1         G  20  -3.991   2.034   2.231
  216   1H2     G  20          1H2         G  20  -6.877   3.832   2.820
  217   2H2     G  20          2H2         G  20  -6.144   2.409   2.115
  218   1H5*    U  21          H5*         U  21  -6.583   6.380   8.031
  219   2H5*    U  21          2H5*        U  21  -7.306   5.699   9.502
  220    H4*    U  21           H4*        U  21  -8.426   4.737   7.663
  221    H3*    U  21           H3*        U  21  -6.597   2.878   9.115
  222    H2*    U  21          1H2*        U  21  -6.966   1.140   7.514
  223   2HO*    U  21          2HO*        U  21  -8.746   1.073   6.283
  224    H1*    U  21           H1*        U  21  -6.908   2.749   5.226
  225    H3     U  21           H3         U  21  -3.078   0.290   5.105
  226    H5     U  21           H5         U  21  -2.204   3.598   7.518
  227    H6     U  21           H6         U  21  -4.547   4.148   7.492
  228   1H5*    U  22          H5*         U  22  -9.858   0.619   8.729
  229   2H5*    U  22          2H5*        U  22 -10.560   0.103  10.275
  230    H4*    U  22           H4*        U  22 -10.336  -1.882   9.144
  231    H3*    U  22           H3*        U  22  -7.910  -1.549  10.893
  232    H2*    U  22          1H2*        U  22  -7.108  -3.671  10.074
  233   2HO*    U  22          2HO*        U  22  -8.458  -5.123   9.282
  234    H1*    U  22           H1*        U  22  -7.682  -3.123   7.395
  235    H3     U  22           H3         U  22  -3.196  -2.838   7.648
  236    H5     U  22           H5         U  22  -4.558   0.804   9.242
  237    H6     U  22           H6         U  22  -6.792  -0.091   9.155
  238   1H5*    U  23          H5*         U  23  -9.446  -5.176  10.786
  239   2H5*    U  23          2H5*        U  23  -9.665  -6.064  12.306
  240    H4*    U  23           H4*        U  23  -8.581  -7.481  10.715
  241    H3*    U  23           H3*        U  23  -6.797  -6.597  12.974
  242    H2*    U  23          1H2*        U  23  -5.069  -7.996  12.044
  243   2HO*    U  23          2HO*        U  23  -5.661  -9.740  10.996
  244    H1*    U  23           H1*        U  23  -5.523  -7.182   9.393
  245    H3     U  23           H3         U  23  -1.563  -5.298  10.484
  246    H5     U  23           H5         U  23  -4.427  -2.865  12.353
  247    H6     U  23           H6         U  23  -6.097  -4.479  11.722
  248   1H5*    C  24          H5*         C  24  -6.662 -10.558  12.587
  249   2H5*    C  24          2H5*        C  24  -6.857 -11.540  14.052
  250    H4*    C  24           H4*        C  24  -4.945 -12.367  12.998
  251    H3*    C  24           H3*        C  24  -4.184 -10.584  15.300
  252    H2*    C  24          1H2*        C  24  -1.871 -11.056  14.816
  253   2HO*    C  24          2HO*        C  24  -1.553 -12.560  12.892
  254    H1*    C  24           H1*        C  24  -2.137 -10.738  12.043
  255   1H4     C  24          1H4         C  24  -1.893  -4.640  14.566
  256   2H4     C  24          2H4         C  24  -0.284  -5.022  13.989
  257    H5     C  24           H5         C  24  -3.700  -6.264  14.548
  258    H6     C  24           H6         C  24  -4.313  -8.556  13.977
  259   1H5*    C  25          H5*         C  25  -1.717 -13.773  15.532
  260   2H5*    C  25          2H5*        C  25  -2.284 -14.770  16.886
  261    H4*    C  25           H4*        C  25   0.055 -14.875  16.939
  262    H3*    C  25           H3*        C  25  -1.062 -13.104  19.078
  263    H2*    C  25          1H2*        C  25   1.152 -12.513  19.790
  264   2HO*    C  25          2HO*        C  25   1.748 -14.902  19.064
  265    H1*    C  25           H1*        C  25   2.212 -12.141  17.237
  266   1H4     C  25          1H4         C  25  -1.395  -6.730  18.321
  267   2H4     C  25          2H4         C  25   0.160  -6.398  19.046
  268    H5     C  25           H5         C  25  -1.970  -8.886  17.374
  269    H6     C  25           H6         C  25  -1.180 -11.156  16.962
  270    H3T    C  25           H3T        C  25  -1.302 -15.186  19.461
  Start of MODEL   15
    1   1H5*    G   1          H5*         G   1   7.437  -0.624  16.695
    2   2H5*    G   1          2H5*        G   1   5.835  -1.287  16.324
    3    H4*    G   1           H4*        G   1   8.491  -2.525  16.176
    4    H3*    G   1           H3*        G   1   5.922  -2.759  14.656
    5    H2*    G   1          1H2*        G   1   6.488  -5.028  14.039
    6   2HO*    G   1          2HO*        G   1   8.959  -4.150  14.395
    7    H1*    G   1           H1*        G   1   7.139  -5.842  16.585
    8    H8     G   1           H8         G   1   4.569  -3.064  16.736
    9    H1     G   1           H1         G   1   2.093  -8.932  16.019
   10   1H2     G   1          1H2         G   1   5.364  -9.929  15.526
   11   2H2     G   1          2H2         G   1   3.676 -10.390  15.614
   12    H5T    G   1           H5T        G   1   6.524  -2.614  18.394
   13   1H5*    G   2          H5*         G   2   8.818  -4.099  12.287
   14   2H5*    G   2          2H5*        G   2   8.927  -3.429  10.647
   15    H4*    G   2           H4*        G   2   8.932  -5.732  10.346
   16    H3*    G   2           H3*        G   2   6.200  -4.622   9.774
   17    H2*    G   2          1H2*        G   2   5.453  -6.874   9.275
   18   2HO*    G   2          2HO*        G   2   8.027  -7.247   8.762
   19    H1*    G   2           H1*        G   2   6.483  -7.975  11.583
   20    H8     G   2           H8         G   2   5.621  -4.395  12.323
   21    H1     G   2           H1         G   2   0.608  -8.372  12.642
   22   1H2     G   2          1H2         G   2   2.743 -10.682  11.174
   23   2H2     G   2          2H2         G   2   1.143 -10.347  11.801
   24   1H5*    A   3          H5*         A   3   7.181  -7.212   7.020
   25   2H5*    A   3          2H5*        A   3   6.963  -6.781   5.313
   26    H4*    A   3           H4*        A   3   5.898  -8.840   5.582
   27    H3*    A   3           H3*        A   3   3.930  -6.585   5.442
   28    H2*    A   3          1H2*        A   3   2.124  -8.162   5.754
   29   2HO*    A   3          2HO*        A   3   3.952  -9.859   4.766
   30    H1*    A   3           H1*        A   3   3.265  -9.443   7.912
   31    H8     A   3           H8         A   3   4.452  -5.880   7.984
   32   1H6     A   3          1H6         A   3   0.867  -3.956  10.599
   33   2H6     A   3          2H6         A   3  -0.713  -4.522  11.096
   34    H2     A   3           H2         A   3  -1.105  -8.705   9.512
   35   1H5*    A   4          H5*         A   4   2.619  -9.429   2.975
   36   2H5*    A   4          2H5*        A   4   2.380  -8.960   1.280
   37    H4*    A   4           H4*        A   4   0.421 -10.049   1.808
   38    H3*    A   4           H3*        A   4   0.013  -7.089   2.016
   39    H2*    A   4          1H2*        A   4  -2.257  -7.459   2.766
   40   2HO*    A   4          2HO*        A   4  -2.157  -9.593   1.372
   41    H1*    A   4           H1*        A   4  -1.579  -9.269   4.718
   42    H8     A   4           H8         A   4   1.419  -7.038   4.332
   43   1H6     A   4          1H6         A   4   0.098  -3.505   7.393
   44   2H6     A   4          2H6         A   4  -1.415  -3.112   8.185
   45    H2     A   4           H2         A   4  -4.363  -6.268   6.996
   46   1H5*    G   5          H5*         G   5  -3.018  -8.448  -0.195
   47   2H5*    G   5          2H5*        G   5  -3.577  -7.485  -1.576
   48    H4*    G   5           H4*        G   5  -5.368  -7.756  -0.009
   49    H3*    G   5           H3*        G   5  -4.288  -4.947  -0.161
   50    H2*    G   5          1H2*        G   5  -6.045  -4.304   1.381
   51   2HO*    G   5          2HO*        G   5  -7.802  -5.504   1.580
   52    H1*    G   5           H1*        G   5  -5.515  -6.380   3.148
   53    H8     G   5           H8         G   5  -2.145  -5.703   1.947
   54    H1     G   5           H1         G   5  -4.358  -0.951   5.639
   55   1H2     G   5          1H2         G   5  -7.443  -2.399   5.135
   56   2H2     G   5          2H2         G   5  -6.524  -1.102   5.865
   57   1H5*    C   6          H5*         C   6  -8.038  -4.428   0.207
   58   2H5*    C   6          2H5*        C   6  -8.748  -3.994  -1.360
   59    H4*    C   6           H4*        C   6  -9.883  -2.636   0.103
   60    H3*    C   6           H3*        C   6  -7.649  -1.093  -1.150
   61    H2*    C   6          1H2*        C   6  -8.179   0.819   0.217
   62   2HO*    C   6          2HO*        C   6 -10.597  -0.170   0.103
   63    H1*    C   6           H1*        C   6  -8.466  -0.587   2.595
   64   1H4     C   6          1H4         C   6  -1.949  -0.589   1.708
   65   2H4     C   6          2H4         C   6  -2.296   0.939   2.479
   66    H5     C   6           H5         C   6  -3.673  -2.094   0.937
   67    H6     C   6           H6         C   6  -6.077  -2.449   0.765
   68   1H5*    A   7          H5*         A   7  -7.055   1.885  -3.091
   69   2H5*    A   7          2H5*        A   7  -7.325   0.935  -1.617
   70    H4*    A   7           H4*        A   7  -9.101   3.119  -1.529
   71    H3*    A   7           H3*        A   7  -6.488   3.949  -2.681
   72    H2*    A   7          1H2*        A   7  -6.177   5.665  -1.027
   73   2HO*    A   7          2HO*        A   7  -8.783   5.733  -1.041
   74    H1*    A   7           H1*        A   7  -6.826   4.150   1.168
   75    H8     A   7           H8         A   7  -5.446   1.414  -0.732
   76   1H6     A   7          1H6         A   7  -0.686   2.227  -0.219
   77   2H6     A   7          2H6         A   7   0.244   3.604   0.340
   78    H2     A   7           H2         A   7  -2.698   6.826   1.365
   79   1H5*    G   8          H5*         G   8  -7.125   7.348  -1.654
   80   2H5*    G   8          2H5*        G   8  -7.852   8.211  -3.023
   81    H4*    G   8           H4*        G   8  -6.299   9.714  -2.295
   82    H3*    G   8           H3*        G   8  -5.129   8.147  -4.551
   83    H2*    G   8          1H2*        G   8  -2.992   9.202  -4.241
   84   2HO*    G   8          2HO*        G   8  -4.482  11.182  -3.335
   85    H1*    G   8           H1*        G   8  -2.903   8.954  -1.489
   86    H8     G   8           H8         G   8  -4.744   5.949  -2.660
   87    H1     G   8           H1         G   8   1.603   5.547  -3.499
   88   1H2     G   8          1H2         G   8   1.598   8.915  -2.778
   89   2H2     G   8          2H2         G   8   2.539   7.501  -3.194
   90   1H5*    G   9          H5*         G   9  -4.018  11.737  -5.393
   91   2H5*    G   9          2H5*        G   9  -4.552  12.427  -6.938
   92    H4*    G   9           H4*        G   9  -2.260  12.739  -6.951
   93    H3*    G   9           H3*        G   9  -2.932  10.289  -8.561
   94    H2*    G   9          1H2*        G   9  -0.584  10.020  -9.022
   95   2HO*    G   9          2HO*        G   9   0.534  11.810  -9.192
   96    H1*    G   9           H1*        G   9   0.244  10.522  -6.392
   97    H8     G   9           H8         G   9  -2.971   8.572  -6.375
   98    H1     G   9           H1         G   9   2.272   4.972  -7.204
   99   1H2     G   9          1H2         G   9   3.907   7.996  -7.598
  100   2H2     G   9          2H2         G   9   4.026   6.252  -7.563
  101   1H5*    C  10          H5*         C  10  -0.500  12.784 -10.594
  102   2H5*    C  10          2H5*        C  10  -0.794  13.028 -12.328
  103    H4*    C  10           H4*        C  10   1.453  12.395 -12.118
  104    H3*    C  10           H3*        C  10  -0.243  10.152 -13.157
  105    H2*    C  10          1H2*        C  10   1.719   8.760 -13.255
  106   2HO*    C  10          2HO*        C  10   3.573   9.708 -13.652
  107    H1*    C  10           H1*        C  10   2.710   9.516 -10.750
  108   1H4     C  10          1H4         C  10  -2.211   5.196  -9.746
  109   2H4     C  10          2H4         C  10  -0.711   4.373  -9.448
  110    H5     C  10           H5         C  10  -2.284   7.533 -10.461
  111    H6     C  10           H6         C  10  -0.932   9.451 -11.124
  112   1H5*    U  11          H5*         U  11   2.538  10.081 -15.293
  113   2H5*    U  11          2H5*        U  11   2.533  10.017 -17.066
  114    H4*    U  11           H4*        U  11   3.570   8.040 -16.327
  115    H3*    U  11           H3*        U  11   0.799   7.623 -17.370
  116    H2*    U  11          1H2*        U  11   0.781   5.366 -16.684
  117   2HO*    U  11          2HO*        U  11   2.826   4.315 -16.186
  118    H1*    U  11           H1*        U  11   2.658   5.660 -14.490
  119    H3     U  11           H3         U  11  -0.832   3.510 -12.590
  120    H5     U  11           H5         U  11  -2.133   7.492 -13.097
  121    H6     U  11           H6         U  11  -0.149   7.887 -14.390
  122   1H5*    U  12          H5*         U  12   0.252   5.015 -19.554
  123   2H5*    U  12          2H5*        U  12   1.885   5.129 -18.870
  124    H4*    U  12           H4*        U  12   1.062   3.880 -21.487
  125    H3*    U  12           H3*        U  12   0.921   2.524 -19.243
  126    H2*    U  12          1H2*        U  12   3.060   3.146 -18.305
  127   2HO*    U  12          2HO*        U  12   3.635   1.098 -18.142
  128    H1*    U  12           H1*        U  12   4.446   2.618 -20.971
  129    H3     U  12           H3         U  12   8.178   4.038 -18.931
  130    H5     U  12           H5         U  12   5.462   7.171 -18.296
  131    H6     U  12           H6         U  12   3.762   5.799 -19.300
  132   1H5*    C  13          H5*         C  13   2.229  -0.139 -18.485
  133   2H5*    C  13          2H5*        C  13   1.300  -1.564 -18.988
  134    H4*    C  13           H4*        C  13   1.601  -1.458 -16.572
  135    H3*    C  13           H3*        C  13  -0.711  -2.238 -17.708
  136    H2*    C  13          1H2*        C  13  -1.805  -0.072 -17.648
  137   2HO*    C  13          2HO*        C  13  -2.490  -0.518 -15.017
  138    H1*    C  13           H1*        C  13  -0.641   0.278 -14.826
  139   1H4     C  13          1H4         C  13  -2.123   6.332 -16.997
  140   2H4     C  13          2H4         C  13  -2.920   6.128 -15.451
  141    H5     C  13           H5         C  13  -0.899   4.547 -18.074
  142    H6     C  13           H6         C  13  -0.181   2.227 -17.882
  143   1H5*    G  14          H5*         G  14   1.049  -3.527 -17.231
  144   2H5*    G  14          2H5*        G  14   1.224  -5.224 -17.716
  145    H4*    G  14           H4*        G  14   2.886  -5.637 -16.242
  146    H3*    G  14           H3*        G  14   1.673  -3.610 -14.370
  147    H2*    G  14          1H2*        G  14   3.833  -3.312 -13.388
  148   2HO*    G  14          2HO*        G  14   4.066  -5.865 -13.928
  149    H1*    G  14           H1*        G  14   5.269  -3.590 -15.845
  150    H8     G  14           H8         G  14   6.187  -1.312 -16.376
  151    H1     G  14           H1         G  14   1.354   1.609 -13.321
  152   1H2     G  14          1H2         G  14   0.062  -1.596 -12.991
  153   2H2     G  14          2H2         G  14  -0.139   0.113 -12.667
  154   1H5*    G  15          H5*         G  15   3.845  -4.966 -10.626
  155   2H5*    G  15          2H5*        G  15   2.784  -3.753  -9.884
  156    H4*    G  15           H4*        G  15   5.269  -3.433 -11.435
  157    H3*    G  15           H3*        G  15   4.050  -2.138  -9.044
  158    H2*    G  15          1H2*        G  15   5.050  -0.025  -9.588
  159   2HO*    G  15          2HO*        G  15   6.959  -0.138 -10.510
  160    H1*    G  15           H1*        G  15   4.386  -0.023 -12.262
  161    H8     G  15           H8         G  15   1.594  -1.879 -10.741
  162    H1     G  15           H1         G  15   1.221   4.426  -9.690
  163   1H2     G  15          1H2         G  15   4.462   4.495 -10.870
  164   2H2     G  15          2H2         G  15   3.099   5.406 -10.260
  165   1H5*    C  16          H5*         C  16   8.250  -1.047  -8.899
  166   2H5*    C  16          2H5*        C  16   8.748  -1.021  -7.196
  167    H4*    C  16           H4*        C  16   9.106   1.119  -8.367
  168    H3*    C  16           H3*        C  16   7.357   1.031  -5.933
  169    H2*    C  16          1H2*        C  16   6.901   3.378  -6.166
  170   2HO*    C  16          2HO*        C  16   8.149   4.694  -7.389
  171    H1*    C  16           H1*        C  16   6.512   3.335  -8.932
  172   1H4     C  16          1H4         C  16   0.899   0.902  -6.522
  173   2H4     C  16          2H4         C  16   0.672   2.638  -6.582
  174    H5     C  16           H5         C  16   3.018  -0.162  -6.994
  175    H6     C  16           H6         C  16   5.339   0.219  -7.637
  176   1H5*    C  17          H5*         C  17   9.372   4.805  -6.029
  177   2H5*    C  17          2H5*        C  17  10.585   4.541  -4.761
  178    H4*    C  17           H4*        C  17   9.927   6.710  -4.393
  179    H3*    C  17           H3*        C  17   8.475   4.892  -2.515
  180    H2*    C  17          1H2*        C  17   7.170   6.725  -1.680
  181   2HO*    C  17          2HO*        C  17   9.314   8.110  -2.427
  182    H1*    C  17           H1*        C  17   6.553   7.819  -4.150
  183   1H4     C  17          1H4         C  17   2.882   2.336  -3.800
  184   2H4     C  17          2H4         C  17   1.808   3.668  -3.465
  185    H5     C  17           H5         C  17   5.265   2.601  -4.113
  186    H6     C  17           H6         C  17   7.100   4.204  -4.188
  187   1H5*    U  18          H5*         U  18   9.144   7.893   0.003
  188   2H5*    U  18          2H5*        U  18  10.780   7.553   0.597
  189    H4*    U  18           H4*        U  18  10.154   7.497   2.767
  190    H3*    U  18           H3*        U  18   8.250   5.730   2.327
  191    H2*    U  18          1H2*        U  18   6.644   7.109   1.200
  192   2HO*    U  18          2HO*        U  18   6.109   7.722   3.944
  193    H1*    U  18           H1*        U  18   7.038   9.434   3.113
  194    H3     U  18           H3         U  18   5.417  12.506   0.342
  195    H5     U  18           H5         U  18   6.345   9.334  -2.245
  196    H6     U  18           H6         U  18   7.221   8.145  -0.358
  197   1H5*    U  19          H5*         U  19   4.849   5.450   6.664
  198   2H5*    U  19          2H5*        U  19   4.705   5.824   4.936
  199    H4*    U  19           H4*        U  19   4.785   7.913   7.104
  200    H3*    U  19           H3*        U  19   2.391   6.462   6.025
  201    H2*    U  19          1H2*        U  19   1.176   8.537   5.949
  202   2HO*    U  19          2HO*        U  19   1.693   9.733   7.675
  203    H1*    U  19           H1*        U  19   3.251  10.043   4.848
  204    H3     U  19           H3         U  19   0.099   9.378   1.609
  205    H5     U  19           H5         U  19   2.638   6.041   1.426
  206    H6     U  19           H6         U  19   3.659   6.802   3.467
  207   1H5*    G  20          H5*         G  20   0.390   8.525   7.841
  208   2H5*    G  20          2H5*        G  20  -0.131   7.885   9.411
  209    H4*    G  20           H4*        G  20  -2.034   8.864   8.517
  210    H3*    G  20           H3*        G  20  -2.099   5.891   8.232
  211    H2*    G  20          1H2*        G  20  -4.189   6.028   7.022
  212   2HO*    G  20          2HO*        G  20  -4.386   8.335   8.342
  213    H1*    G  20           H1*        G  20  -3.329   7.918   5.232
  214    H8     G  20           H8         G  20  -0.093   6.446   5.899
  215    H1     G  20           H1         G  20  -3.849   2.422   2.612
  216   1H2     G  20          1H2         G  20  -6.411   4.519   3.582
  217   2H2     G  20          2H2         G  20  -5.949   3.062   2.732
  218   1H5*    U  21          H5*         U  21  -5.665   6.214   9.481
  219   2H5*    U  21          2H5*        U  21  -6.066   5.339  10.972
  220    H4*    U  21           H4*        U  21  -7.543   4.577   9.299
  221    H3*    U  21           H3*        U  21  -5.439   2.587  10.048
  222    H2*    U  21          1H2*        U  21  -6.208   1.073   8.358
  223   2HO*    U  21          2HO*        U  21  -8.342   1.071   8.193
  224    H1*    U  21           H1*        U  21  -6.582   2.976   6.352
  225    H3     U  21           H3         U  21  -2.898   0.497   5.250
  226    H5     U  21           H5         U  21  -1.504   3.587   7.711
  227    H6     U  21           H6         U  21  -3.795   4.137   8.200
  228   1H5*    U  22          H5*         U  22  -9.390   0.782   9.825
  229   2H5*    U  22          2H5*        U  22  -9.736   0.132  11.439
  230    H4*    U  22           H4*        U  22 -10.571  -1.460   9.966
  231    H3*    U  22           H3*        U  22  -7.935  -2.322  11.101
  232    H2*    U  22          1H2*        U  22  -8.005  -4.319   9.744
  233   2HO*    U  22          2HO*        U  22  -9.837  -5.018   8.831
  234    H1*    U  22           H1*        U  22  -8.643  -3.024   7.393
  235    H3     U  22           H3         U  22  -4.140  -3.920   7.383
  236    H5     U  22           H5         U  22  -4.569  -0.128   9.120
  237    H6     U  22           H6         U  22  -6.942  -0.521   9.209
  238   1H5*    U  23          H5*         U  23  -9.901  -5.538  10.609
  239   2H5*    U  23          2H5*        U  23 -10.071  -6.546  12.058
  240    H4*    U  23           H4*        U  23  -9.219  -7.915  10.328
  241    H3*    U  23           H3*        U  23  -7.145  -7.235  12.398
  242    H2*    U  23          1H2*        U  23  -5.579  -8.619  11.186
  243   2HO*    U  23          2HO*        U  23  -7.827  -9.821  10.388
  244    H1*    U  23           H1*        U  23  -6.258  -7.597   8.674
  245    H3     U  23           H3         U  23  -2.173  -5.903   9.727
  246    H5     U  23           H5         U  23  -4.952  -3.346  11.577
  247    H6     U  23           H6         U  23  -6.666  -4.937  11.015
  248   1H5*    C  24          H5*         C  24  -7.146 -11.140  11.670
  249   2H5*    C  24          2H5*        C  24  -7.335 -12.213  13.071
  250    H4*    C  24           H4*        C  24  -5.568 -13.088  11.802
  251    H3*    C  24           H3*        C  24  -4.600 -11.671  14.265
  252    H2*    C  24          1H2*        C  24  -2.328 -12.192  13.636
  253   2HO*    C  24          2HO*        C  24  -3.523 -13.696  11.516
  254    H1*    C  24           H1*        C  24  -2.609 -11.391  10.995
  255   1H4     C  24          1H4         C  24  -2.539  -5.717  14.355
  256   2H4     C  24          2H4         C  24  -0.867  -6.092  13.992
  257    H5     C  24           H5         C  24  -4.349  -7.261  13.863
  258    H6     C  24           H6         C  24  -4.908  -9.442  12.926
  259   1H5*    C  25          H5*         C  25  -2.862 -15.283  14.348
  260   2H5*    C  25          2H5*        C  25  -2.949 -16.199  15.866
  261    H4*    C  25           H4*        C  25  -0.678 -16.086  15.307
  262    H3*    C  25           H3*        C  25  -1.392 -14.215  17.536
  263    H2*    C  25          1H2*        C  25   0.866 -13.400  17.595
  264   2HO*    C  25          2HO*        C  25   1.465 -15.806  16.871
  265    H1*    C  25           H1*        C  25   1.185 -13.196  14.828
  266   1H4     C  25          1H4         C  25  -2.467  -7.980  16.594
  267   2H4     C  25          2H4         C  25  -0.808  -7.424  16.496
  268    H5     C  25           H5         C  25  -3.080 -10.310  16.301
  269    H6     C  25           H6         C  25  -2.230 -12.554  15.865
  270    H3T    C  25           H3T        C  25  -1.331 -16.393  17.924
  Start of MODEL   16
    1   1H5*    G   1          H5*         G   1   4.376   0.637  17.201
    2   2H5*    G   1          2H5*        G   1   5.591   1.484  18.175
    3    H4*    G   1           H4*        G   1   7.311  -0.058  17.278
    4    H3*    G   1           H3*        G   1   5.000  -1.294  15.833
    5    H2*    G   1          1H2*        G   1   5.811  -3.492  16.366
    6   2HO*    G   1          2HO*        G   1   8.140  -2.362  16.304
    7    H1*    G   1           H1*        G   1   6.284  -3.008  19.036
    8    H8     G   1           H8         G   1   3.438  -0.826  18.577
    9    H1     G   1           H1         G   1   1.718  -6.982  18.125
   10   1H2     G   1          1H2         G   1   5.111  -7.583  17.837
   11   2H2     G   1          2H2         G   1   3.495  -8.254  17.869
   12    H5T    G   1           H5T        G   1   5.760   1.121  15.356
   13   1H5*    G   2          H5*         G   2   8.339  -3.610  14.709
   14   2H5*    G   2          2H5*        G   2   8.540  -3.308  12.972
   15    H4*    G   2           H4*        G   2   8.821  -5.617  13.291
   16    H3*    G   2           H3*        G   2   6.195  -4.935  12.020
   17    H2*    G   2          1H2*        G   2   5.591  -7.274  12.021
   18   2HO*    G   2          2HO*        G   2   8.154  -7.653  11.888
   19    H1*    G   2           H1*        G   2   6.227  -7.711  14.658
   20    H8     G   2           H8         G   2   5.308  -4.160  14.760
   21    H1     G   2           H1         G   2   0.187  -7.939  14.067
   22   1H2     G   2          1H2         G   2   2.499 -10.421  13.338
   23   2H2     G   2          2H2         G   2   0.813  -9.985  13.506
   24   1H5*    A   3          H5*         A   3   7.723  -8.074   9.612
   25   2H5*    A   3          2H5*        A   3   8.105  -7.342   8.041
   26    H4*    A   3           H4*        A   3   7.094  -9.309   7.434
   27    H3*    A   3           H3*        A   3   5.082  -7.099   7.346
   28    H2*    A   3          1H2*        A   3   3.329  -8.681   6.828
   29   2HO*    A   3          2HO*        A   3   3.820 -10.542   5.920
   30    H1*    A   3           H1*        A   3   3.906 -10.394   8.879
   31    H8     A   3           H8         A   3   5.161  -7.191  10.239
   32   1H6     A   3          1H6         A   3   1.013  -5.297  11.894
   33   2H6     A   3          2H6         A   3  -0.674  -5.702  11.646
   34    H2     A   3           H2         A   3  -0.771  -9.290   8.976
   35   1H5*    A   4          H5*         A   4   4.323  -9.564   4.464
   36   2H5*    A   4          2H5*        A   4   4.402  -8.914   2.816
   37    H4*    A   4           H4*        A   4   2.441 -10.163   2.873
   38    H3*    A   4           H3*        A   4   1.892  -7.229   3.064
   39    H2*    A   4          1H2*        A   4  -0.465  -7.655   3.332
   40   2HO*    A   4          2HO*        A   4   0.069  -9.790   1.940
   41    H1*    A   4           H1*        A   4  -0.184  -9.590   5.276
   42    H8     A   4           H8         A   4   2.736  -7.313   5.760
   43   1H6     A   4          1H6         A   4   0.652  -3.975   8.576
   44   2H6     A   4          2H6         A   4  -1.007  -3.610   8.998
   45    H2     A   4           H2         A   4  -3.541  -6.687   6.931
   46   1H5*    G   5          H5*         G   5  -0.643  -7.909  -0.469
   47   2H5*    G   5          2H5*        G   5  -0.638  -6.332  -1.280
   48    H4*    G   5           H4*        G   5  -2.792  -7.254  -0.118
   49    H3*    G   5           H3*        G   5  -1.865  -4.388  -0.082
   50    H2*    G   5          1H2*        G   5  -3.864  -3.872   1.194
   51   2HO*    G   5          2HO*        G   5  -4.711  -6.171   0.051
   52    H1*    G   5           H1*        G   5  -3.474  -5.941   3.004
   53    H8     G   5           H8         G   5  -0.008  -5.104   2.338
   54    H1     G   5           H1         G   5  -2.968  -0.444   5.601
   55   1H2     G   5          1H2         G   5  -5.870  -2.045   4.659
   56   2H2     G   5          2H2         G   5  -5.134  -0.701   5.503
   57   1H5*    C   6          H5*         C   6  -5.736  -4.405  -0.224
   58   2H5*    C   6          2H5*        C   6  -6.279  -4.016  -1.868
   59    H4*    C   6           H4*        C   6  -7.840  -3.024  -0.445
   60    H3*    C   6           H3*        C   6  -5.952  -1.059  -1.657
   61    H2*    C   6          1H2*        C   6  -6.843   0.735  -0.342
   62   2HO*    C   6          2HO*        C   6  -8.878   0.682   0.266
   63    H1*    C   6           H1*        C   6  -7.015  -0.648   2.065
   64   1H4     C   6          1H4         C   6  -0.581   0.602   1.447
   65   2H4     C   6          2H4         C   6  -1.231   1.964   2.326
   66    H5     C   6           H5         C   6  -1.949  -1.149   0.516
   67    H6     C   6           H6         C   6  -4.229  -1.959   0.234
   68   1H5*    A   7          H5*         A   7  -6.344   2.316  -3.579
   69   2H5*    A   7          2H5*        A   7  -6.009   1.203  -2.239
   70    H4*    A   7           H4*        A   7  -8.313   2.852  -1.688
   71    H3*    A   7           H3*        A   7  -5.950   4.323  -2.720
   72    H2*    A   7          1H2*        A   7  -5.821   5.742  -0.790
   73   2HO*    A   7          2HO*        A   7  -8.393   5.446  -0.767
   74    H1*    A   7           H1*        A   7  -6.180   3.793   1.129
   75    H8     A   7           H8         A   7  -4.356   1.737  -1.227
   76   1H6     A   7          1H6         A   7   0.197   3.273  -0.465
   77   2H6     A   7          2H6         A   7   0.859   4.666   0.371
   78    H2     A   7           H2         A   7  -2.588   7.032   1.945
   79   1H5*    G   8          H5*         G   8  -7.062   7.269  -1.768
   80   2H5*    G   8          2H5*        G   8  -7.720   8.392  -2.974
   81    H4*    G   8           H4*        G   8  -6.098   9.717  -2.167
   82    H3*    G   8           H3*        G   8  -4.762   8.124  -4.320
   83    H2*    G   8          1H2*        G   8  -2.628   9.098  -3.717
   84   2HO*    G   8          2HO*        G   8  -4.033  11.097  -2.903
   85    H1*    G   8           H1*        G   8  -2.828   8.479  -1.065
   86    H8     G   8           H8         G   8  -5.019   5.988  -2.754
   87    H1     G   8           H1         G   8   1.203   4.555  -3.228
   88   1H2     G   8          1H2         G   8   1.714   7.749  -1.986
   89   2H2     G   8          2H2         G   8   2.434   6.265  -2.572
   90   1H5*    G   9          H5*         G   9  -3.160  11.536  -4.814
   91   2H5*    G   9          2H5*        G   9  -3.486  12.356  -6.354
   92    H4*    G   9           H4*        G   9  -1.184  12.485  -6.114
   93    H3*    G   9           H3*        G   9  -1.897  10.250  -7.989
   94    H2*    G   9          1H2*        G   9   0.452   9.758  -8.240
   95   2HO*    G   9          2HO*        G   9   1.971  11.204  -7.742
   96    H1*    G   9           H1*        G   9   1.011   9.815  -5.524
   97    H8     G   9           H8         G   9  -2.408   8.486  -5.528
   98    H1     G   9           H1         G   9   1.855   4.210  -7.673
   99   1H2     G   9          1H2         G   9   4.017   6.904  -7.836
  100   2H2     G   9          2H2         G   9   3.781   5.191  -8.086
  101   1H5*    C  10          H5*         C  10   1.534  12.148  -9.214
  102   2H5*    C  10          2H5*        C  10   1.183  12.939 -10.763
  103    H4*    C  10           H4*        C  10   3.300  12.052 -11.048
  104    H3*    C  10           H3*        C  10   1.273  10.245 -12.327
  105    H2*    C  10          1H2*        C  10   3.074   8.771 -12.988
  106   2HO*    C  10          2HO*        C  10   4.524  11.060 -12.564
  107    H1*    C  10           H1*        C  10   4.266   8.714 -10.489
  108   1H4     C  10          1H4         C  10  -1.335   5.224  -9.943
  109   2H4     C  10          2H4         C  10  -0.061   4.088 -10.266
  110    H5     C  10           H5         C  10  -0.948   7.632  -9.903
  111    H6     C  10           H6         C  10   0.715   9.383 -10.227
  112   1H5*    U  11          H5*         U  11   3.805   9.697 -14.779
  113   2H5*    U  11          2H5*        U  11   3.403  10.256 -16.414
  114    H4*    U  11           H4*        U  11   4.029   8.001 -16.619
  115    H3*    U  11           H3*        U  11   1.061   8.389 -16.836
  116    H2*    U  11          1H2*        U  11   0.775   6.026 -17.099
  117   2HO*    U  11          2HO*        U  11   2.406   4.715 -17.718
  118    H1*    U  11           H1*        U  11   2.717   5.282 -15.184
  119    H3     U  11           H3         U  11  -1.272   3.948 -13.495
  120    H5     U  11           H5         U  11  -1.000   8.058 -12.595
  121    H6     U  11           H6         U  11   0.946   8.150 -14.005
  122   1H5*    U  12          H5*         U  12   1.360   7.742 -22.130
  123   2H5*    U  12          2H5*        U  12  -0.101   6.764 -21.893
  124    H4*    U  12           H4*        U  12   1.277   5.407 -23.158
  125    H3*    U  12           H3*        U  12   0.585   4.375 -20.774
  126    H2*    U  12          1H2*        U  12   2.562   5.046 -19.555
  127   2HO*    U  12          2HO*        U  12   2.888   2.519 -20.770
  128    H1*    U  12           H1*        U  12   4.238   4.251 -22.003
  129    H3     U  12           H3         U  12   7.916   5.290 -19.660
  130    H5     U  12           H5         U  12   5.482   8.681 -19.205
  131    H6     U  12           H6         U  12   3.743   7.494 -20.369
  132   1H5*    C  13          H5*         C  13   1.789   0.928 -19.786
  133   2H5*    C  13          2H5*        C  13   0.666  -0.127 -20.665
  134    H4*    C  13           H4*        C  13   0.677  -0.467 -18.216
  135    H3*    C  13           H3*        C  13  -1.499  -0.724 -19.752
  136    H2*    C  13          1H2*        C  13  -2.272   1.568 -19.567
  137   2HO*    C  13          2HO*        C  13  -3.813  -0.054 -18.586
  138    H1*    C  13           H1*        C  13  -1.620   1.438 -16.571
  139   1H4     C  13          1H4         C  13  -1.711   7.829 -18.250
  140   2H4     C  13          2H4         C  13  -2.833   7.626 -16.922
  141    H5     C  13           H5         C  13  -0.552   5.959 -19.274
  142    H6     C  13           H6         C  13  -0.236   3.542 -19.221
  143   1H5*    G  14          H5*         G  14   0.003  -2.291 -19.231
  144   2H5*    G  14          2H5*        G  14  -0.070  -3.884 -20.006
  145    H4*    G  14           H4*        G  14   1.359  -4.838 -18.537
  146    H3*    G  14           H3*        G  14   0.324  -2.983 -16.403
  147    H2*    G  14          1H2*        G  14   2.415  -3.162 -15.270
  148   2HO*    G  14          2HO*        G  14   2.348  -5.573 -15.790
  149    H1*    G  14           H1*        G  14   4.003  -3.368 -17.654
  150    H8     G  14           H8         G  14   5.430  -1.316 -17.606
  151    H1     G  14           H1         G  14   0.816   2.163 -14.817
  152   1H2     G  14          1H2         G  14  -1.105  -0.714 -15.164
  153   2H2     G  14          2H2         G  14  -1.028   0.944 -14.612
  154   1H5*    G  15          H5*         G  15   1.811  -5.531 -12.906
  155   2H5*    G  15          2H5*        G  15   1.003  -4.289 -11.930
  156    H4*    G  15           H4*        G  15   3.670  -4.346 -13.038
  157    H3*    G  15           H3*        G  15   2.285  -2.824 -10.869
  158    H2*    G  15          1H2*        G  15   3.919  -1.059 -11.030
  159   2HO*    G  15          2HO*        G  15   5.517  -2.939 -11.762
  160    H1*    G  15           H1*        G  15   3.812  -0.814 -13.769
  161    H8     G  15           H8         G  15   0.409  -1.965 -12.836
  162    H1     G  15           H1         G  15   1.374   4.248 -11.638
  163   1H2     G  15          1H2         G  15   4.684   3.548 -12.246
  164   2H2     G  15          2H2         G  15   3.490   4.750 -11.817
  165   1H5*    C  16          H5*         C  16   6.440  -2.283 -10.344
  166   2H5*    C  16          2H5*        C  16   6.805  -2.736  -8.668
  167    H4*    C  16           H4*        C  16   7.769  -0.597  -9.147
  168    H3*    C  16           H3*        C  16   5.487  -0.571  -7.197
  169    H2*    C  16          1H2*        C  16   5.699   1.817  -7.004
  170   2HO*    C  16          2HO*        C  16   8.215   1.310  -7.532
  171    H1*    C  16           H1*        C  16   6.001   2.295  -9.742
  172   1H4     C  16          1H4         C  16  -0.446   1.215  -8.744
  173   2H4     C  16          2H4         C  16  -0.219   2.951  -8.786
  174    H5     C  16           H5         C  16   1.417  -0.342  -8.841
  175    H6     C  16           H6         C  16   3.844  -0.538  -8.994
  176   1H5*    C  17          H5*         C  17   8.379   2.061  -5.683
  177   2H5*    C  17          2H5*        C  17   8.942   1.320  -4.172
  178    H4*    C  17           H4*        C  17   8.694   3.545  -3.623
  179    H3*    C  17           H3*        C  17   6.275   2.030  -2.695
  180    H2*    C  17          1H2*        C  17   5.316   4.090  -1.896
  181   2HO*    C  17          2HO*        C  17   7.928   4.837  -1.931
  182    H1*    C  17           H1*        C  17   5.792   5.507  -4.215
  183   1H4     C  17          1H4         C  17   1.027   1.182  -5.771
  184   2H4     C  17          2H4         C  17   0.242   2.712  -5.440
  185    H5     C  17           H5         C  17   3.413   0.854  -5.470
  186    H6     C  17           H6         C  17   5.500   1.917  -4.794
  187   1H5*    U  18          H5*         U  18   7.574   5.164  -0.066
  188   2H5*    U  18          2H5*        U  18   8.611   4.119   0.923
  189    H4*    U  18           H4*        U  18   8.049   5.193   2.744
  190    H3*    U  18           H3*        U  18   5.807   3.763   2.648
  191    H2*    U  18          1H2*        U  18   4.417   5.147   1.291
  192   2HO*    U  18          2HO*        U  18   4.349   6.315   3.893
  193    H1*    U  18           H1*        U  18   5.460   7.743   2.442
  194    H3     U  18           H3         U  18   4.076  10.125  -1.025
  195    H5     U  18           H5         U  18   4.680   6.342  -2.728
  196    H6     U  18           H6         U  18   5.421   5.566  -0.581
  197   1H5*    U  19          H5*         U  19   3.002   5.314   7.199
  198   2H5*    U  19          2H5*        U  19   3.046   5.930   5.535
  199    H4*    U  19           H4*        U  19   4.312   7.323   7.890
  200    H3*    U  19           H3*        U  19   1.501   7.499   6.926
  201    H2*    U  19          1H2*        U  19   1.541   9.881   6.861
  202   2HO*    U  19          2HO*        U  19   3.098   9.554   8.936
  203    H1*    U  19           H1*        U  19   4.174  10.190   5.940
  204    H3     U  19           H3         U  19   1.460  11.695   2.626
  205    H5     U  19           H5         U  19   1.670   7.539   2.091
  206    H6     U  19           H6         U  19   2.792   7.398   4.214
  207   1H5*    G  20          H5*         G  20   0.025   8.666   7.794
  208   2H5*    G  20          2H5*        G  20  -0.300   9.526   9.310
  209    H4*    G  20           H4*        G  20  -2.469   9.586   8.917
  210    H3*    G  20           H3*        G  20  -2.241   6.631   8.645
  211    H2*    G  20          1H2*        G  20  -4.264   6.500   7.340
  212   2HO*    G  20          2HO*        G  20  -5.731   7.970   7.804
  213    H1*    G  20           H1*        G  20  -3.587   8.453   5.553
  214    H8     G  20           H8         G  20  -0.204   7.494   6.374
  215    H1     G  20           H1         G  20  -3.170   2.854   3.093
  216   1H2     G  20          1H2         G  20  -6.054   4.591   3.844
  217   2H2     G  20          2H2         G  20  -5.337   3.194   3.071
  218   1H5*    U  21          H5*         U  21  -5.918   6.519   9.077
  219   2H5*    U  21          2H5*        U  21  -6.440   5.472  10.410
  220    H4*    U  21           H4*        U  21  -7.349   4.731   8.286
  221    H3*    U  21           H3*        U  21  -5.514   2.905   9.774
  222    H2*    U  21          1H2*        U  21  -5.522   1.316   7.984
  223   2HO*    U  21          2HO*        U  21  -7.940   1.971   7.679
  224    H1*    U  21           H1*        U  21  -5.358   3.149   5.882
  225    H3     U  21           H3         U  21  -1.349   0.944   6.182
  226    H5     U  21           H5         U  21  -1.054   4.243   8.747
  227    H6     U  21           H6         U  21  -3.415   4.601   8.447
  228   1H5*    U  22          H5*         U  22  -9.391   0.428   8.903
  229   2H5*    U  22          2H5*        U  22  -9.617  -0.372  10.471
  230    H4*    U  22           H4*        U  22  -9.783  -1.939   8.613
  231    H3*    U  22           H3*        U  22  -7.532  -2.367  10.560
  232    H2*    U  22          1H2*        U  22  -6.834  -4.275   9.287
  233   2HO*    U  22          2HO*        U  22  -8.270  -5.415   8.209
  234    H1*    U  22           H1*        U  22  -7.271  -3.106   6.756
  235    H3     U  22           H3         U  22  -2.782  -3.804   7.408
  236    H5     U  22           H5         U  22  -3.627  -0.001   8.976
  237    H6     U  22           H6         U  22  -5.968  -0.506   8.731
  238   1H5*    U  23          H5*         U  23  -9.448  -5.985   9.363
  239   2H5*    U  23          2H5*        U  23 -10.078  -6.729  10.845
  240    H4*    U  23           H4*        U  23  -9.197  -8.491   9.600
  241    H3*    U  23           H3*        U  23  -7.303  -7.703  11.797
  242    H2*    U  23          1H2*        U  23  -5.825  -9.477  11.068
  243   2HO*    U  23          2HO*        U  23  -6.715 -11.155  10.115
  244    H1*    U  23           H1*        U  23  -5.911  -8.751   8.398
  245    H3     U  23           H3         U  23  -1.971  -7.029   9.814
  246    H5     U  23           H5         U  23  -4.852  -4.331  11.229
  247    H6     U  23           H6         U  23  -6.547  -5.876  10.505
  248   1H5*    C  24          H5*         C  24  -7.270 -11.600  11.947
  249   2H5*    C  24          2H5*        C  24  -7.200 -12.276  13.586
  250    H4*    C  24           H4*        C  24  -5.258 -12.911  12.282
  251    H3*    C  24           H3*        C  24  -4.687 -11.099  14.625
  252    H2*    C  24          1H2*        C  24  -2.338 -11.398  14.111
  253   2HO*    C  24          2HO*        C  24  -1.654 -13.033  12.875
  254    H1*    C  24           H1*        C  24  -2.686 -10.935  11.376
  255   1H4     C  24          1H4         C  24  -3.088  -4.956  14.111
  256   2H4     C  24          2H4         C  24  -1.374  -5.325  14.075
  257    H5     C  24           H5         C  24  -4.778  -6.597  13.516
  258    H6     C  24           H6         C  24  -5.154  -8.894  12.784
  259   1H5*    C  25          H5*         C  25  -1.817 -13.939  14.648
  260   2H5*    C  25          2H5*        C  25  -2.051 -14.924  16.105
  261    H4*    C  25           H4*        C  25   0.259 -14.577  15.921
  262    H3*    C  25           H3*        C  25  -0.968 -12.864  18.055
  263    H2*    C  25          1H2*        C  25   1.182 -11.894  18.509
  264   2HO*    C  25          2HO*        C  25   3.064 -12.776  17.701
  265    H1*    C  25           H1*        C  25   1.904 -11.539  15.834
  266   1H4     C  25          1H4         C  25  -2.374  -6.672  17.064
  267   2H4     C  25          2H4         C  25  -0.798  -6.037  17.474
  268    H5     C  25           H5         C  25  -2.728  -8.989  16.440
  269    H6     C  25           H6         C  25  -1.645 -11.144  16.083
  270    H3T    C  25           H3T        C  25  -0.749 -15.126  18.240
  Start of MODEL   17
    1   1H5*    G   1          H5*         G   1   8.730   0.632  15.665
    2   2H5*    G   1          2H5*        G   1   7.826  -0.348  16.834
    3    H4*    G   1           H4*        G   1  10.094  -1.493  15.241
    4    H3*    G   1           H3*        G   1   7.307  -1.031  14.241
    5    H2*    G   1          1H2*        G   1   7.267  -3.249  13.310
    6   2HO*    G   1          2HO*        G   1   9.115  -3.976  12.578
    7    H1*    G   1           H1*        G   1   8.381  -4.522  15.522
    8    H8     G   1           H8         G   1   6.093  -1.591  16.368
    9    H1     G   1           H1         G   1   3.191  -7.297  15.977
   10   1H2     G   1          1H2         G   1   6.229  -8.412  14.760
   11   2H2     G   1          2H2         G   1   4.578  -8.809  15.191
   12    H5T    G   1           H5T        G   1  10.062  -0.925  17.608
   13   1H5*    G   2          H5*         G   2   9.594  -2.811  11.031
   14   2H5*    G   2          2H5*        G   2   8.886  -2.289   9.491
   15    H4*    G   2           H4*        G   2   8.838  -4.734   9.853
   16    H3*    G   2           H3*        G   2   6.217  -3.304   9.439
   17    H2*    G   2          1H2*        G   2   5.146  -5.462   9.510
   18   2HO*    G   2          2HO*        G   2   6.333  -6.974   8.578
   19    H1*    G   2           H1*        G   2   6.641  -6.387  11.705
   20    H8     G   2           H8         G   2   5.764  -2.770  12.195
   21    H1     G   2           H1         G   2   1.042  -6.829  13.731
   22   1H2     G   2          1H2         G   2   3.021  -9.219  12.199
   23   2H2     G   2          2H2         G   2   1.530  -8.861  13.045
   24   1H5*    A   3          H5*         A   3   6.855  -6.385   6.563
   25   2H5*    A   3          2H5*        A   3   6.111  -6.084   4.980
   26    H4*    A   3           H4*        A   3   5.421  -8.223   5.877
   27    H3*    A   3           H3*        A   3   3.296  -6.137   5.523
   28    H2*    A   3          1H2*        A   3   1.660  -7.666   6.407
   29   2HO*    A   3          2HO*        A   3   1.999  -9.718   5.986
   30    H1*    A   3           H1*        A   3   3.184  -8.482   8.575
   31    H8     A   3           H8         A   3   4.043  -4.881   8.013
   32   1H6     A   3          1H6         A   3   0.451  -2.853  10.570
   33   2H6     A   3          2H6         A   3  -1.036  -3.472  11.259
   34    H2     A   3           H2         A   3  -1.133  -7.864  10.367
   35   1H5*    A   4          H5*         A   4   1.893  -9.673   3.980
   36   2H5*    A   4          2H5*        A   4   1.620  -9.547   2.231
   37    H4*    A   4           H4*        A   4  -0.238 -10.691   2.936
   38    H3*    A   4           H3*        A   4  -0.878  -7.793   2.646
   39    H2*    A   4          1H2*        A   4  -3.071  -8.108   3.595
   40   2HO*    A   4          2HO*        A   4  -2.788 -10.534   2.627
   41    H1*    A   4           H1*        A   4  -2.251  -9.558   5.779
   42    H8     A   4           H8         A   4   0.587  -7.272   4.782
   43   1H6     A   4          1H6         A   4  -0.632  -3.418   7.480
   44   2H6     A   4          2H6         A   4  -2.063  -3.007   8.398
   45    H2     A   4           H2         A   4  -4.913  -6.433   7.971
   46   1H5*    G   5          H5*         G   5  -4.040  -9.194   1.809
   47   2H5*    G   5          2H5*        G   5  -4.730  -8.905   0.201
   48    H4*    G   5           H4*        G   5  -6.392  -8.227   1.667
   49    H3*    G   5           H3*        G   5  -4.882  -5.765   0.783
   50    H2*    G   5          1H2*        G   5  -6.525  -4.496   2.027
   51   2HO*    G   5          2HO*        G   5  -8.028  -6.640   1.511
   52    H1*    G   5           H1*        G   5  -6.428  -6.213   4.257
   53    H8     G   5           H8         G   5  -2.925  -5.983   3.190
   54    H1     G   5           H1         G   5  -4.999  -0.602   5.991
   55   1H2     G   5          1H2         G   5  -8.143  -1.944   5.545
   56   2H2     G   5          2H2         G   5  -7.181  -0.607   6.135
   57   1H5*    C   6          H5*         C   6  -8.931  -5.163   0.707
   58   2H5*    C   6          2H5*        C   6  -9.412  -5.036  -0.997
   59    H4*    C   6           H4*        C   6 -10.766  -3.482  -0.003
   60    H3*    C   6           H3*        C   6  -8.382  -2.163  -1.195
   61    H2*    C   6          1H2*        C   6  -8.903  -0.048  -0.195
   62   2HO*    C   6          2HO*        C   6 -11.356  -0.874  -0.456
   63    H1*    C   6           H1*        C   6  -9.544  -0.990   2.326
   64   1H4     C   6          1H4         C   6  -2.988  -1.646   2.087
   65   2H4     C   6          2H4         C   6  -3.300  -0.199   3.012
   66    H5     C   6           H5         C   6  -4.718  -2.913   0.991
   67    H6     C   6           H6         C   6  -7.113  -3.075   0.578
   68   1H5*    A   7          H5*         A   7  -7.811   0.818  -3.732
   69   2H5*    A   7          2H5*        A   7  -7.850  -0.024  -2.171
   70    H4*    A   7           H4*        A   7  -9.727   2.207  -2.375
   71    H3*    A   7           H3*        A   7  -6.876   2.758  -2.998
   72    H2*    A   7          1H2*        A   7  -6.691   4.445  -1.302
   73   2HO*    A   7          2HO*        A   7  -9.311   4.669  -1.791
   74    H1*    A   7           H1*        A   7  -7.976   3.083   0.720
   75    H8     A   7           H8         A   7  -6.485   0.173  -0.813
   76   1H6     A   7          1H6         A   7  -1.917   0.520   0.795
   77   2H6     A   7          2H6         A   7  -1.004   1.816   1.543
   78    H2     A   7           H2         A   7  -3.758   5.337   1.848
   79   1H5*    G   8          H5*         G   8  -7.800   6.153  -2.293
   80   2H5*    G   8          2H5*        G   8  -8.038   7.185  -3.717
   81    H4*    G   8           H4*        G   8  -6.772   8.469  -2.252
   82    H3*    G   8           H3*        G   8  -5.151   7.351  -4.487
   83    H2*    G   8          1H2*        G   8  -3.102   8.135  -3.520
   84   2HO*    G   8          2HO*        G   8  -4.634  10.024  -2.575
   85    H1*    G   8           H1*        G   8  -3.587   7.304  -0.940
   86    H8     G   8           H8         G   8  -5.341   4.724  -2.834
   87    H1     G   8           H1         G   8   1.018   4.107  -3.298
   88   1H2     G   8          1H2         G   8   1.112   7.302  -1.969
   89   2H2     G   8          2H2         G   8   2.021   5.932  -2.567
   90   1H5*    G   9          H5*         G   9  -3.363  10.648  -4.474
   91   2H5*    G   9          2H5*        G   9  -3.437  11.523  -6.015
   92    H4*    G   9           H4*        G   9  -1.156  11.197  -5.487
   93    H3*    G   9           H3*        G   9  -2.012   9.299  -7.678
   94    H2*    G   9          1H2*        G   9   0.324   8.686  -7.831
   95   2HO*    G   9          2HO*        G   9   0.605  11.136  -6.625
   96    H1*    G   9           H1*        G   9   0.644   8.532  -5.031
   97    H8     G   9           H8         G   9  -2.625   6.986  -5.507
   98    H1     G   9           H1         G   9   2.115   3.320  -7.803
   99   1H2     G   9          1H2         G   9   4.069   6.136  -7.402
  100   2H2     G   9          2H2         G   9   3.984   4.462  -7.895
  101   1H5*    C  10          H5*         C  10   1.460  11.208  -8.358
  102   2H5*    C  10          2H5*        C  10   1.380  12.218  -9.815
  103    H4*    C  10           H4*        C  10   3.523  11.299  -9.809
  104    H3*    C  10           H3*        C  10   1.758   9.857 -11.763
  105    H2*    C  10          1H2*        C  10   3.625   8.442 -12.331
  106   2HO*    C  10          2HO*        C  10   5.005  10.588 -11.473
  107    H1*    C  10           H1*        C  10   4.438   8.012  -9.688
  108   1H4     C  10          1H4         C  10  -0.822   4.133 -10.627
  109   2H4     C  10          2H4         C  10   0.569   3.171 -11.047
  110    H5     C  10           H5         C  10  -0.661   6.489 -10.046
  111    H6     C  10           H6         C  10   0.864   8.376  -9.800
  112   1H5*    U  11          H5*         U  11   4.671   9.968 -13.728
  113   2H5*    U  11          2H5*        U  11   4.661  10.824 -15.282
  114    H4*    U  11           H4*        U  11   5.391   8.676 -15.796
  115    H3*    U  11           H3*        U  11   2.499   9.032 -16.497
  116    H2*    U  11          1H2*        U  11   2.334   6.748 -17.140
  117   2HO*    U  11          2HO*        U  11   4.023   5.656 -17.896
  118    H1*    U  11           H1*        U  11   4.154   5.730 -15.183
  119    H3     U  11           H3         U  11   0.258   3.608 -14.346
  120    H5     U  11           H5         U  11  -0.228   7.468 -12.718
  121    H6     U  11           H6         U  11   1.841   8.082 -13.778
  122   1H5*    U  12          H5*         U  12   3.654   9.319 -21.686
  123   2H5*    U  12          2H5*        U  12   2.189   8.326 -21.814
  124    H4*    U  12           H4*        U  12   3.727   7.162 -23.073
  125    H3*    U  12           H3*        U  12   2.776   5.757 -21.017
  126    H2*    U  12          1H2*        U  12   4.498   6.366 -19.418
  127   2HO*    U  12          2HO*        U  12   4.862   3.944 -20.697
  128    H1*    U  12           H1*        U  12   6.584   5.886 -21.617
  129    H3     U  12           H3         U  12   9.766   6.791 -18.589
  130    H5     U  12           H5         U  12   7.120  10.030 -18.219
  131    H6     U  12           H6         U  12   5.668   8.923 -19.785
  132   1H5*    C  13          H5*         C  13   3.781   2.164 -20.183
  133   2H5*    C  13          2H5*        C  13   2.988   1.314 -21.524
  134    H4*    C  13           H4*        C  13   2.276   0.518 -19.317
  135    H3*    C  13           H3*        C  13   0.615   0.690 -21.397
  136    H2*    C  13          1H2*        C  13  -0.111   2.983 -20.997
  137   2HO*    C  13          2HO*        C  13  -1.778   1.040 -19.839
  138    H1*    C  13           H1*        C  13  -0.389   2.250 -18.027
  139   1H4     C  13          1H4         C  13   0.139   8.828 -18.403
  140   2H4     C  13          2H4         C  13  -1.327   8.473 -17.517
  141    H5     C  13           H5         C  13   1.521   7.091 -19.384
  142    H6     C  13           H6         C  13   1.769   4.685 -19.697
  143   1H5*    G  14          H5*         G  14  -0.325  -2.799 -17.226
  144   2H5*    G  14          2H5*        G  14   0.519  -1.395 -17.901
  145    H4*    G  14           H4*        G  14   1.206  -4.189 -18.745
  146    H3*    G  14           H3*        G  14   2.077  -2.846 -16.206
  147    H2*    G  14          1H2*        G  14   4.318  -3.639 -16.568
  148   2HO*    G  14          2HO*        G  14   3.035  -5.570 -17.860
  149    H1*    G  14           H1*        G  14   4.398  -3.011 -19.284
  150    H8     G  14           H8         G  14   6.383  -1.587 -18.397
  151    H1     G  14           H1         G  14   2.255   2.473 -15.638
  152   1H2     G  14          1H2         G  14  -0.123   0.059 -16.382
  153   2H2     G  14          2H2         G  14   0.212   1.626 -15.680
  154   1H5*    G  15          H5*         G  15   4.018  -5.176 -15.286
  155   2H5*    G  15          2H5*        G  15   4.047  -5.551 -13.553
  156    H4*    G  15           H4*        G  15   5.937  -4.160 -14.294
  157    H3*    G  15           H3*        G  15   4.096  -3.118 -12.174
  158    H2*    G  15          1H2*        G  15   5.427  -1.109 -12.046
  159   2HO*    G  15          2HO*        G  15   7.272  -2.765 -13.223
  160    H1*    G  15           H1*        G  15   5.506  -0.685 -14.777
  161    H8     G  15           H8         G  15   2.250  -2.291 -14.363
  162    H1     G  15           H1         G  15   2.238   3.720 -12.175
  163   1H2     G  15          1H2         G  15   5.662   3.508 -12.441
  164   2H2     G  15          2H2         G  15   4.276   4.483 -12.013
  165   1H5*    C  16          H5*         C  16   8.175  -2.386 -10.610
  166   2H5*    C  16          2H5*        C  16   8.065  -2.827  -8.895
  167    H4*    C  16           H4*        C  16   8.962  -0.554  -9.323
  168    H3*    C  16           H3*        C  16   6.518  -0.872  -7.598
  169    H2*    C  16          1H2*        C  16   6.503   1.518  -7.280
  170   2HO*    C  16          2HO*        C  16   9.134   1.200  -7.851
  171    H1*    C  16           H1*        C  16   7.009   2.137  -9.967
  172   1H4     C  16          1H4         C  16   0.600   0.593  -9.712
  173   2H4     C  16          2H4         C  16   0.694   2.272  -9.230
  174    H5     C  16           H5         C  16   2.578  -0.769 -10.075
  175    H6     C  16           H6         C  16   5.017  -0.788 -10.037
  176   1H5*    C  17          H5*         C  17   8.566   2.308  -6.072
  177   2H5*    C  17          2H5*        C  17   9.402   1.576  -4.689
  178    H4*    C  17           H4*        C  17   8.800   3.632  -3.871
  179    H3*    C  17           H3*        C  17   6.685   1.668  -3.028
  180    H2*    C  17          1H2*        C  17   5.552   3.499  -1.901
  181   2HO*    C  17          2HO*        C  17   7.873   4.977  -2.680
  182    H1*    C  17           H1*        C  17   5.648   5.177  -4.088
  183   1H4     C  17          1H4         C  17   1.347   0.455  -5.795
  184   2H4     C  17          2H4         C  17   0.402   1.742  -5.079
  185    H5     C  17           H5         C  17   3.768   0.495  -5.860
  186    H6     C  17           H6         C  17   5.757   1.760  -5.240
  187   1H5*    U  18          H5*         U  18   7.777   4.365  -0.377
  188   2H5*    U  18          2H5*        U  18   7.932   3.931   1.335
  189    H4*    U  18           H4*        U  18   6.516   5.920   0.852
  190    H3*    U  18           H3*        U  18   6.159   4.150   2.867
  191    H2*    U  18          1H2*        U  18   4.391   2.815   2.022
  192   2HO*    U  18          2HO*        U  18   3.393   5.215   3.035
  193    H1*    U  18           H1*        U  18   3.143   5.084   0.443
  194    H3     U  18           H3         U  18   0.683   2.160  -1.835
  195    H5     U  18           H5         U  18   4.347   0.156  -1.417
  196    H6     U  18           H6         U  18   5.147   2.037  -0.165
  197   1H5*    U  19          H5*         U  19   4.118   5.967   6.572
  198   2H5*    U  19          2H5*        U  19   3.554   5.575   4.935
  199    H4*    U  19           H4*        U  19   2.958   8.090   6.490
  200    H3*    U  19           H3*        U  19   1.285   5.646   5.980
  201    H2*    U  19          1H2*        U  19  -0.640   7.057   5.687
  202   2HO*    U  19          2HO*        U  19  -0.725   9.057   6.509
  203    H1*    U  19           H1*        U  19   0.682   9.025   4.178
  204    H3     U  19           H3         U  19  -1.886   7.211   0.995
  205    H5     U  19           H5         U  19   0.926   4.207   1.801
  206    H6     U  19           H6         U  19   1.760   5.567   3.600
  207   1H5*    G  20          H5*         G  20  -0.813   8.180   8.000
  208   2H5*    G  20          2H5*        G  20  -1.411   7.582   9.559
  209    H4*    G  20           H4*        G  20  -3.187   8.658   8.354
  210    H3*    G  20           H3*        G  20  -3.438   5.726   8.835
  211    H2*    G  20          1H2*        G  20  -5.471   5.625   7.552
  212   2HO*    G  20          2HO*        G  20  -5.807   8.040   8.382
  213    H1*    G  20           H1*        G  20  -4.555   7.091   5.399
  214    H8     G  20           H8         G  20  -1.476   5.450   6.549
  215    H1     G  20           H1         G  20  -5.390   1.412   3.474
  216   1H2     G  20          1H2         G  20  -7.761   3.904   3.864
  217   2H2     G  20          2H2         G  20  -7.398   2.302   3.265
  218   1H5*    U  21          H5*         U  21  -6.822   6.395  10.183
  219   2H5*    U  21          2H5*        U  21  -7.312   5.509  11.639
  220    H4*    U  21           H4*        U  21  -8.430   4.588   9.737
  221    H3*    U  21           H3*        U  21  -6.353   2.798  10.967
  222    H2*    U  21          1H2*        U  21  -6.875   1.123   9.322
  223   2HO*    U  21          2HO*        U  21  -9.245   2.423   9.321
  224    H1*    U  21           H1*        U  21  -6.995   2.897   7.157
  225    H3     U  21           H3         U  21  -3.200   0.439   6.604
  226    H5     U  21           H5         U  21  -2.157   3.483   9.287
  227    H6     U  21           H6         U  21  -4.486   4.075   9.412
  228   1H5*    U  22          H5*         U  22  -9.968   0.586  10.110
  229   2H5*    U  22          2H5*        U  22 -10.531   0.048  11.705
  230    H4*    U  22           H4*        U  22 -10.901  -1.806  10.414
  231    H3*    U  22           H3*        U  22  -8.254  -2.119  11.785
  232    H2*    U  22          1H2*        U  22  -7.912  -4.211  10.645
  233   2HO*    U  22          2HO*        U  22 -10.547  -4.270  10.682
  234    H1*    U  22           H1*        U  22  -8.732  -3.305   8.140
  235    H3     U  22           H3         U  22  -4.260  -3.499   7.648
  236    H5     U  22           H5         U  22  -4.895  -0.024   9.918
  237    H6     U  22           H6         U  22  -7.204  -0.673  10.116
  238   1H5*    U  23          H5*         U  23  -9.761  -5.691  11.910
  239   2H5*    U  23          2H5*        U  23 -10.059  -6.261  13.564
  240    H4*    U  23           H4*        U  23  -8.950  -8.034  12.622
  241    H3*    U  23           H3*        U  23  -6.954  -6.355  14.106
  242    H2*    U  23          1H2*        U  23  -5.193  -7.821  13.375
  243   2HO*    U  23          2HO*        U  23  -5.635  -9.863  13.008
  244    H1*    U  23           H1*        U  23  -6.079  -8.036  10.731
  245    H3     U  23           H3         U  23  -2.497  -5.407  10.177
  246    H5     U  23           H5         U  23  -5.274  -2.897  12.083
  247    H6     U  23           H6         U  23  -6.712  -4.811  12.333
  248   1H5*    C  24          H5*         C  24  -6.631 -10.543  14.685
  249   2H5*    C  24          2H5*        C  24  -6.294 -10.997  16.368
  250    H4*    C  24           H4*        C  24  -4.828 -12.130  14.767
  251    H3*    C  24           H3*        C  24  -3.623 -10.365  16.863
  252    H2*    C  24          1H2*        C  24  -1.430 -10.741  15.960
  253   2HO*    C  24          2HO*        C  24  -1.158 -12.731  15.242
  254    H1*    C  24           H1*        C  24  -2.135 -10.440  13.284
  255   1H4     C  24          1H4         C  24  -2.050  -4.271  15.600
  256   2H4     C  24          2H4         C  24  -0.426  -4.588  15.022
  257    H5     C  24           H5         C  24  -3.763  -5.980  15.687
  258    H6     C  24           H6         C  24  -4.268  -8.322  15.232
  259   1H5*    C  25          H5*         C  25  -1.639 -14.252  16.736
  260   2H5*    C  25          2H5*        C  25  -1.138 -14.767  18.359
  261    H4*    C  25           H4*        C  25   0.726 -14.867  16.841
  262    H3*    C  25           H3*        C  25   0.904 -12.834  19.035
  263    H2*    C  25          1H2*        C  25   3.022 -12.083  18.185
  264   2HO*    C  25          2HO*        C  25   3.370 -14.513  17.509
  265    H1*    C  25           H1*        C  25   2.271 -12.052  15.498
  266   1H4     C  25          1H4         C  25  -0.486  -6.680  18.177
  267   2H4     C  25          2H4         C  25   0.905  -6.135  17.266
  268    H5     C  25           H5         C  25  -1.040  -9.019  18.454
  269    H6     C  25           H6         C  25  -0.384 -11.302  17.901
  270    H3T    C  25           H3T        C  25   1.093 -15.002  19.497
  Start of MODEL   18
    1   1H5*    G   1          H5*         G   1   6.627  -0.225  16.990
    2   2H5*    G   1          2H5*        G   1   8.105   0.415  17.731
    3    H4*    G   1           H4*        G   1   9.438  -1.088  16.304
    4    H3*    G   1           H3*        G   1   6.776  -1.970  15.249
    5    H2*    G   1          1H2*        G   1   7.530  -4.258  15.260
    6   2HO*    G   1          2HO*        G   1   9.856  -3.255  14.851
    7    H1*    G   1           H1*        G   1   8.520  -4.214  17.823
    8    H8     G   1           H8         G   1   5.843  -1.809  18.228
    9    H1     G   1           H1         G   1   3.526  -7.710  17.298
   10   1H2     G   1          1H2         G   1   6.744  -8.471  16.284
   11   2H2     G   1          2H2         G   1   5.107  -9.038  16.536
   12    H5T    G   1           H5T        G   1   7.929   1.766  16.099
   13   1H5*    G   2          H5*         G   2   9.584  -4.049  12.939
   14   2H5*    G   2          2H5*        G   2   9.289  -3.657  11.233
   15    H4*    G   2           H4*        G   2   9.540  -6.020  11.468
   16    H3*    G   2           H3*        G   2   6.781  -5.092  10.750
   17    H2*    G   2          1H2*        G   2   6.020  -7.385  10.774
   18   2HO*    G   2          2HO*        G   2   7.401  -8.999  10.540
   19    H1*    G   2           H1*        G   2   7.111  -7.991  13.224
   20    H8     G   2           H8         G   2   6.492  -4.478  13.843
   21    H1     G   2           H1         G   2   0.997  -7.733  13.410
   22   1H2     G   2          1H2         G   2   2.938 -10.240  12.008
   23   2H2     G   2          2H2         G   2   1.342  -9.707  12.485
   24   1H5*    A   3          H5*         A   3   7.473  -8.136   7.881
   25   2H5*    A   3          2H5*        A   3   7.633  -7.286   6.331
   26    H4*    A   3           H4*        A   3   6.295  -9.066   5.782
   27    H3*    A   3           H3*        A   3   4.568  -6.675   6.289
   28    H2*    A   3          1H2*        A   3   2.587  -8.034   5.957
   29   2HO*    A   3          2HO*        A   3   4.115  -9.474   4.460
   30    H1*    A   3           H1*        A   3   3.328  -9.962   7.746
   31    H8     A   3           H8         A   3   5.200  -7.140   9.157
   32   1H6     A   3          1H6         A   3   1.667  -4.850  11.569
   33   2H6     A   3          2H6         A   3  -0.082  -4.967  11.537
   34    H2     A   3           H2         A   3  -1.106  -8.185   8.599
   35   1H5*    A   4          H5*         A   4   3.154  -8.462   2.810
   36   2H5*    A   4          2H5*        A   4   2.550  -7.306   1.607
   37    H4*    A   4           H4*        A   4   0.880  -8.977   2.359
   38    H3*    A   4           H3*        A   4   0.329  -6.044   2.579
   39    H2*    A   4          1H2*        A   4  -1.767  -6.486   3.672
   40   2HO*    A   4          2HO*        A   4  -2.573  -8.624   3.813
   41    H1*    A   4           H1*        A   4  -0.815  -8.439   5.404
   42    H8     A   4           H8         A   4   2.090  -6.275   5.443
   43   1H6     A   4          1H6         A   4   0.579  -2.795   8.454
   44   2H6     A   4          2H6         A   4  -0.994  -2.320   9.059
   45    H2     A   4           H2         A   4  -3.959  -5.190   7.293
   46   1H5*    G   5          H5*         G   5  -3.171  -7.756   2.217
   47   2H5*    G   5          2H5*        G   5  -3.572  -7.654   0.492
   48    H4*    G   5           H4*        G   5  -5.614  -7.366   1.494
   49    H3*    G   5           H3*        G   5  -4.473  -4.665   0.857
   50    H2*    G   5          1H2*        G   5  -6.413  -3.636   1.854
   51   2HO*    G   5          2HO*        G   5  -7.545  -5.941   1.167
   52    H1*    G   5           H1*        G   5  -6.422  -5.236   4.130
   53    H8     G   5           H8         G   5  -2.830  -4.825   3.373
   54    H1     G   5           H1         G   5  -5.423   0.387   6.060
   55   1H2     G   5          1H2         G   5  -8.434  -1.139   5.341
   56   2H2     G   5          2H2         G   5  -7.617   0.250   6.027
   57   1H5*    C   6          H5*         C   6  -8.221  -4.742  -0.482
   58   2H5*    C   6          2H5*        C   6  -8.544  -4.160  -2.127
   59    H4*    C   6           H4*        C   6  -9.984  -2.951  -0.747
   60    H3*    C   6           H3*        C   6  -7.626  -1.312  -1.603
   61    H2*    C   6          1H2*        C   6  -8.427   0.537  -0.285
   62   2HO*    C   6          2HO*        C   6 -10.787  -0.760  -0.653
   63    H1*    C   6           H1*        C   6  -9.065  -0.969   1.970
   64   1H4     C   6          1H4         C   6  -2.494  -0.490   2.085
   65   2H4     C   6          2H4         C   6  -3.091   0.709   3.207
   66    H5     C   6           H5         C   6  -3.931  -1.815   0.668
   67    H6     C   6           H6         C   6  -6.247  -2.290   0.070
   68   1H5*    A   7          H5*         A   7 -10.691   0.855  -1.696
   69   2H5*    A   7          2H5*        A   7 -11.190   1.676  -3.188
   70    H4*    A   7           H4*        A   7 -11.235   3.328  -1.549
   71    H3*    A   7           H3*        A   7  -8.768   3.551  -3.240
   72    H2*    A   7          1H2*        A   7  -8.043   5.428  -1.911
   73   2HO*    A   7          2HO*        A   7  -9.915   6.539  -1.505
   74    H1*    A   7           H1*        A   7  -8.599   4.251   0.542
   75    H8     A   7           H8         A   7  -7.408   1.648  -1.940
   76   1H6     A   7          1H6         A   7  -2.661   1.915  -0.975
   77   2H6     A   7          2H6         A   7  -1.689   2.993   0.005
   78    H2     A   7           H2         A   7  -4.501   6.027   1.746
   79   1H5*    G   8          H5*         G   8  -6.923   5.531  -5.294
   80   2H5*    G   8          2H5*        G   8  -7.449   4.836  -3.750
   81    H4*    G   8           H4*        G   8  -7.351   7.577  -3.301
   82    H3*    G   8           H3*        G   8  -5.316   6.910  -5.321
   83    H2*    G   8          1H2*        G   8  -3.445   7.574  -4.012
   84   2HO*    G   8          2HO*        G   8  -5.096   9.369  -3.113
   85    H1*    G   8           H1*        G   8  -4.181   6.528  -1.586
   86    H8     G   8           H8         G   8  -5.694   3.998  -3.641
   87    H1     G   8           H1         G   8   0.696   3.674  -3.978
   88   1H2     G   8          1H2         G   8   0.629   6.809  -2.525
   89   2H2     G   8          2H2         G   8   1.599   5.504  -3.174
   90   1H5*    G   9          H5*         G   9  -3.607  10.003  -4.644
   91   2H5*    G   9          2H5*        G   9  -3.608  11.164  -5.986
   92    H4*    G   9           H4*        G   9  -1.366  10.827  -5.611
   93    H3*    G   9           H3*        G   9  -2.134   8.895  -7.802
   94    H2*    G   9          1H2*        G   9   0.227   8.349  -7.919
   95   2HO*    G   9          2HO*        G   9   0.466  10.797  -6.865
   96    H1*    G   9           H1*        G   9   0.458   8.069  -5.144
   97    H8     G   9           H8         G   9  -2.926   6.805  -6.036
   98    H1     G   9           H1         G   9   1.787   2.741  -7.583
   99   1H2     G   9          1H2         G   9   3.884   5.379  -6.831
  100   2H2     G   9          2H2         G   9   3.738   3.718  -7.359
  101   1H5*    C  10          H5*         C  10   1.279  10.821  -8.458
  102   2H5*    C  10          2H5*        C  10   1.208  11.854  -9.899
  103    H4*    C  10           H4*        C  10   3.354  10.980  -9.916
  104    H3*    C  10           H3*        C  10   1.611   9.505 -11.855
  105    H2*    C  10          1H2*        C  10   3.432   8.032 -12.378
  106   2HO*    C  10          2HO*        C  10   4.869  10.140 -11.928
  107    H1*    C  10           H1*        C  10   4.348   7.726  -9.740
  108   1H4     C  10          1H4         C  10  -0.806   3.643 -10.353
  109   2H4     C  10          2H4         C  10   0.619   2.693 -10.675
  110    H5     C  10           H5         C  10  -0.722   6.051  -9.996
  111    H6     C  10           H6         C  10   0.746   7.997  -9.902
  112   1H5*    U  11          H5*         U  11   4.365  10.134 -13.991
  113   2H5*    U  11          2H5*        U  11   4.331  10.969 -15.557
  114    H4*    U  11           H4*        U  11   5.028   8.808 -16.061
  115    H3*    U  11           H3*        U  11   2.122   9.172 -16.693
  116    H2*    U  11          1H2*        U  11   1.871   6.880 -17.175
  117   2HO*    U  11          2HO*        U  11   3.781   5.602 -17.644
  118    H1*    U  11           H1*        U  11   4.081   5.970 -15.494
  119    H3     U  11           H3         U  11   0.701   3.177 -14.367
  120    H5     U  11           H5         U  11  -0.270   6.859 -12.575
  121    H6     U  11           H6         U  11   1.546   7.848 -13.800
  122   1H5*    U  12          H5*         U  12   1.043   7.592 -20.527
  123   2H5*    U  12          2H5*        U  12   2.114   6.756 -19.386
  124    H4*    U  12           H4*        U  12   1.751   6.371 -22.230
  125    H3*    U  12           H3*        U  12   1.845   4.633 -20.235
  126    H2*    U  12          1H2*        U  12   4.086   5.070 -19.463
  127   2HO*    U  12          2HO*        U  12   3.953   3.014 -21.355
  128    H1*    U  12           H1*        U  12   5.103   5.152 -22.343
  129    H3     U  12           H3         U  12   9.121   6.092 -20.588
  130    H5     U  12           H5         U  12   6.609   9.000 -18.903
  131    H6     U  12           H6         U  12   4.745   7.871 -19.923
  132   1H5*    C  13          H5*         C  13   2.885   1.337 -20.020
  133   2H5*    C  13          2H5*        C  13   1.628   0.437 -20.891
  134    H4*    C  13           H4*        C  13   1.933  -0.147 -18.472
  135    H3*    C  13           H3*        C  13  -0.361  -0.352 -19.839
  136    H2*    C  13          1H2*        C  13  -1.174   1.891 -19.368
  137   2HO*    C  13          2HO*        C  13  -2.013   0.092 -17.331
  138    H1*    C  13           H1*        C  13  -0.259   1.459 -16.467
  139   1H4     C  13          1H4         C  13  -0.708   7.987 -17.331
  140   2H4     C  13          2H4         C  13  -1.689   7.587 -15.937
  141    H5     C  13           H5         C  13   0.378   6.306 -18.686
  142    H6     C  13           H6         C  13   0.774   3.918 -18.960
  143   1H5*    G  14          H5*         G  14   1.832  -2.012 -19.408
  144   2H5*    G  14          2H5*        G  14   1.449  -3.526 -20.249
  145    H4*    G  14           H4*        G  14   3.053  -4.698 -19.199
  146    H3*    G  14           H3*        G  14   2.544  -3.061 -16.728
  147    H2*    G  14          1H2*        G  14   4.782  -3.529 -15.995
  148   2HO*    G  14          2HO*        G  14   4.378  -5.763 -17.305
  149    H1*    G  14           H1*        G  14   5.976  -3.218 -18.527
  150    H8     G  14           H8         G  14   7.341  -1.188 -18.035
  151    H1     G  14           H1         G  14   2.411   1.801 -15.223
  152   1H2     G  14          1H2         G  14   0.658  -1.100 -15.952
  153   2H2     G  14          2H2         G  14   0.627   0.495 -15.235
  154   1H5*    G  15          H5*         G  15   4.164  -5.812 -14.800
  155   2H5*    G  15          2H5*        G  15   3.635  -5.769 -13.107
  156    H4*    G  15           H4*        G  15   5.885  -4.667 -13.862
  157    H3*    G  15           H3*        G  15   3.987  -3.669 -11.775
  158    H2*    G  15          1H2*        G  15   5.327  -1.682 -11.500
  159   2HO*    G  15          2HO*        G  15   7.327  -3.048 -11.983
  160    H1*    G  15           H1*        G  15   5.537  -1.119 -14.191
  161    H8     G  15           H8         G  15   2.256  -2.822 -13.852
  162    H1     G  15           H1         G  15   2.126   3.287 -11.955
  163   1H2     G  15          1H2         G  15   5.555   3.111 -12.173
  164   2H2     G  15          2H2         G  15   4.154   4.093 -11.816
  165   1H5*    C  16          H5*         C  16   7.986  -2.910 -10.125
  166   2H5*    C  16          2H5*        C  16   7.858  -3.427  -8.433
  167    H4*    C  16           H4*        C  16   8.694  -1.131  -8.679
  168    H3*    C  16           H3*        C  16   6.111  -1.530  -7.185
  169    H2*    C  16          1H2*        C  16   6.057   0.844  -6.777
  170   2HO*    C  16          2HO*        C  16   8.458   0.870  -6.498
  171    H1*    C  16           H1*        C  16   6.793   1.561  -9.388
  172   1H4     C  16          1H4         C  16   0.375   0.047  -9.683
  173   2H4     C  16          2H4         C  16   0.451   1.732  -9.221
  174    H5     C  16           H5         C  16   2.366  -1.341  -9.856
  175    H6     C  16           H6         C  16   4.793  -1.380  -9.615
  176   1H5*    C  17          H5*         C  17   8.897   1.161  -4.741
  177   2H5*    C  17          2H5*        C  17   8.797   0.347  -3.168
  178    H4*    C  17           H4*        C  17   8.579   2.729  -2.901
  179    H3*    C  17           H3*        C  17   6.111   1.141  -2.242
  180    H2*    C  17          1H2*        C  17   5.039   3.215  -1.611
  181   2HO*    C  17          2HO*        C  17   7.611   3.999  -1.373
  182    H1*    C  17           H1*        C  17   5.711   4.512  -3.946
  183   1H4     C  17          1H4         C  17   1.374  -0.083  -5.892
  184   2H4     C  17          2H4         C  17   0.429   1.349  -5.560
  185    H5     C  17           H5         C  17   3.744  -0.228  -5.444
  186    H6     C  17           H6         C  17   5.687   0.966  -4.585
  187   1H5*    U  18          H5*         U  18   7.664   4.470   0.294
  188   2H5*    U  18          2H5*        U  18   8.282   3.417   1.582
  189    H4*    U  18           H4*        U  18   7.793   5.009   3.016
  190    H3*    U  18           H3*        U  18   5.534   3.630   3.093
  191    H2*    U  18          1H2*        U  18   4.355   4.682   1.298
  192   2HO*    U  18          2HO*        U  18   3.901   6.305   3.610
  193    H1*    U  18           H1*        U  18   5.278   7.451   2.170
  194    H3     U  18           H3         U  18   4.438   9.446  -1.708
  195    H5     U  18           H5         U  18   4.352   5.376  -2.720
  196    H6     U  18           H6         U  18   5.029   4.871  -0.484
  197   1H5*    U  19          H5*         U  19   4.586   7.358   5.950
  198   2H5*    U  19          2H5*        U  19   3.383   6.821   7.138
  199    H4*    U  19           H4*        U  19   2.935   8.925   5.699
  200    H3*    U  19           H3*        U  19   0.925   6.818   6.401
  201    H2*    U  19          1H2*        U  19  -0.708   7.869   4.997
  202   2HO*    U  19          2HO*        U  19   0.682  10.041   5.683
  203    H1*    U  19           H1*        U  19   1.044   8.545   2.900
  204    H3     U  19           H3         U  19  -1.596   5.400   1.035
  205    H5     U  19           H5         U  19   1.005   3.229   3.509
  206    H6     U  19           H6         U  19   1.816   5.325   4.372
  207   1H5*    G  20          H5*         G  20  -1.787   9.734   6.522
  208   2H5*    G  20          2H5*        G  20  -1.944  10.064   8.258
  209    H4*    G  20           H4*        G  20  -4.128   9.910   7.709
  210    H3*    G  20           H3*        G  20  -3.272   7.169   8.524
  211    H2*    G  20          1H2*        G  20  -5.379   6.238   7.828
  212   2HO*    G  20          2HO*        G  20  -6.293   8.586   8.462
  213    H1*    G  20           H1*        G  20  -5.505   7.523   5.386
  214    H8     G  20           H8         G  20  -1.897   6.869   6.310
  215    H1     G  20           H1         G  20  -4.843   1.981   3.382
  216   1H2     G  20          1H2         G  20  -7.718   3.828   3.870
  217   2H2     G  20          2H2         G  20  -6.992   2.363   3.243
  218   1H5*    U  21          H5*         U  21  -6.677   7.318  10.590
  219   2H5*    U  21          2H5*        U  21  -6.602   6.511  12.168
  220    H4*    U  21           H4*        U  21  -8.049   5.302  10.664
  221    H3*    U  21           H3*        U  21  -5.536   3.903  11.515
  222    H2*    U  21          1H2*        U  21  -6.124   2.017  10.147
  223   2HO*    U  21          2HO*        U  21  -8.276   1.744  10.368
  224    H1*    U  21           H1*        U  21  -6.931   3.502   7.926
  225    H3     U  21           H3         U  21  -2.967   1.692   6.700
  226    H5     U  21           H5         U  21  -1.932   4.954   9.123
  227    H6     U  21           H6         U  21  -4.265   5.204   9.654
  228   1H5*    U  22          H5*         U  22  -9.246   1.329  11.947
  229   2H5*    U  22          2H5*        U  22  -8.959   0.277  13.347
  230    H4*    U  22           H4*        U  22  -9.685  -0.909  11.290
  231    H3*    U  22           H3*        U  22  -7.068  -1.673  12.571
  232    H2*    U  22          1H2*        U  22  -6.856  -3.400  10.895
  233   2HO*    U  22          2HO*        U  22  -9.548  -3.123  10.845
  234    H1*    U  22           H1*        U  22  -7.614  -1.746   8.765
  235    H3     U  22           H3         U  22  -3.138  -2.499   8.345
  236    H5     U  22           H5         U  22  -3.479   0.673  11.075
  237    H6     U  22           H6         U  22  -5.852   0.273  11.127
  238   1H5*    U  23          H5*         U  23  -9.096  -4.830  11.320
  239   2H5*    U  23          2H5*        U  23  -9.616  -5.871  12.660
  240    H4*    U  23           H4*        U  23  -8.979  -7.394  11.068
  241    H3*    U  23           H3*        U  23  -6.647  -6.980  12.921
  242    H2*    U  23          1H2*        U  23  -5.400  -8.581  11.604
  243   2HO*    U  23          2HO*        U  23  -7.672  -9.656  11.148
  244    H1*    U  23           H1*        U  23  -6.084  -7.449   9.159
  245    H3     U  23           H3         U  23  -1.863  -5.973   9.728
  246    H5     U  23           H5         U  23  -4.128  -3.598  12.339
  247    H6     U  23           H6         U  23  -6.026  -4.991  11.838
  248   1H5*    C  24          H5*         C  24  -6.823 -10.836  12.449
  249   2H5*    C  24          2H5*        C  24  -6.463 -11.819  13.881
  250    H4*    C  24           H4*        C  24  -4.876 -12.259  12.115
  251    H3*    C  24           H3*        C  24  -3.724 -10.903  14.548
  252    H2*    C  24          1H2*        C  24  -1.555 -11.105  13.498
  253   2HO*    C  24          2HO*        C  24  -1.283 -12.321  11.622
  254    H1*    C  24           H1*        C  24  -2.451 -10.220  10.996
  255   1H4     C  24          1H4         C  24  -1.933  -4.729  14.604
  256   2H4     C  24          2H4         C  24  -0.316  -5.060  14.013
  257    H5     C  24           H5         C  24  -3.770  -6.291  14.290
  258    H6     C  24           H6         C  24  -4.412  -8.448  13.346
  259   1H5*    C  25          H5*         C  25  -1.095 -13.703  13.448
  260   2H5*    C  25          2H5*        C  25  -1.120 -14.992  14.668
  261    H4*    C  25           H4*        C  25   1.126 -14.732  14.138
  262    H3*    C  25           H3*        C  25   0.485 -13.355  16.723
  263    H2*    C  25          1H2*        C  25   2.752 -12.575  16.877
  264   2HO*    C  25          2HO*        C  25   4.346 -13.340  15.445
  265    H1*    C  25           H1*        C  25   2.973 -11.797  14.205
  266   1H4     C  25          1H4         C  25  -0.611  -7.003  16.964
  267   2H4     C  25          2H4         C  25   1.060  -6.520  17.150
  268    H5     C  25           H5         C  25  -1.254  -9.175  16.090
  269    H6     C  25           H6         C  25  -0.425 -11.295  15.214
  270    H3T    C  25           H3T        C  25   0.622 -15.676  16.355
  Start of MODEL   19
    1   1H5*    G   1          H5*         G   1   8.892  -0.296  13.484
    2   2H5*    G   1          2H5*        G   1  10.399  -0.748  14.300
    3    H4*    G   1           H4*        G   1  10.912  -2.093  12.177
    4    H3*    G   1           H3*        G   1   8.009  -1.510  11.675
    5    H2*    G   1          1H2*        G   1   7.686  -3.792  10.992
    6   2HO*    G   1          2HO*        G   1   9.294  -4.856  10.122
    7    H1*    G   1           H1*        G   1   9.196  -4.923  13.060
    8    H8     G   1           H8         G   1   7.104  -1.876  14.014
    9    H1     G   1           H1         G   1   4.153  -7.532  14.646
   10   1H2     G   1          1H2         G   1   6.966  -8.813  13.083
   11   2H2     G   1          2H2         G   1   5.410  -9.146  13.812
   12    H5T    G   1           H5T        G   1   9.998   1.054  12.342
   13   1H5*    G   2          H5*         G   2   9.538  -3.881   8.643
   14   2H5*    G   2          2H5*        G   2   8.892  -3.422   7.056
   15    H4*    G   2           H4*        G   2   8.483  -5.756   7.490
   16    H3*    G   2           H3*        G   2   5.989  -4.056   7.448
   17    H2*    G   2          1H2*        G   2   4.740  -6.104   7.690
   18   2HO*    G   2          2HO*        G   2   5.592  -7.790   6.725
   19    H1*    G   2           H1*        G   2   6.440  -7.156   9.669
   20    H8     G   2           H8         G   2   5.910  -3.444  10.096
   21    H1     G   2           H1         G   2   1.290  -7.080  12.659
   22   1H2     G   2          1H2         G   2   2.843  -9.687  11.001
   23   2H2     G   2          2H2         G   2   1.538  -9.173  12.046
   24   1H5*    A   3          H5*         A   3   5.822  -7.187   4.975
   25   2H5*    A   3          2H5*        A   3   5.054  -7.011   3.385
   26    H4*    A   3           H4*        A   3   4.080  -8.875   4.489
   27    H3*    A   3           H3*        A   3   2.223  -6.508   4.336
   28    H2*    A   3          1H2*        A   3   0.537  -7.876   5.374
   29   2HO*    A   3          2HO*        A   3   0.602  -9.937   4.858
   30    H1*    A   3           H1*        A   3   2.263  -8.947   7.306
   31    H8     A   3           H8         A   3   3.254  -5.378   6.953
   32   1H6     A   3          1H6         A   3   0.027  -3.386   9.969
   33   2H6     A   3          2H6         A   3  -1.451  -3.960  10.715
   34    H2     A   3           H2         A   3  -1.932  -8.237   9.435
   35   1H5*    A   4          H5*         A   4   0.369  -9.931   2.847
   36   2H5*    A   4          2H5*        A   4  -0.012  -9.697   1.129
   37    H4*    A   4           H4*        A   4  -1.879 -10.778   1.901
   38    H3*    A   4           H3*        A   4  -2.371  -7.840   1.789
   39    H2*    A   4          1H2*        A   4  -4.496  -8.066   2.895
   40   2HO*    A   4          2HO*        A   4  -4.461 -10.443   1.784
   41    H1*    A   4           H1*        A   4  -3.626  -9.699   4.930
   42    H8     A   4           H8         A   4  -0.690  -7.535   3.947
   43   1H6     A   4          1H6         A   4  -1.573  -3.790   6.913
   44   2H6     A   4          2H6         A   4  -2.943  -3.338   7.899
   45    H2     A   4           H2         A   4  -6.034  -6.542   7.357
   46   1H5*    G   5          H5*         G   5  -5.689  -9.015   0.969
   47   2H5*    G   5          2H5*        G   5  -6.419  -8.562  -0.583
   48    H4*    G   5           H4*        G   5  -7.962  -7.872   1.006
   49    H3*    G   5           H3*        G   5  -6.319  -5.477   0.189
   50    H2*    G   5          1H2*        G   5  -7.748  -4.162   1.623
   51   2HO*    G   5          2HO*        G   5  -9.508  -6.023   1.012
   52    H1*    G   5           H1*        G   5  -7.725  -6.048   3.722
   53    H8     G   5           H8         G   5  -4.268  -5.967   2.421
   54    H1     G   5           H1         G   5  -5.737  -0.833   5.972
   55   1H2     G   5          1H2         G   5  -8.990  -1.922   5.653
   56   2H2     G   5          2H2         G   5  -7.894  -0.722   6.301
   57   1H5*    C   6          H5*         C   6 -10.354  -4.327   0.202
   58   2H5*    C   6          2H5*        C   6 -10.736  -3.911  -1.480
   59    H4*    C   6           H4*        C   6 -11.742  -2.212  -0.315
   60    H3*    C   6           H3*        C   6  -9.047  -1.277  -1.235
   61    H2*    C   6          1H2*        C   6  -9.396   0.826  -0.103
   62   2HO*    C   6          2HO*        C   6 -11.360   1.496   0.430
   63    H1*    C   6           H1*        C   6 -10.229  -0.295   2.280
   64   1H4     C   6          1H4         C   6  -3.788  -1.692   1.939
   65   2H4     C   6          2H4         C   6  -3.924  -0.296   2.982
   66    H5     C   6           H5         C   6  -5.656  -2.671   0.785
   67    H6     C   6           H6         C   6  -8.054  -2.516   0.383
   68   1H5*    A   7          H5*         A   7 -11.387   1.737  -1.634
   69   2H5*    A   7          2H5*        A   7 -11.131   2.801  -3.030
   70    H4*    A   7           H4*        A   7 -10.789   3.974  -0.930
   71    H3*    A   7           H3*        A   7  -8.343   3.674  -2.670
   72    H2*    A   7          1H2*        A   7  -7.166   5.025  -1.056
   73   2HO*    A   7          2HO*        A   7  -9.455   6.157  -0.708
   74    H1*    A   7           H1*        A   7  -8.264   3.713   1.174
   75    H8     A   7           H8         A   7  -7.555   0.837  -0.910
   76   1H6     A   7          1H6         A   7  -2.723   0.513  -0.376
   77   2H6     A   7          2H6         A   7  -1.517   1.620   0.248
   78    H2     A   7           H2         A   7  -3.663   5.346   1.488
   79   1H5*    G   8          H5*         G   8  -6.529   5.776  -2.660
   80   2H5*    G   8          2H5*        G   8  -7.632   6.795  -1.714
   81    H4*    G   8           H4*        G   8  -6.548   8.790  -2.552
   82    H3*    G   8           H3*        G   8  -4.939   6.934  -4.262
   83    H2*    G   8          1H2*        G   8  -2.963   8.245  -3.849
   84   2HO*    G   8          2HO*        G   8  -3.050  10.264  -3.039
   85    H1*    G   8           H1*        G   8  -3.270   8.382  -1.123
   86    H8     G   8           H8         G   8  -4.813   5.143  -1.885
   87    H1     G   8           H1         G   8   1.567   5.004  -2.510
   88   1H2     G   8          1H2         G   8   1.345   8.443  -2.307
   89   2H2     G   8          2H2         G   8   2.377   7.041  -2.483
   90   1H5*    G   9          H5*         G   9  -3.522  10.621  -4.724
   91   2H5*    G   9          2H5*        G   9  -3.930  11.199  -6.351
   92    H4*    G   9           H4*        G   9  -1.754  11.939  -5.963
   93    H3*    G   9           H3*        G   9  -1.790   9.533  -7.756
   94    H2*    G   9          1H2*        G   9   0.626   9.616  -7.866
   95   2HO*    G   9          2HO*        G   9   0.203  12.177  -7.266
   96    H1*    G   9           H1*        G   9   0.982   9.802  -5.138
   97    H8     G   9           H8         G   9  -2.192   7.895  -5.582
   98    H1     G   9           H1         G   9   3.054   4.349  -6.567
   99   1H2     G   9          1H2         G   9   4.739   7.361  -6.495
  100   2H2     G   9          2H2         G   9   4.838   5.625  -6.677
  101   1H5*    C  10          H5*         C  10   1.109  11.870  -8.933
  102   2H5*    C  10          2H5*        C  10   0.749  12.588 -10.515
  103    H4*    C  10           H4*        C  10   2.990  12.026 -10.643
  104    H3*    C  10           H3*        C  10   1.348   9.916 -12.012
  105    H2*    C  10          1H2*        C  10   3.386   8.741 -12.537
  106   2HO*    C  10          2HO*        C  10   5.232   9.795 -12.671
  107    H1*    C  10           H1*        C  10   4.487   8.999  -9.984
  108   1H4     C  10          1H4         C  10  -0.179   4.313  -9.645
  109   2H4     C  10          2H4         C  10   1.348   3.499  -9.828
  110    H5     C  10           H5         C  10  -0.371   6.744  -9.676
  111    H6     C  10           H6         C  10   0.857   8.830  -9.963
  112   1H5*    U  11          H5*         U  11   3.897  10.179 -14.420
  113   2H5*    U  11          2H5*        U  11   3.552  10.700 -16.080
  114    H4*    U  11           H4*        U  11   4.621   8.666 -16.354
  115    H3*    U  11           H3*        U  11   1.649   8.253 -16.538
  116    H2*    U  11          1H2*        U  11   2.024   5.914 -16.869
  117   2HO*    U  11          2HO*        U  11   4.187   5.141 -17.176
  118    H1*    U  11           H1*        U  11   4.142   5.707 -14.998
  119    H3     U  11           H3         U  11   0.735   3.171 -13.391
  120    H5     U  11           H5         U  11  -0.192   7.128 -12.284
  121    H6     U  11           H6         U  11   1.630   7.857 -13.673
  122   1H5*    U  12          H5*         U  12   1.581   7.590 -21.788
  123   2H5*    U  12          2H5*        U  12   0.461   6.320 -21.255
  124    H4*    U  12           H4*        U  12   1.903   5.234 -22.705
  125    H3*    U  12           H3*        U  12   1.837   4.209 -20.247
  126    H2*    U  12          1H2*        U  12   3.676   5.475 -19.315
  127   2HO*    U  12          2HO*        U  12   4.340   2.958 -20.246
  128    H1*    U  12           H1*        U  12   5.270   4.959 -21.882
  129    H3     U  12           H3         U  12   8.651   7.229 -20.004
  130    H5     U  12           H5         U  12   5.373   9.814 -19.561
  131    H6     U  12           H6         U  12   3.980   8.075 -20.465
  132   1H5*    C  13          H5*         C  13   4.056   1.056 -19.306
  133   2H5*    C  13          2H5*        C  13   3.108  -0.182 -20.153
  134    H4*    C  13           H4*        C  13   3.417  -0.586 -17.722
  135    H3*    C  13           H3*        C  13   1.268  -1.337 -19.092
  136    H2*    C  13          1H2*        C  13   0.004   0.720 -18.867
  137   2HO*    C  13          2HO*        C  13  -1.373   0.319 -16.882
  138    H1*    C  13           H1*        C  13   0.772   0.811 -15.903
  139   1H4     C  13          1H4         C  13  -0.600   6.994 -17.771
  140   2H4     C  13          2H4         C  13  -1.638   6.620 -16.415
  141    H5     C  13           H5         C  13   0.889   5.354 -18.759
  142    H6     C  13           H6         C  13   1.677   3.051 -18.641
  143   1H5*    G  14          H5*         G  14   3.380  -2.595 -18.318
  144   2H5*    G  14          2H5*        G  14   3.535  -4.178 -19.103
  145    H4*    G  14           H4*        G  14   5.077  -4.935 -17.628
  146    H3*    G  14           H3*        G  14   3.802  -3.229 -15.505
  147    H2*    G  14          1H2*        G  14   5.907  -3.117 -14.366
  148   2HO*    G  14          2HO*        G  14   6.185  -5.523 -15.441
  149    H1*    G  14           H1*        G  14   7.491  -2.913 -16.711
  150    H8     G  14           H8         G  14   8.419  -0.607 -16.505
  151    H1     G  14           H1         G  14   2.865   1.750 -14.324
  152   1H2     G  14          1H2         G  14   1.697  -1.493 -14.753
  153   2H2     G  14          2H2         G  14   1.337   0.145 -14.254
  154   1H5*    G  15          H5*         G  15   5.638  -5.372 -11.978
  155   2H5*    G  15          2H5*        G  15   4.559  -4.338 -11.022
  156    H4*    G  15           H4*        G  15   7.208  -3.828 -11.979
  157    H3*    G  15           H3*        G  15   5.357  -2.537 -10.023
  158    H2*    G  15          1H2*        G  15   6.542  -0.450 -10.204
  159   2HO*    G  15          2HO*        G  15   8.593  -1.921 -10.668
  160    H1*    G  15           H1*        G  15   6.614  -0.379 -12.950
  161    H8     G  15           H8         G  15   3.507  -2.251 -12.289
  162    H1     G  15           H1         G  15   2.884   4.021 -11.180
  163   1H2     G  15          1H2         G  15   6.315   4.102 -11.423
  164   2H2     G  15          2H2         G  15   4.834   4.998 -11.177
  165   1H5*    C  16          H5*         C  16   9.349  -1.229  -8.791
  166   2H5*    C  16          2H5*        C  16   9.348  -1.411  -7.026
  167    H4*    C  16           H4*        C  16   9.983   0.846  -7.820
  168    H3*    C  16           H3*        C  16   7.622   0.558  -5.975
  169    H2*    C  16          1H2*        C  16   7.391   2.961  -6.011
  170   2HO*    C  16          2HO*        C  16  10.023   2.789  -6.629
  171    H1*    C  16           H1*        C  16   7.774   3.205  -8.779
  172   1H4     C  16          1H4         C  16   1.534   1.189  -8.210
  173   2H4     C  16          2H4         C  16   1.485   2.923  -7.972
  174    H5     C  16           H5         C  16   3.619  -0.042  -8.378
  175    H6     C  16           H6         C  16   6.050   0.149  -8.371
  176   1H5*    C  17          H5*         C  17   9.461   4.001  -5.154
  177   2H5*    C  17          2H5*        C  17  10.404   3.689  -3.684
  178    H4*    C  17           H4*        C  17   9.660   5.845  -3.384
  179    H3*    C  17           H3*        C  17   7.852   3.979  -1.883
  180    H2*    C  17          1H2*        C  17   6.517   5.865  -1.196
  181   2HO*    C  17          2HO*        C  17   8.525   7.441  -2.487
  182    H1*    C  17           H1*        C  17   6.370   7.013  -3.718
  183   1H4     C  17          1H4         C  17   2.435   1.715  -4.063
  184   2H4     C  17          2H4         C  17   1.394   3.084  -3.755
  185    H5     C  17           H5         C  17   4.851   1.885  -4.108
  186    H6     C  17           H6         C  17   6.748   3.400  -3.879
  187   1H5*    U  18          H5*         U  18   9.066   6.264   1.695
  188   2H5*    U  18          2H5*        U  18   9.946   5.016   2.595
  189    H4*    U  18           H4*        U  18   8.278   4.676   4.071
  190    H3*    U  18           H3*        U  18   6.472   4.218   2.217
  191    H2*    U  18          1H2*        U  18   6.116   6.409   1.324
  192   2HO*    U  18          2HO*        U  18   4.579   6.667   3.715
  193    H1*    U  18           H1*        U  18   6.226   7.844   3.969
  194    H3     U  18           H3         U  18   7.853  11.660   2.380
  195    H5     U  18           H5         U  18   8.494   8.994  -0.796
  196    H6     U  18           H6         U  18   7.676   7.226   0.615
  197   1H5*    U  19          H5*         U  19   4.978   5.742   5.716
  198   2H5*    U  19          2H5*        U  19   4.049   4.791   6.890
  199    H4*    U  19           H4*        U  19   3.486   7.115   7.088
  200    H3*    U  19           H3*        U  19   1.317   5.312   6.072
  201    H2*    U  19          1H2*        U  19  -0.157   7.202   5.872
  202   2HO*    U  19          2HO*        U  19   0.266   9.124   6.860
  203    H1*    U  19           H1*        U  19   1.711   8.900   4.688
  204    H3     U  19           H3         U  19  -1.386   7.444   1.598
  205    H5     U  19           H5         U  19   1.833   4.758   1.437
  206    H6     U  19           H6         U  19   2.705   5.804   3.421
  207   1H5*    G  20          H5*         G  20  -0.680   7.851   7.916
  208   2H5*    G  20          2H5*        G  20  -1.383   7.190   9.404
  209    H4*    G  20           H4*        G  20  -3.034   8.452   8.207
  210    H3*    G  20           H3*        G  20  -3.479   5.511   8.450
  211    H2*    G  20          1H2*        G  20  -5.472   5.655   7.101
  212   2HO*    G  20          2HO*        G  20  -5.582   8.075   8.066
  213    H1*    G  20           H1*        G  20  -4.348   7.158   5.085
  214    H8     G  20           H8         G  20  -1.401   5.311   6.206
  215    H1     G  20           H1         G  20  -5.493   1.588   2.964
  216   1H2     G  20          1H2         G  20  -7.730   4.185   3.440
  217   2H2     G  20          2H2         G  20  -7.448   2.589   2.781
  218   1H5*    U  21          H5*         U  21  -6.842   6.262  10.335
  219   2H5*    U  21          2H5*        U  21  -7.094   5.263  11.780
  220    H4*    U  21           H4*        U  21  -8.532   4.565   9.954
  221    H3*    U  21           H3*        U  21  -6.472   2.602  10.910
  222    H2*    U  21          1H2*        U  21  -7.209   1.033   9.249
  223   2HO*    U  21          2HO*        U  21  -9.508   2.418   9.535
  224    H1*    U  21           H1*        U  21  -7.473   2.900   7.173
  225    H3     U  21           H3         U  21  -3.890   0.174   6.275
  226    H5     U  21           H5         U  21  -2.396   3.337   8.575
  227    H6     U  21           H6         U  21  -4.669   4.016   8.992
  228   1H5*    U  22          H5*         U  22 -10.364   0.556  10.538
  229   2H5*    U  22          2H5*        U  22 -10.692   0.053  12.208
  230    H4*    U  22           H4*        U  22 -11.326  -1.795  11.013
  231    H3*    U  22           H3*        U  22  -8.517  -2.199  11.974
  232    H2*    U  22          1H2*        U  22  -8.425  -4.311  10.819
  233   2HO*    U  22          2HO*        U  22 -11.059  -4.213  11.193
  234    H1*    U  22           H1*        U  22  -9.539  -3.382   8.448
  235    H3     U  22           H3         U  22  -5.191  -3.649   7.334
  236    H5     U  22           H5         U  22  -5.413  -0.213   9.734
  237    H6     U  22           H6         U  22  -7.695  -0.799  10.224
  238   1H5*    U  23          H5*         U  23 -10.187  -5.733  12.669
  239   2H5*    U  23          2H5*        U  23 -10.041  -6.249  14.360
  240    H4*    U  23           H4*        U  23  -9.224  -8.040  13.131
  241    H3*    U  23           H3*        U  23  -6.929  -6.419  14.201
  242    H2*    U  23          1H2*        U  23  -5.410  -7.959  13.143
  243   2HO*    U  23          2HO*        U  23  -7.310  -9.681  13.591
  244    H1*    U  23           H1*        U  23  -6.838  -8.121  10.733
  245    H3     U  23           H3         U  23  -3.265  -5.733   9.468
  246    H5     U  23           H5         U  23  -5.442  -3.054  11.861
  247    H6     U  23           H6         U  23  -6.928  -4.870  12.399
  248   1H5*    C  24          H5*         C  24  -6.416 -10.563  14.958
  249   2H5*    C  24          2H5*        C  24  -5.714 -10.871  16.558
  250    H4*    C  24           H4*        C  24  -4.546 -12.000  14.684
  251    H3*    C  24           H3*        C  24  -3.038 -10.150  16.506
  252    H2*    C  24          1H2*        C  24  -1.040 -10.552  15.232
  253   2HO*    C  24          2HO*        C  24  -2.282 -12.874  14.751
  254    H1*    C  24           H1*        C  24  -2.271 -10.416  12.714
  255   1H4     C  24          1H4         C  24  -1.502  -4.110  14.437
  256   2H4     C  24          2H4         C  24   0.029  -4.588  13.735
  257    H5     C  24           H5         C  24  -3.291  -5.695  14.867
  258    H6     C  24           H6         C  24  -3.967  -8.033  14.697
  259   1H5*    C  25          H5*         C  25  -0.836 -14.008  16.001
  260   2H5*    C  25          2H5*        C  25  -0.469 -14.513  17.662
  261    H4*    C  25           H4*        C  25   1.491 -14.822  16.385
  262    H3*    C  25           H3*        C  25   1.637 -12.510  18.279
  263    H2*    C  25          1H2*        C  25   3.818 -11.930  17.459
  264   2HO*    C  25          2HO*        C  25   4.074 -14.465  17.095
  265    H1*    C  25           H1*        C  25   3.225 -12.228  14.756
  266   1H4     C  25          1H4         C  25   0.403  -6.539  16.591
  267   2H4     C  25          2H4         C  25   1.862  -6.125  15.721
  268    H5     C  25           H5         C  25  -0.219  -8.825  17.094
  269    H6     C  25           H6         C  25   0.428 -11.164  16.861
  270    H3T    C  25           H3T        C  25   1.746 -14.560  19.076
  Start of MODEL   20
    1   1H5*    G   1          H5*         G   1   5.597   0.634  15.088
    2   2H5*    G   1          2H5*        G   1   6.557   1.261  16.440
    3    H4*    G   1           H4*        G   1   8.517   0.147  15.015
    4    H3*    G   1           H3*        G   1   6.080  -1.280  14.050
    5    H2*    G   1          1H2*        G   1   7.105  -3.419  14.437
    6   2HO*    G   1          2HO*        G   1   9.306  -2.183  13.935
    7    H1*    G   1           H1*        G   1   7.977  -2.895  16.979
    8    H8     G   1           H8         G   1   5.069  -0.733  16.962
    9    H1     G   1           H1         G   1   3.358  -6.905  16.892
   10   1H2     G   1          1H2         G   1   6.671  -7.491  16.083
   11   2H2     G   1          2H2         G   1   5.087  -8.170  16.385
   12    H5T    G   1           H5T        G   1   7.778   2.440  15.035
   13   1H5*    G   2          H5*         G   2   8.943  -3.494  12.206
   14   2H5*    G   2          2H5*        G   2   8.919  -3.008  10.499
   15    H4*    G   2           H4*        G   2   9.114  -5.306  10.409
   16    H3*    G   2           H3*        G   2   6.268  -4.498   9.952
   17    H2*    G   2          1H2*        G   2   5.614  -6.823   9.852
   18   2HO*    G   2          2HO*        G   2   8.096  -7.164   9.069
   19    H1*    G   2           H1*        G   2   6.891  -7.558  12.169
   20    H8     G   2           H8         G   2   6.195  -4.088  13.022
   21    H1     G   2           H1         G   2   0.833  -7.587  12.899
   22   1H2     G   2          1H2         G   2   2.782  -9.952  11.282
   23   2H2     G   2          2H2         G   2   1.202  -9.526  11.897
   24   1H5*    A   3          H5*         A   3   6.998  -7.420   7.356
   25   2H5*    A   3          2H5*        A   3   7.060  -6.846   5.678
   26    H4*    A   3           H4*        A   3   5.893  -8.809   5.481
   27    H3*    A   3           H3*        A   3   3.948  -6.537   5.623
   28    H2*    A   3          1H2*        A   3   2.108  -8.113   5.568
   29   2HO*    A   3          2HO*        A   3   3.882  -9.657   4.379
   30    H1*    A   3           H1*        A   3   3.047  -9.638   7.633
   31    H8     A   3           H8         A   3   4.604  -6.355   8.353
   32   1H6     A   3          1H6         A   3   0.920  -4.132  10.573
   33   2H6     A   3          2H6         A   3  -0.787  -4.489  10.740
   34    H2     A   3           H2         A   3  -1.481  -8.378   8.611
   35   1H5*    A   4          H5*         A   4   2.869  -9.037   2.674
   36   2H5*    A   4          2H5*        A   4   2.400  -8.346   1.108
   37    H4*    A   4           H4*        A   4   0.675  -9.810   1.809
   38    H3*    A   4           H3*        A   4  -0.046  -6.906   1.928
   39    H2*    A   4          1H2*        A   4  -2.216  -7.477   2.820
   40   2HO*    A   4          2HO*        A   4  -2.942  -9.322   2.003
   41    H1*    A   4           H1*        A   4  -1.268  -9.202   4.753
   42    H8     A   4           H8         A   4   1.461  -6.695   4.376
   43   1H6     A   4          1H6         A   4  -0.213  -3.266   7.382
   44   2H6     A   4          2H6         A   4  -1.757  -3.004   8.160
   45    H2     A   4           H2         A   4  -4.413  -6.405   6.937
   46   1H5*    G   5          H5*         G   5  -3.147  -8.489   0.126
   47   2H5*    G   5          2H5*        G   5  -3.682  -7.715  -1.378
   48    H4*    G   5           H4*        G   5  -5.534  -7.732   0.069
   49    H3*    G   5           H3*        G   5  -4.309  -4.981  -0.073
   50    H2*    G   5          1H2*        G   5  -6.135  -4.230   1.338
   51   2HO*    G   5          2HO*        G   5  -7.338  -6.370   0.286
   52    H1*    G   5           H1*        G   5  -5.830  -6.312   3.163
   53    H8     G   5           H8         G   5  -2.359  -5.725   2.162
   54    H1     G   5           H1         G   5  -4.634  -1.014   5.866
   55   1H2     G   5          1H2         G   5  -7.727  -2.364   5.181
   56   2H2     G   5          2H2         G   5  -6.802  -1.114   5.987
   57   1H5*    C   6          H5*         C   6  -8.174  -4.335  -0.098
   58   2H5*    C   6          2H5*        C   6  -8.659  -3.799  -1.718
   59    H4*    C   6           H4*        C   6  -9.869  -2.410  -0.346
   60    H3*    C   6           H3*        C   6  -7.389  -0.977  -1.228
   61    H2*    C   6          1H2*        C   6  -7.993   0.912   0.145
   62   2HO*    C   6          2HO*        C   6 -10.418   0.119  -0.323
   63    H1*    C   6           H1*        C   6  -8.622  -0.572   2.401
   64   1H4     C   6          1H4         C   6  -2.041  -0.851   2.062
   65   2H4     C   6          2H4         C   6  -2.397   0.602   2.969
   66    H5     C   6           H5         C   6  -3.749  -2.201   1.013
   67    H6     C   6           H6         C   6  -6.143  -2.430   0.615
   68   1H5*    A   7          H5*         A   7 -10.403   1.679  -2.314
   69   2H5*    A   7          2H5*        A   7  -9.986   2.710  -3.697
   70    H4*    A   7           H4*        A   7 -10.215   3.931  -1.561
   71    H3*    A   7           H3*        A   7  -7.572   4.048  -3.005
   72    H2*    A   7          1H2*        A   7  -6.815   5.579  -1.301
   73   2HO*    A   7          2HO*        A   7  -9.393   6.159  -1.165
   74    H1*    A   7           H1*        A   7  -7.906   4.102   0.829
   75    H8     A   7           H8         A   7  -6.576   1.383  -1.176
   76   1H6     A   7          1H6         A   7  -1.838   1.722  -0.106
   77   2H6     A   7          2H6         A   7  -0.881   2.975   0.658
   78    H2     A   7           H2         A   7  -3.648   6.333   1.674
   79   1H5*    G   8          H5*         G   8  -7.743   7.550  -1.708
   80   2H5*    G   8          2H5*        G   8  -8.216   8.638  -3.027
   81    H4*    G   8           H4*        G   8  -6.557   9.833  -2.016
   82    H3*    G   8           H3*        G   8  -5.381   8.336  -4.319
   83    H2*    G   8          1H2*        G   8  -3.165   9.058  -3.712
   84   2HO*    G   8          2HO*        G   8  -4.398  11.146  -2.800
   85    H1*    G   8           H1*        G   8  -3.382   8.497  -1.017
   86    H8     G   8           H8         G   8  -5.520   5.992  -2.784
   87    H1     G   8           H1         G   8   0.726   4.533  -2.797
   88   1H2     G   8          1H2         G   8   1.162   7.766  -1.667
   89   2H2     G   8          2H2         G   8   1.915   6.253  -2.123
   90   1H5*    G   9          H5*         G   9  -3.649  11.695  -4.770
   91   2H5*    G   9          2H5*        G   9  -3.774  12.489  -6.351
   92    H4*    G   9           H4*        G   9  -1.488  12.230  -5.967
   93    H3*    G   9           H3*        G   9  -2.414  10.051  -7.841
   94    H2*    G   9          1H2*        G   9  -0.094   9.391  -8.002
   95   2HO*    G   9          2HO*        G   9   0.269  11.977  -7.284
   96    H1*    G   9           H1*        G   9   0.363   9.608  -5.233
   97    H8     G   9           H8         G   9  -2.993   8.122  -5.453
   98    H1     G   9           H1         G   9   1.639   3.985  -7.051
   99   1H2     G   9          1H2         G   9   3.676   6.765  -7.126
  100   2H2     G   9          2H2         G   9   3.543   5.036  -7.345
  101   1H5*    C  10          H5*         C  10   1.119  11.803  -8.828
  102   2H5*    C  10          2H5*        C  10   0.954  12.646 -10.381
  103    H4*    C  10           H4*        C  10   3.080  11.767 -10.476
  104    H3*    C  10           H3*        C  10   1.215   9.942 -11.958
  105    H2*    C  10          1H2*        C  10   3.083   8.490 -12.434
  106   2HO*    C  10          2HO*        C  10   4.446  10.767 -12.144
  107    H1*    C  10           H1*        C  10   4.086   8.509  -9.837
  108   1H4     C  10          1H4         C  10  -1.301   4.655  -9.808
  109   2H4     C  10          2H4         C  10   0.083   3.601  -9.933
  110    H5     C  10           H5         C  10  -1.091   7.084  -9.813
  111    H6     C  10           H6         C  10   0.475   8.944  -9.998
  112   1H5*    U  11          H5*         U  11   4.072   9.600 -14.112
  113   2H5*    U  11          2H5*        U  11   3.866  10.180 -15.776
  114    H4*    U  11           H4*        U  11   4.657   7.997 -15.984
  115    H3*    U  11           H3*        U  11   1.702   8.143 -16.477
  116    H2*    U  11          1H2*        U  11   1.624   5.774 -16.782
  117   2HO*    U  11          2HO*        U  11   3.416   4.584 -17.200
  118    H1*    U  11           H1*        U  11   3.476   5.141 -14.735
  119    H3     U  11           H3         U  11  -0.422   3.366 -13.319
  120    H5     U  11           H5         U  11  -0.747   7.487 -12.489
  121    H6     U  11           H6         U  11   1.289   7.810 -13.729
  122   1H5*    U  12          H5*         U  12   2.029   7.603 -21.750
  123   2H5*    U  12          2H5*        U  12   0.769   6.416 -21.357
  124    H4*    U  12           H4*        U  12   2.226   5.342 -22.837
  125    H3*    U  12           H3*        U  12   1.780   4.110 -20.497
  126    H2*    U  12          1H2*        U  12   3.704   4.967 -19.309
  127   2HO*    U  12          2HO*        U  12   4.339   2.584 -20.699
  128    H1*    U  12           H1*        U  12   5.388   4.515 -21.835
  129    H3     U  12           H3         U  12   8.941   5.967 -19.517
  130    H5     U  12           H5         U  12   6.065   8.959 -18.872
  131    H6     U  12           H6         U  12   4.490   7.593 -20.068
  132   1H5*    C  13          H5*         C  13   3.040   0.896 -19.343
  133   2H5*    C  13          2H5*        C  13   2.180  -0.227 -20.412
  134    H4*    C  13           H4*        C  13   1.752  -0.680 -18.061
  135    H3*    C  13           H3*        C  13  -0.167  -0.849 -19.922
  136    H2*    C  13          1H2*        C  13  -0.967   1.442 -19.711
  137   2HO*    C  13          2HO*        C  13  -2.677   1.071 -17.811
  138    H1*    C  13           H1*        C  13  -0.779   1.083 -16.666
  139   1H4     C  13          1H4         C  13  -0.755   7.585 -17.836
  140   2H4     C  13          2H4         C  13  -2.032   7.263 -16.685
  141    H5     C  13           H5         C  13   0.564   5.810 -18.840
  142    H6     C  13           H6         C  13   0.920   3.401 -18.926
  143   1H5*    G  14          H5*         G  14  -0.296  -3.896 -15.285
  144   2H5*    G  14          2H5*        G  14   0.268  -2.466 -16.164
  145    H4*    G  14           H4*        G  14   1.175  -5.123 -17.120
  146    H3*    G  14           H3*        G  14   1.910  -4.090 -14.429
  147    H2*    G  14          1H2*        G  14   4.243  -4.257 -14.842
  148   2HO*    G  14          2HO*        G  14   4.716  -6.127 -15.763
  149    H1*    G  14           H1*        G  14   4.205  -3.624 -17.594
  150    H8     G  14           H8         G  14   6.141  -2.162 -16.512
  151    H1     G  14           H1         G  14   1.627   1.873 -14.398
  152   1H2     G  14          1H2         G  14  -0.565  -0.731 -15.072
  153   2H2     G  14          2H2         G  14  -0.357   0.902 -14.479
  154   1H5*    G  15          H5*         G  15   3.216  -5.225 -11.326
  155   2H5*    G  15          2H5*        G  15   2.468  -4.212 -12.575
  156    H4*    G  15           H4*        G  15   5.442  -4.306 -12.309
  157    H3*    G  15           H3*        G  15   3.608  -2.879 -10.420
  158    H2*    G  15          1H2*        G  15   5.109  -0.983 -10.455
  159   2HO*    G  15          2HO*        G  15   7.009  -1.147 -11.864
  160    H1*    G  15           H1*        G  15   5.190  -0.842 -13.200
  161    H8     G  15           H8         G  15   1.879  -2.333 -12.589
  162    H1     G  15           H1         G  15   2.016   3.908 -11.182
  163   1H2     G  15          1H2         G  15   5.437   3.593 -11.510
  164   2H2     G  15          2H2         G  15   4.082   4.653 -11.200
  165   1H5*    C  16          H5*         C  16   7.268  -2.172  -9.378
  166   2H5*    C  16          2H5*        C  16   7.739  -2.523  -7.703
  167    H4*    C  16           H4*        C  16   8.517  -0.349  -8.241
  168    H3*    C  16           H3*        C  16   6.170  -0.328  -6.359
  169    H2*    C  16          1H2*        C  16   6.307   2.078  -6.298
  170   2HO*    C  16          2HO*        C  16   8.069   3.165  -7.196
  171    H1*    C  16           H1*        C  16   6.669   2.381  -9.059
  172   1H4     C  16          1H4         C  16   0.218   1.237  -8.238
  173   2H4     C  16          2H4         C  16   0.415   2.972  -8.220
  174    H5     C  16           H5         C  16   2.107  -0.290  -8.297
  175    H6     C  16           H6         C  16   4.540  -0.446  -8.381
  176   1H5*    C  17          H5*         C  17   8.417   2.639  -5.362
  177   2H5*    C  17          2H5*        C  17   9.438   2.084  -4.022
  178    H4*    C  17           H4*        C  17   9.081   4.297  -3.518
  179    H3*    C  17           H3*        C  17   7.155   2.612  -1.957
  180    H2*    C  17          1H2*        C  17   6.184   4.607  -1.021
  181   2HO*    C  17          2HO*        C  17   8.589   5.594  -1.513
  182    H1*    C  17           H1*        C  17   5.922   5.923  -3.438
  183   1H4     C  17          1H4         C  17   1.408   1.123  -3.844
  184   2H4     C  17          2H4         C  17   0.566   2.501  -3.179
  185    H5     C  17           H5         C  17   3.790   1.100  -4.255
  186    H6     C  17           H6         C  17   5.852   2.392  -4.109
  187   1H5*    U  18          H5*         U  18   8.382   5.310   0.734
  188   2H5*    U  18          2H5*        U  18   9.755   4.544   1.555
  189    H4*    U  18           H4*        U  18   8.845   4.735   3.601
  190    H3*    U  18           H3*        U  18   6.641   3.470   2.847
  191    H2*    U  18          1H2*        U  18   5.574   5.217   1.602
  192   2HO*    U  18          2HO*        U  18   4.850   6.014   4.244
  193    H1*    U  18           H1*        U  18   6.320   7.322   3.669
  194    H3     U  18           H3         U  18   5.621  10.770   0.964
  195    H5     U  18           H5         U  18   6.091   7.577  -1.723
  196    H6     U  18           H6         U  18   6.532   6.155   0.154
  197   1H5*    U  19          H5*         U  19   2.655   4.491   6.344
  198   2H5*    U  19          2H5*        U  19   3.211   4.979   4.731
  199    H4*    U  19           H4*        U  19   3.862   6.814   6.948
  200    H3*    U  19           H3*        U  19   1.007   6.228   6.295
  201    H2*    U  19          1H2*        U  19   0.507   8.570   6.112
  202   2HO*    U  19          2HO*        U  19   2.512   8.750   7.850
  203    H1*    U  19           H1*        U  19   2.769   9.283   4.661
  204    H3     U  19           H3         U  19  -0.878   9.306   1.877
  205    H5     U  19           H5         U  19   0.710   5.427   1.691
  206    H6     U  19           H6         U  19   2.144   6.007   3.534
  207   1H5*    G  20          H5*         G  20  -0.574   8.721   7.876
  208   2H5*    G  20          2H5*        G  20  -1.088   8.207   9.495
  209    H4*    G  20           H4*        G  20  -3.001   9.121   8.577
  210    H3*    G  20           H3*        G  20  -3.056   6.141   8.438
  211    H2*    G  20          1H2*        G  20  -5.113   6.181   7.170
  212   2HO*    G  20          2HO*        G  20  -5.374   8.555   8.356
  213    H1*    G  20           H1*        G  20  -4.242   7.968   5.291
  214    H8     G  20           H8         G  20  -0.996   6.600   6.204
  215    H1     G  20           H1         G  20  -4.492   2.342   2.934
  216   1H2     G  20          1H2         G  20  -7.133   4.488   3.572
  217   2H2     G  20          2H2         G  20  -6.594   2.995   2.838
  218   1H5*    U  21          H5*         U  21  -6.501   6.293   9.208
  219   2H5*    U  21          2H5*        U  21  -7.076   5.579  10.727
  220    H4*    U  21           H4*        U  21  -8.260   4.519   8.998
  221    H3*    U  21           H3*        U  21  -6.149   2.773  10.204
  222    H2*    U  21          1H2*        U  21  -6.657   1.032   8.625
  223   2HO*    U  21          2HO*        U  21  -9.055   2.182   8.684
  224    H1*    U  21           H1*        U  21  -6.820   2.683   6.388
  225    H3     U  21           H3         U  21  -2.895   0.264   6.269
  226    H5     U  21           H5         U  21  -2.019   3.872   8.207
  227    H6     U  21           H6         U  21  -4.383   4.313   8.309
  228   1H5*    U  22          H5*         U  22  -9.738   0.388   9.617
  229   2H5*    U  22          2H5*        U  22 -10.212  -0.062  11.267
  230    H4*    U  22           H4*        U  22 -10.524  -2.020  10.110
  231    H3*    U  22           H3*        U  22  -7.820  -2.110  11.409
  232    H2*    U  22          1H2*        U  22  -7.439  -4.273  10.410
  233   2HO*    U  22          2HO*        U  22  -9.103  -5.501   9.952
  234    H1*    U  22           H1*        U  22  -8.283  -3.538   7.873
  235    H3     U  22           H3         U  22  -3.806  -3.482   7.415
  236    H5     U  22           H5         U  22  -4.642   0.011   9.588
  237    H6     U  22           H6         U  22  -6.926  -0.730   9.747
  238   1H5*    U  23          H5*         U  23  -9.726  -5.567  11.603
  239   2H5*    U  23          2H5*        U  23  -9.714  -6.455  13.139
  240    H4*    U  23           H4*        U  23  -9.013  -7.950  11.447
  241    H3*    U  23           H3*        U  23  -6.766  -7.053  13.229
  242    H2*    U  23          1H2*        U  23  -5.263  -8.446  11.970
  243   2HO*    U  23          2HO*        U  23  -6.053 -10.228  11.149
  244    H1*    U  23           H1*        U  23  -6.264  -7.710   9.459
  245    H3     U  23           H3         U  23  -2.308  -5.602   9.471
  246    H5     U  23           H5         U  23  -4.632  -3.374  12.172
  247    H6     U  23           H6         U  23  -6.337  -5.060  11.969
  248   1H5*    C  24          H5*         C  24  -6.707 -11.182  12.985
  249   2H5*    C  24          2H5*        C  24  -6.191 -12.004  14.471
  250    H4*    C  24           H4*        C  24  -4.773 -12.626  12.623
  251    H3*    C  24           H3*        C  24  -3.449 -11.012  14.788
  252    H2*    C  24          1H2*        C  24  -1.373 -11.189  13.567
  253   2HO*    C  24          2HO*        C  24  -2.612 -13.381  12.580
  254    H1*    C  24           H1*        C  24  -2.501 -10.587  11.083
  255   1H4     C  24          1H4         C  24  -2.105  -4.792  14.216
  256   2H4     C  24          2H4         C  24  -0.614  -4.967  13.313
  257    H5     C  24           H5         C  24  -3.744  -6.575  14.377
  258    H6     C  24           H6         C  24  -4.283  -8.853  13.693
  259   1H5*    C  25          H5*         C  25  -0.634 -13.610  13.978
  260   2H5*    C  25          2H5*        C  25  -0.543 -14.770  15.317
  261    H4*    C  25           H4*        C  25   1.668 -14.309  14.883
  262    H3*    C  25           H3*        C  25   0.754 -12.619  17.185
  263    H2*    C  25          1H2*        C  25   2.909 -11.562  17.271
  264   2HO*    C  25          2HO*        C  25   3.837 -13.238  15.175
  265    H1*    C  25           H1*        C  25   3.180 -11.225  14.509
  266   1H4     C  25          1H4         C  25  -0.974  -6.460  16.408
  267   2H4     C  25          2H4         C  25   0.631  -5.765  16.456
  268    H5     C  25           H5         C  25  -1.360  -8.814  15.938
  269    H6     C  25           H6         C  25  -0.288 -10.947  15.435
  270    H3T    C  25           H3T        C  25   2.829 -14.370  17.361
  Start of MODEL   21
    1   1H5*    G   1          H5*         G   1   5.320   2.984  14.172
    2   2H5*    G   1          2H5*        G   1   5.087   2.545  15.874
    3    H4*    G   1           H4*        G   1   7.718   1.934  14.656
    4    H3*    G   1           H3*        G   1   5.213   0.575  13.727
    5    H2*    G   1          1H2*        G   1   6.304  -1.561  13.917
    6   2HO*    G   1          2HO*        G   1   8.461  -0.199  13.405
    7    H1*    G   1           H1*        G   1   7.364  -1.122  16.427
    8    H8     G   1           H8         G   1   4.284   0.756  16.756
    9    H1     G   1           H1         G   1   3.139  -5.538  16.425
   10   1H2     G   1          1H2         G   1   6.404  -5.761  15.307
   11   2H2     G   1          2H2         G   1   4.914  -6.599  15.685
   12    H5T    G   1           H5T        G   1   7.144   3.647  16.249
   13   1H5*    G   2          H5*         G   2   8.358  -0.877  11.432
   14   2H5*    G   2          2H5*        G   2   8.016  -0.886   9.691
   15    H4*    G   2           H4*        G   2   8.841  -3.029  10.340
   16    H3*    G   2           H3*        G   2   5.953  -2.971   9.536
   17    H2*    G   2          1H2*        G   2   5.802  -5.345   9.990
   18   2HO*    G   2          2HO*        G   2   8.287  -5.403   9.371
   19    H1*    G   2           H1*        G   2   6.953  -5.196  12.484
   20    H8     G   2           H8         G   2   5.423  -1.886  12.354
   21    H1     G   2           H1         G   2   1.028  -6.494  13.011
   22   1H2     G   2          1H2         G   2   3.589  -8.639  12.071
   23   2H2     G   2          2H2         G   2   1.904  -8.465  12.513
   24   1H5*    A   3          H5*         A   3   7.088  -6.270   7.914
   25   2H5*    A   3          2H5*        A   3   7.157  -6.159   6.144
   26    H4*    A   3           H4*        A   3   6.088  -8.161   6.473
   27    H3*    A   3           H3*        A   3   4.050  -6.034   5.960
   28    H2*    A   3          1H2*        A   3   2.266  -7.611   6.362
   29   2HO*    A   3          2HO*        A   3   4.216  -9.369   5.727
   30    H1*    A   3           H1*        A   3   3.283  -8.587   8.721
   31    H8     A   3           H8         A   3   4.540  -5.087   8.642
   32   1H6     A   3          1H6         A   3   0.668  -2.811  10.460
   33   2H6     A   3          2H6         A   3  -0.993  -3.292  10.748
   34    H2     A   3           H2         A   3  -1.303  -7.594   9.504
   35   1H5*    A   4          H5*         A   4   2.931  -9.321   3.870
   36   2H5*    A   4          2H5*        A   4   3.030  -9.070   2.115
   37    H4*    A   4           H4*        A   4   1.054 -10.212   2.343
   38    H3*    A   4           H3*        A   4   0.502  -7.285   2.129
   39    H2*    A   4          1H2*        A   4  -1.848  -7.653   2.544
   40   2HO*    A   4          2HO*        A   4  -1.389  -9.968   1.468
   41    H1*    A   4           H1*        A   4  -1.504  -9.231   4.761
   42    H8     A   4           H8         A   4   1.507  -6.994   4.662
   43   1H6     A   4          1H6         A   4  -0.295  -3.216   7.122
   44   2H6     A   4          2H6         A   4  -1.904  -2.770   7.643
   45    H2     A   4           H2         A   4  -4.634  -6.061   6.269
   46   1H5*    G   5          H5*         G   5  -2.383  -8.971  -0.020
   47   2H5*    G   5          2H5*        G   5  -2.627  -8.261  -1.627
   48    H4*    G   5           H4*        G   5  -4.702  -8.170  -0.523
   49    H3*    G   5           H3*        G   5  -3.400  -5.449  -0.558
   50    H2*    G   5          1H2*        G   5  -5.434  -4.609   0.457
   51   2HO*    G   5          2HO*        G   5  -6.450  -6.841  -0.677
   52    H1*    G   5           H1*        G   5  -5.540  -6.645   2.369
   53    H8     G   5           H8         G   5  -1.928  -5.917   1.881
   54    H1     G   5           H1         G   5  -4.956  -1.517   5.424
   55   1H2     G   5          1H2         G   5  -7.839  -3.031   4.315
   56   2H2     G   5          2H2         G   5  -7.112  -1.767   5.281
   57   1H5*    C   6          H5*         C   6  -7.255  -4.801  -1.499
   58   2H5*    C   6          2H5*        C   6  -7.315  -4.246  -3.184
   59    H4*    C   6           H4*        C   6  -8.789  -2.830  -2.141
   60    H3*    C   6           H3*        C   6  -6.127  -1.437  -2.280
   61    H2*    C   6          1H2*        C   6  -7.149   0.465  -1.177
   62   2HO*    C   6          2HO*        C   6  -9.385  -0.642  -2.180
   63    H1*    C   6           H1*        C   6  -8.293  -1.046   0.838
   64   1H4     C   6          1H4         C   6  -1.819  -1.187   2.125
   65   2H4     C   6          2H4         C   6  -2.423   0.227   2.951
   66    H5     C   6           H5         C   6  -3.175  -2.542   0.656
   67    H6     C   6           H6         C   6  -5.390  -2.813  -0.325
   68   1H5*    A   7          H5*         A   7  -9.014   1.005  -3.538
   69   2H5*    A   7          2H5*        A   7  -8.644   2.281  -4.715
   70    H4*    A   7           H4*        A   7  -9.407   3.120  -2.520
   71    H3*    A   7           H3*        A   7  -6.769   3.974  -3.645
   72    H2*    A   7          1H2*        A   7  -6.297   5.239  -1.654
   73   2HO*    A   7          2HO*        A   7  -8.935   5.409  -1.572
   74    H1*    A   7           H1*        A   7  -7.147   3.305   0.158
   75    H8     A   7           H8         A   7  -5.639   1.098  -2.286
   76   1H6     A   7          1H6         A   7  -0.936   1.614  -1.198
   77   2H6     A   7          2H6         A   7  -0.048   2.785  -0.244
   78    H2     A   7           H2         A   7  -3.045   5.706   1.353
   79   1H5*    G   8          H5*         G   8  -7.149   7.173  -1.809
   80   2H5*    G   8          2H5*        G   8  -7.596   8.424  -2.985
   81    H4*    G   8           H4*        G   8  -5.831   9.396  -1.901
   82    H3*    G   8           H3*        G   8  -4.885   8.151  -4.439
   83    H2*    G   8          1H2*        G   8  -2.585   8.586  -3.893
   84   2HO*    G   8          2HO*        G   8  -3.619  10.606  -2.561
   85    H1*    G   8           H1*        G   8  -2.689   7.690  -1.286
   86    H8     G   8           H8         G   8  -5.179   5.688  -3.252
   87    H1     G   8           H1         G   8   0.851   3.561  -3.742
   88   1H2     G   8          1H2         G   8   1.706   6.536  -2.235
   89   2H2     G   8          2H2         G   8   2.251   5.020  -2.921
   90   1H5*    G   9          H5*         G   9  -2.637  11.093  -4.011
   91   2H5*    G   9          2H5*        G   9  -2.760  12.387  -5.219
   92    H4*    G   9           H4*        G   9  -0.497  12.030  -5.108
   93    H3*    G   9           H3*        G   9  -1.567  10.409  -7.405
   94    H2*    G   9          1H2*        G   9   0.681   9.656  -7.836
   95   2HO*    G   9          2HO*        G   9   2.100  11.213  -7.468
   96    H1*    G   9           H1*        G   9   1.283   9.134  -5.155
   97    H8     G   9           H8         G   9  -2.296   8.357  -6.226
   98    H1     G   9           H1         G   9   1.855   3.507  -6.870
   99   1H2     G   9          1H2         G   9   4.255   5.854  -6.042
  100   2H2     G   9          2H2         G   9   3.902   4.195  -6.471
  101   1H5*    C  10          H5*         C  10   1.722  12.887  -8.869
  102   2H5*    C  10          2H5*        C  10   1.552  13.124 -10.619
  103    H4*    C  10           H4*        C  10   3.645  12.016 -10.026
  104    H3*    C  10           H3*        C  10   1.702  10.498 -11.740
  105    H2*    C  10          1H2*        C  10   3.269   8.663 -11.812
  106   2HO*    C  10          2HO*        C  10   5.018  10.631 -11.360
  107    H1*    C  10           H1*        C  10   3.799   8.679  -9.081
  108   1H4     C  10          1H4         C  10  -2.197   5.996  -9.967
  109   2H4     C  10          2H4         C  10  -1.085   4.713  -9.587
  110    H5     C  10           H5         C  10  -1.471   8.323 -10.136
  111    H6     C  10           H6         C  10   0.458   9.811 -10.076
  112   1H5*    U  11          H5*         U  11   4.732   9.423 -13.271
  113   2H5*    U  11          2H5*        U  11   4.996   9.882 -14.964
  114    H4*    U  11           H4*        U  11   5.319   7.605 -14.991
  115    H3*    U  11           H3*        U  11   2.496   8.179 -15.845
  116    H2*    U  11          1H2*        U  11   2.139   5.807 -16.096
  117   2HO*    U  11          2HO*        U  11   3.934   4.370 -15.764
  118    H1*    U  11           H1*        U  11   3.359   5.118 -13.673
  119    H3     U  11           H3         U  11  -0.963   4.547 -12.622
  120    H5     U  11           H5         U  11  -0.544   8.731 -12.889
  121    H6     U  11           H6         U  11   1.704   8.369 -13.666
  122   1H5*    U  12          H5*         U  12   3.653   8.006 -20.914
  123   2H5*    U  12          2H5*        U  12   1.903   7.741 -21.041
  124    H4*    U  12           H4*        U  12   2.755   5.976 -22.225
  125    H3*    U  12           H3*        U  12   1.364   5.197 -20.083
  126    H2*    U  12          1H2*        U  12   3.209   5.017 -18.534
  127   2HO*    U  12          2HO*        U  12   2.166   2.805 -19.236
  128    H1*    U  12           H1*        U  12   4.875   3.677 -20.729
  129    H3     U  12           H3         U  12   8.163   3.318 -17.700
  130    H5     U  12           H5         U  12   7.135   7.384 -17.554
  131    H6     U  12           H6         U  12   5.322   6.901 -19.059
  132   1H5*    C  13          H5*         C  13   1.910   1.051 -19.698
  133   2H5*    C  13          2H5*        C  13   0.357   0.501 -20.356
  134    H4*    C  13           H4*        C  13   0.901  -0.162 -17.979
  135    H3*    C  13           H3*        C  13  -1.534   0.063 -19.018
  136    H2*    C  13          1H2*        C  13  -1.799   2.453 -18.646
  137   2HO*    C  13          2HO*        C  13  -2.813   0.910 -16.504
  138    H1*    C  13           H1*        C  13  -0.696   2.027 -15.818
  139   1H4     C  13          1H4         C  13   0.309   8.391 -17.238
  140   2H4     C  13          2H4         C  13  -0.627   8.332 -15.759
  141    H5     C  13           H5         C  13   0.868   6.401 -18.503
  142    H6     C  13           H6         C  13   0.660   3.972 -18.595
  143   1H5*    G  14          H5*         G  14  -0.276  -1.770 -18.957
  144   2H5*    G  14          2H5*        G  14  -0.551  -3.433 -19.509
  145    H4*    G  14           H4*        G  14   1.254  -4.169 -18.476
  146    H3*    G  14           H3*        G  14   0.146  -2.875 -16.007
  147    H2*    G  14          1H2*        G  14   2.296  -2.716 -15.057
  148   2HO*    G  14          2HO*        G  14   2.806  -4.892 -15.192
  149    H1*    G  14           H1*        G  14   3.750  -2.781 -17.600
  150    H8     G  14           H8         G  14   5.269  -0.802 -17.462
  151    H1     G  14           H1         G  14   1.093   2.508 -13.888
  152   1H2     G  14          1H2         G  14  -0.974  -0.253 -14.339
  153   2H2     G  14          2H2         G  14  -0.773   1.334 -13.630
  154   1H5*    G  15          H5*         G  15   0.956  -4.098 -12.025
  155   2H5*    G  15          2H5*        G  15   0.647  -2.991 -13.376
  156    H4*    G  15           H4*        G  15   3.434  -3.771 -13.223
  157    H3*    G  15           H3*        G  15   2.219  -2.797 -10.685
  158    H2*    G  15          1H2*        G  15   3.907  -1.107 -10.419
  159   2HO*    G  15          2HO*        G  15   5.486  -2.723 -11.519
  160    H1*    G  15           H1*        G  15   3.792  -0.133 -12.986
  161    H8     G  15           H8         G  15   0.360  -1.414 -12.310
  162    H1     G  15           H1         G  15   1.480   4.306  -9.672
  163   1H2     G  15          1H2         G  15   4.783   3.682 -10.477
  164   2H2     G  15          2H2         G  15   3.630   4.795  -9.778
  165   1H5*    C  16          H5*         C  16   6.192  -3.806  -9.152
  166   2H5*    C  16          2H5*        C  16   5.932  -4.444  -7.517
  167    H4*    C  16           H4*        C  16   7.312  -2.398  -7.587
  168    H3*    C  16           H3*        C  16   4.783  -2.439  -5.979
  169    H2*    C  16          1H2*        C  16   5.129  -0.143  -5.369
  170   2HO*    C  16          2HO*        C  16   7.137   0.500  -5.141
  171    H1*    C  16           H1*        C  16   5.901   0.735  -7.906
  172   1H4     C  16          1H4         C  16  -0.666   0.211  -8.235
  173   2H4     C  16          2H4         C  16  -0.322   1.873  -7.798
  174    H5     C  16           H5         C  16   1.070  -1.476  -8.394
  175    H6     C  16           H6         C  16   3.462  -1.899  -8.195
  176   1H5*    C  17          H5*         C  17   8.159  -0.608  -4.281
  177   2H5*    C  17          2H5*        C  17   8.491  -1.174  -2.632
  178    H4*    C  17           H4*        C  17   8.794   1.166  -2.649
  179    H3*    C  17           H3*        C  17   6.318   0.286  -1.214
  180    H2*    C  17          1H2*        C  17   5.741   2.579  -0.780
  181   2HO*    C  17          2HO*        C  17   8.364   2.891  -0.940
  182    H1*    C  17           H1*        C  17   6.215   3.485  -3.356
  183   1H4     C  17          1H4         C  17   0.671  -0.023  -4.010
  184   2H4     C  17          2H4         C  17   0.171   1.640  -3.832
  185    H5     C  17           H5         C  17   2.965  -0.740  -3.792
  186    H6     C  17           H6         C  17   5.250  -0.007  -3.364
  187   1H5*    U  18          H5*         U  18   8.034   3.427   0.954
  188   2H5*    U  18          2H5*        U  18   9.102   2.459   1.988
  189    H4*    U  18           H4*        U  18   8.492   3.517   3.840
  190    H3*    U  18           H3*        U  18   6.052   2.552   3.603
  191    H2*    U  18          1H2*        U  18   5.183   3.994   1.899
  192   2HO*    U  18          2HO*        U  18   4.856   5.534   4.288
  193    H1*    U  18           H1*        U  18   6.422   6.480   3.123
  194    H3     U  18           H3         U  18   6.384   8.874  -0.616
  195    H5     U  18           H5         U  18   5.806   4.962  -2.020
  196    H6     U  18           H6         U  18   6.091   4.187   0.230
  197   1H5*    U  19          H5*         U  19   2.499   4.475   6.521
  198   2H5*    U  19          2H5*        U  19   3.354   4.842   5.010
  199    H4*    U  19           H4*        U  19   3.886   6.745   7.162
  200    H3*    U  19           H3*        U  19   1.033   6.303   6.358
  201    H2*    U  19          1H2*        U  19   0.714   8.675   6.144
  202   2HO*    U  19          2HO*        U  19   2.600   8.724   8.003
  203    H1*    U  19           H1*        U  19   3.133   9.187   4.841
  204    H3     U  19           H3         U  19  -0.316   9.666   1.856
  205    H5     U  19           H5         U  19   0.874   5.647   1.646
  206    H6     U  19           H6         U  19   2.221   6.021   3.606
  207   1H5*    G  20          H5*         G  20  -0.678   8.260   7.456
  208   2H5*    G  20          2H5*        G  20  -1.223   7.995   9.123
  209    H4*    G  20           H4*        G  20  -3.204   8.500   8.172
  210    H3*    G  20           H3*        G  20  -2.918   5.533   7.926
  211    H2*    G  20          1H2*        G  20  -4.950   5.433   6.615
  212   2HO*    G  20          2HO*        G  20  -6.390   6.981   6.828
  213    H1*    G  20           H1*        G  20  -4.179   7.357   4.829
  214    H8     G  20           H8         G  20  -0.851   6.247   5.771
  215    H1     G  20           H1         G  20  -3.937   1.783   2.352
  216   1H2     G  20          1H2         G  20  -6.743   3.691   2.983
  217   2H2     G  20          2H2         G  20  -6.072   2.266   2.224
  218   1H5*    U  21          H5*         U  21  -6.588   5.791   8.528
  219   2H5*    U  21          2H5*        U  21  -7.197   5.135  10.061
  220    H4*    U  21           H4*        U  21  -8.607   4.261   8.432
  221    H3*    U  21           H3*        U  21  -6.646   2.267   9.449
  222    H2*    U  21          1H2*        U  21  -7.275   0.645   7.799
  223   2HO*    U  21          2HO*        U  21  -9.592   1.984   7.947
  224    H1*    U  21           H1*        U  21  -7.388   2.360   5.626
  225    H3     U  21           H3         U  21  -3.497   0.008   5.176
  226    H5     U  21           H5         U  21  -2.554   3.284   7.601
  227    H6     U  21           H6         U  21  -4.906   3.762   7.750
  228   1H5*    U  22          H5*         U  22 -10.130   0.070   9.348
  229   2H5*    U  22          2H5*        U  22 -10.589  -0.445  10.983
  230    H4*    U  22           H4*        U  22 -10.734  -2.399   9.790
  231    H3*    U  22           H3*        U  22  -8.061  -2.295  11.144
  232    H2*    U  22          1H2*        U  22  -7.454  -4.377  10.101
  233   2HO*    U  22          2HO*        U  22  -9.005  -5.759   9.683
  234    H1*    U  22           H1*        U  22  -8.348  -3.692   7.563
  235    H3     U  22           H3         U  22  -3.914  -3.234   7.084
  236    H5     U  22           H5         U  22  -5.015   0.112   9.372
  237    H6     U  22           H6         U  22  -7.232  -0.816   9.508
  238   1H5*    U  23          H5*         U  23  -9.751  -5.948  11.611
  239   2H5*    U  23          2H5*        U  23  -9.580  -6.738  13.190
  240    H4*    U  23           H4*        U  23  -8.761  -8.248  11.578
  241    H3*    U  23           H3*        U  23  -6.549  -6.946  13.142
  242    H2*    U  23          1H2*        U  23  -4.956  -8.233  11.876
  243   2HO*    U  23          2HO*        U  23  -5.547 -10.140  11.156
  244    H1*    U  23           H1*        U  23  -6.172  -7.787   9.398
  245    H3     U  23           H3         U  23  -2.581  -5.131   9.030
  246    H5     U  23           H5         U  23  -4.949  -3.177  11.889
  247    H6     U  23           H6         U  23  -6.427  -5.075  11.849
  248   1H5*    C  24          H5*         C  24  -5.919 -10.832  12.944
  249   2H5*    C  24          2H5*        C  24  -5.627 -11.699  14.465
  250    H4*    C  24           H4*        C  24  -3.928 -12.376  13.004
  251    H3*    C  24           H3*        C  24  -2.937 -10.407  15.039
  252    H2*    C  24          1H2*        C  24  -0.734 -10.536  14.048
  253   2HO*    C  24          2HO*        C  24  -1.601 -12.918  13.273
  254    H1*    C  24           H1*        C  24  -1.614 -10.167  11.457
  255   1H4     C  24          1H4         C  24  -2.557  -4.278  14.277
  256   2H4     C  24          2H4         C  24  -0.913  -4.264  13.678
  257    H5     C  24           H5         C  24  -3.946  -6.260  14.221
  258    H6     C  24           H6         C  24  -4.040  -8.609  13.578
  259   1H5*    C  25          H5*         C  25  -0.240 -13.165  14.800
  260   2H5*    C  25          2H5*        C  25   0.378 -13.869  16.307
  261    H4*    C  25           H4*        C  25   2.213 -13.069  15.006
  262    H3*    C  25           H3*        C  25   1.665 -11.504  17.509
  263    H2*    C  25          1H2*        C  25   3.496 -10.043  16.979
  264   2HO*    C  25          2HO*        C  25   4.472 -12.192  15.848
  265    H1*    C  25           H1*        C  25   2.888  -9.808  14.253
  266   1H4     C  25          1H4         C  25  -1.345  -5.746  17.256
  267   2H4     C  25          2H4         C  25   0.109  -4.806  16.995
  268    H5     C  25           H5         C  25  -1.461  -8.124  16.786
  269    H6     C  25           H6         C  25  -0.215 -10.059  15.978
  270    H3T    C  25           H3T        C  25   2.508 -13.391  17.932
  Start of MODEL   22
    1   1H5*    G   1          H5*         G   1   7.493  -0.202  17.173
    2   2H5*    G   1          2H5*        G   1   7.146  -1.374  18.458
    3    H4*    G   1           H4*        G   1   9.569  -1.918  16.890
    4    H3*    G   1           H3*        G   1   6.931  -1.774  15.482
    5    H2*    G   1          1H2*        G   1   7.348  -3.907  14.441
    6   2HO*    G   1          2HO*        G   1   9.819  -3.193  14.565
    7    H1*    G   1           H1*        G   1   8.237  -5.192  16.733
    8    H8     G   1           H8         G   1   5.561  -2.580  17.443
    9    H1     G   1           H1         G   1   3.337  -8.445  16.113
   10   1H2     G   1          1H2         G   1   6.629  -9.164  15.307
   11   2H2     G   1          2H2         G   1   4.986  -9.750  15.433
   12    H5T    G   1           H5T        G   1   9.372  -1.090  19.119
   13   1H5*    G   2          H5*         G   2   9.571  -2.754  12.258
   14   2H5*    G   2          2H5*        G   2   8.840  -2.106  10.777
   15    H4*    G   2           H4*        G   2   9.012  -4.587  10.874
   16    H3*    G   2           H3*        G   2   6.277  -3.369  10.476
   17    H2*    G   2          1H2*        G   2   5.459  -5.629  10.228
   18   2HO*    G   2          2HO*        G   2   7.896  -6.084   9.364
   19    H1*    G   2           H1*        G   2   6.878  -6.603  12.439
   20    H8     G   2           H8         G   2   5.785  -3.228  13.461
   21    H1     G   2           H1         G   2   0.990  -7.486  13.471
   22   1H2     G   2          1H2         G   2   3.210  -9.509  11.741
   23   2H2     G   2          2H2         G   2   1.610  -9.329  12.425
   24   1H5*    A   3          H5*         A   3   7.403  -6.119   7.454
   25   2H5*    A   3          2H5*        A   3   7.049  -5.538   5.815
   26    H4*    A   3           H4*        A   3   6.381  -7.814   5.975
   27    H3*    A   3           H3*        A   3   4.150  -5.840   5.735
   28    H2*    A   3          1H2*        A   3   2.521  -7.603   5.953
   29   2HO*    A   3          2HO*        A   3   4.524  -9.074   4.983
   30    H1*    A   3           H1*        A   3   3.688  -8.821   8.133
   31    H8     A   3           H8         A   3   4.569  -5.264   8.668
   32   1H6     A   3          1H6         A   3   0.479  -3.715  10.736
   33   2H6     A   3          2H6         A   3  -1.135  -4.382  10.882
   34    H2     A   3           H2         A   3  -1.024  -8.412   8.907
   35   1H5*    A   4          H5*         A   4   3.229  -8.909   3.132
   36   2H5*    A   4          2H5*        A   4   3.335  -8.326   1.459
   37    H4*    A   4           H4*        A   4   1.421  -9.583   1.416
   38    H3*    A   4           H3*        A   4   0.713  -6.705   1.771
   39    H2*    A   4          1H2*        A   4  -1.616  -7.260   2.074
   40   2HO*    A   4          2HO*        A   4  -1.034  -9.293   0.570
   41    H1*    A   4           H1*        A   4  -1.207  -9.219   3.949
   42    H8     A   4           H8         A   4   1.710  -6.911   4.344
   43   1H6     A   4          1H6         A   4  -0.265  -3.711   7.397
   44   2H6     A   4          2H6         A   4  -1.905  -3.400   7.922
   45    H2     A   4           H2         A   4  -4.491  -6.471   5.923
   46   1H5*    G   5          H5*         G   5  -1.973  -8.107  -0.716
   47   2H5*    G   5          2H5*        G   5  -2.340  -7.139  -2.157
   48    H4*    G   5           H4*        G   5  -4.354  -7.501  -0.931
   49    H3*    G   5           H3*        G   5  -3.366  -4.658  -0.795
   50    H2*    G   5          1H2*        G   5  -5.376  -4.131   0.449
   51   2HO*    G   5          2HO*        G   5  -7.104  -5.349   0.202
   52    H1*    G   5           H1*        G   5  -5.104  -6.286   2.188
   53    H8     G   5           H8         G   5  -1.605  -5.411   1.619
   54    H1     G   5           H1         G   5  -4.629  -1.012   5.171
   55   1H2     G   5          1H2         G   5  -7.511  -2.558   4.092
   56   2H2     G   5          2H2         G   5  -6.791  -1.273   5.035
   57   1H5*    C   6          H5*         C   6  -7.205  -4.226  -1.148
   58   2H5*    C   6          2H5*        C   6  -7.576  -3.637  -2.781
   59    H4*    C   6           H4*        C   6  -8.958  -2.359  -1.471
   60    H3*    C   6           H3*        C   6  -6.455  -0.786  -1.998
   61    H2*    C   6          1H2*        C   6  -7.360   1.016  -0.665
   62   2HO*    C   6          2HO*        C   6  -9.512   1.040  -1.084
   63    H1*    C   6           H1*        C   6  -8.118  -0.610   1.449
   64   1H4     C   6          1H4         C   6  -1.538  -0.468   1.853
   65   2H4     C   6          2H4         C   6  -2.080   0.929   2.751
   66    H5     C   6           H5         C   6  -3.028  -1.873   0.573
   67    H6     C   6           H6         C   6  -5.343  -2.231  -0.101
   68   1H5*    A   7          H5*         A   7  -9.450   1.618  -2.920
   69   2H5*    A   7          2H5*        A   7  -9.251   2.781  -4.245
   70    H4*    A   7           H4*        A   7  -9.579   3.902  -2.118
   71    H3*    A   7           H3*        A   7  -6.900   4.297  -3.438
   72    H2*    A   7          1H2*        A   7  -6.318   5.788  -1.634
   73   2HO*    A   7          2HO*        A   7  -8.907   6.218  -1.584
   74    H1*    A   7           H1*        A   7  -7.356   4.138   0.384
   75    H8     A   7           H8         A   7  -5.803   1.593  -1.673
   76   1H6     A   7          1H6         A   7  -1.137   2.177  -0.428
   77   2H6     A   7          2H6         A   7  -0.275   3.466   0.389
   78    H2     A   7           H2         A   7  -3.267   6.633   1.385
   79   1H5*    G   8          H5*         G   8  -7.075   7.705  -1.900
   80   2H5*    G   8          2H5*        G   8  -7.589   8.812  -3.187
   81    H4*    G   8           H4*        G   8  -5.886   9.985  -2.231
   82    H3*    G   8           H3*        G   8  -4.757   8.487  -4.562
   83    H2*    G   8          1H2*        G   8  -2.547   9.272  -4.008
   84   2HO*    G   8          2HO*        G   8  -3.820  11.329  -3.074
   85    H1*    G   8           H1*        G   8  -2.708   8.718  -1.302
   86    H8     G   8           H8         G   8  -4.771   6.098  -2.908
   87    H1     G   8           H1         G   8   1.530   5.005  -3.422
   88   1H2     G   8          1H2         G   8   1.870   8.270  -2.365
   89   2H2     G   8          2H2         G   8   2.662   6.794  -2.873
   90   1H5*    G   9          H5*         G   9  -3.071  11.878  -4.952
   91   2H5*    G   9          2H5*        G   9  -3.399  12.794  -6.435
   92    H4*    G   9           H4*        G   9  -1.101  12.774  -6.342
   93    H3*    G   9           H3*        G   9  -1.988  10.554  -8.164
   94    H2*    G   9          1H2*        G   9   0.328   9.963  -8.494
   95   2HO*    G   9          2HO*        G   9   0.675  12.545  -7.866
   96    H1*    G   9           H1*        G   9   1.022  10.122  -5.796
   97    H8     G   9           H8         G   9  -2.467   8.789  -5.979
   98    H1     G   9           H1         G   9   2.051   4.373  -7.098
   99   1H2     G   9          1H2         G   9   4.202   7.073  -7.280
  100   2H2     G   9          2H2         G   9   4.003   5.340  -7.380
  101   1H5*    C  10          H5*         C  10   1.090  12.434  -9.700
  102   2H5*    C  10          2H5*        C  10   0.885  13.127 -11.321
  103    H4*    C  10           H4*        C  10   2.907  12.058 -11.487
  104    H3*    C  10           H3*        C  10   0.783  10.247 -12.578
  105    H2*    C  10          1H2*        C  10   2.461   8.557 -12.977
  106   2HO*    C  10          2HO*        C  10   4.045  10.679 -13.125
  107    H1*    C  10           H1*        C  10   3.668   8.787 -10.487
  108   1H4     C  10          1H4         C  10  -2.066   5.683  -9.357
  109   2H4     C  10          2H4         C  10  -0.799   4.484  -9.315
  110    H5     C  10           H5         C  10  -1.625   8.011  -9.927
  111    H6     C  10           H6         C  10   0.102   9.612 -10.562
  112   1H5*    U  11          H5*         U  11   3.452  10.283 -15.150
  113   2H5*    U  11          2H5*        U  11   3.233  10.455 -16.904
  114    H4*    U  11           H4*        U  11   4.166   8.333 -16.593
  115    H3*    U  11           H3*        U  11   1.206   8.130 -17.094
  116    H2*    U  11          1H2*        U  11   1.356   5.761 -16.873
  117   2HO*    U  11          2HO*        U  11   3.572   4.844 -16.676
  118    H1*    U  11           H1*        U  11   3.374   5.801 -14.841
  119    H3     U  11           H3         U  11  -0.150   3.594 -13.050
  120    H5     U  11           H5         U  11  -1.113   7.675 -12.719
  121    H6     U  11           H6         U  11   0.796   8.159 -14.099
  122   1H5*    U  12          H5*         U  12   1.736   6.081 -22.043
  123   2H5*    U  12          2H5*        U  12   0.337   5.325 -21.256
  124    H4*    U  12           H4*        U  12   1.675   3.636 -22.297
  125    H3*    U  12           H3*        U  12   0.778   3.232 -19.834
  126    H2*    U  12          1H2*        U  12   2.644   4.263 -18.662
  127   2HO*    U  12          2HO*        U  12   2.798   1.494 -18.914
  128    H1*    U  12           H1*        U  12   4.551   2.737 -20.516
  129    H3     U  12           H3         U  12   7.955   4.527 -18.211
  130    H5     U  12           H5         U  12   5.623   7.856 -19.260
  131    H6     U  12           H6         U  12   3.989   6.333 -20.154
  132   1H5*    C  13          H5*         C  13   1.806  -0.288 -17.932
  133   2H5*    C  13          2H5*        C  13   0.769  -1.350 -18.903
  134    H4*    C  13           H4*        C  13   0.353  -1.540 -16.499
  135    H3*    C  13           H3*        C  13  -1.587  -1.710 -18.298
  136    H2*    C  13          1H2*        C  13  -2.104   0.658 -18.454
  137   2HO*    C  13          2HO*        C  13  -3.722  -0.811 -16.771
  138    H1*    C  13           H1*        C  13  -1.990   0.856 -15.401
  139   1H4     C  13          1H4         C  13  -0.652   6.849 -17.837
  140   2H4     C  13          2H4         C  13  -2.044   7.022 -16.793
  141    H5     C  13           H5         C  13   0.360   4.699 -18.316
  142    H6     C  13           H6         C  13   0.232   2.301 -17.908
  143   1H5*    G  14          H5*         G  14  -2.035  -4.053 -13.289
  144   2H5*    G  14          2H5*        G  14  -1.330  -2.820 -14.347
  145    H4*    G  14           H4*        G  14  -0.759  -5.706 -14.848
  146    H3*    G  14           H3*        G  14   0.261  -4.202 -12.495
  147    H2*    G  14          1H2*        G  14   2.542  -4.711 -12.982
  148   2HO*    G  14          2HO*        G  14   1.409  -6.915 -13.968
  149    H1*    G  14           H1*        G  14   2.416  -4.481 -15.761
  150    H8     G  14           H8         G  14   4.368  -2.872 -15.063
  151    H1     G  14           H1         G  14   0.005   1.444 -13.208
  152   1H2     G  14          1H2         G  14  -2.238  -1.188 -13.427
  153   2H2     G  14          2H2         G  14  -1.988   0.503 -13.057
  154   1H5*    G  15          H5*         G  15   1.926  -4.706  -9.360
  155   2H5*    G  15          2H5*        G  15   1.150  -3.930 -10.753
  156    H4*    G  15           H4*        G  15   4.037  -4.461 -11.007
  157    H3*    G  15           H3*        G  15   3.027  -2.771  -8.793
  158    H2*    G  15          1H2*        G  15   4.369  -0.900  -9.407
  159   2HO*    G  15          2HO*        G  15   6.286  -1.301 -10.205
  160    H1*    G  15           H1*        G  15   3.977  -1.028 -12.146
  161    H8     G  15           H8         G  15   0.725  -2.092 -10.844
  162    H1     G  15           H1         G  15   1.618   4.217 -10.253
  163   1H2     G  15          1H2         G  15   4.918   3.499 -10.977
  164   2H2     G  15          2H2         G  15   3.726   4.732 -10.630
  165   1H5*    C  16          H5*         C  16   7.064  -2.218  -8.835
  166   2H5*    C  16          2H5*        C  16   7.801  -2.545  -7.254
  167    H4*    C  16           H4*        C  16   8.575  -0.433  -7.931
  168    H3*    C  16           H3*        C  16   6.513  -0.286  -5.762
  169    H2*    C  16          1H2*        C  16   6.597   2.118  -5.825
  170   2HO*    C  16          2HO*        C  16   9.065   1.666  -6.638
  171    H1*    C  16           H1*        C  16   6.533   2.344  -8.595
  172   1H4     C  16          1H4         C  16   0.359   0.748  -6.908
  173   2H4     C  16          2H4         C  16   0.391   2.486  -7.113
  174    H5     C  16           H5         C  16   2.354  -0.619  -7.029
  175    H6     C  16           H6         C  16   4.764  -0.596  -7.391
  176   1H5*    C  17          H5*         C  17   9.220   2.607  -5.104
  177   2H5*    C  17          2H5*        C  17  10.167   2.199  -3.660
  178    H4*    C  17           H4*        C  17   9.820   4.446  -3.397
  179    H3*    C  17           H3*        C  17   7.744   2.978  -1.813
  180    H2*    C  17          1H2*        C  17   6.731   5.076  -1.197
  181   2HO*    C  17          2HO*        C  17   9.215   5.961  -1.724
  182    H1*    C  17           H1*        C  17   6.692   6.117  -3.756
  183   1H4     C  17          1H4         C  17   2.165   1.315  -4.012
  184   2H4     C  17          2H4         C  17   1.283   2.812  -3.827
  185    H5     C  17           H5         C  17   4.575   1.187  -3.942
  186    H6     C  17           H6         C  17   6.635   2.468  -3.711
  187   1H5*    U  18          H5*         U  18   8.786   5.842   0.885
  188   2H5*    U  18          2H5*        U  18  10.032   5.069   1.884
  189    H4*    U  18           H4*        U  18   8.831   5.236   3.795
  190    H3*    U  18           H3*        U  18   6.701   4.098   2.742
  191    H2*    U  18          1H2*        U  18   5.952   5.860   1.296
  192   2HO*    U  18          2HO*        U  18   4.309   5.462   2.962
  193    H1*    U  18           H1*        U  18   6.440   8.007   3.387
  194    H3     U  18           H3         U  18   6.693  11.375   0.502
  195    H5     U  18           H5         U  18   7.200   8.013  -1.958
  196    H6     U  18           H6         U  18   7.141   6.650   0.012
  197   1H5*    U  19          H5*         U  19   5.521   6.368   6.720
  198   2H5*    U  19          2H5*        U  19   4.183   5.546   7.545
  199    H4*    U  19           H4*        U  19   4.088   8.061   7.471
  200    H3*    U  19           H3*        U  19   1.769   6.372   6.571
  201    H2*    U  19          1H2*        U  19   0.554   8.378   6.056
  202   2HO*    U  19          2HO*        U  19   1.881   9.330   8.075
  203    H1*    U  19           H1*        U  19   2.755   9.765   4.952
  204    H3     U  19           H3         U  19  -0.118   9.042   1.510
  205    H5     U  19           H5         U  19   1.994   5.441   1.951
  206    H6     U  19           H6         U  19   2.937   6.331   3.979
  207   1H5*    G  20          H5*         G  20  -0.520   8.911   7.849
  208   2H5*    G  20          2H5*        G  20  -1.075   8.386   9.449
  209    H4*    G  20           H4*        G  20  -3.022   9.046   8.428
  210    H3*    G  20           H3*        G  20  -2.755   6.076   8.218
  211    H2*    G  20          1H2*        G  20  -4.766   5.971   6.878
  212   2HO*    G  20          2HO*        G  20  -5.238   8.319   8.105
  213    H1*    G  20           H1*        G  20  -4.001   7.918   5.105
  214    H8     G  20           H8         G  20  -0.695   6.715   6.076
  215    H1     G  20           H1         G  20  -3.792   2.467   2.410
  216   1H2     G  20          1H2         G  20  -6.582   4.396   3.073
  217   2H2     G  20          2H2         G  20  -5.927   2.984   2.274
  218   1H5*    U  21          H5*         U  21  -6.614   6.128   9.126
  219   2H5*    U  21          2H5*        U  21  -6.949   5.167  10.580
  220    H4*    U  21           H4*        U  21  -8.322   4.382   8.794
  221    H3*    U  21           H3*        U  21  -6.182   2.501   9.706
  222    H2*    U  21          1H2*        U  21  -6.772   0.934   7.984
  223   2HO*    U  21          2HO*        U  21  -9.154   2.152   8.234
  224    H1*    U  21           H1*        U  21  -7.021   2.789   5.929
  225    H3     U  21           H3         U  21  -3.101   0.484   5.335
  226    H5     U  21           H5         U  21  -2.161   3.766   7.762
  227    H6     U  21           H6         U  21  -4.519   4.185   7.984
  228   1H5*    U  22          H5*         U  22  -9.782   0.459   8.784
  229   2H5*    U  22          2H5*        U  22 -10.406  -0.124  10.340
  230    H4*    U  22           H4*        U  22 -10.915  -1.857   8.930
  231    H3*    U  22           H3*        U  22  -8.336  -2.485  10.319
  232    H2*    U  22          1H2*        U  22  -8.156  -4.530   9.047
  233   2HO*    U  22          2HO*        U  22 -10.807  -4.255   8.933
  234    H1*    U  22           H1*        U  22  -8.711  -3.371   6.597
  235    H3     U  22           H3         U  22  -4.195  -3.854   6.610
  236    H5     U  22           H5         U  22  -4.910  -0.315   8.747
  237    H6     U  22           H6         U  22  -7.254  -0.851   8.702
  238   1H5*    U  23          H5*         U  23 -10.263  -5.907  10.155
  239   2H5*    U  23          2H5*        U  23 -10.309  -6.795  11.690
  240    H4*    U  23           H4*        U  23  -9.395  -8.228  10.037
  241    H3*    U  23           H3*        U  23  -7.312  -7.245  11.980
  242    H2*    U  23          1H2*        U  23  -5.713  -8.642  10.823
  243   2HO*    U  23          2HO*        U  23  -7.934 -10.009  10.216
  244    H1*    U  23           H1*        U  23  -6.559  -7.875   8.263
  245    H3     U  23           H3         U  23  -2.526  -5.898   8.870
  246    H5     U  23           H5         U  23  -5.267  -3.395  10.841
  247    H6     U  23           H6         U  23  -6.938  -5.091  10.499
  248   1H5*    C  24          H5*         C  24  -6.671 -11.152  11.308
  249   2H5*    C  24          2H5*        C  24  -6.446 -12.069  12.811
  250    H4*    C  24           H4*        C  24  -4.657 -12.413  11.144
  251    H3*    C  24           H3*        C  24  -3.946 -11.362  13.867
  252    H2*    C  24          1H2*        C  24  -1.634 -11.309  13.206
  253   2HO*    C  24          2HO*        C  24  -2.421 -13.284  11.607
  254    H1*    C  24           H1*        C  24  -2.097 -10.222  10.665
  255   1H4     C  24          1H4         C  24  -2.551  -5.040  14.685
  256   2H4     C  24          2H4         C  24  -0.829  -5.336  14.548
  257    H5     C  24           H5         C  24  -4.210  -6.545  13.761
  258    H6     C  24           H6         C  24  -4.550  -8.627  12.536
  259   1H5*    C  25          H5*         C  25  -1.127 -14.457  12.759
  260   2H5*    C  25          2H5*        C  25  -1.336 -15.695  14.014
  261    H4*    C  25           H4*        C  25   0.968 -15.516  13.694
  262    H3*    C  25           H3*        C  25   0.078 -14.145  16.202
  263    H2*    C  25          1H2*        C  25   2.318 -13.377  16.611
  264   2HO*    C  25          2HO*        C  25   3.433 -14.492  14.326
  265    H1*    C  25           H1*        C  25   2.845 -12.566  14.001
  266   1H4     C  25          1H4         C  25  -1.109  -7.910  16.514
  267   2H4     C  25          2H4         C  25   0.522  -7.282  16.577
  268    H5     C  25           H5         C  25  -1.614 -10.168  15.786
  269    H6     C  25           H6         C  25  -0.660 -12.261  14.976
  270    H3T    C  25           H3T        C  25   1.944 -16.143  16.115
  Start of MODEL   23
    1   1H5*    G   1          H5*         G   1   6.882  -0.121  14.240
    2   2H5*    G   1          2H5*        G   1   7.870  -0.749  15.572
    3    H4*    G   1           H4*        G   1   9.541  -1.012  13.421
    4    H3*    G   1           H3*        G   1   6.752  -1.326  12.376
    5    H2*    G   1          1H2*        G   1   7.390  -3.363  11.254
    6   2HO*    G   1          2HO*        G   1   9.394  -3.437  10.572
    7    H1*    G   1           H1*        G   1   8.687  -4.483  13.419
    8    H8     G   1           H8         G   1   5.839  -2.223  14.516
    9    H1     G   1           H1         G   1   4.130  -8.273  13.264
   10   1H2     G   1          1H2         G   1   7.347  -8.614  12.048
   11   2H2     G   1          2H2         G   1   5.796  -9.370  12.360
   12    H5T    G   1           H5T        G   1   8.949   1.041  13.674
   13   1H5*    G   2          H5*         G   2   9.445  -1.880   9.238
   14   2H5*    G   2          2H5*        G   2   8.839  -1.340   7.660
   15    H4*    G   2           H4*        G   2   9.416  -3.695   7.630
   16    H3*    G   2           H3*        G   2   6.546  -2.967   7.177
   17    H2*    G   2          1H2*        G   2   5.973  -5.302   7.019
   18   2HO*    G   2          2HO*        G   2   7.516  -6.878   6.811
   19    H1*    G   2           H1*        G   2   7.413  -6.106   9.247
   20    H8     G   2           H8         G   2   6.063  -2.618   9.772
   21    H1     G   2           H1         G   2   1.938  -7.304  11.218
   22   1H2     G   2          1H2         G   2   4.230  -9.386   9.671
   23   2H2     G   2          2H2         G   2   2.687  -9.236  10.484
   24   1H5*    A   3          H5*         A   3   7.307  -5.997   4.943
   25   2H5*    A   3          2H5*        A   3   7.067  -5.734   3.204
   26    H4*    A   3           H4*        A   3   5.941  -7.703   3.590
   27    H3*    A   3           H3*        A   3   3.971  -5.437   3.623
   28    H2*    A   3          1H2*        A   3   2.211  -7.026   4.085
   29   2HO*    A   3          2HO*        A   3   3.847  -8.681   2.839
   30    H1*    A   3           H1*        A   3   3.589  -8.348   6.097
   31    H8     A   3           H8         A   3   4.488  -4.660   6.038
   32   1H6     A   3          1H6         A   3   1.152  -3.106   9.203
   33   2H6     A   3          2H6         A   3  -0.243  -3.851   9.950
   34    H2     A   3           H2         A   3  -0.418  -8.057   8.399
   35   1H5*    A   4          H5*         A   4   2.215  -8.289   1.515
   36   2H5*    A   4          2H5*        A   4   1.838  -7.799  -0.148
   37    H4*    A   4           H4*        A   4  -0.141  -8.720   0.548
   38    H3*    A   4           H3*        A   4  -0.286  -5.750   0.934
   39    H2*    A   4          1H2*        A   4  -2.496  -5.998   1.873
   40   2HO*    A   4          2HO*        A   4  -3.676  -7.677   1.335
   41    H1*    A   4           H1*        A   4  -1.803  -8.035   3.607
   42    H8     A   4           H8         A   4   1.176  -5.755   3.078
   43   1H6     A   4          1H6         A   4   0.287  -2.618   6.665
   44   2H6     A   4          2H6         A   4  -1.075  -2.348   7.732
   45    H2     A   4           H2         A   4  -4.158  -5.419   6.628
   46   1H5*    G   5          H5*         G   5  -3.626  -7.090  -0.445
   47   2H5*    G   5          2H5*        G   5  -4.483  -6.217  -1.731
   48    H4*    G   5           H4*        G   5  -5.952  -6.522   0.128
   49    H3*    G   5           H3*        G   5  -5.070  -3.662  -0.240
   50    H2*    G   5          1H2*        G   5  -6.582  -3.087   1.558
   51   2HO*    G   5          2HO*        G   5  -7.855  -5.248   0.713
   52    H1*    G   5           H1*        G   5  -5.762  -5.214   3.195
   53    H8     G   5           H8         G   5  -2.651  -4.077   1.573
   54    H1     G   5           H1         G   5  -4.667  -0.071   6.155
   55   1H2     G   5          1H2         G   5  -7.627  -1.835   5.971
   56   2H2     G   5          2H2         G   5  -6.731  -0.527   6.713
   57   1H5*    C   6          H5*         C   6  -9.021  -3.228   0.289
   58   2H5*    C   6          2H5*        C   6  -9.709  -2.817  -1.295
   59    H4*    C   6           H4*        C   6 -10.820  -1.381   0.103
   60    H3*    C   6           H3*        C   6  -8.498   0.035  -1.139
   61    H2*    C   6          1H2*        C   6  -8.924   1.991   0.183
   62   2HO*    C   6          2HO*        C   6 -10.931   2.414   0.685
   63    H1*    C   6           H1*        C   6  -9.372   0.657   2.584
   64   1H4     C   6          1H4         C   6  -2.831   0.415   1.828
   65   2H4     C   6          2H4         C   6  -3.150   1.861   2.758
   66    H5     C   6           H5         C   6  -4.585  -0.954   0.878
   67    H6     C   6           H6         C   6  -6.997  -1.221   0.640
   68   1H5*    A   7          H5*         A   7 -11.352   2.263  -1.141
   69   2H5*    A   7          2H5*        A   7 -12.065   3.198  -2.470
   70    H4*    A   7           H4*        A   7 -11.551   4.831  -0.941
   71    H3*    A   7           H3*        A   7  -9.220   4.662  -2.846
   72    H2*    A   7          1H2*        A   7  -8.216   6.479  -1.619
   73   2HO*    A   7          2HO*        A   7 -10.670   7.212  -1.260
   74    H1*    A   7           H1*        A   7  -8.950   5.462   0.914
   75    H8     A   7           H8         A   7  -7.674   2.704  -1.323
   76   1H6     A   7          1H6         A   7  -2.933   3.065  -0.230
   77   2H6     A   7          2H6         A   7  -2.014   4.256   0.670
   78    H2     A   7           H2         A   7  -4.880   7.376   2.085
   79   1H5*    G   8          H5*         G   8  -7.236   6.361  -4.982
   80   2H5*    G   8          2H5*        G   8  -7.761   5.757  -3.401
   81    H4*    G   8           H4*        G   8  -7.259   8.480  -3.038
   82    H3*    G   8           H3*        G   8  -5.404   7.435  -5.078
   83    H2*    G   8          1H2*        G   8  -3.426   7.897  -3.836
   84   2HO*    G   8          2HO*        G   8  -4.902   9.908  -2.949
   85    H1*    G   8           H1*        G   8  -4.262   7.134  -1.329
   86    H8     G   8           H8         G   8  -6.057   4.661  -3.226
   87    H1     G   8           H1         G   8   0.252   3.519  -3.343
   88   1H2     G   8          1H2         G   8   0.556   6.751  -2.181
   89   2H2     G   8          2H2         G   8   1.364   5.280  -2.680
   90   1H5*    G   9          H5*         G   9  -3.498  10.545  -4.475
   91   2H5*    G   9          2H5*        G   9  -3.436  11.697  -5.824
   92    H4*    G   9           H4*        G   9  -1.215  11.343  -5.373
   93    H3*    G   9           H3*        G   9  -1.982   9.453  -7.589
   94    H2*    G   9          1H2*        G   9   0.318   8.715  -7.625
   95   2HO*    G   9          2HO*        G   9   0.740  11.164  -6.691
   96    H1*    G   9           H1*        G   9   0.524   8.517  -4.835
   97    H8     G   9           H8         G   9  -2.910   7.423  -5.831
   98    H1     G   9           H1         G   9   1.582   2.914  -6.645
   99   1H2     G   9          1H2         G   9   3.819   5.476  -6.057
  100   2H2     G   9          2H2         G   9   3.583   3.779  -6.413
  101   1H5*    C  10          H5*         C  10   1.247  11.685  -8.645
  102   2H5*    C  10          2H5*        C  10   1.312  12.328 -10.298
  103    H4*    C  10           H4*        C  10   3.340  11.232  -9.999
  104    H3*    C  10           H3*        C  10   1.472   9.491 -11.585
  105    H2*    C  10          1H2*        C  10   3.257   7.863 -11.739
  106   2HO*    C  10          2HO*        C  10   4.753  10.085 -11.146
  107    H1*    C  10           H1*        C  10   3.882   7.967  -9.029
  108   1H4     C  10          1H4         C  10  -1.814   4.622  -9.554
  109   2H4     C  10          2H4         C  10  -0.549   3.472  -9.260
  110    H5     C  10           H5         C  10  -1.360   7.015  -9.784
  111    H6     C  10           H6         C  10   0.394   8.707  -9.854
  112   1H5*    U  11          H5*         U  11   4.522   9.681 -13.686
  113   2H5*    U  11          2H5*        U  11   4.581  10.031 -15.424
  114    H4*    U  11           H4*        U  11   5.473   7.887 -15.202
  115    H3*    U  11           H3*        U  11   2.604   7.685 -16.108
  116    H2*    U  11          1H2*        U  11   2.892   5.305 -16.197
  117   2HO*    U  11          2HO*        U  11   5.257   4.702 -15.501
  118    H1*    U  11           H1*        U  11   4.465   5.176 -13.829
  119    H3     U  11           H3         U  11   0.600   2.834 -13.147
  120    H5     U  11           H5         U  11  -0.251   6.836 -12.170
  121    H6     U  11           H6         U  11   1.869   7.441 -13.125
  122   1H5*    U  12          H5*         U  12   3.285   6.150 -21.184
  123   2H5*    U  12          2H5*        U  12   2.114   5.212 -20.237
  124    H4*    U  12           H4*        U  12   3.535   3.836 -21.707
  125    H3*    U  12           H3*        U  12   2.694   3.031 -19.308
  126    H2*    U  12          1H2*        U  12   4.549   3.866 -18.001
  127   2HO*    U  12          2HO*        U  12   4.866   1.220 -18.838
  128    H1*    U  12           H1*        U  12   6.483   2.845 -20.146
  129    H3     U  12           H3         U  12   9.812   4.395 -17.572
  130    H5     U  12           H5         U  12   7.253   7.700 -17.959
  131    H6     U  12           H6         U  12   5.699   6.264 -19.104
  132   1H5*    C  13          H5*         C  13   4.059  -0.575 -17.968
  133   2H5*    C  13          2H5*        C  13   2.970  -1.594 -18.928
  134    H4*    C  13           H4*        C  13   2.871  -1.971 -16.473
  135    H3*    C  13           H3*        C  13   0.810  -2.321 -18.089
  136    H2*    C  13          1H2*        C  13   0.057  -0.006 -18.132
  137   2HO*    C  13          2HO*        C  13  -1.596  -1.553 -17.239
  138    H1*    C  13           H1*        C  13   0.345   0.079 -15.086
  139   1H4     C  13          1H4         C  13   0.870   6.306 -17.195
  140   2H4     C  13          2H4         C  13  -0.534   6.250 -16.154
  141    H5     C  13           H5         C  13   2.131   4.326 -17.793
  142    H6     C  13           H6         C  13   2.294   1.912 -17.530
  143   1H5*    G  14          H5*         G  14   2.096  -3.831 -17.584
  144   2H5*    G  14          2H5*        G  14   2.158  -5.522 -18.114
  145    H4*    G  14           H4*        G  14   3.723  -6.039 -16.639
  146    H3*    G  14           H3*        G  14   2.041  -4.664 -14.558
  147    H2*    G  14          1H2*        G  14   3.954  -4.409 -13.184
  148   2HO*    G  14          2HO*        G  14   4.698  -6.500 -13.187
  149    H1*    G  14           H1*        G  14   5.856  -4.269 -15.370
  150    H8     G  14           H8         G  14   7.025  -2.129 -14.850
  151    H1     G  14           H1         G  14   1.609   0.701 -12.901
  152   1H2     G  14          1H2         G  14   0.117  -2.336 -13.713
  153   2H2     G  14          2H2         G  14  -0.098  -0.714 -13.093
  154   1H5*    G  15          H5*         G  15   2.079  -5.681 -10.329
  155   2H5*    G  15          2H5*        G  15   1.855  -4.651 -11.756
  156    H4*    G  15           H4*        G  15   4.651  -5.178 -11.053
  157    H3*    G  15           H3*        G  15   2.880  -3.941  -8.996
  158    H2*    G  15          1H2*        G  15   4.423  -2.117  -8.679
  159   2HO*    G  15          2HO*        G  15   6.122  -3.630 -10.405
  160    H1*    G  15           H1*        G  15   4.810  -1.572 -11.351
  161    H8     G  15           H8         G  15   1.329  -2.927 -11.014
  162    H1     G  15           H1         G  15   1.813   3.315  -9.684
  163   1H2     G  15          1H2         G  15   5.218   2.756  -9.821
  164   2H2     G  15          2H2         G  15   3.931   3.926  -9.626
  165   1H5*    C  16          H5*         C  16   6.632  -4.045  -7.335
  166   2H5*    C  16          2H5*        C  16   6.665  -4.475  -5.614
  167    H4*    C  16           H4*        C  16   7.687  -2.341  -5.894
  168    H3*    C  16           H3*        C  16   5.023  -2.255  -4.509
  169    H2*    C  16          1H2*        C  16   5.240   0.137  -4.322
  170   2HO*    C  16          2HO*        C  16   7.817  -0.447  -4.349
  171    H1*    C  16           H1*        C  16   6.115   0.536  -6.940
  172   1H4     C  16          1H4         C  16  -0.381  -0.537  -7.430
  173   2H4     C  16          2H4         C  16  -0.143   1.199  -7.483
  174    H5     C  16           H5         C  16   1.441  -2.084  -7.019
  175    H6     C  16           H6         C  16   3.834  -2.276  -6.598
  176   1H5*    C  17          H5*         C  17   7.949   0.254  -2.802
  177   2H5*    C  17          2H5*        C  17   8.132  -0.150  -1.085
  178    H4*    C  17           H4*        C  17   8.157   2.165  -1.136
  179    H3*    C  17           H3*        C  17   5.453   1.189  -0.287
  180    H2*    C  17          1H2*        C  17   4.688   3.468  -0.154
  181   2HO*    C  17          2HO*        C  17   6.814   4.238   0.602
  182    H1*    C  17           H1*        C  17   5.613   4.186  -2.648
  183   1H4     C  17          1H4         C  17   0.747  -0.094  -3.951
  184   2H4     C  17          2H4         C  17   0.086   1.496  -4.240
  185    H5     C  17           H5         C  17   2.947  -0.467  -3.052
  186    H6     C  17           H6         C  17   4.990   0.603  -2.272
  187   1H5*    U  18          H5*         U  18   7.841   4.450   2.061
  188   2H5*    U  18          2H5*        U  18   7.675   3.817   3.710
  189    H4*    U  18           H4*        U  18   7.498   5.985   4.211
  190    H3*    U  18           H3*        U  18   5.013   4.905   4.324
  191    H2*    U  18          1H2*        U  18   4.173   5.665   2.230
  192   2HO*    U  18          2HO*        U  18   3.734   7.509   4.254
  193    H1*    U  18           H1*        U  18   5.707   8.296   2.525
  194    H3     U  18           H3         U  18   5.296   9.541  -1.731
  195    H5     U  18           H5         U  18   4.288   5.470  -1.844
  196    H6     U  18           H6         U  18   4.843   5.332   0.474
  197   1H5*    U  19          H5*         U  19   3.948   9.248   4.706
  198   2H5*    U  19          2H5*        U  19   4.219   9.302   6.459
  199    H4*    U  19           H4*        U  19   2.535  10.756   6.440
  200    H3*    U  19           H3*        U  19   1.099   8.125   6.390
  201    H2*    U  19          1H2*        U  19  -0.997   9.284   6.091
  202   2HO*    U  19          2HO*        U  19   0.384  11.273   7.264
  203    H1*    U  19           H1*        U  19  -0.089  10.973   4.090
  204    H3     U  19           H3         U  19  -2.291   7.992   1.566
  205    H5     U  19           H5         U  19   1.087   5.867   2.865
  206    H6     U  19           H6         U  19   1.641   7.749   4.258
  207   1H5*    G  20          H5*         G  20  -1.067  10.258   8.262
  208   2H5*    G  20          2H5*        G  20  -1.508   9.915   9.946
  209    H4*    G  20           H4*        G  20  -3.531  10.271   8.896
  210    H3*    G  20           H3*        G  20  -3.072   7.313   9.129
  211    H2*    G  20          1H2*        G  20  -5.226   6.972   8.075
  212   2HO*    G  20          2HO*        G  20  -5.687   9.397   9.083
  213    H1*    G  20           H1*        G  20  -4.755   8.767   6.008
  214    H8     G  20           H8         G  20  -1.393   7.447   6.643
  215    H1     G  20           H1         G  20  -5.185   3.223   3.656
  216   1H2     G  20          1H2         G  20  -7.743   5.367   4.596
  217   2H2     G  20          2H2         G  20  -7.286   3.887   3.789
  218   1H5*    U  21          H5*         U  21  -6.720   6.893  10.298
  219   2H5*    U  21          2H5*        U  21  -6.725   5.931  11.789
  220    H4*    U  21           H4*        U  21  -7.916   4.793  10.018
  221    H3*    U  21           H3*        U  21  -5.386   3.478  10.974
  222    H2*    U  21          1H2*        U  21  -5.788   1.686   9.418
  223   2HO*    U  21          2HO*        U  21  -8.314   2.400   9.811
  224    H1*    U  21           H1*        U  21  -6.536   3.352   7.288
  225    H3     U  21           H3         U  21  -2.481   1.644   6.164
  226    H5     U  21           H5         U  21  -1.636   4.829   8.765
  227    H6     U  21           H6         U  21  -3.994   4.996   9.210
  228   1H5*    U  22          H5*         U  22  -9.160   0.679  11.579
  229   2H5*    U  22          2H5*        U  22  -8.672  -0.346  12.942
  230    H4*    U  22           H4*        U  22  -9.606  -1.578  11.000
  231    H3*    U  22           H3*        U  22  -6.861  -2.249  12.019
  232    H2*    U  22          1H2*        U  22  -6.675  -3.932  10.302
  233   2HO*    U  22          2HO*        U  22  -9.266  -3.317   9.345
  234    H1*    U  22           H1*        U  22  -7.650  -2.330   8.246
  235    H3     U  22           H3         U  22  -3.148  -2.749   7.680
  236    H5     U  22           H5         U  22  -3.655   0.506  10.282
  237    H6     U  22           H6         U  22  -5.980  -0.098  10.451
  238   1H5*    U  23          H5*         U  23  -9.016  -5.873  11.050
  239   2H5*    U  23          2H5*        U  23  -8.855  -6.935  12.462
  240    H4*    U  23           H4*        U  23  -8.341  -8.197  10.517
  241    H3*    U  23           H3*        U  23  -5.956  -7.591  12.237
  242    H2*    U  23          1H2*        U  23  -4.561  -8.791  10.669
  243   2HO*    U  23          2HO*        U  23  -5.399 -10.258   9.362
  244    H1*    U  23           H1*        U  23  -5.592  -7.557   8.415
  245    H3     U  23           H3         U  23  -1.691  -5.385   9.001
  246    H5     U  23           H5         U  23  -4.244  -3.708  11.883
  247    H6     U  23           H6         U  23  -5.856  -5.402  11.321
  248   1H5*    C  24          H5*         C  24  -5.493 -11.342  10.782
  249   2H5*    C  24          2H5*        C  24  -5.189 -12.487  12.103
  250    H4*    C  24           H4*        C  24  -3.533 -12.778  10.398
  251    H3*    C  24           H3*        C  24  -2.541 -11.642  12.990
  252    H2*    C  24          1H2*        C  24  -0.330 -11.477  12.080
  253   2HO*    C  24          2HO*        C  24   0.137 -13.173  10.859
  254    H1*    C  24           H1*        C  24  -1.110 -10.542   9.552
  255   1H4     C  24          1H4         C  24  -1.290  -5.150  13.311
  256   2H4     C  24          2H4         C  24   0.340  -5.246  12.683
  257    H5     C  24           H5         C  24  -2.913  -6.931  12.993
  258    H6     C  24           H6         C  24  -3.296  -9.122  11.994
  259   1H5*    C  25          H5*         C  25  -0.207 -14.991  11.770
  260   2H5*    C  25          2H5*        C  25   0.134 -16.115  13.100
  261    H4*    C  25           H4*        C  25   2.180 -15.707  12.014
  262    H3*    C  25           H3*        C  25   1.951 -14.360  14.674
  263    H2*    C  25          1H2*        C  25   4.076 -13.285  14.368
  264   2HO*    C  25          2HO*        C  25   4.686 -15.414  13.066
  265    H1*    C  25           H1*        C  25   3.667 -12.516  11.726
  266   1H4     C  25          1H4         C  25   0.013  -8.353  15.328
  267   2H4     C  25          2H4         C  25   1.456  -7.485  14.847
  268    H5     C  25           H5         C  25  -0.322 -10.701  14.837
  269    H6     C  25           H6         C  25   0.641 -12.671  13.772
  270    H3T    C  25           H3T        C  25   2.276 -16.536  14.586
  Start of MODEL   24
    1   1H5*    G   1          H5*         G   1   8.432   0.367  12.480
    2   2H5*    G   1          2H5*        G   1   8.002   0.057  14.172
    3    H4*    G   1           H4*        G   1  10.340  -1.291  12.860
    4    H3*    G   1           H3*        G   1   7.459  -2.087  12.585
    5    H2*    G   1          1H2*        G   1   8.095  -4.391  12.913
    6   2HO*    G   1          2HO*        G   1  10.281  -3.773  11.798
    7    H1*    G   1           H1*        G   1   9.643  -3.913  15.145
    8    H8     G   1           H8         G   1   7.097  -1.301  15.462
    9    H1     G   1           H1         G   1   4.721  -7.125  16.680
   10   1H2     G   1          1H2         G   1   7.677  -8.278  15.305
   11   2H2     G   1          2H2         G   1   6.140  -8.678  16.038
   12    H5T    G   1           H5T        G   1   9.428   1.809  14.029
   13   1H5*    G   2          H5*         G   2   9.580  -4.630   9.924
   14   2H5*    G   2          2H5*        G   2   8.815  -4.570   8.323
   15    H4*    G   2           H4*        G   2   9.175  -6.852   9.000
   16    H3*    G   2           H3*        G   2   6.324  -5.966   8.741
   17    H2*    G   2          1H2*        G   2   5.592  -8.167   9.430
   18   2HO*    G   2          2HO*        G   2   7.792  -8.972   8.371
   19    H1*    G   2           H1*        G   2   7.222  -8.298  11.641
   20    H8     G   2           H8         G   2   6.762  -4.710  11.644
   21    H1     G   2           H1         G   2   1.308  -7.726  13.125
   22   1H2     G   2          1H2         G   2   2.892 -10.550  11.896
   23   2H2     G   2          2H2         G   2   1.442  -9.863  12.590
   24   1H5*    A   3          H5*         A   3   6.338  -9.557   6.577
   25   2H5*    A   3          2H5*        A   3   6.126  -9.128   4.868
   26    H4*    A   3           H4*        A   3   4.711 -10.918   5.110
   27    H3*    A   3           H3*        A   3   3.131  -8.389   5.358
   28    H2*    A   3          1H2*        A   3   1.136  -9.675   5.850
   29   2HO*    A   3          2HO*        A   3   2.289 -11.531   4.476
   30    H1*    A   3           H1*        A   3   2.280 -11.120   7.864
   31    H8     A   3           H8         A   3   4.436  -8.166   8.018
   32   1H6     A   3          1H6         A   3   1.587  -5.091  10.466
   33   2H6     A   3          2H6         A   3  -0.120  -5.096  10.866
   34    H2     A   3           H2         A   3  -1.829  -8.883   9.202
   35   1H5*    A   4          H5*         A   4   1.000 -10.806   2.894
   36   2H5*    A   4          2H5*        A   4   0.299 -10.035   1.459
   37    H4*    A   4           H4*        A   4  -1.399 -11.153   2.771
   38    H3*    A   4           H3*        A   4  -1.593  -8.177   2.499
   39    H2*    A   4          1H2*        A   4  -3.531  -8.155   3.927
   40   2HO*    A   4          2HO*        A   4  -3.771 -10.652   2.998
   41    H1*    A   4           H1*        A   4  -2.499  -9.867   5.857
   42    H8     A   4           H8         A   4   0.557  -8.089   5.015
   43   1H6     A   4          1H6         A   4  -0.113  -3.971   7.510
   44   2H6     A   4          2H6         A   4  -1.516  -3.221   8.238
   45    H2     A   4           H2         A   4  -4.969  -5.998   7.522
   46   1H5*    G   5          H5*         G   5  -5.338  -9.233   2.954
   47   2H5*    G   5          2H5*        G   5  -5.965  -9.341   1.298
   48    H4*    G   5           H4*        G   5  -7.730  -8.425   2.446
   49    H3*    G   5           H3*        G   5  -6.186  -6.170   1.189
   50    H2*    G   5          1H2*        G   5  -7.771  -4.629   2.147
   51   2HO*    G   5          2HO*        G   5  -9.386  -6.725   1.951
   52    H1*    G   5           H1*        G   5  -7.837  -5.872   4.662
   53    H8     G   5           H8         G   5  -4.315  -6.018   3.444
   54    H1     G   5           H1         G   5  -5.980  -0.319   5.870
   55   1H2     G   5          1H2         G   5  -9.190  -1.557   5.758
   56   2H2     G   5          2H2         G   5  -8.137  -0.220   6.171
   57   1H5*    C   6          H5*         C   6 -10.042  -5.417   0.496
   58   2H5*    C   6          2H5*        C   6 -10.427  -5.391  -1.237
   59    H4*    C   6           H4*        C   6 -11.499  -3.516  -0.464
   60    H3*    C   6           H3*        C   6  -8.841  -2.715  -1.592
   61    H2*    C   6          1H2*        C   6  -9.232  -0.437  -0.923
   62   2HO*    C   6          2HO*        C   6 -11.681  -0.950  -1.381
   63    H1*    C   6           H1*        C   6 -10.179  -1.037   1.624
   64   1H4     C   6          1H4         C   6  -3.639  -1.896   1.931
   65   2H4     C   6          2H4         C   6  -3.982  -0.353   2.679
   66    H5     C   6           H5         C   6  -5.339  -3.245   0.856
   67    H6     C   6           H6         C   6  -7.708  -3.388   0.295
   68   1H5*    A   7          H5*         A   7  -9.639   0.794  -5.407
   69   2H5*    A   7          2H5*        A   7  -8.418   0.322  -4.208
   70    H4*    A   7           H4*        A   7 -10.627   2.345  -3.900
   71    H3*    A   7           H3*        A   7  -7.682   2.627  -4.279
   72    H2*    A   7          1H2*        A   7  -7.537   4.302  -2.567
   73   2HO*    A   7          2HO*        A   7 -10.016   4.790  -3.347
   74    H1*    A   7           H1*        A   7  -9.180   3.053  -0.713
   75    H8     A   7           H8         A   7  -7.587   0.068  -1.996
   76   1H6     A   7          1H6         A   7  -3.279   0.305   0.257
   77   2H6     A   7          2H6         A   7  -2.456   1.592   1.117
   78    H2     A   7           H2         A   7  -5.110   5.188   0.980
   79   1H5*    G   8          H5*         G   8  -8.490   6.269  -3.123
   80   2H5*    G   8          2H5*        G   8  -8.487   7.250  -4.601
   81    H4*    G   8           H4*        G   8  -7.298   8.426  -2.921
   82    H3*    G   8           H3*        G   8  -5.633   7.386  -5.170
   83    H2*    G   8          1H2*        G   8  -3.618   8.145  -4.096
   84   2HO*    G   8          2HO*        G   8  -5.169   9.998  -3.155
   85    H1*    G   8           H1*        G   8  -4.228   7.223  -1.558
   86    H8     G   8           H8         G   8  -5.775   4.762  -3.858
   87    H1     G   8           H1         G   8   0.554   3.960  -3.192
   88   1H2     G   8          1H2         G   8   0.494   7.067  -1.698
   89   2H2     G   8          2H2         G   8   1.456   5.702  -2.212
   90   1H5*    G   9          H5*         G   9  -4.030  10.884  -4.947
   91   2H5*    G   9          2H5*        G   9  -4.069  11.812  -6.459
   92    H4*    G   9           H4*        G   9  -1.814  11.675  -5.895
   93    H3*    G   9           H3*        G   9  -2.407   9.587  -7.992
   94    H2*    G   9          1H2*        G   9  -0.058   9.065  -7.974
   95   2HO*    G   9          2HO*        G   9   1.335  10.595  -7.504
   96    H1*    G   9           H1*        G   9   0.164   9.186  -5.160
   97    H8     G   9           H8         G   9  -3.005   7.411  -5.807
   98    H1     G   9           H1         G   9   2.160   3.820  -7.049
   99   1H2     G   9          1H2         G   9   3.904   6.783  -6.765
  100   2H2     G   9          2H2         G   9   3.969   5.062  -7.067
  101   1H5*    C  10          H5*         C  10   1.102  11.843  -8.657
  102   2H5*    C  10          2H5*        C  10   0.966  12.591 -10.260
  103    H4*    C  10           H4*        C  10   3.191  11.877 -10.038
  104    H3*    C  10           H3*        C  10   1.606  10.105 -11.866
  105    H2*    C  10          1H2*        C  10   3.553   8.733 -12.192
  106   2HO*    C  10          2HO*        C  10   4.815  10.978 -11.850
  107    H1*    C  10           H1*        C  10   4.336   8.706  -9.500
  108   1H4     C  10          1H4         C  10  -0.606   4.361  -9.973
  109   2H4     C  10          2H4         C  10   0.862   3.448 -10.219
  110    H5     C  10           H5         C  10  -0.631   6.776  -9.769
  111    H6     C  10           H6         C  10   0.747   8.787  -9.770
  112   1H5*    U  11          H5*         U  11   4.359  10.820 -14.057
  113   2H5*    U  11          2H5*        U  11   4.256  11.480 -15.701
  114    H4*    U  11           H4*        U  11   5.160   9.347 -15.958
  115    H3*    U  11           H3*        U  11   2.239   9.345 -16.657
  116    H2*    U  11          1H2*        U  11   2.314   7.000 -17.015
  117   2HO*    U  11          2HO*        U  11   4.540   6.019 -17.094
  118    H1*    U  11           H1*        U  11   4.404   6.479 -15.077
  119    H3     U  11           H3         U  11   1.052   3.656 -13.900
  120    H5     U  11           H5         U  11  -0.157   7.447 -12.533
  121    H6     U  11           H6         U  11   1.696   8.391 -13.737
  122   1H5*    U  12          H5*         U  12   1.697   7.297 -19.572
  123   2H5*    U  12          2H5*        U  12   3.388   7.517 -19.082
  124    H4*    U  12           H4*        U  12   2.341   6.990 -21.860
  125    H3*    U  12           H3*        U  12   2.697   5.002 -20.177
  126    H2*    U  12          1H2*        U  12   4.859   5.651 -19.304
  127   2HO*    U  12          2HO*        U  12   4.838   3.529 -20.662
  128    H1*    U  12           H1*        U  12   5.891   6.208 -22.120
  129    H3     U  12           H3         U  12   9.681   7.526 -20.116
  130    H5     U  12           H5         U  12   6.722   9.833 -18.237
  131    H6     U  12           H6         U  12   5.074   8.570 -19.450
  132   1H5*    C  13          H5*         C  13   4.411   1.714 -20.833
  133   2H5*    C  13          2H5*        C  13   3.238   0.958 -21.923
  134    H4*    C  13           H4*        C  13   3.838  -0.233 -19.763
  135    H3*    C  13           H3*        C  13   1.633  -0.567 -21.223
  136    H2*    C  13          1H2*        C  13   0.263   1.143 -20.208
  137   2HO*    C  13          2HO*        C  13  -0.009  -1.010 -18.340
  138    H1*    C  13           H1*        C  13   1.303   0.395 -17.439
  139   1H4     C  13          1H4         C  13  -0.327   6.770 -17.155
  140   2H4     C  13          2H4         C  13  -1.398   5.933 -16.054
  141    H5     C  13           H5         C  13   1.222   5.603 -18.609
  142    H6     C  13           H6         C  13   2.066   3.414 -19.276
  143   1H5*    G  14          H5*         G  14   0.802  -2.281 -16.105
  144   2H5*    G  14          2H5*        G  14   1.703  -1.301 -17.258
  145    H4*    G  14           H4*        G  14   2.184  -4.194 -17.407
  146    H3*    G  14           H3*        G  14   2.752  -2.720 -14.877
  147    H2*    G  14          1H2*        G  14   5.019  -3.485 -14.826
  148   2HO*    G  14          2HO*        G  14   3.943  -5.560 -16.093
  149    H1*    G  14           H1*        G  14   5.562  -3.175 -17.541
  150    H8     G  14           H8         G  14   7.352  -1.516 -16.824
  151    H1     G  14           H1         G  14   2.910   2.521 -14.567
  152   1H2     G  14          1H2         G  14   0.705  -0.089 -15.132
  153   2H2     G  14          2H2         G  14   0.924   1.549 -14.570
  154   1H5*    G  15          H5*         G  15   4.725  -5.219 -13.384
  155   2H5*    G  15          2H5*        G  15   4.428  -5.193 -11.635
  156    H4*    G  15           H4*        G  15   6.511  -4.031 -12.489
  157    H3*    G  15           H3*        G  15   4.590  -2.766 -10.572
  158    H2*    G  15          1H2*        G  15   5.920  -0.753 -10.585
  159   2HO*    G  15          2HO*        G  15   7.798  -2.514 -11.617
  160    H1*    G  15           H1*        G  15   6.125  -0.585 -13.329
  161    H8     G  15           H8         G  15   2.870  -2.205 -12.924
  162    H1     G  15           H1         G  15   2.650   4.003 -11.400
  163   1H2     G  15          1H2         G  15   6.094   3.835 -11.450
  164   2H2     G  15          2H2         G  15   4.672   4.823 -11.207
  165   1H5*    C  16          H5*         C  16   8.198  -1.420  -9.687
  166   2H5*    C  16          2H5*        C  16   8.712  -2.035  -8.103
  167    H4*    C  16           H4*        C  16   9.343   0.198  -8.095
  168    H3*    C  16           H3*        C  16   6.794  -0.164  -6.549
  169    H2*    C  16          1H2*        C  16   6.766   2.212  -6.112
  170   2HO*    C  16          2HO*        C  16   9.419   1.909  -6.626
  171    H1*    C  16           H1*        C  16   7.317   2.961  -8.731
  172   1H4     C  16          1H4         C  16   1.037   0.933  -8.877
  173   2H4     C  16          2H4         C  16   0.981   2.641  -8.503
  174    H5     C  16           H5         C  16   3.115  -0.310  -8.995
  175    H6     C  16           H6         C  16   5.540  -0.160  -8.796
  176   1H5*    C  17          H5*         C  17   8.822   2.937  -4.843
  177   2H5*    C  17          2H5*        C  17   9.612   2.135  -3.471
  178    H4*    C  17           H4*        C  17   9.068   4.176  -2.590
  179    H3*    C  17           H3*        C  17   6.879   2.248  -1.869
  180    H2*    C  17          1H2*        C  17   5.768   4.066  -0.697
  181   2HO*    C  17          2HO*        C  17   6.792   5.951  -0.282
  182    H1*    C  17           H1*        C  17   5.933   5.810  -2.816
  183   1H4     C  17          1H4         C  17   1.676   1.241  -4.968
  184   2H4     C  17          2H4         C  17   0.694   2.512  -4.288
  185    H5     C  17           H5         C  17   4.087   1.219  -4.852
  186    H6     C  17           H6         C  17   6.056   2.418  -4.062
  187   1H5*    U  18          H5*         U  18   8.383   4.725   0.982
  188   2H5*    U  18          2H5*        U  18   8.398   4.269   2.696
  189    H4*    U  18           H4*        U  18   7.329   6.456   2.169
  190    H3*    U  18           H3*        U  18   6.616   4.774   4.163
  191    H2*    U  18          1H2*        U  18   4.739   3.704   3.163
  192   2HO*    U  18          2HO*        U  18   3.832   5.007   4.836
  193    H1*    U  18           H1*        U  18   3.933   6.245   1.683
  194    H3     U  18           H3         U  18   1.048   4.041  -0.886
  195    H5     U  18           H5         U  18   3.986   1.146  -0.108
  196    H6     U  18           H6         U  18   5.157   2.788   1.179
  197   1H5*    U  19          H5*         U  19   2.829   7.189   6.852
  198   2H5*    U  19          2H5*        U  19   3.022   6.486   5.234
  199    H4*    U  19           H4*        U  19   2.633   9.431   5.572
  200    H3*    U  19           H3*        U  19   0.451   7.385   5.838
  201    H2*    U  19          1H2*        U  19  -0.963   8.750   4.442
  202   2HO*    U  19          2HO*        U  19   0.367  10.701   5.500
  203    H1*    U  19           H1*        U  19   0.996   9.333   2.545
  204    H3     U  19           H3         U  19  -1.693   6.413   0.402
  205    H5     U  19           H5         U  19   0.631   4.010   2.941
  206    H6     U  19           H6         U  19   1.511   6.026   3.920
  207   1H5*    G  20          H5*         G  20  -1.669   7.704   5.939
  208   2H5*    G  20          2H5*        G  20  -1.950   9.450   6.082
  209    H4*    G  20           H4*        G  20  -4.126   9.167   6.841
  210    H3*    G  20           H3*        G  20  -3.392   6.364   7.577
  211    H2*    G  20          1H2*        G  20  -5.609   5.608   7.005
  212   2HO*    G  20          2HO*        G  20  -6.278   8.039   7.677
  213    H1*    G  20           H1*        G  20  -5.746   6.924   4.578
  214    H8     G  20           H8         G  20  -2.142   6.140   4.902
  215    H1     G  20           H1         G  20  -5.706   1.062   3.257
  216   1H2     G  20          1H2         G  20  -8.380   3.078   4.106
  217   2H2     G  20          2H2         G  20  -7.835   1.522   3.519
  218   1H5*    U  21          H5*         U  21  -6.503   6.928   9.947
  219   2H5*    U  21          2H5*        U  21  -6.457   6.227  11.576
  220    H4*    U  21           H4*        U  21  -8.101   5.076  10.295
  221    H3*    U  21           H3*        U  21  -5.650   3.453  10.905
  222    H2*    U  21          1H2*        U  21  -6.601   1.602   9.690
  223   2HO*    U  21          2HO*        U  21  -8.911   3.000  10.226
  224    H1*    U  21           H1*        U  21  -7.491   3.122   7.523
  225    H3     U  21           H3         U  21  -3.905   0.836   5.938
  226    H5     U  21           H5         U  21  -2.265   4.072   8.036
  227    H6     U  21           H6         U  21  -4.477   4.584   8.834
  228   1H5*    U  22          H5*         U  22  -8.858   1.238  11.194
  229   2H5*    U  22          2H5*        U  22  -9.206   0.663  12.836
  230    H4*    U  22           H4*        U  22  -9.657  -1.188  11.554
  231    H3*    U  22           H3*        U  22  -6.825  -1.456  12.544
  232    H2*    U  22          1H2*        U  22  -6.708  -3.570  11.395
  233   2HO*    U  22          2HO*        U  22  -8.477  -4.702  11.061
  234    H1*    U  22           H1*        U  22  -7.973  -2.643   9.062
  235    H3     U  22           H3         U  22  -3.683  -3.289   7.817
  236    H5     U  22           H5         U  22  -3.602   0.306   9.984
  237    H6     U  22           H6         U  22  -5.899  -0.096  10.584
  238   1H5*    U  23          H5*         U  23  -9.033  -4.759  12.746
  239   2H5*    U  23          2H5*        U  23  -9.132  -5.557  14.328
  240    H4*    U  23           H4*        U  23  -8.834  -7.298  12.828
  241    H3*    U  23           H3*        U  23  -6.204  -6.617  14.117
  242    H2*    U  23          1H2*        U  23  -5.189  -8.398  12.842
  243   2HO*    U  23          2HO*        U  23  -7.379  -9.602  13.058
  244    H1*    U  23           H1*        U  23  -6.416  -7.694  10.435
  245    H3     U  23           H3         U  23  -2.210  -6.259   9.753
  246    H5     U  23           H5         U  23  -3.810  -3.446  12.424
  247    H6     U  23           H6         U  23  -5.755  -4.852  12.619
  248   1H5*    C  24          H5*         C  24  -6.509 -10.577  14.538
  249   2H5*    C  24          2H5*        C  24  -5.933 -11.220  16.087
  250    H4*    C  24           H4*        C  24  -4.688 -12.194  14.280
  251    H3*    C  24           H3*        C  24  -3.102 -10.329  16.033
  252    H2*    C  24          1H2*        C  24  -1.157 -10.861  14.707
  253   2HO*    C  24          2HO*        C  24  -2.608 -13.099  14.222
  254    H1*    C  24           H1*        C  24  -2.485 -10.652  12.245
  255   1H4     C  24          1H4         C  24  -1.323  -4.437  14.132
  256   2H4     C  24          2H4         C  24   0.110  -4.955  13.263
  257    H5     C  24           H5         C  24  -3.141  -5.960  14.661
  258    H6     C  24           H6         C  24  -3.934  -8.259  14.465
  259   1H5*    C  25          H5*         C  25  -0.644 -13.394  15.421
  260   2H5*    C  25          2H5*        C  25  -0.568 -14.338  16.922
  261    H4*    C  25           H4*        C  25   1.615 -14.333  16.171
  262    H3*    C  25           H3*        C  25   1.271 -12.251  18.300
  263    H2*    C  25          1H2*        C  25   3.555 -11.565  18.011
  264   2HO*    C  25          2HO*        C  25   3.973 -14.035  17.459
  265    H1*    C  25           H1*        C  25   3.522 -11.592  15.220
  266   1H4     C  25          1H4         C  25   0.337  -6.055  16.877
  267   2H4     C  25          2H4         C  25   2.030  -5.624  16.769
  268    H5     C  25           H5         C  25  -0.439  -8.349  16.675
  269    H6     C  25           H6         C  25   0.252 -10.664  16.336
  270    H3T    C  25           H3T        C  25   1.278 -14.421  18.823
  Start of MODEL   25
    1   1H5*    G   1          H5*         G   1   7.582   0.392  16.706
    2   2H5*    G   1          2H5*        G   1   7.593  -0.483  18.249
    3    H4*    G   1           H4*        G   1   9.921  -1.106  16.652
    4    H3*    G   1           H3*        G   1   7.294  -1.337  15.239
    5    H2*    G   1          1H2*        G   1   7.827  -3.584  14.548
    6   2HO*    G   1          2HO*        G   1  10.258  -2.737  14.565
    7    H1*    G   1           H1*        G   1   8.724  -4.455  17.012
    8    H8     G   1           H8         G   1   6.057  -1.911  17.680
    9    H1     G   1           H1         G   1   3.780  -7.743  16.295
   10   1H2     G   1          1H2         G   1   7.038  -8.451  15.364
   11   2H2     G   1          2H2         G   1   5.398  -9.034  15.539
   12    H5T    G   1           H5T        G   1   9.414   0.495  18.825
   13   1H5*    G   2          H5*         G   2   9.904  -2.191  11.780
   14   2H5*    G   2          2H5*        G   2   8.984  -1.568  10.396
   15    H4*    G   2           H4*        G   2   9.368  -4.020  10.369
   16    H3*    G   2           H3*        G   2   6.552  -2.967  10.259
   17    H2*    G   2          1H2*        G   2   5.767  -5.246  10.141
   18   2HO*    G   2          2HO*        G   2   7.045  -6.676   9.237
   19    H1*    G   2           H1*        G   2   7.343  -6.159  12.231
   20    H8     G   2           H8         G   2   6.588  -2.716  13.285
   21    H1     G   2           H1         G   2   1.511  -6.600  13.772
   22   1H2     G   2          1H2         G   2   3.397  -8.790  11.878
   23   2H2     G   2          2H2         G   2   1.891  -8.482  12.713
   24   1H5*    A   3          H5*         A   3   7.182  -5.930   7.570
   25   2H5*    A   3          2H5*        A   3   6.782  -5.501   5.895
   26    H4*    A   3           H4*        A   3   5.936  -7.673   6.309
   27    H3*    A   3           H3*        A   3   3.830  -5.555   6.086
   28    H2*    A   3          1H2*        A   3   2.123  -7.196   6.532
   29   2HO*    A   3          2HO*        A   3   2.624  -9.091   5.663
   30    H1*    A   3           H1*        A   3   3.393  -8.337   8.705
   31    H8     A   3           H8         A   3   4.446  -4.798   8.948
   32   1H6     A   3          1H6         A   3   0.548  -2.938  11.152
   33   2H6     A   3          2H6         A   3  -1.077  -3.534  11.431
   34    H2     A   3           H2         A   3  -1.244  -7.671   9.720
   35   1H5*    A   4          H5*         A   4   2.601  -8.746   3.773
   36   2H5*    A   4          2H5*        A   4   2.564  -8.293   2.058
   37    H4*    A   4           H4*        A   4   0.624  -9.495   2.299
   38    H3*    A   4           H3*        A   4   0.037  -6.575   2.438
   39    H2*    A   4          1H2*        A   4  -2.263  -6.990   3.024
   40   2HO*    A   4          2HO*        A   4  -3.069  -9.136   3.058
   41    H1*    A   4           H1*        A   4  -1.742  -8.783   5.030
   42    H8     A   4           H8         A   4   1.269  -6.540   4.819
   43   1H6     A   4          1H6         A   4  -0.225  -2.996   7.772
   44   2H6     A   4          2H6         A   4  -1.768  -2.622   8.509
   45    H2     A   4           H2         A   4  -4.634  -5.817   7.226
   46   1H5*    G   5          H5*         G   5  -2.963  -8.005   0.734
   47   2H5*    G   5          2H5*        G   5  -3.473  -7.357  -0.837
   48    H4*    G   5           H4*        G   5  -5.320  -7.286   0.675
   49    H3*    G   5           H3*        G   5  -4.191  -4.584  -0.015
   50    H2*    G   5          1H2*        G   5  -5.920  -3.589   1.342
   51   2HO*    G   5          2HO*        G   5  -7.183  -5.878   0.728
   52    H1*    G   5           H1*        G   5  -5.624  -5.387   3.467
   53    H8     G   5           H8         G   5  -2.175  -4.831   2.305
   54    H1     G   5           H1         G   5  -4.524   0.150   5.588
   55   1H2     G   5          1H2         G   5  -7.579  -1.389   5.149
   56   2H2     G   5          2H2         G   5  -6.695  -0.028   5.801
   57   1H5*    C   6          H5*         C   6  -8.259  -4.285  -0.014
   58   2H5*    C   6          2H5*        C   6  -8.772  -4.028  -1.693
   59    H4*    C   6           H4*        C   6 -10.115  -2.569  -0.542
   60    H3*    C   6           H3*        C   6  -7.759  -1.110  -1.651
   61    H2*    C   6          1H2*        C   6  -8.393   0.911  -0.512
   62   2HO*    C   6          2HO*        C   6 -10.444   1.253  -0.136
   63    H1*    C   6           H1*        C   6  -8.898  -0.252   1.940
   64   1H4     C   6          1H4         C   6  -2.324  -0.510   1.337
   65   2H4     C   6          2H4         C   6  -2.685   0.819   2.416
   66    H5     C   6           H5         C   6  -4.045  -1.785   0.212
   67    H6     C   6           H6         C   6  -6.447  -2.055  -0.093
   68   1H5*    A   7          H5*         A   7 -10.834   0.981  -1.905
   69   2H5*    A   7          2H5*        A   7 -11.385   1.872  -3.337
   70    H4*    A   7           H4*        A   7 -11.235   3.493  -1.690
   71    H3*    A   7           H3*        A   7  -8.762   3.589  -3.400
   72    H2*    A   7          1H2*        A   7  -7.986   5.438  -2.057
   73   2HO*    A   7          2HO*        A   7 -10.538   5.904  -1.782
   74    H1*    A   7           H1*        A   7  -8.697   4.272   0.389
   75    H8     A   7           H8         A   7  -7.304   1.729  -2.066
   76   1H6     A   7          1H6         A   7  -2.629   2.018  -0.734
   77   2H6     A   7          2H6         A   7  -1.760   3.105   0.327
   78    H2     A   7           H2         A   7  -4.730   6.038   1.940
   79   1H5*    G   8          H5*         G   8  -6.770   5.574  -5.332
   80   2H5*    G   8          2H5*        G   8  -7.372   4.805  -3.853
   81    H4*    G   8           H4*        G   8  -7.161   7.514  -3.236
   82    H3*    G   8           H3*        G   8  -5.080   6.842  -5.209
   83    H2*    G   8          1H2*        G   8  -3.238   7.345  -3.793
   84   2HO*    G   8          2HO*        G   8  -3.400   8.834  -2.265
   85    H1*    G   8           H1*        G   8  -4.129   6.216  -1.458
   86    H8     G   8           H8         G   8  -5.671   3.874  -3.699
   87    H1     G   8           H1         G   8   0.702   3.232  -3.785
   88   1H2     G   8          1H2         G   8   0.726   6.301  -2.192
   89   2H2     G   8          2H2         G   8   1.659   4.976  -2.861
   90   1H5*    G   9          H5*         G   9  -3.250   9.785  -4.313
   91   2H5*    G   9          2H5*        G   9  -3.144  11.018  -5.585
   92    H4*    G   9           H4*        G   9  -0.937  10.544  -5.161
   93    H3*    G   9           H3*        G   9  -1.743   8.795  -7.485
   94    H2*    G   9          1H2*        G   9   0.573   8.089  -7.568
   95   2HO*    G   9          2HO*        G   9   1.887   9.086  -5.683
   96    H1*    G   9           H1*        G   9   0.716   7.649  -4.809
   97    H8     G   9           H8         G   9  -2.715   6.629  -5.752
   98    H1     G   9           H1         G   9   1.753   2.413  -7.595
   99   1H2     G   9          1H2         G   9   3.994   4.906  -6.767
  100   2H2     G   9          2H2         G   9   3.758   3.284  -7.374
  101   1H5*    C  10          H5*         C  10   1.914  10.470  -7.879
  102   2H5*    C  10          2H5*        C  10   1.920  11.573  -9.268
  103    H4*    C  10           H4*        C  10   4.000  10.558  -9.336
  104    H3*    C  10           H3*        C  10   2.169   9.232 -11.313
  105    H2*    C  10          1H2*        C  10   3.966   7.747 -11.920
  106   2HO*    C  10          2HO*        C  10   5.445   9.809 -11.116
  107    H1*    C  10           H1*        C  10   4.775   7.226  -9.293
  108   1H4     C  10          1H4         C  10  -0.660   3.610 -10.328
  109   2H4     C  10          2H4         C  10   0.699   2.571 -10.659
  110    H5     C  10           H5         C  10  -0.404   5.972  -9.788
  111    H6     C  10           H6         C  10   1.204   7.785  -9.517
  112   1H5*    U  11          H5*         U  11   5.049   9.730 -13.693
  113   2H5*    U  11          2H5*        U  11   4.684  10.559 -15.219
  114    H4*    U  11           H4*        U  11   5.504   8.414 -15.769
  115    H3*    U  11           H3*        U  11   2.526   8.623 -16.147
  116    H2*    U  11          1H2*        U  11   2.501   6.354 -16.896
  117   2HO*    U  11          2HO*        U  11   4.398   5.280 -17.446
  118    H1*    U  11           H1*        U  11   4.470   5.440 -15.050
  119    H3     U  11           H3         U  11   0.674   3.152 -14.090
  120    H5     U  11           H5         U  11   0.157   6.938 -12.320
  121    H6     U  11           H6         U  11   2.156   7.652 -13.450
  122   1H5*    U  12          H5*         U  12   2.442   8.950 -21.399
  123   2H5*    U  12          2H5*        U  12   0.999   8.038 -20.912
  124    H4*    U  12           H4*        U  12   1.969   6.797 -22.636
  125    H3*    U  12           H3*        U  12   1.538   5.465 -20.393
  126    H2*    U  12          1H2*        U  12   3.653   5.944 -19.310
  127   2HO*    U  12          2HO*        U  12   3.557   3.510 -20.652
  128    H1*    U  12           H1*        U  12   5.114   5.303 -21.923
  129    H3     U  12           H3         U  12   8.920   6.215 -19.734
  130    H5     U  12           H5         U  12   6.548   9.608 -19.036
  131    H6     U  12           H6         U  12   4.745   8.481 -20.159
  132   1H5*    C  13          H5*         C  13   2.714   1.586 -20.261
  133   2H5*    C  13          2H5*        C  13   1.314   0.859 -21.073
  134    H4*    C  13           H4*        C  13   1.774   0.050 -18.749
  135    H3*    C  13           H3*        C  13  -0.626   0.109 -19.884
  136    H2*    C  13          1H2*        C  13  -1.178   2.407 -19.308
  137   2HO*    C  13          2HO*        C  13  -2.109   0.544 -17.402
  138    H1*    C  13           H1*        C  13  -0.153   1.843 -16.474
  139   1H4     C  13          1H4         C  13   0.223   8.378 -17.306
  140   2H4     C  13          2H4         C  13  -0.755   8.085 -15.885
  141    H5     C  13           H5         C  13   1.048   6.573 -18.704
  142    H6     C  13           H6         C  13   1.114   4.153 -19.000
  143   1H5*    G  14          H5*         G  14   1.477  -1.883 -19.547
  144   2H5*    G  14          2H5*        G  14   0.902  -3.369 -20.328
  145    H4*    G  14           H4*        G  14   2.428  -4.661 -19.329
  146    H3*    G  14           H3*        G  14   2.051  -3.045 -16.821
  147    H2*    G  14          1H2*        G  14   4.234  -3.711 -16.093
  148   2HO*    G  14          2HO*        G  14   3.624  -5.883 -17.469
  149    H1*    G  14           H1*        G  14   5.454  -3.530 -18.641
  150    H8     G  14           H8         G  14   7.080  -1.716 -18.098
  151    H1     G  14           H1         G  14   2.578   1.869 -15.259
  152   1H2     G  14          1H2         G  14   0.457  -0.758 -16.038
  153   2H2     G  14          2H2         G  14   0.637   0.819 -15.303
  154   1H5*    G  15          H5*         G  15   3.731  -6.058 -14.760
  155   2H5*    G  15          2H5*        G  15   3.129  -5.767 -13.117
  156    H4*    G  15           H4*        G  15   5.542  -5.003 -13.959
  157    H3*    G  15           H3*        G  15   3.800  -3.848 -11.828
  158    H2*    G  15          1H2*        G  15   5.234  -1.930 -11.618
  159   2HO*    G  15          2HO*        G  15   7.121  -3.502 -12.211
  160    H1*    G  15           H1*        G  15   5.449  -1.398 -14.310
  161    H8     G  15           H8         G  15   2.087  -2.889 -14.049
  162    H1     G  15           H1         G  15   2.296   3.111 -11.842
  163   1H2     G  15          1H2         G  15   5.712   2.734 -12.013
  164   2H2     G  15          2H2         G  15   4.367   3.775 -11.613
  165   1H5*    C  16          H5*         C  16   7.848  -3.436 -10.116
  166   2H5*    C  16          2H5*        C  16   7.640  -3.875  -8.410
  167    H4*    C  16           H4*        C  16   8.634  -1.635  -8.776
  168    H3*    C  16           H3*        C  16   6.074  -1.845  -7.206
  169    H2*    C  16          1H2*        C  16   6.162   0.542  -6.878
  170   2HO*    C  16          2HO*        C  16   8.441   0.680  -6.560
  171    H1*    C  16           H1*        C  16   6.846   1.129  -9.531
  172   1H4     C  16          1H4         C  16   0.367  -0.087  -9.658
  173   2H4     C  16          2H4         C  16   0.515   1.580  -9.151
  174    H5     C  16           H5         C  16   2.294  -1.548  -9.911
  175    H6     C  16           H6         C  16   4.722  -1.690  -9.728
  176   1H5*    C  17          H5*         C  17   8.891   0.520  -4.557
  177   2H5*    C  17          2H5*        C  17   8.574  -0.192  -2.963
  178    H4*    C  17           H4*        C  17   8.446   2.259  -2.977
  179    H3*    C  17           H3*        C  17   5.970   0.742  -2.191
  180    H2*    C  17          1H2*        C  17   4.895   2.868  -1.785
  181   2HO*    C  17          2HO*        C  17   7.469   3.670  -1.580
  182    H1*    C  17           H1*        C  17   5.643   3.947  -4.219
  183   1H4     C  17          1H4         C  17   1.205  -0.591  -5.982
  184   2H4     C  17          2H4         C  17   0.256   0.785  -5.471
  185    H5     C  17           H5         C  17   3.609  -0.698  -5.714
  186    H6     C  17           H6         C  17   5.579   0.494  -4.916
  187   1H5*    U  18          H5*         U  18   7.185   4.296   0.047
  188   2H5*    U  18          2H5*        U  18   7.976   3.377   1.342
  189    H4*    U  18           H4*        U  18   7.334   4.866   2.815
  190    H3*    U  18           H3*        U  18   5.068   3.491   2.775
  191    H2*    U  18          1H2*        U  18   3.932   4.555   0.966
  192   2HO*    U  18          2HO*        U  18   2.680   5.013   2.873
  193    H1*    U  18           H1*        U  18   4.870   7.329   1.769
  194    H3     U  18           H3         U  18   4.133   9.139  -2.210
  195    H5     U  18           H5         U  18   4.421   5.053  -3.114
  196    H6     U  18           H6         U  18   4.924   4.642  -0.807
  197   1H5*    U  19          H5*         U  19   3.865   7.104   4.125
  198   2H5*    U  19          2H5*        U  19   4.773   7.355   5.628
  199    H4*    U  19           H4*        U  19   3.231   8.694   6.463
  200    H3*    U  19           H3*        U  19   1.236   6.569   5.776
  201    H2*    U  19          1H2*        U  19  -0.539   8.189   5.830
  202   2HO*    U  19          2HO*        U  19   1.116   9.374   7.556
  203    H1*    U  19           H1*        U  19   0.835  10.206   4.467
  204    H3     U  19           H3         U  19  -2.330   8.612   1.601
  205    H5     U  19           H5         U  19   0.964   6.049   1.170
  206    H6     U  19           H6         U  19   1.957   7.125   3.079
  207   1H5*    G  20          H5*         G  20  -0.627   8.718   8.038
  208   2H5*    G  20          2H5*        G  20  -1.081   8.031   9.609
  209    H4*    G  20           H4*        G  20  -2.976   9.115   8.647
  210    H3*    G  20           H3*        G  20  -3.111   6.157   8.931
  211    H2*    G  20          1H2*        G  20  -5.209   6.045   7.765
  212   2HO*    G  20          2HO*        G  20  -5.576   8.383   8.797
  213    H1*    G  20           H1*        G  20  -4.527   7.719   5.676
  214    H8     G  20           H8         G  20  -1.301   6.147   6.473
  215    H1     G  20           H1         G  20  -5.226   2.216   3.283
  216   1H2     G  20          1H2         G  20  -7.684   4.530   4.083
  217   2H2     G  20          2H2         G  20  -7.293   3.020   3.293
  218   1H5*    U  21          H5*         U  21  -6.440   6.673  10.407
  219   2H5*    U  21          2H5*        U  21  -6.898   5.698  11.817
  220    H4*    U  21           H4*        U  21  -8.047   4.867   9.900
  221    H3*    U  21           H3*        U  21  -5.906   3.055  10.966
  222    H2*    U  21          1H2*        U  21  -6.368   1.485   9.214
  223   2HO*    U  21          2HO*        U  21  -8.448   1.345   8.754
  224    H1*    U  21           H1*        U  21  -6.619   3.385   7.170
  225    H3     U  21           H3         U  21  -2.739   1.190   6.317
  226    H5     U  21           H5         U  21  -1.758   4.019   9.245
  227    H6     U  21           H6         U  21  -4.108   4.484   9.481
  228   1H5*    U  22          H5*         U  22  -9.608   0.987   9.936
  229   2H5*    U  22          2H5*        U  22 -10.162   0.308  11.479
  230    H4*    U  22           H4*        U  22 -10.658  -1.373  10.005
  231    H3*    U  22           H3*        U  22  -8.013  -1.957  11.285
  232    H2*    U  22          1H2*        U  22  -7.787  -3.933   9.924
  233   2HO*    U  22          2HO*        U  22 -10.377  -3.954  10.024
  234    H1*    U  22           H1*        U  22  -8.524  -2.717   7.542
  235    H3     U  22           H3         U  22  -4.028  -2.987   7.154
  236    H5     U  22           H5         U  22  -4.664   0.285   9.701
  237    H6     U  22           H6         U  22  -6.988  -0.328   9.785
  238   1H5*    U  23          H5*         U  23 -10.034  -5.490  11.910
  239   2H5*    U  23          2H5*        U  23  -9.773  -6.147  13.537
  240    H4*    U  23           H4*        U  23  -9.032  -7.740  11.919
  241    H3*    U  23           H3*        U  23  -6.787  -6.454  13.462
  242    H2*    U  23          1H2*        U  23  -5.260  -7.900  12.263
  243   2HO*    U  23          2HO*        U  23  -7.455  -9.417  12.078
  244    H1*    U  23           H1*        U  23  -6.425  -7.432   9.766
  245    H3     U  23           H3         U  23  -2.474  -5.175   9.818
  246    H5     U  23           H5         U  23  -5.233  -2.617  11.686
  247    H6     U  23           H6         U  23  -6.804  -4.440  11.685
  248   1H5*    C  24          H5*         C  24  -6.341 -10.479  13.033
  249   2H5*    C  24          2H5*        C  24  -5.928 -11.317  14.541
  250    H4*    C  24           H4*        C  24  -4.495 -11.965  12.660
  251    H3*    C  24           H3*        C  24  -3.248 -10.732  15.090
  252    H2*    C  24          1H2*        C  24  -1.089 -10.822  14.053
  253   2HO*    C  24          2HO*        C  24  -2.167 -12.926  12.841
  254    H1*    C  24           H1*        C  24  -1.932 -10.019  11.499
  255   1H4     C  24          1H4         C  24  -1.468  -4.393  14.877
  256   2H4     C  24          2H4         C  24   0.153  -4.721  14.314
  257    H5     C  24           H5         C  24  -3.289  -5.975  14.625
  258    H6     C  24           H6         C  24  -3.917  -8.169  13.766
  259   1H5*    C  25          H5*         C  25  -0.753 -14.293  14.041
  260   2H5*    C  25          2H5*        C  25  -0.826 -15.225  15.550
  261    H4*    C  25           H4*        C  25   1.429 -15.186  14.803
  262    H3*    C  25           H3*        C  25   0.868 -13.603  17.274
  263    H2*    C  25          1H2*        C  25   3.120 -12.778  17.334
  264   2HO*    C  25          2HO*        C  25   3.697 -15.063  16.283
  265    H1*    C  25           H1*        C  25   3.322 -12.179  14.630
  266   1H4     C  25          1H4         C  25  -0.515  -7.426  17.145
  267   2H4     C  25          2H4         C  25   1.109  -6.777  17.093
  268    H5     C  25           H5         C  25  -1.029  -9.719  16.558
  269    H6     C  25           H6         C  25  -0.093 -11.841  15.806
  270    H3T    C  25           H3T        C  25   0.957 -15.768  17.459
  Start of MODEL   26
    1   1H5*    G   1          H5*         G   1   6.776  -0.197  15.640
    2   2H5*    G   1          2H5*        G   1   6.538  -0.543  17.363
    3    H4*    G   1           H4*        G   1   8.920  -1.762  16.138
    4    H3*    G   1           H3*        G   1   6.192  -2.478  15.113
    5    H2*    G   1          1H2*        G   1   6.776  -4.816  15.256
    6   2HO*    G   1          2HO*        G   1   9.197  -3.967  14.870
    7    H1*    G   1           H1*        G   1   7.754  -4.678  17.829
    8    H8     G   1           H8         G   1   5.176  -2.057  17.851
    9    H1     G   1           H1         G   1   2.647  -7.943  17.826
   10   1H2     G   1          1H2         G   1   5.857  -8.981  17.058
   11   2H2     G   1          2H2         G   1   4.193  -9.438  17.356
   12    H5T    G   1           H5T        G   1   8.786   0.083  17.636
   13   1H5*    G   2          H5*         G   2   8.937  -4.791  13.130
   14   2H5*    G   2          2H5*        G   2   8.677  -4.832  11.375
   15    H4*    G   2           H4*        G   2   8.883  -7.065  12.278
   16    H3*    G   2           H3*        G   2   6.267  -6.311  11.039
   17    H2*    G   2          1H2*        G   2   5.337  -8.452  11.627
   18   2HO*    G   2          2HO*        G   2   7.787  -9.267  11.367
   19    H1*    G   2           H1*        G   2   6.264  -8.482  14.234
   20    H8     G   2           H8         G   2   5.663  -4.894  13.678
   21    H1     G   2           H1         G   2   0.222  -8.166  14.501
   22   1H2     G   2          1H2         G   2   2.208 -10.983  14.029
   23   2H2     G   2          2H2         G   2   0.603 -10.346  14.309
   24   1H5*    A   3          H5*         A   3   7.047 -10.077   8.904
   25   2H5*    A   3          2H5*        A   3   7.401  -9.471   7.274
   26    H4*    A   3           H4*        A   3   5.971 -11.210   6.851
   27    H3*    A   3           H3*        A   3   4.470  -8.635   6.824
   28    H2*    A   3          1H2*        A   3   2.357  -9.775   6.640
   29   2HO*    A   3          2HO*        A   3   3.799 -11.596   5.445
   30    H1*    A   3           H1*        A   3   2.806 -11.598   8.647
   31    H8     A   3           H8         A   3   4.805  -8.636   9.709
   32   1H6     A   3          1H6         A   3   1.314  -6.088  11.922
   33   2H6     A   3          2H6         A   3  -0.431  -6.224  11.957
   34    H2     A   3           H2         A   3  -1.504  -9.794   9.475
   35   1H5*    A   4          H5*         A   4   3.250 -10.529   2.973
   36   2H5*    A   4          2H5*        A   4   3.278  -9.228   1.767
   37    H4*    A   4           H4*        A   4   1.133 -10.384   1.822
   38    H3*    A   4           H3*        A   4   1.182  -7.466   2.507
   39    H2*    A   4          1H2*        A   4  -1.197  -7.524   2.901
   40   2HO*    A   4          2HO*        A   4  -2.303  -8.909   1.733
   41    H1*    A   4           H1*        A   4  -1.157  -9.805   4.469
   42    H8     A   4           H8         A   4   2.092  -8.144   5.206
   43   1H6     A   4          1H6         A   4   0.601  -4.915   8.516
   44   2H6     A   4          2H6         A   4  -0.977  -4.364   9.035
   45    H2     A   4           H2         A   4  -3.988  -6.696   6.659
   46   1H5*    G   5          H5*         G   5  -1.959  -8.432  -0.037
   47   2H5*    G   5          2H5*        G   5  -2.140  -7.316  -1.405
   48    H4*    G   5           H4*        G   5  -4.260  -7.740  -0.283
   49    H3*    G   5           H3*        G   5  -3.223  -4.917  -0.212
   50    H2*    G   5          1H2*        G   5  -5.251  -4.287   0.955
   51   2HO*    G   5          2HO*        G   5  -6.962  -5.670   1.140
   52    H1*    G   5           H1*        G   5  -5.083  -6.346   2.803
   53    H8     G   5           H8         G   5  -1.540  -5.679   2.231
   54    H1     G   5           H1         G   5  -4.364  -0.969   5.546
   55   1H2     G   5          1H2         G   5  -7.308  -2.417   4.520
   56   2H2     G   5          2H2         G   5  -6.529  -1.129   5.413
   57   1H5*    C   6          H5*         C   6  -7.035  -4.589  -0.465
   58   2H5*    C   6          2H5*        C   6  -7.502  -4.014  -2.077
   59    H4*    C   6           H4*        C   6  -8.862  -2.806  -0.657
   60    H3*    C   6           H3*        C   6  -6.495  -1.116  -1.417
   61    H2*    C   6          1H2*        C   6  -7.427   0.673  -0.080
   62   2HO*    C   6          2HO*        C   6  -9.699  -0.463  -0.648
   63    H1*    C   6           H1*        C   6  -7.925  -0.936   2.126
   64   1H4     C   6          1H4         C   6  -1.366  -0.319   2.090
   65   2H4     C   6          2H4         C   6  -1.941   1.074   2.977
   66    H5     C   6           H5         C   6  -2.824  -1.860   0.947
   67    H6     C   6           H6         C   6  -5.145  -2.399   0.434
   68   1H5*    A   7          H5*         A   7  -9.634   1.006  -2.105
   69   2H5*    A   7          2H5*        A   7  -9.754   2.089  -3.505
   70    H4*    A   7           H4*        A   7  -9.910   3.364  -1.481
   71    H3*    A   7           H3*        A   7  -7.385   3.809  -3.056
   72    H2*    A   7          1H2*        A   7  -6.724   5.445  -1.412
   73   2HO*    A   7          2HO*        A   7  -8.324   6.552  -0.539
   74    H1*    A   7           H1*        A   7  -7.477   3.890   0.797
   75    H8     A   7           H8         A   7  -6.025   1.275  -1.241
   76   1H6     A   7          1H6         A   7  -1.285   2.084  -0.493
   77   2H6     A   7          2H6         A   7  -0.405   3.446   0.167
   78    H2     A   7           H2         A   7  -3.404   6.577   1.253
   79   1H5*    G   8          H5*         G   8  -8.039   7.287  -2.030
   80   2H5*    G   8          2H5*        G   8  -8.646   8.299  -3.354
   81    H4*    G   8           H4*        G   8  -7.077   9.655  -2.399
   82    H3*    G   8           H3*        G   8  -5.829   8.255  -4.727
   83    H2*    G   8          1H2*        G   8  -3.687   9.218  -4.196
   84   2HO*    G   8          2HO*        G   8  -5.128  11.173  -3.264
   85    H1*    G   8           H1*        G   8  -3.783   8.712  -1.474
   86    H8     G   8           H8         G   8  -5.605   5.892  -3.066
   87    H1     G   8           H1         G   8   0.778   5.305  -3.376
   88   1H2     G   8          1H2         G   8   0.812   8.612  -2.388
   89   2H2     G   8          2H2         G   8   1.745   7.200  -2.830
   90   1H5*    G   9          H5*         G   9  -4.433  11.861  -5.454
   91   2H5*    G   9          2H5*        G   9  -4.772  12.432  -7.100
   92    H4*    G   9           H4*        G   9  -2.437  12.481  -6.837
   93    H3*    G   9           H3*        G   9  -3.282  10.121  -8.510
   94    H2*    G   9          1H2*        G   9  -0.947   9.600  -8.789
   95   2HO*    G   9          2HO*        G   9   0.526  11.135  -8.664
   96    H1*    G   9           H1*        G   9  -0.279  10.084  -6.094
   97    H8     G   9           H8         G   9  -3.527   8.326  -5.999
   98    H1     G   9           H1         G   9   1.381   4.433  -7.380
   99   1H2     G   9          1H2         G   9   3.168   7.355  -7.821
  100   2H2     G   9          2H2         G   9   3.180   5.607  -7.861
  101   1H5*    C  10          H5*         C  10  -0.117  12.349  -9.907
  102   2H5*    C  10          2H5*        C  10  -0.292  12.848 -11.600
  103    H4*    C  10           H4*        C  10   1.940  12.163 -11.315
  104    H3*    C  10           H3*        C  10   0.313  10.152 -12.838
  105    H2*    C  10          1H2*        C  10   2.272   8.766 -13.029
  106   2HO*    C  10          2HO*        C  10   3.573  10.913 -13.173
  107    H1*    C  10           H1*        C  10   3.098   9.101 -10.372
  108   1H4     C  10          1H4         C  10  -1.833   4.709 -10.214
  109   2H4     C  10          2H4         C  10  -0.353   3.786 -10.224
  110    H5     C  10           H5         C  10  -1.878   7.125 -10.435
  111    H6     C  10           H6         C  10  -0.511   9.122 -10.731
  112   1H5*    U  11          H5*         U  11   3.142  10.505 -14.969
  113   2H5*    U  11          2H5*        U  11   3.127  10.774 -16.723
  114    H4*    U  11           H4*        U  11   4.105   8.667 -16.399
  115    H3*    U  11           H3*        U  11   1.268   8.451 -17.355
  116    H2*    U  11          1H2*        U  11   1.379   6.082 -17.205
  117   2HO*    U  11          2HO*        U  11   3.259   4.991 -17.378
  118    H1*    U  11           H1*        U  11   3.203   6.012 -14.972
  119    H3     U  11           H3         U  11  -0.392   3.549 -13.702
  120    H5     U  11           H5         U  11  -1.554   7.565 -13.207
  121    H6     U  11           H6         U  11   0.459   8.206 -14.357
  122   1H5*    U  12          H5*         U  12   2.814   7.517 -22.303
  123   2H5*    U  12          2H5*        U  12   1.329   6.546 -22.333
  124    H4*    U  12           H4*        U  12   2.906   5.061 -23.086
  125    H3*    U  12           H3*        U  12   1.770   4.269 -20.807
  126    H2*    U  12          1H2*        U  12   3.388   5.248 -19.292
  127   2HO*    U  12          2HO*        U  12   3.820   2.576 -19.902
  128    H1*    U  12           H1*        U  12   5.624   4.209 -21.117
  129    H3     U  12           H3         U  12   8.562   5.892 -18.177
  130    H5     U  12           H5         U  12   5.996   9.123 -18.954
  131    H6     U  12           H6         U  12   4.641   7.631 -20.267
  132   1H5*    C  13          H5*         C  13   2.843   0.810 -19.140
  133   2H5*    C  13          2H5*        C  13   2.019  -0.276 -20.277
  134    H4*    C  13           H4*        C  13   1.350  -0.598 -17.930
  135    H3*    C  13           H3*        C  13  -0.332  -0.898 -19.968
  136    H2*    C  13          1H2*        C  13  -1.036   1.436 -20.093
  137   2HO*    C  13          2HO*        C  13  -2.987   1.179 -18.314
  138    H1*    C  13           H1*        C  13  -1.326   1.380 -17.036
  139   1H4     C  13          1H4         C  13  -0.734   7.712 -18.818
  140   2H4     C  13          2H4         C  13  -2.200   7.576 -17.879
  141    H5     C  13           H5         C  13   0.625   5.793 -19.407
  142    H6     C  13           H6         C  13   0.850   3.374 -19.198
  143   1H5*    G  14          H5*         G  14  -1.089  -3.422 -15.093
  144   2H5*    G  14          2H5*        G  14  -0.408  -2.093 -16.048
  145    H4*    G  14           H4*        G  14   0.516  -4.923 -16.421
  146    H3*    G  14           H3*        G  14   1.355  -3.057 -14.220
  147    H2*    G  14          1H2*        G  14   3.634  -3.742 -14.541
  148   2HO*    G  14          2HO*        G  14   2.502  -5.996 -15.266
  149    H1*    G  14           H1*        G  14   3.528  -3.722 -17.344
  150    H8     G  14           H8         G  14   5.525  -2.114 -16.900
  151    H1     G  14           H1         G  14   1.454   2.351 -14.758
  152   1H2     G  14          1H2         G  14  -0.891  -0.204 -14.841
  153   2H2     G  14          2H2         G  14  -0.565   1.479 -14.494
  154   1H5*    G  15          H5*         G  15   3.542  -5.016 -13.050
  155   2H5*    G  15          2H5*        G  15   3.656  -5.156 -11.286
  156    H4*    G  15           H4*        G  15   5.443  -3.788 -12.227
  157    H3*    G  15           H3*        G  15   3.536  -2.518 -10.303
  158    H2*    G  15          1H2*        G  15   4.733  -0.438 -10.505
  159   2HO*    G  15          2HO*        G  15   6.800  -0.509 -10.976
  160    H1*    G  15           H1*        G  15   4.820  -0.457 -13.268
  161    H8     G  15           H8         G  15   1.662  -2.169 -12.593
  162    H1     G  15           H1         G  15   1.281   4.109 -11.409
  163   1H2     G  15          1H2         G  15   4.713   4.043 -11.612
  164   2H2     G  15          2H2         G  15   3.277   5.004 -11.355
  165   1H5*    C  16          H5*         C  16   7.490  -1.509  -9.427
  166   2H5*    C  16          2H5*        C  16   7.850  -1.502  -7.690
  167    H4*    C  16           H4*        C  16   8.519   0.574  -8.796
  168    H3*    C  16           H3*        C  16   6.463   0.713  -6.616
  169    H2*    C  16          1H2*        C  16   6.307   3.099  -6.930
  170   2HO*    C  16          2HO*        C  16   7.816   4.223  -8.073
  171    H1*    C  16           H1*        C  16   6.168   3.005  -9.705
  172   1H4     C  16          1H4         C  16   0.210   0.930  -7.793
  173   2H4     C  16          2H4         C  16   0.121   2.679  -7.861
  174    H5     C  16           H5         C  16   2.303  -0.263  -8.108
  175    H6     C  16           H6         C  16   4.687  -0.019  -8.547
  176   1H5*    C  17          H5*         C  17   8.352   4.207  -6.283
  177   2H5*    C  17          2H5*        C  17   9.581   3.848  -5.054
  178    H4*    C  17           H4*        C  17   8.994   5.998  -4.538
  179    H3*    C  17           H3*        C  17   7.458   4.130  -2.775
  180    H2*    C  17          1H2*        C  17   6.255   5.978  -1.820
  181   2HO*    C  17          2HO*        C  17   8.462   7.298  -2.550
  182    H1*    C  17           H1*        C  17   5.673   7.226  -4.224
  183   1H4     C  17          1H4         C  17   1.739   1.937  -4.309
  184   2H4     C  17          2H4         C  17   0.782   3.217  -3.605
  185    H5     C  17           H5         C  17   4.081   2.173  -4.843
  186    H6     C  17           H6         C  17   5.988   3.692  -4.828
  187   1H5*    U  18          H5*         U  18   8.403   6.942  -0.138
  188   2H5*    U  18          2H5*        U  18   9.974   6.443   0.516
  189    H4*    U  18           H4*        U  18   9.242   6.370   2.651
  190    H3*    U  18           H3*        U  18   7.207   4.793   2.079
  191    H2*    U  18          1H2*        U  18   5.818   6.370   0.909
  192   2HO*    U  18          2HO*        U  18   5.019   7.150   3.507
  193    H1*    U  18           H1*        U  18   6.325   8.526   3.001
  194    H3     U  18           H3         U  18   4.894  11.862   0.437
  195    H5     U  18           H5         U  18   5.768   8.859  -2.363
  196    H6     U  18           H6         U  18   6.536   7.493  -0.554
  197   1H5*    U  19          H5*         U  19   3.362   5.314   5.824
  198   2H5*    U  19          2H5*        U  19   3.773   5.866   4.188
  199    H4*    U  19           H4*        U  19   4.325   7.766   6.372
  200    H3*    U  19           H3*        U  19   1.522   6.848   5.902
  201    H2*    U  19          1H2*        U  19   0.742   9.111   5.742
  202   2HO*    U  19          2HO*        U  19   2.780   9.534   7.384
  203    H1*    U  19           H1*        U  19   2.833  10.091   4.185
  204    H3     U  19           H3         U  19  -0.923   9.770   1.586
  205    H5     U  19           H5         U  19   1.003   6.053   1.296
  206    H6     U  19           H6         U  19   2.466   6.758   3.073
  207   1H5*    G  20          H5*         G  20  -0.398   9.396   7.336
  208   2H5*    G  20          2H5*        G  20  -0.752   8.858   8.988
  209    H4*    G  20           H4*        G  20  -2.831   9.376   8.149
  210    H3*    G  20           H3*        G  20  -2.370   6.426   7.991
  211    H2*    G  20          1H2*        G  20  -4.496   6.133   6.875
  212   2HO*    G  20          2HO*        G  20  -5.051   8.440   8.095
  213    H1*    G  20           H1*        G  20  -4.042   8.040   4.963
  214    H8     G  20           H8         G  20  -0.574   7.169   5.624
  215    H1     G  20           H1         G  20  -3.651   2.446   2.573
  216   1H2     G  20          1H2         G  20  -6.511   4.173   3.443
  217   2H2     G  20          2H2         G  20  -5.824   2.771   2.655
  218   1H5*    U  21          H5*         U  21  -6.044   6.340   9.147
  219   2H5*    U  21          2H5*        U  21  -6.298   5.522  10.702
  220    H4*    U  21           H4*        U  21  -7.766   4.555   9.110
  221    H3*    U  21           H3*        U  21  -5.510   2.779   9.960
  222    H2*    U  21          1H2*        U  21  -6.243   1.076   8.422
  223   2HO*    U  21          2HO*        U  21  -8.596   2.279   8.813
  224    H1*    U  21           H1*        U  21  -6.665   2.778   6.266
  225    H3     U  21           H3         U  21  -2.760   0.510   5.498
  226    H5     U  21           H5         U  21  -1.693   3.918   7.689
  227    H6     U  21           H6         U  21  -4.035   4.321   8.065
  228   1H5*    U  22          H5*         U  22  -8.831   0.610   9.665
  229   2H5*    U  22          2H5*        U  22  -9.362  -0.139  11.184
  230    H4*    U  22           H4*        U  22  -9.591  -1.755   9.469
  231    H3*    U  22           H3*        U  22  -7.256  -2.327  11.280
  232    H2*    U  22          1H2*        U  22  -6.831  -4.319  10.003
  233   2HO*    U  22          2HO*        U  22  -8.403  -5.299   8.935
  234    H1*    U  22           H1*        U  22  -7.294  -3.116   7.494
  235    H3     U  22           H3         U  22  -2.860  -4.165   7.790
  236    H5     U  22           H5         U  22  -3.257  -0.432   9.656
  237    H6     U  22           H6         U  22  -5.646  -0.700   9.518
  238   1H5*    U  23          H5*         U  23  -9.359  -5.653  10.317
  239   2H5*    U  23          2H5*        U  23 -10.065  -6.397  11.766
  240    H4*    U  23           H4*        U  23  -9.322  -8.211  10.558
  241    H3*    U  23           H3*        U  23  -7.244  -7.513  12.613
  242    H2*    U  23          1H2*        U  23  -5.897  -9.345  11.804
  243   2HO*    U  23          2HO*        U  23  -7.371 -10.930  11.345
  244    H1*    U  23           H1*        U  23  -6.232  -8.723   9.107
  245    H3     U  23           H3         U  23  -2.036  -7.254   9.809
  246    H5     U  23           H5         U  23  -4.425  -4.426  11.780
  247    H6     U  23           H6         U  23  -6.326  -5.833  11.336
  248   1H5*    C  24          H5*         C  24  -7.556 -11.356  13.048
  249   2H5*    C  24          2H5*        C  24  -7.540 -11.957  14.717
  250    H4*    C  24           H4*        C  24  -5.673 -12.848  13.491
  251    H3*    C  24           H3*        C  24  -4.939 -10.906  15.672
  252    H2*    C  24          1H2*        C  24  -2.622 -11.327  15.154
  253   2HO*    C  24          2HO*        C  24  -3.596 -13.664  14.367
  254    H1*    C  24           H1*        C  24  -2.975 -11.198  12.372
  255   1H4     C  24          1H4         C  24  -2.828  -4.915  14.346
  256   2H4     C  24          2H4         C  24  -1.149  -5.425  14.274
  257    H5     C  24           H5         C  24  -4.665  -6.483  14.038
  258    H6     C  24           H6         C  24  -5.241  -8.816  13.608
  259   1H5*    C  25          H5*         C  25  -2.353 -14.171  15.683
  260   2H5*    C  25          2H5*        C  25  -2.602 -15.008  17.228
  261    H4*    C  25           H4*        C  25  -0.293 -15.033  16.846
  262    H3*    C  25           H3*        C  25  -1.083 -13.031  18.927
  263    H2*    C  25          1H2*        C  25   1.193 -12.298  19.127
  264   2HO*    C  25          2HO*        C  25   1.758 -14.751  18.592
  265    H1*    C  25           H1*        C  25   1.743 -12.247  16.390
  266   1H4     C  25          1H4         C  25  -1.805  -6.801  17.577
  267   2H4     C  25          2H4         C  25  -0.122  -6.320  17.588
  268    H5     C  25           H5         C  25  -2.496  -9.121  17.371
  269    H6     C  25           H6         C  25  -1.715 -11.420  17.132
  270    H3T    C  25           H3T        C  25  -1.154 -15.175  19.422
  Start of MODEL   27
    1   1H5*    G   1          H5*         G   1   7.702   0.951  16.297
    2   2H5*    G   1          2H5*        G   1   8.579   1.620  14.910
    3    H4*    G   1           H4*        G   1   9.610  -0.347  14.894
    4    H3*    G   1           H3*        G   1   7.059  -0.985  13.452
    5    H2*    G   1          1H2*        G   1   7.654  -3.323  13.451
    6   2HO*    G   1          2HO*        G   1   9.704  -3.894  13.545
    7    H1*    G   1           H1*        G   1   8.407  -3.420  16.119
    8    H8     G   1           H8         G   1   5.622  -0.927  15.832
    9    H1     G   1           H1         G   1   3.637  -7.021  16.071
   10   1H2     G   1          1H2         G   1   6.980  -7.798  15.623
   11   2H2     G   1          2H2         G   1   5.348  -8.389  15.841
   12    H5T    G   1           H5T        G   1   6.877   1.111  13.587
   13   1H5*    G   2          H5*         G   2   9.661  -3.343  11.773
   14   2H5*    G   2          2H5*        G   2   9.843  -3.025  10.037
   15    H4*    G   2           H4*        G   2   9.550  -5.310  10.149
   16    H3*    G   2           H3*        G   2   6.875  -4.088   9.483
   17    H2*    G   2          1H2*        G   2   6.008  -6.337   9.354
   18   2HO*    G   2          2HO*        G   2   8.534  -6.907   8.779
   19    H1*    G   2           H1*        G   2   7.189  -7.158  11.742
   20    H8     G   2           H8         G   2   6.237  -3.566  12.145
   21    H1     G   2           H1         G   2   1.319  -7.604  12.901
   22   1H2     G   2          1H2         G   2   3.492  -9.995  11.636
   23   2H2     G   2          2H2         G   2   1.887  -9.632  12.229
   24   1H5*    A   3          H5*         A   3   7.799  -7.061   6.596
   25   2H5*    A   3          2H5*        A   3   7.874  -6.261   5.014
   26    H4*    A   3           H4*        A   3   6.746  -8.195   4.532
   27    H3*    A   3           H3*        A   3   4.759  -5.995   4.958
   28    H2*    A   3          1H2*        A   3   2.951  -7.571   4.670
   29   2HO*    A   3          2HO*        A   3   4.815  -8.887   3.290
   30    H1*    A   3           H1*        A   3   3.965  -9.463   6.399
   31    H8     A   3           H8         A   3   5.156  -6.165   7.750
   32   1H6     A   3          1H6         A   3   1.268  -5.015  10.413
   33   2H6     A   3          2H6         A   3  -0.360  -5.655  10.501
   34    H2     A   3           H2         A   3  -0.564  -9.088   7.638
   35   1H5*    A   4          H5*         A   4   3.710  -8.318   1.923
   36   2H5*    A   4          2H5*        A   4   3.404  -7.532   0.361
   37    H4*    A   4           H4*        A   4   1.628  -9.021   0.709
   38    H3*    A   4           H3*        A   4   0.884  -6.156   1.073
   39    H2*    A   4          1H2*        A   4  -1.329  -6.750   1.801
   40   2HO*    A   4          2HO*        A   4  -2.185  -8.526   1.025
   41    H1*    A   4           H1*        A   4  -0.569  -8.738   3.560
   42    H8     A   4           H8         A   4   2.151  -6.130   3.474
   43   1H6     A   4          1H6         A   4   0.533  -3.281   7.045
   44   2H6     A   4          2H6         A   4  -0.977  -3.192   7.926
   45    H2     A   4           H2         A   4  -3.582  -6.477   6.334
   46   1H5*    G   5          H5*         G   5  -2.060  -7.713  -0.771
   47   2H5*    G   5          2H5*        G   5  -2.752  -6.897  -2.187
   48    H4*    G   5           H4*        G   5  -4.481  -7.151  -0.596
   49    H3*    G   5           H3*        G   5  -3.511  -4.297  -0.718
   50    H2*    G   5          1H2*        G   5  -5.313  -3.768   0.818
   51   2HO*    G   5          2HO*        G   5  -7.044  -4.997   0.591
   52    H1*    G   5           H1*        G   5  -4.717  -5.896   2.526
   53    H8     G   5           H8         G   5  -1.379  -4.874   1.424
   54    H1     G   5           H1         G   5  -4.031  -0.601   5.406
   55   1H2     G   5          1H2         G   5  -6.965  -2.293   4.785
   56   2H2     G   5          2H2         G   5  -6.169  -0.972   5.611
   57   1H5*    C   6          H5*         C   6  -7.488  -4.090  -0.768
   58   2H5*    C   6          2H5*        C   6  -8.036  -3.487  -2.343
   59    H4*    C   6           H4*        C   6  -9.380  -2.376  -0.824
   60    H3*    C   6           H3*        C   6  -7.138  -0.578  -1.695
   61    H2*    C   6          1H2*        C   6  -7.973   1.137  -0.226
   62   2HO*    C   6          2HO*        C   6 -10.275  -0.136  -0.672
   63    H1*    C   6           H1*        C   6  -8.454  -0.566   1.941
   64   1H4     C   6          1H4         C   6  -1.934   0.322   2.079
   65   2H4     C   6          2H4         C   6  -2.595   1.696   2.933
   66    H5     C   6           H5         C   6  -3.312  -1.280   0.894
   67    H6     C   6           H6         C   6  -5.599  -1.898   0.315
   68   1H5*    A   7          H5*         A   7 -10.264   1.530  -1.843
   69   2H5*    A   7          2H5*        A   7 -10.479   2.807  -3.055
   70    H4*    A   7           H4*        A   7 -10.279   3.666  -0.758
   71    H3*    A   7           H3*        A   7  -8.293   4.533  -2.832
   72    H2*    A   7          1H2*        A   7  -7.065   5.750  -1.204
   73   2HO*    A   7          2HO*        A   7  -9.453   6.324  -0.357
   74    H1*    A   7           H1*        A   7  -7.713   4.036   1.028
   75    H8     A   7           H8         A   7  -6.218   1.725  -1.293
   76   1H6     A   7          1H6         A   7  -1.488   2.610  -0.541
   77   2H6     A   7          2H6         A   7  -0.635   3.921   0.246
   78    H2     A   7           H2         A   7  -3.714   6.816   1.710
   79   1H5*    G   8          H5*         G   8  -7.909   8.130  -4.999
   80   2H5*    G   8          2H5*        G   8  -6.960   6.770  -4.370
   81    H4*    G   8           H4*        G   8  -6.893   9.644  -3.477
   82    H3*    G   8           H3*        G   8  -5.032   7.982  -5.105
   83    H2*    G   8          1H2*        G   8  -3.117   8.824  -3.932
   84   2HO*    G   8          2HO*        G   8  -4.587  10.952  -3.640
   85    H1*    G   8           H1*        G   8  -4.105   8.493  -1.397
   86    H8     G   8           H8         G   8  -5.846   5.771  -3.050
   87    H1     G   8           H1         G   8   0.425   4.568  -2.516
   88   1H2     G   8          1H2         G   8   0.689   7.920  -1.774
   89   2H2     G   8          2H2         G   8   1.515   6.395  -2.007
   90   1H5*    G   9          H5*         G   9  -3.307  11.494  -5.118
   91   2H5*    G   9          2H5*        G   9  -3.206  12.271  -6.710
   92    H4*    G   9           H4*        G   9  -1.073  12.493  -5.837
   93    H3*    G   9           H3*        G   9  -1.172  10.203  -7.771
   94    H2*    G   9          1H2*        G   9   1.160   9.746  -7.321
   95   2HO*    G   9          2HO*        G   9   2.427  11.279  -6.537
   96    H1*    G   9           H1*        G   9   0.884   9.772  -4.578
   97    H8     G   9           H8         G   9  -2.447   8.629  -5.689
   98    H1     G   9           H1         G   9   2.019   4.065  -6.205
   99   1H2     G   9          1H2         G   9   4.275   6.633  -5.694
  100   2H2     G   9          2H2         G   9   4.030   4.928  -5.993
  101   1H5*    C  10          H5*         C  10   2.322  11.754  -8.515
  102   2H5*    C  10          2H5*        C  10   2.428  12.367 -10.177
  103    H4*    C  10           H4*        C  10   4.351  11.082  -9.847
  104    H3*    C  10           H3*        C  10   2.328   9.602 -11.499
  105    H2*    C  10          1H2*        C  10   3.867   7.746 -11.638
  106   2HO*    C  10          2HO*        C  10   5.654   9.735 -11.001
  107    H1*    C  10           H1*        C  10   4.504   7.744  -8.929
  108   1H4     C  10          1H4         C  10  -1.562   5.148  -9.362
  109   2H4     C  10          2H4         C  10  -0.436   3.822  -9.460
  110    H5     C  10           H5         C  10  -0.817   7.473  -9.272
  111    H6     C  10           H6         C  10   1.133   8.937  -9.329
  112   1H5*    U  11          H5*         U  11   5.071   8.570 -13.361
  113   2H5*    U  11          2H5*        U  11   5.204   9.047 -15.065
  114    H4*    U  11           H4*        U  11   5.351   6.726 -15.089
  115    H3*    U  11           H3*        U  11   2.587   7.614 -15.859
  116    H2*    U  11          1H2*        U  11   1.911   5.330 -16.054
  117   2HO*    U  11          2HO*        U  11   3.307   3.775 -16.517
  118    H1*    U  11           H1*        U  11   3.422   4.388 -13.834
  119    H3     U  11           H3         U  11  -0.882   3.642 -12.707
  120    H5     U  11           H5         U  11  -0.260   7.754 -11.995
  121    H6     U  11           H6         U  11   1.875   7.527 -13.078
  122   1H5*    U  12          H5*         U  12   3.926   6.655 -20.921
  123   2H5*    U  12          2H5*        U  12   2.271   6.051 -21.130
  124    H4*    U  12           H4*        U  12   3.475   4.297 -21.934
  125    H3*    U  12           H3*        U  12   2.171   3.609 -19.708
  126    H2*    U  12          1H2*        U  12   3.950   4.100 -18.139
  127   2HO*    U  12          2HO*        U  12   3.584   1.507 -18.776
  128    H1*    U  12           H1*        U  12   5.924   2.747 -20.059
  129    H3     U  12           H3         U  12   9.149   3.534 -17.044
  130    H5     U  12           H5         U  12   7.314   7.281 -17.509
  131    H6     U  12           H6         U  12   5.678   6.220 -18.918
  132   1H5*    C  13          H5*         C  13   2.418  -0.048 -18.262
  133   2H5*    C  13          2H5*        C  13   1.400  -0.872 -19.459
  134    H4*    C  13           H4*        C  13   0.661  -1.116 -17.099
  135    H3*    C  13           H3*        C  13  -0.989  -1.081 -19.192
  136    H2*    C  13          1H2*        C  13  -1.294   1.334 -19.281
  137   2HO*    C  13          2HO*        C  13  -3.309   1.595 -17.775
  138    H1*    C  13           H1*        C  13  -1.635   1.291 -16.231
  139   1H4     C  13          1H4         C  13   0.084   7.449 -17.892
  140   2H4     C  13          2H4         C  13  -1.410   7.551 -16.989
  141    H5     C  13           H5         C  13   1.107   5.329 -18.481
  142    H6     C  13           H6         C  13   0.902   2.904 -18.311
  143   1H5*    G  14          H5*         G  14  -2.327  -3.602 -14.428
  144   2H5*    G  14          2H5*        G  14  -1.375  -2.394 -15.309
  145    H4*    G  14           H4*        G  14  -0.989  -5.307 -15.857
  146    H3*    G  14           H3*        G  14  -0.094  -3.928 -13.366
  147    H2*    G  14          1H2*        G  14   2.141  -4.726 -13.613
  148   2HO*    G  14          2HO*        G  14   0.852  -6.776 -14.753
  149    H1*    G  14           H1*        G  14   2.298  -4.523 -16.415
  150    H8     G  14           H8         G  14   4.442  -3.258 -15.595
  151    H1     G  14           H1         G  14   0.755   1.705 -13.888
  152   1H2     G  14          1H2         G  14  -1.879  -0.519 -14.320
  153   2H2     G  14          2H2         G  14  -1.379   1.106 -13.904
  154   1H5*    G  15          H5*         G  15   1.539  -5.173  -9.914
  155   2H5*    G  15          2H5*        G  15   0.813  -3.991 -11.019
  156    H4*    G  15           H4*        G  15   3.631  -4.985 -11.333
  157    H3*    G  15           H3*        G  15   2.652  -2.933  -9.420
  158    H2*    G  15          1H2*        G  15   4.322  -1.355 -10.092
  159   2HO*    G  15          2HO*        G  15   5.533  -3.662 -11.000
  160    H1*    G  15           H1*        G  15   3.977  -1.636 -12.797
  161    H8     G  15           H8         G  15   0.587  -2.341 -11.856
  162    H1     G  15           H1         G  15   1.995   3.784 -10.714
  163   1H2     G  15          1H2         G  15   5.275   2.786 -11.086
  164   2H2     G  15          2H2         G  15   4.168   4.099 -10.755
  165   1H5*    C  16          H5*         C  16   6.839  -2.596  -8.431
  166   2H5*    C  16          2H5*        C  16   6.845  -2.975  -6.698
  167    H4*    C  16           H4*        C  16   7.983  -0.893  -7.103
  168    H3*    C  16           H3*        C  16   5.400  -0.681  -5.577
  169    H2*    C  16          1H2*        C  16   5.746   1.703  -5.420
  170   2HO*    C  16          2HO*        C  16   8.310   0.955  -5.717
  171    H1*    C  16           H1*        C  16   6.464   2.032  -8.096
  172   1H4     C  16          1H4         C  16  -0.075   1.250  -8.282
  173   2H4     C  16          2H4         C  16   0.180   2.926  -7.835
  174    H5     C  16           H5         C  16   1.755  -0.339  -8.437
  175    H6     C  16           H6         C  16   4.165  -0.630  -8.208
  176   1H5*    C  17          H5*         C  17   8.097   2.053  -4.202
  177   2H5*    C  17          2H5*        C  17   8.708   1.340  -2.697
  178    H4*    C  17           H4*        C  17   8.687   3.574  -2.203
  179    H3*    C  17           H3*        C  17   6.152   2.373  -1.152
  180    H2*    C  17          1H2*        C  17   5.455   4.570  -0.404
  181   2HO*    C  17          2HO*        C  17   7.872   5.577  -1.522
  182    H1*    C  17           H1*        C  17   5.900   5.781  -2.828
  183   1H4     C  17          1H4         C  17   0.969   1.612  -4.212
  184   2H4     C  17          2H4         C  17   0.204   3.142  -3.865
  185    H5     C  17           H5         C  17   3.330   1.221  -3.953
  186    H6     C  17           H6         C  17   5.458   2.221  -3.322
  187   1H5*    U  18          H5*         U  18   7.951   4.204   2.670
  188   2H5*    U  18          2H5*        U  18   7.981   2.739   3.666
  189    H4*    U  18           H4*        U  18   6.305   3.418   4.997
  190    H3*    U  18           H3*        U  18   4.605   3.732   3.036
  191    H2*    U  18          1H2*        U  18   5.507   5.667   1.938
  192   2HO*    U  18          2HO*        U  18   4.148   6.996   4.062
  193    H1*    U  18           H1*        U  18   6.126   7.182   4.466
  194    H3     U  18           H3         U  18   9.652   9.388   2.904
  195    H5     U  18           H5         U  18   9.024   6.453  -0.031
  196    H6     U  18           H6         U  18   7.288   5.536   1.354
  197   1H5*    U  19          H5*         U  19   4.168   6.690   5.708
  198   2H5*    U  19          2H5*        U  19   3.059   6.408   7.064
  199    H4*    U  19           H4*        U  19   3.471   8.746   6.889
  200    H3*    U  19           H3*        U  19   0.706   7.864   6.163
  201    H2*    U  19          1H2*        U  19   0.104  10.116   5.582
  202   2HO*    U  19          2HO*        U  19   1.834  10.739   7.414
  203    H1*    U  19           H1*        U  19   2.407  10.688   4.140
  204    H3     U  19           H3         U  19  -1.156   9.973   1.304
  205    H5     U  19           H5         U  19   0.809   6.289   1.734
  206    H6     U  19           H6         U  19   2.097   7.271   3.516
  207   1H5*    G  20          H5*         G  20  -1.222   9.781   7.439
  208   2H5*    G  20          2H5*        G  20  -1.590   9.600   9.166
  209    H4*    G  20           H4*        G  20  -3.694   9.824   8.415
  210    H3*    G  20           H3*        G  20  -3.117   6.897   8.224
  211    H2*    G  20          1H2*        G  20  -5.225   6.532   7.091
  212   2HO*    G  20          2HO*        G  20  -5.890   8.783   8.342
  213    H1*    G  20           H1*        G  20  -4.826   8.461   5.195
  214    H8     G  20           H8         G  20  -1.324   7.755   5.880
  215    H1     G  20           H1         G  20  -4.175   2.861   2.866
  216   1H2     G  20          1H2         G  20  -7.109   4.481   3.668
  217   2H2     G  20          2H2         G  20  -6.347   3.106   2.903
  218   1H5*    U  21          H5*         U  21  -6.826   6.434   8.859
  219   2H5*    U  21          2H5*        U  21  -7.100   5.487  10.335
  220    H4*    U  21           H4*        U  21  -8.215   4.442   8.489
  221    H3*    U  21           H3*        U  21  -5.893   2.934   9.637
  222    H2*    U  21          1H2*        U  21  -6.178   1.212   7.986
  223   2HO*    U  21          2HO*        U  21  -8.653   1.730   8.187
  224    H1*    U  21           H1*        U  21  -6.584   2.928   5.823
  225    H3     U  21           H3         U  21  -2.422   1.003   5.494
  226    H5     U  21           H5         U  21  -1.913   4.533   7.691
  227    H6     U  21           H6         U  21  -4.309   4.707   7.835
  228   1H5*    U  22          H5*         U  22  -9.642   0.118   9.867
  229   2H5*    U  22          2H5*        U  22  -9.337  -0.761  11.378
  230    H4*    U  22           H4*        U  22  -9.887  -2.202   9.434
  231    H3*    U  22           H3*        U  22  -7.302  -2.632  10.910
  232    H2*    U  22          1H2*        U  22  -6.801  -4.445   9.407
  233   2HO*    U  22          2HO*        U  22  -9.493  -4.494   9.215
  234    H1*    U  22           H1*        U  22  -7.629  -3.109   7.084
  235    H3     U  22           H3         U  22  -3.052  -3.605   7.189
  236    H5     U  22           H5         U  22  -3.914   0.127   8.923
  237    H6     U  22           H6         U  22  -6.232  -0.517   8.957
  238   1H5*    U  23          H5*         U  23  -9.124  -6.233   9.795
  239   2H5*    U  23          2H5*        U  23  -9.575  -7.062  11.297
  240    H4*    U  23           H4*        U  23  -8.808  -8.786   9.994
  241    H3*    U  23           H3*        U  23  -6.539  -7.879  11.742
  242    H2*    U  23          1H2*        U  23  -5.154  -9.585  10.718
  243   2HO*    U  23          2HO*        U  23  -7.416 -10.813  10.352
  244    H1*    U  23           H1*        U  23  -5.806  -8.867   8.132
  245    H3     U  23           H3         U  23  -1.810  -6.844   8.719
  246    H5     U  23           H5         U  23  -4.515  -4.393  10.788
  247    H6     U  23           H6         U  23  -6.204  -6.060  10.397
  248   1H5*    C  24          H5*         C  24  -6.241 -11.607  11.792
  249   2H5*    C  24          2H5*        C  24  -5.911 -12.407  13.341
  250    H4*    C  24           H4*        C  24  -4.151 -12.880  11.778
  251    H3*    C  24           H3*        C  24  -3.315 -11.099  14.062
  252    H2*    C  24          1H2*        C  24  -1.063 -11.237  13.187
  253   2HO*    C  24          2HO*        C  24  -1.997 -13.525  12.168
  254    H1*    C  24           H1*        C  24  -1.846 -10.726  10.554
  255   1H4     C  24          1H4         C  24  -2.179  -4.873  13.572
  256   2H4     C  24          2H4         C  24  -0.466  -5.162  13.316
  257    H5     C  24           H5         C  24  -3.855  -6.579  13.097
  258    H6     C  24           H6         C  24  -4.200  -8.867  12.320
  259   1H5*    C  25          H5*         C  25  -0.361 -13.974  13.793
  260   2H5*    C  25          2H5*        C  25  -0.523 -14.969  15.253
  261    H4*    C  25           H4*        C  25   1.763 -14.715  14.995
  262    H3*    C  25           H3*        C  25   0.733 -12.815  17.070
  263    H2*    C  25          1H2*        C  25   2.936 -11.890  17.334
  264   2HO*    C  25          2HO*        C  25   4.728 -12.920  16.598
  265    H1*    C  25           H1*        C  25   3.494 -11.693  14.615
  266   1H4     C  25          1H4         C  25  -0.727  -6.761  15.809
  267   2H4     C  25          2H4         C  25   0.877  -6.092  16.018
  268    H5     C  25           H5         C  25  -1.114  -9.120  15.394
  269    H6     C  25           H6         C  25  -0.047 -11.294  15.106
  270    H3T    C  25           H3T        C  25   1.132 -15.228  17.137
  Start of MODEL   28
    1   1H5*    G   1          H5*         G   1   7.782  -1.716  17.877
    2   2H5*    G   1          2H5*        G   1   9.346  -1.562  18.699
    3    H4*    G   1           H4*        G   1  10.397  -2.908  16.947
    4    H3*    G   1           H3*        G   1   7.665  -2.951  15.706
    5    H2*    G   1          1H2*        G   1   7.971  -5.252  15.116
    6   2HO*    G   1          2HO*        G   1   9.922  -6.017  14.760
    7    H1*    G   1           H1*        G   1   9.071  -6.048  17.549
    8    H8     G   1           H8         G   1   6.556  -3.706  18.698
    9    H1     G   1           H1         G   1   3.898  -8.983  16.213
   10   1H2     G   1          1H2         G   1   7.046  -9.580  14.928
   11   2H2     G   1          2H2         G   1   5.386 -10.114  15.068
   12    H5T    G   1           H5T        G   1   9.978  -0.158  17.257
   13   1H5*    G   2          H5*         G   2  10.428  -5.005  13.489
   14   2H5*    G   2          2H5*        G   2  10.695  -4.148  11.958
   15    H4*    G   2           H4*        G   2  10.777  -6.415  11.421
   16    H3*    G   2           H3*        G   2   8.228  -5.119  10.573
   17    H2*    G   2          1H2*        G   2   7.309  -7.234   9.872
   18   2HO*    G   2          2HO*        G   2   9.841  -7.826   9.491
   19    H1*    G   2           H1*        G   2   7.996  -8.646  12.133
   20    H8     G   2           H8         G   2   7.492  -5.159  13.329
   21    H1     G   2           H1         G   2   1.998  -8.325  12.461
   22   1H2     G   2          1H2         G   2   3.963 -10.650  10.783
   23   2H2     G   2          2H2         G   2   2.359 -10.188  11.301
   24   1H5*    A   3          H5*         A   3   8.692  -7.667   7.911
   25   2H5*    A   3          2H5*        A   3   8.827  -7.068   6.247
   26    H4*    A   3           H4*        A   3   7.145  -8.668   6.164
   27    H3*    A   3           H3*        A   3   5.898  -5.928   6.275
   28    H2*    A   3          1H2*        A   3   3.741  -7.004   6.107
   29   2HO*    A   3          2HO*        A   3   5.144  -8.869   4.862
   30    H1*    A   3           H1*        A   3   4.325  -8.969   8.010
   31    H8     A   3           H8         A   3   5.988  -5.928   9.308
   32   1H6     A   3          1H6         A   3   2.202  -3.827  11.510
   33   2H6     A   3          2H6         A   3   0.473  -4.104  11.458
   34    H2     A   3           H2         A   3  -0.191  -7.533   8.648
   35   1H5*    A   4          H5*         A   4   4.402  -7.912   2.687
   36   2H5*    A   4          2H5*        A   4   3.973  -6.704   1.462
   37    H4*    A   4           H4*        A   4   2.118  -8.214   2.144
   38    H3*    A   4           H3*        A   4   1.769  -5.234   2.407
   39    H2*    A   4          1H2*        A   4  -0.486  -5.657   3.180
   40   2HO*    A   4          2HO*        A   4  -1.062  -8.019   3.364
   41    H1*    A   4           H1*        A   4   0.264  -7.640   4.982
   42    H8     A   4           H8         A   4   3.125  -5.345   5.210
   43   1H6     A   4          1H6         A   4   1.236  -1.953   8.174
   44   2H6     A   4          2H6         A   4  -0.404  -1.606   8.685
   45    H2     A   4           H2         A   4  -3.059  -4.659   6.788
   46   1H5*    G   5          H5*         G   5  -1.697  -6.990   0.257
   47   2H5*    G   5          2H5*        G   5  -2.016  -5.889  -1.097
   48    H4*    G   5           H4*        G   5  -4.039  -6.465   0.150
   49    H3*    G   5           H3*        G   5  -3.232  -3.561   0.138
   50    H2*    G   5          1H2*        G   5  -5.289  -3.113   1.354
   51   2HO*    G   5          2HO*        G   5  -6.005  -5.445   0.226
   52    H1*    G   5           H1*        G   5  -4.839  -5.108   3.225
   53    H8     G   5           H8         G   5  -1.403  -4.096   2.522
   54    H1     G   5           H1         G   5  -4.585   0.373   5.849
   55   1H2     G   5          1H2         G   5  -7.394  -1.391   4.945
   56   2H2     G   5          2H2         G   5  -6.725  -0.010   5.787
   57   1H5*    C   6          H5*         C   6  -7.081  -3.832  -0.154
   58   2H5*    C   6          2H5*        C   6  -7.715  -3.208  -1.690
   59    H4*    C   6           H4*        C   6  -9.170  -2.414  -0.047
   60    H3*    C   6           H3*        C   6  -7.290  -0.259  -0.960
   61    H2*    C   6          1H2*        C   6  -8.355   1.268   0.586
   62   2HO*    C   6          2HO*        C   6 -10.406  -0.387   0.267
   63    H1*    C   6           H1*        C   6  -8.264  -0.468   2.741
   64   1H4     C   6          1H4         C   6  -1.970   1.282   1.930
   65   2H4     C   6          2H4         C   6  -2.650   2.533   2.947
   66    H5     C   6           H5         C   6  -3.280  -0.450   0.899
   67    H6     C   6           H6         C   6  -5.523  -1.368   0.642
   68   1H5*    A   7          H5*         A   7 -10.580   1.240  -0.916
   69   2H5*    A   7          2H5*        A   7 -11.350   2.214  -2.184
   70    H4*    A   7           H4*        A   7 -11.238   3.597  -0.302
   71    H3*    A   7           H3*        A   7  -9.146   4.300  -2.333
   72    H2*    A   7          1H2*        A   7  -8.284   5.994  -0.877
   73   2HO*    A   7          2HO*        A   7 -10.764   6.253  -0.210
   74    H1*    A   7           H1*        A   7  -8.588   4.524   1.518
   75    H8     A   7           H8         A   7  -7.139   2.020  -0.695
   76   1H6     A   7          1H6         A   7  -2.455   3.258  -0.442
   77   2H6     A   7          2H6         A   7  -1.618   4.687   0.132
   78    H2     A   7           H2         A   7  -4.766   7.525   1.598
   79   1H5*    G   8          H5*         G   8  -9.400   7.993  -5.181
   80   2H5*    G   8          2H5*        G   8  -8.415   6.538  -4.937
   81    H4*    G   8           H4*        G   8  -8.031   9.306  -3.889
   82    H3*    G   8           H3*        G   8  -6.412   7.414  -5.518
   83    H2*    G   8          1H2*        G   8  -4.385   8.010  -4.390
   84   2HO*    G   8          2HO*        G   8  -5.690  10.306  -4.013
   85    H1*    G   8           H1*        G   8  -5.352   7.880  -1.826
   86    H8     G   8           H8         G   8  -7.458   5.348  -3.320
   87    H1     G   8           H1         G   8  -1.366   3.393  -2.980
   88   1H2     G   8          1H2         G   8  -0.666   6.720  -2.365
   89   2H2     G   8          2H2         G   8  -0.042   5.098  -2.576
   90   1H5*    G   9          H5*         G   9  -4.125  10.658  -5.346
   91   2H5*    G   9          2H5*        G   9  -3.900  11.388  -6.948
   92    H4*    G   9           H4*        G   9  -1.778  11.298  -5.934
   93    H3*    G   9           H3*        G   9  -2.123   9.250  -8.098
   94    H2*    G   9          1H2*        G   9   0.108   8.434  -7.664
   95   2HO*    G   9          2HO*        G   9   0.410  10.923  -6.697
   96    H1*    G   9           H1*        G   9  -0.191   8.290  -4.919
   97    H8     G   9           H8         G   9  -3.600   7.577  -6.156
   98    H1     G   9           H1         G   9   0.415   2.647  -6.966
   99   1H2     G   9          1H2         G   9   2.885   4.924  -6.168
  100   2H2     G   9          2H2         G   9   2.487   3.276  -6.606
  101   1H5*    C  10          H5*         C  10   1.684  10.599  -8.069
  102   2H5*    C  10          2H5*        C  10   1.983  11.515  -9.559
  103    H4*    C  10           H4*        C  10   3.921  10.274  -9.214
  104    H3*    C  10           H3*        C  10   2.214   8.974 -11.316
  105    H2*    C  10          1H2*        C  10   3.877   7.247 -11.536
  106   2HO*    C  10          2HO*        C  10   5.913   7.516 -10.843
  107    H1*    C  10           H1*        C  10   4.248   6.895  -8.785
  108   1H4     C  10          1H4         C  10  -1.424   3.879 -10.354
  109   2H4     C  10          2H4         C  10  -0.185   2.656 -10.425
  110    H5     C  10           H5         C  10  -0.936   6.221  -9.921
  111    H6     C  10           H6         C  10   0.844   7.843  -9.537
  112   1H5*    U  11          H5*         U  11   5.334   8.795 -13.088
  113   2H5*    U  11          2H5*        U  11   5.529   9.544 -14.685
  114    H4*    U  11           H4*        U  11   6.022   7.304 -15.038
  115    H3*    U  11           H3*        U  11   3.188   7.846 -15.890
  116    H2*    U  11          1H2*        U  11   2.981   5.544 -16.511
  117   2HO*    U  11          2HO*        U  11   4.837   4.189 -16.544
  118    H1*    U  11           H1*        U  11   4.463   4.538 -14.307
  119    H3     U  11           H3         U  11   0.266   2.913 -13.800
  120    H5     U  11           H5         U  11   0.066   6.899 -12.450
  121    H6     U  11           H6         U  11   2.301   7.208 -13.284
  122   1H5*    U  12          H5*         U  12   4.056   7.819 -21.108
  123   2H5*    U  12          2H5*        U  12   2.474   7.045 -20.887
  124    H4*    U  12           H4*        U  12   3.643   5.645 -22.341
  125    H3*    U  12           H3*        U  12   2.700   4.471 -20.165
  126    H2*    U  12          1H2*        U  12   4.619   4.840 -18.734
  127   2HO*    U  12          2HO*        U  12   4.249   2.383 -19.618
  128    H1*    U  12           H1*        U  12   6.458   3.957 -21.018
  129    H3     U  12           H3         U  12   9.881   4.640 -18.202
  130    H5     U  12           H5         U  12   7.737   8.244 -18.029
  131    H6     U  12           H6         U  12   6.068   7.228 -19.431
  132   1H5*    C  13          H5*         C  13   3.736   0.579 -19.562
  133   2H5*    C  13          2H5*        C  13   2.447  -0.171 -20.524
  134    H4*    C  13           H4*        C  13   2.543  -0.808 -18.095
  135    H3*    C  13           H3*        C  13   0.354  -0.837 -19.589
  136    H2*    C  13          1H2*        C  13  -0.237   1.509 -19.313
  137   2HO*    C  13          2HO*        C  13  -1.455  -0.013 -17.227
  138    H1*    C  13           H1*        C  13   0.302   1.205 -16.313
  139   1H4     C  13          1H4         C  13   0.994   7.620 -17.678
  140   2H4     C  13          2H4         C  13  -0.250   7.483 -16.456
  141    H5     C  13           H5         C  13   2.027   5.677 -18.698
  142    H6     C  13           H6         C  13   2.070   3.242 -18.756
  143   1H5*    G  14          H5*         G  14   1.570  -2.973 -18.834
  144   2H5*    G  14          2H5*        G  14   1.083  -4.523 -19.545
  145    H4*    G  14           H4*        G  14   2.185  -5.739 -18.023
  146    H3*    G  14           H3*        G  14   1.390  -3.727 -15.932
  147    H2*    G  14          1H2*        G  14   3.251  -4.430 -14.600
  148   2HO*    G  14          2HO*        G  14   3.413  -6.575 -14.676
  149    H1*    G  14           H1*        G  14   5.040  -4.753 -16.778
  150    H8     G  14           H8         G  14   6.712  -2.962 -16.295
  151    H1     G  14           H1         G  14   2.166   1.223 -14.568
  152   1H2     G  14          1H2         G  14  -0.033  -1.352 -15.350
  153   2H2     G  14          2H2         G  14   0.161   0.288 -14.773
  154   1H5*    G  15          H5*         G  15   2.042  -6.622 -13.570
  155   2H5*    G  15          2H5*        G  15   1.164  -6.436 -12.040
  156    H4*    G  15           H4*        G  15   3.691  -5.853 -12.194
  157    H3*    G  15           H3*        G  15   1.604  -4.347 -10.664
  158    H2*    G  15          1H2*        G  15   3.263  -2.706 -10.035
  159   2HO*    G  15          2HO*        G  15   4.963  -4.443  -9.950
  160    H1*    G  15           H1*        G  15   4.244  -2.342 -12.586
  161    H8     G  15           H8         G  15   0.664  -3.266 -13.034
  162    H1     G  15           H1         G  15   1.513   2.841 -11.332
  163   1H2     G  15          1H2         G  15   4.769   1.912 -10.735
  164   2H2     G  15          2H2         G  15   3.582   3.194 -10.731
  165   1H5*    C  16          H5*         C  16   5.037  -4.597  -8.069
  166   2H5*    C  16          2H5*        C  16   4.444  -4.827  -6.414
  167    H4*    C  16           H4*        C  16   5.920  -2.854  -6.723
  168    H3*    C  16           H3*        C  16   3.144  -2.451  -5.628
  169    H2*    C  16          1H2*        C  16   3.649  -0.106  -5.413
  170   2HO*    C  16          2HO*        C  16   6.077  -0.988  -5.041
  171    H1*    C  16           H1*        C  16   4.949   0.099  -7.904
  172   1H4     C  16          1H4         C  16  -1.525   0.391  -9.166
  173   2H4     C  16          2H4         C  16  -1.005   2.042  -8.885
  174    H5     C  16           H5         C  16  -0.044  -1.506  -8.829
  175    H6     C  16           H6         C  16   2.207  -2.185  -8.177
  176   1H5*    C  17          H5*         C  17   6.186  -0.413  -3.385
  177   2H5*    C  17          2H5*        C  17   5.979  -0.822  -1.671
  178    H4*    C  17           H4*        C  17   6.406   1.526  -1.907
  179    H3*    C  17           H3*        C  17   3.649   0.826  -0.950
  180    H2*    C  17          1H2*        C  17   3.145   3.185  -0.822
  181   2HO*    C  17          2HO*        C  17   5.198   3.953  -0.176
  182    H1*    C  17           H1*        C  17   3.990   3.723  -3.381
  183   1H4     C  17          1H4         C  17  -1.290  -0.109  -4.419
  184   2H4     C  17          2H4         C  17  -1.921   1.514  -4.282
  185    H5     C  17           H5         C  17   1.031  -0.656  -4.016
  186    H6     C  17           H6         C  17   3.210   0.240  -3.392
  187   1H5*    U  18          H5*         U  18   6.601   3.801   0.812
  188   2H5*    U  18          2H5*        U  18   6.659   3.269   2.504
  189    H4*    U  18           H4*        U  18   7.019   5.445   2.863
  190    H3*    U  18           H3*        U  18   4.459   4.883   3.557
  191    H2*    U  18          1H2*        U  18   3.325   5.737   1.651
  192   2HO*    U  18          2HO*        U  18   3.951   7.956   3.324
  193    H1*    U  18           H1*        U  18   5.347   8.008   1.366
  194    H3     U  18           H3         U  18   4.062   9.114  -2.741
  195    H5     U  18           H5         U  18   2.743   5.149  -2.405
  196    H6     U  18           H6         U  18   3.744   5.063  -0.238
  197   1H5*    U  19          H5*         U  19   2.689   8.732   6.962
  198   2H5*    U  19          2H5*        U  19   1.814   7.579   5.936
  199    H4*    U  19           H4*        U  19   2.072  10.519   5.731
  200    H3*    U  19           H3*        U  19  -0.142   8.534   5.388
  201    H2*    U  19          1H2*        U  19  -1.199   9.948   3.757
  202   2HO*    U  19          2HO*        U  19  -0.199  11.860   5.137
  203    H1*    U  19           H1*        U  19   1.110  10.558   2.337
  204    H3     U  19           H3         U  19  -0.709   7.568  -0.456
  205    H5     U  19           H5         U  19   0.581   5.229   2.777
  206    H6     U  19           H6         U  19   1.113   7.265   3.940
  207   1H5*    G  20          H5*         G  20  -2.290  10.945   6.646
  208   2H5*    G  20          2H5*        G  20  -2.647  11.595   8.258
  209    H4*    G  20           H4*        G  20  -4.763  11.092   7.968
  210    H3*    G  20           H3*        G  20  -3.737   8.280   8.022
  211    H2*    G  20          1H2*        G  20  -5.869   7.490   7.183
  212   2HO*    G  20          2HO*        G  20  -6.721   9.799   8.231
  213    H1*    G  20           H1*        G  20  -5.942   9.220   5.062
  214    H8     G  20           H8         G  20  -2.326   9.056   5.454
  215    H1     G  20           H1         G  20  -4.710   3.551   3.187
  216   1H2     G  20          1H2         G  20  -7.763   4.844   4.152
  217   2H2     G  20          2H2         G  20  -6.888   3.510   3.433
  218   1H5*    U  21          H5*         U  21  -7.334   7.524   8.973
  219   2H5*    U  21          2H5*        U  21  -7.424   6.846  10.610
  220    H4*    U  21           H4*        U  21  -8.625   5.404   9.168
  221    H3*    U  21           H3*        U  21  -6.011   4.278  10.111
  222    H2*    U  21          1H2*        U  21  -6.391   2.296   8.805
  223   2HO*    U  21          2HO*        U  21  -8.479   1.775   8.874
  224    H1*    U  21           H1*        U  21  -7.238   3.619   6.506
  225    H3     U  21           H3         U  21  -3.018   2.110   5.673
  226    H5     U  21           H5         U  21  -2.510   5.746   7.698
  227    H6     U  21           H6         U  21  -4.878   5.757   8.124
  228   1H5*    U  22          H5*         U  22  -9.358   1.370  10.444
  229   2H5*    U  22          2H5*        U  22  -9.154   0.538  11.997
  230    H4*    U  22           H4*        U  22  -9.565  -0.994  10.121
  231    H3*    U  22           H3*        U  22  -6.986  -1.266  11.644
  232    H2*    U  22          1H2*        U  22  -6.408  -3.128  10.230
  233   2HO*    U  22          2HO*        U  22  -8.031  -4.324   9.577
  234    H1*    U  22           H1*        U  22  -7.211  -1.901   7.845
  235    H3     U  22           H3         U  22  -2.652  -2.091   7.862
  236    H5     U  22           H5         U  22  -3.639   1.412   9.947
  237    H6     U  22           H6         U  22  -5.935   0.691   9.918
  238   1H5*    U  23          H5*         U  23  -8.969  -4.945  11.020
  239   2H5*    U  23          2H5*        U  23  -8.693  -6.128  12.314
  240    H4*    U  23           H4*        U  23  -8.093  -6.918  10.036
  241    H3*    U  23           H3*        U  23  -5.984  -6.916  12.188
  242    H2*    U  23          1H2*        U  23  -4.484  -7.933  10.584
  243   2HO*    U  23          2HO*        U  23  -5.339  -8.399   8.434
  244    H1*    U  23           H1*        U  23  -5.131  -6.159   8.530
  245    H3     U  23           H3         U  23  -0.995  -5.034  10.088
  246    H5     U  23           H5         U  23  -3.710  -3.058  12.604
  247    H6     U  23           H6         U  23  -5.475  -4.323  11.564
  248   1H5*    C  24          H5*         C  24  -5.956 -11.049  10.599
  249   2H5*    C  24          2H5*        C  24  -5.649 -12.071  12.016
  250    H4*    C  24           H4*        C  24  -4.046 -12.382  10.146
  251    H3*    C  24           H3*        C  24  -3.022 -11.609  12.867
  252    H2*    C  24          1H2*        C  24  -0.782 -11.674  11.984
  253   2HO*    C  24          2HO*        C  24  -0.317 -12.900  10.301
  254    H1*    C  24           H1*        C  24  -1.402 -10.325   9.608
  255   1H4     C  24          1H4         C  24  -1.040  -5.537  14.110
  256   2H4     C  24          2H4         C  24   0.618  -5.870  13.642
  257    H5     C  24           H5         C  24  -2.896  -6.916  13.354
  258    H6     C  24           H6         C  24  -3.518  -8.857  12.011
  259   1H5*    C  25          H5*         C  25  -0.485 -14.553  11.068
  260   2H5*    C  25          2H5*        C  25  -0.439 -15.904  12.217
  261    H4*    C  25           H4*        C  25   1.774 -15.447  11.410
  262    H3*    C  25           H3*        C  25   1.291 -14.849  14.308
  263    H2*    C  25          1H2*        C  25   3.550 -14.066  14.529
  264   2HO*    C  25          2HO*        C  25   4.108 -15.847  12.794
  265    H1*    C  25           H1*        C  25   3.588 -12.600  12.149
  266   1H4     C  25          1H4         C  25   0.201  -8.838  16.376
  267   2H4     C  25          2H4         C  25   1.867  -8.330  16.514
  268    H5     C  25           H5         C  25  -0.490 -10.733  15.032
  269    H6     C  25           H6         C  25   0.279 -12.516  13.556
  270    H3T    C  25           H3T        C  25   1.373 -16.956  13.632
  Start of MODEL   29
    1   1H5*    G   1          H5*         G   1   6.452   1.349  18.536
    2   2H5*    G   1          2H5*        G   1   7.177   0.904  20.091
    3    H4*    G   1           H4*        G   1   8.859  -0.179  18.137
    4    H3*    G   1           H3*        G   1   5.990  -0.475  17.293
    5    H2*    G   1          1H2*        G   1   6.399  -2.784  16.804
    6   2HO*    G   1          2HO*        G   1   8.324  -3.147  15.972
    7    H1*    G   1           H1*        G   1   7.891  -3.309  19.108
    8    H8     G   1           H8         G   1   5.282  -1.111  20.382
    9    H1     G   1           H1         G   1   2.960  -6.851  18.717
   10   1H2     G   1          1H2         G   1   5.999  -7.276  17.137
   11   2H2     G   1          2H2         G   1   4.433  -7.949  17.530
   12    H5T    G   1           H5T        G   1   8.796   1.868  17.997
   13   1H5*    G   2          H5*         G   2   8.944  -1.935  14.251
   14   2H5*    G   2          2H5*        G   2   8.273  -1.642  12.635
   15    H4*    G   2           H4*        G   2   9.128  -3.933  12.962
   16    H3*    G   2           H3*        G   2   6.261  -3.517  12.185
   17    H2*    G   2          1H2*        G   2   5.935  -5.920  12.220
   18   2HO*    G   2          2HO*        G   2   7.744  -6.930  11.600
   19    H1*    G   2           H1*        G   2   7.032  -6.273  14.712
   20    H8     G   2           H8         G   2   5.796  -2.863  15.105
   21    H1     G   2           H1         G   2   0.991  -7.087  14.992
   22   1H2     G   2          1H2         G   2   3.369  -9.295  13.747
   23   2H2     G   2          2H2         G   2   1.700  -9.041  14.210
   24   1H5*    A   3          H5*         A   3   7.342  -6.610   9.977
   25   2H5*    A   3          2H5*        A   3   7.530  -6.116   8.283
   26    H4*    A   3           H4*        A   3   6.460  -8.130   8.084
   27    H3*    A   3           H3*        A   3   4.502  -5.900   7.878
   28    H2*    A   3          1H2*        A   3   2.626  -7.395   7.937
   29   2HO*    A   3          2HO*        A   3   2.995  -9.238   6.933
   30    H1*    A   3           H1*        A   3   3.464  -8.915  10.064
   31    H8     A   3           H8         A   3   4.938  -5.552  10.707
   32   1H6     A   3          1H6         A   3   1.170  -3.450  12.920
   33   2H6     A   3          2H6         A   3  -0.520  -3.879  13.086
   34    H2     A   3           H2         A   3  -1.054  -7.822  11.022
   35   1H5*    A   4          H5*         A   4   3.664  -8.862   5.209
   36   2H5*    A   4          2H5*        A   4   3.544  -8.377   3.507
   37    H4*    A   4           H4*        A   4   1.713  -9.776   3.906
   38    H3*    A   4           H3*        A   4   0.935  -6.889   3.762
   39    H2*    A   4          1H2*        A   4  -1.360  -7.479   4.253
   40   2HO*    A   4          2HO*        A   4  -0.789  -9.704   3.103
   41    H1*    A   4           H1*        A   4  -0.767  -9.039   6.435
   42    H8     A   4           H8         A   4   2.004  -6.543   6.302
   43   1H6     A   4          1H6         A   4  -0.077  -2.930   8.768
   44   2H6     A   4          2H6         A   4  -1.714  -2.613   9.299
   45    H2     A   4           H2         A   4  -4.176  -6.129   7.974
   46   1H5*    G   5          H5*         G   5  -1.771  -8.736   1.380
   47   2H5*    G   5          2H5*        G   5  -2.090  -7.909  -0.157
   48    H4*    G   5           H4*        G   5  -4.139  -8.166   1.051
   49    H3*    G   5           H3*        G   5  -3.164  -5.325   0.858
   50    H2*    G   5          1H2*        G   5  -5.183  -4.648   2.018
   51   2HO*    G   5          2HO*        G   5  -6.061  -7.006   1.052
   52    H1*    G   5           H1*        G   5  -4.909  -6.534   4.031
   53    H8     G   5           H8         G   5  -1.397  -5.840   3.307
   54    H1     G   5           H1         G   5  -4.255  -0.907   6.240
   55   1H2     G   5          1H2         G   5  -7.193  -2.516   5.432
   56   2H2     G   5          2H2         G   5  -6.425  -1.132   6.179
   57   1H5*    C   6          H5*         C   6  -6.967  -5.045   0.521
   58   2H5*    C   6          2H5*        C   6  -7.407  -4.765  -1.175
   59    H4*    C   6           H4*        C   6  -8.865  -3.395  -0.054
   60    H3*    C   6           H3*        C   6  -6.532  -1.814  -1.030
   61    H2*    C   6          1H2*        C   6  -7.276   0.150   0.131
   62   2HO*    C   6          2HO*        C   6  -9.353   0.435   0.471
   63    H1*    C   6           H1*        C   6  -7.909  -1.093   2.525
   64   1H4     C   6          1H4         C   6  -1.323  -1.078   2.516
   65   2H4     C   6          2H4         C   6  -1.788   0.440   3.248
   66    H5     C   6           H5         C   6  -2.908  -2.598   1.521
   67    H6     C   6           H6         C   6  -5.263  -2.984   1.034
   68   1H5*    A   7          H5*         A   7  -9.357   0.501  -1.433
   69   2H5*    A   7          2H5*        A   7  -9.653   1.343  -2.967
   70    H4*    A   7           H4*        A   7  -9.377   2.997  -1.305
   71    H3*    A   7           H3*        A   7  -6.956   2.778  -3.082
   72    H2*    A   7          1H2*        A   7  -5.943   4.549  -1.835
   73   2HO*    A   7          2HO*        A   7  -7.217   6.114  -1.193
   74    H1*    A   7           H1*        A   7  -7.027   3.739   0.690
   75    H8     A   7           H8         A   7  -5.510   0.729  -0.816
   76   1H6     A   7          1H6         A   7  -0.879   1.416   0.506
   77   2H6     A   7          2H6         A   7  -0.016   2.788   1.171
   78    H2     A   7           H2         A   7  -2.976   6.123   1.569
   79   1H5*    G   8          H5*         G   8  -7.837   6.455  -2.743
   80   2H5*    G   8          2H5*        G   8  -7.888   7.510  -4.168
   81    H4*    G   8           H4*        G   8  -6.407   8.442  -2.541
   82    H3*    G   8           H3*        G   8  -5.140   7.459  -5.064
   83    H2*    G   8          1H2*        G   8  -2.955   8.015  -4.214
   84   2HO*    G   8          2HO*        G   8  -4.255   9.836  -2.886
   85    H1*    G   8           H1*        G   8  -3.284   6.826  -1.753
   86    H8     G   8           H8         G   8  -5.421   4.764  -3.920
   87    H1     G   8           H1         G   8   0.809   3.575  -4.822
   88   1H2     G   8          1H2         G   8   1.308   6.465  -2.982
   89   2H2     G   8          2H2         G   8   2.033   5.135  -3.855
   90   1H5*    G   9          H5*         G   9  -3.156  10.390  -4.735
   91   2H5*    G   9          2H5*        G   9  -3.101  11.569  -6.060
   92    H4*    G   9           H4*        G   9  -0.896  10.878  -5.770
   93    H3*    G   9           H3*        G   9  -2.051   9.342  -8.103
   94    H2*    G   9          1H2*        G   9   0.180   8.476  -8.427
   95   2HO*    G   9          2HO*        G   9   1.867   9.584  -7.752
   96    H1*    G   9           H1*        G   9   0.564   7.971  -5.678
   97    H8     G   9           H8         G   9  -2.937   7.015  -6.434
   98    H1     G   9           H1         G   9   1.362   2.825  -8.695
   99   1H2     G   9          1H2         G   9   3.682   5.242  -7.872
  100   2H2     G   9          2H2         G   9   3.384   3.648  -8.525
  101   1H5*    C  10          H5*         C  10   1.629  11.061  -8.661
  102   2H5*    C  10          2H5*        C  10   1.637  12.133 -10.074
  103    H4*    C  10           H4*        C  10   3.698  11.037 -10.102
  104    H3*    C  10           H3*        C  10   1.828   9.833 -12.124
  105    H2*    C  10          1H2*        C  10   3.597   8.323 -12.767
  106   2HO*    C  10          2HO*        C  10   5.124  10.311 -11.909
  107    H1*    C  10           H1*        C  10   4.343   7.688 -10.147
  108   1H4     C  10          1H4         C  10  -1.208   4.338 -11.472
  109   2H4     C  10          2H4         C  10   0.115   3.237 -11.736
  110    H5     C  10           H5         C  10  -0.874   6.672 -10.875
  111    H6     C  10           H6         C  10   0.798   8.406 -10.494
  112   1H5*    U  11          H5*         U  11   4.637  10.186 -14.234
  113   2H5*    U  11          2H5*        U  11   4.624  11.137 -15.733
  114    H4*    U  11           H4*        U  11   5.204   9.014 -16.440
  115    H3*    U  11           H3*        U  11   2.254   9.406 -16.882
  116    H2*    U  11          1H2*        U  11   2.132   7.183 -17.760
  117   2HO*    U  11          2HO*        U  11   4.014   6.023 -18.262
  118    H1*    U  11           H1*        U  11   3.948   6.054 -15.892
  119    H3     U  11           H3         U  11  -0.010   4.024 -15.080
  120    H5     U  11           H5         U  11  -0.343   7.815 -13.269
  121    H6     U  11           H6         U  11   1.736   8.409 -14.321
  122   1H5*    U  12          H5*         U  12   2.552  10.301 -22.073
  123   2H5*    U  12          2H5*        U  12   1.013   9.436 -21.892
  124    H4*    U  12           H4*        U  12   2.096   8.342 -23.631
  125    H3*    U  12           H3*        U  12   1.419   6.780 -21.597
  126    H2*    U  12          1H2*        U  12   3.464   7.005 -20.318
  127   2HO*    U  12          2HO*        U  12   3.058   4.711 -21.470
  128    H1*    U  12           H1*        U  12   5.069   6.619 -22.899
  129    H3     U  12           H3         U  12   8.769   6.951 -20.388
  130    H5     U  12           H5         U  12   6.558  10.360 -19.330
  131    H6     U  12           H6         U  12   4.769   9.530 -20.707
  132   1H5*    C  13          H5*         C  13   2.900   2.965 -21.757
  133   2H5*    C  13          2H5*        C  13   1.538   2.206 -22.604
  134    H4*    C  13           H4*        C  13   2.108   1.283 -20.333
  135    H3*    C  13           H3*        C  13  -0.288   1.188 -21.470
  136    H2*    C  13          1H2*        C  13  -1.052   3.388 -20.762
  137   2HO*    C  13          2HO*        C  13  -1.722   1.564 -18.664
  138    H1*    C  13           H1*        C  13   0.020   2.767 -17.961
  139   1H4     C  13          1H4         C  13  -0.169   9.340 -18.430
  140   2H4     C  13          2H4         C  13  -1.202   8.889 -17.091
  141    H5     C  13           H5         C  13   0.888   7.692 -19.862
  142    H6     C  13           H6         C  13   1.169   5.309 -20.288
  143   1H5*    G  14          H5*         G  14   1.048  -0.869 -21.332
  144   2H5*    G  14          2H5*        G  14   0.603  -2.393 -22.123
  145    H4*    G  14           H4*        G  14   2.114  -3.587 -20.995
  146    H3*    G  14           H3*        G  14   1.447  -1.982 -18.535
  147    H2*    G  14          1H2*        G  14   3.578  -2.585 -17.621
  148   2HO*    G  14          2HO*        G  14   3.135  -4.787 -18.994
  149    H1*    G  14           H1*        G  14   4.984  -2.419 -20.092
  150    H8     G  14           H8         G  14   6.536  -0.510 -19.667
  151    H1     G  14           H1         G  14   2.058   2.802 -16.476
  152   1H2     G  14          1H2         G  14  -0.005   0.115 -17.243
  153   2H2     G  14          2H2         G  14   0.153   1.672 -16.459
  154   1H5*    G  15          H5*         G  15   2.944  -5.066 -16.801
  155   2H5*    G  15          2H5*        G  15   2.330  -5.238 -15.145
  156    H4*    G  15           H4*        G  15   4.715  -4.304 -15.580
  157    H3*    G  15           H3*        G  15   2.779  -3.330 -13.511
  158    H2*    G  15          1H2*        G  15   4.343  -1.600 -12.880
  159   2HO*    G  15          2HO*        G  15   6.205  -3.088 -13.343
  160    H1*    G  15           H1*        G  15   4.819  -0.732 -15.453
  161    H8     G  15           H8         G  15   1.335  -2.033 -15.512
  162    H1     G  15           H1         G  15   1.816   3.755 -12.834
  163   1H2     G  15          1H2         G  15   5.213   3.191 -12.928
  164   2H2     G  15          2H2         G  15   3.918   4.282 -12.499
  165   1H5*    C  16          H5*         C  16   6.725  -3.489 -11.485
  166   2H5*    C  16          2H5*        C  16   6.348  -4.150  -9.882
  167    H4*    C  16           H4*        C  16   7.603  -2.016  -9.837
  168    H3*    C  16           H3*        C  16   4.932  -2.177  -8.462
  169    H2*    C  16          1H2*        C  16   5.215   0.111  -7.764
  170   2HO*    C  16          2HO*        C  16   7.697  -0.451  -7.659
  171    H1*    C  16           H1*        C  16   6.160   1.022 -10.240
  172   1H4     C  16          1H4         C  16  -0.396   0.493 -10.833
  173   2H4     C  16          2H4         C  16  -0.090   2.132 -10.302
  174    H5     C  16           H5         C  16   1.356  -1.172 -11.014
  175    H6     C  16           H6         C  16   3.739  -1.595 -10.723
  176   1H5*    C  17          H5*         C  17   8.080  -0.347  -5.610
  177   2H5*    C  17          2H5*        C  17   7.773  -1.346  -4.176
  178    H4*    C  17           H4*        C  17   7.980   0.946  -3.526
  179    H3*    C  17           H3*        C  17   5.221  -0.198  -3.224
  180    H2*    C  17          1H2*        C  17   4.477   1.933  -2.364
  181   2HO*    C  17          2HO*        C  17   7.203   2.255  -2.049
  182    H1*    C  17           H1*        C  17   5.549   3.398  -4.432
  183   1H4     C  17          1H4         C  17   0.658  -0.086  -7.217
  184   2H4     C  17          2H4         C  17  -0.017   1.483  -6.835
  185    H5     C  17           H5         C  17   2.896  -0.739  -6.589
  186    H6     C  17           H6         C  17   4.941  -0.026  -5.473
  187   1H5*    U  18          H5*         U  18   7.224   2.409  -0.321
  188   2H5*    U  18          2H5*        U  18   7.592   1.160   0.883
  189    H4*    U  18           H4*        U  18   7.467   2.761   2.385
  190    H3*    U  18           H3*        U  18   4.991   1.723   2.435
  191    H2*    U  18          1H2*        U  18   3.826   3.235   1.019
  192   2HO*    U  18          2HO*        U  18   4.112   4.627   3.497
  193    H1*    U  18           H1*        U  18   5.442   5.638   1.926
  194    H3     U  18           H3         U  18   4.180   8.075  -1.551
  195    H5     U  18           H5         U  18   4.047   4.177  -3.093
  196    H6     U  18           H6         U  18   4.800   3.377  -0.964
  197   1H5*    U  19          H5*         U  19   2.805   3.755   7.237
  198   2H5*    U  19          2H5*        U  19   2.452   4.161   5.546
  199    H4*    U  19           H4*        U  19   4.039   5.845   7.482
  200    H3*    U  19           H3*        U  19   1.146   5.952   6.758
  201    H2*    U  19          1H2*        U  19   1.228   8.333   6.472
  202   2HO*    U  19          2HO*        U  19   3.130   8.125   8.296
  203    H1*    U  19           H1*        U  19   3.633   8.433   5.082
  204    H3     U  19           H3         U  19   0.181   9.201   2.166
  205    H5     U  19           H5         U  19   0.813   5.054   2.161
  206    H6     U  19           H6         U  19   2.278   5.354   4.044
  207   1H5*    G  20          H5*         G  20  -0.290   8.683   7.809
  208   2H5*    G  20          2H5*        G  20  -0.877   8.374   9.454
  209    H4*    G  20           H4*        G  20  -2.757   9.170   8.416
  210    H3*    G  20           H3*        G  20  -2.813   6.189   8.439
  211    H2*    G  20          1H2*        G  20  -4.800   6.148   7.069
  212   2HO*    G  20          2HO*        G  20  -6.113   7.807   7.172
  213    H1*    G  20           H1*        G  20  -3.846   7.838   5.140
  214    H8     G  20           H8         G  20  -0.641   6.559   6.238
  215    H1     G  20           H1         G  20  -4.004   2.041   3.188
  216   1H2     G  20          1H2         G  20  -6.688   4.181   3.624
  217   2H2     G  20          2H2         G  20  -6.112   2.648   3.007
  218   1H5*    U  21          H5*         U  21  -6.310   6.594   8.815
  219   2H5*    U  21          2H5*        U  21  -7.125   5.960  10.258
  220    H4*    U  21           H4*        U  21  -8.170   4.985   8.384
  221    H3*    U  21           H3*        U  21  -6.490   3.125   9.990
  222    H2*    U  21          1H2*        U  21  -6.727   1.355   8.395
  223   2HO*    U  21          2HO*        U  21  -9.057   2.480   8.001
  224    H1*    U  21           H1*        U  21  -6.400   2.879   6.095
  225    H3     U  21           H3         U  21  -2.571   0.428   6.785
  226    H5     U  21           H5         U  21  -2.009   4.076   8.757
  227    H6     U  21           H6         U  21  -4.341   4.548   8.403
  228   1H5*    U  22          H5*         U  22 -10.205   0.636   9.436
  229   2H5*    U  22          2H5*        U  22 -10.608   0.275  11.126
  230    H4*    U  22           H4*        U  22 -10.628  -1.780   9.994
  231    H3*    U  22           H3*        U  22  -8.125  -1.474  11.637
  232    H2*    U  22          1H2*        U  22  -7.450  -3.670  10.908
  233   2HO*    U  22          2HO*        U  22  -8.949  -5.087  10.439
  234    H1*    U  22           H1*        U  22  -8.119  -3.258   8.224
  235    H3     U  22           H3         U  22  -3.616  -3.160   8.209
  236    H5     U  22           H5         U  22  -4.717   0.563   9.815
  237    H6     U  22           H6         U  22  -6.993  -0.217   9.851
  238   1H5*    U  23          H5*         U  23  -9.962  -5.296  12.090
  239   2H5*    U  23          2H5*        U  23  -9.690  -5.974  13.707
  240    H4*    U  23           H4*        U  23  -8.956  -7.428  11.830
  241    H3*    U  23           H3*        U  23  -6.962  -6.616  13.934
  242    H2*    U  23          1H2*        U  23  -5.312  -7.950  12.791
  243   2HO*    U  23          2HO*        U  23  -7.300  -9.455  12.198
  244    H1*    U  23           H1*        U  23  -6.051  -7.111  10.209
  245    H3     U  23           H3         U  23  -1.961  -5.305  11.014
  246    H5     U  23           H5         U  23  -4.684  -2.737  12.916
  247    H6     U  23           H6         U  23  -6.405  -4.362  12.481
  248   1H5*    C  24          H5*         C  24  -6.553 -11.006  13.602
  249   2H5*    C  24          2H5*        C  24  -6.316 -11.545  15.276
  250    H4*    C  24           H4*        C  24  -4.544 -12.271  13.698
  251    H3*    C  24           H3*        C  24  -3.818 -10.672  16.135
  252    H2*    C  24          1H2*        C  24  -1.508 -10.752  15.473
  253   2HO*    C  24          2HO*        C  24  -0.799 -12.397  14.331
  254    H1*    C  24           H1*        C  24  -1.976 -10.214  12.764
  255   1H4     C  24          1H4         C  24  -2.453  -4.359  15.741
  256   2H4     C  24          2H4         C  24  -0.742  -4.606  15.453
  257    H5     C  24           H5         C  24  -4.099  -6.091  15.317
  258    H6     C  24           H6         C  24  -4.429  -8.376  14.535
  259   1H5*    C  25          H5*         C  25  -1.126 -13.865  15.369
  260   2H5*    C  25          2H5*        C  25  -0.871 -14.793  16.861
  261    H4*    C  25           H4*        C  25   1.231 -14.328  15.762
  262    H3*    C  25           H3*        C  25   0.794 -13.056  18.444
  263    H2*    C  25          1H2*        C  25   2.951 -12.016  18.299
  264   2HO*    C  25          2HO*        C  25   3.678 -14.115  17.092
  265    H1*    C  25           H1*        C  25   2.725 -11.255  15.610
  266   1H4     C  25          1H4         C  25  -0.762  -6.797  19.007
  267   2H4     C  25          2H4         C  25   0.841  -6.128  18.836
  268    H5     C  25           H5         C  25  -1.333  -9.042  18.281
  269    H6     C  25           H6         C  25  -0.475 -11.085  17.262
  270    H3T    C  25           H3T        C  25   1.084 -15.260  18.282
  Start of MODEL   30
    1   1H5*    G   1          H5*         G   1   6.544  -0.954  17.342
    2   2H5*    G   1          2H5*        G   1   8.038  -0.437  18.145
    3    H4*    G   1           H4*        G   1   9.359  -1.866  16.745
    4    H3*    G   1           H3*        G   1   6.845  -2.344  15.181
    5    H2*    G   1          1H2*        G   1   7.471  -4.643  14.880
    6   2HO*    G   1          2HO*        G   1   9.934  -3.618  15.216
    7    H1*    G   1           H1*        G   1   8.228  -5.096  17.509
    8    H8     G   1           H8         G   1   5.447  -2.853  18.068
    9    H1     G   1           H1         G   1   3.450  -8.514  15.821
   10   1H2     G   1          1H2         G   1   6.777  -8.995  14.991
   11   2H2     G   1          2H2         G   1   5.150  -9.635  14.977
   12    H5T    G   1           H5T        G   1   8.171  -0.187  15.432
   13   1H5*    G   2          H5*         G   2   9.775  -4.516  13.458
   14   2H5*    G   2          2H5*        G   2  10.180  -3.756  11.907
   15    H4*    G   2           H4*        G   2  10.236  -6.013  11.434
   16    H3*    G   2           H3*        G   2   7.684  -4.786  10.506
   17    H2*    G   2          1H2*        G   2   6.768  -6.928   9.914
   18   2HO*    G   2          2HO*        G   2   9.290  -7.538   9.537
   19    H1*    G   2           H1*        G   2   7.476  -8.242  12.231
   20    H8     G   2           H8         G   2   6.898  -4.640  13.117
   21    H1     G   2           H1         G   2   1.534  -8.121  12.844
   22   1H2     G   2          1H2         G   2   3.541 -10.526  11.337
   23   2H2     G   2          2H2         G   2   1.936 -10.073  11.868
   24   1H5*    A   3          H5*         A   3   8.365  -7.094   7.324
   25   2H5*    A   3          2H5*        A   3   8.117  -6.213   5.805
   26    H4*    A   3           H4*        A   3   6.588  -8.038   5.902
   27    H3*    A   3           H3*        A   3   5.218  -5.372   6.255
   28    H2*    A   3          1H2*        A   3   3.134  -6.585   6.258
   29   2HO*    A   3          2HO*        A   3   3.220  -8.242   4.891
   30    H1*    A   3           H1*        A   3   4.050  -8.572   8.006
   31    H8     A   3           H8         A   3   5.584  -5.438   9.249
   32   1H6     A   3          1H6         A   3   1.864  -3.693  11.851
   33   2H6     A   3          2H6         A   3   0.164  -4.111  11.938
   34    H2     A   3           H2         A   3  -0.474  -7.559   9.154
   35   1H5*    A   4          H5*         A   4   3.927  -7.676   2.702
   36   2H5*    A   4          2H5*        A   4   3.233  -6.650   1.432
   37    H4*    A   4           H4*        A   4   1.808  -8.561   2.101
   38    H3*    A   4           H3*        A   4   0.786  -5.756   2.185
   39    H2*    A   4          1H2*        A   4  -1.286  -6.482   3.171
   40   2HO*    A   4          2HO*        A   4  -0.864  -8.633   1.815
   41    H1*    A   4           H1*        A   4  -0.170  -8.163   5.063
   42    H8     A   4           H8         A   4   2.394  -5.524   4.919
   43   1H6     A   4          1H6         A   4   0.323  -2.202   7.790
   44   2H6     A   4          2H6         A   4  -1.298  -2.008   8.423
   45    H2     A   4           H2         A   4  -3.694  -5.496   6.953
   46   1H5*    G   5          H5*         G   5  -2.327  -7.684   0.035
   47   2H5*    G   5          2H5*        G   5  -2.785  -6.687  -1.359
   48    H4*    G   5           H4*        G   5  -4.691  -7.113   0.068
   49    H3*    G   5           H3*        G   5  -3.776  -4.252  -0.096
   50    H2*    G   5          1H2*        G   5  -5.633  -3.655   1.339
   51   2HO*    G   5          2HO*        G   5  -6.573  -6.051   0.429
   52    H1*    G   5           H1*        G   5  -5.110  -5.638   3.203
   53    H8     G   5           H8         G   5  -1.714  -4.855   2.089
   54    H1     G   5           H1         G   5  -4.243  -0.152   5.638
   55   1H2     G   5          1H2         G   5  -7.238  -1.773   5.104
   56   2H2     G   5          2H2         G   5  -6.404  -0.416   5.832
   57   1H5*    C   6          H5*         C   6  -7.630  -4.014   0.059
   58   2H5*    C   6          2H5*        C   6  -8.265  -3.593  -1.544
   59    H4*    C   6           H4*        C   6  -9.556  -2.307  -0.156
   60    H3*    C   6           H3*        C   6  -7.296  -0.643  -1.196
   61    H2*    C   6          1H2*        C   6  -8.025   1.215   0.160
   62   2HO*    C   6          2HO*        C   6 -10.375  -0.026  -0.049
   63    H1*    C   6           H1*        C   6  -8.329  -0.245   2.487
   64   1H4     C   6          1H4         C   6  -1.783  -0.047   1.686
   65   2H4     C   6          2H4         C   6  -2.180   1.346   2.666
   66    H5     C   6           H5         C   6  -3.458  -1.485   0.704
   67    H6     C   6           H6         C   6  -5.849  -1.889   0.468
   68   1H5*    A   7          H5*         A   7 -10.386   1.708  -1.627
   69   2H5*    A   7          2H5*        A   7 -10.448   2.710  -3.090
   70    H4*    A   7           H4*        A   7 -10.328   4.109  -1.143
   71    H3*    A   7           H3*        A   7  -7.815   4.156  -2.813
   72    H2*    A   7          1H2*        A   7  -7.013   5.875  -1.319
   73   2HO*    A   7          2HO*        A   7  -9.577   6.410  -1.099
   74    H1*    A   7           H1*        A   7  -7.951   4.572   1.010
   75    H8     A   7           H8         A   7  -6.496   1.800  -0.868
   76   1H6     A   7          1H6         A   7  -1.774   2.466   0.110
   77   2H6     A   7          2H6         A   7  -0.878   3.803   0.803
   78    H2     A   7           H2         A   7  -3.830   7.046   1.699
   79   1H5*    G   8          H5*         G   8  -8.423   7.763  -2.212
   80   2H5*    G   8          2H5*        G   8  -8.836   8.745  -3.630
   81    H4*    G   8           H4*        G   8  -7.235  10.039  -2.672
   82    H3*    G   8           H3*        G   8  -5.910   8.318  -4.719
   83    H2*    G   8          1H2*        G   8  -3.730   9.061  -4.023
   84   2HO*    G   8          2HO*        G   8  -5.042  11.234  -3.371
   85    H1*    G   8           H1*        G   8  -4.146   8.791  -1.308
   86    H8     G   8           H8         G   8  -6.197   6.156  -3.018
   87    H1     G   8           H1         G   8  -0.023   4.591  -2.305
   88   1H2     G   8          1H2         G   8   0.401   7.914  -1.449
   89   2H2     G   8          2H2         G   8   1.146   6.351  -1.691
   90   1H5*    G   9          H5*         G   9  -4.060  11.541  -5.328
   91   2H5*    G   9          2H5*        G   9  -4.032  12.205  -6.973
   92    H4*    G   9           H4*        G   9  -1.791  11.888  -6.325
   93    H3*    G   9           H3*        G   9  -2.665   9.731  -8.245
   94    H2*    G   9          1H2*        G   9  -0.383   8.934  -8.196
   95   2HO*    G   9          2HO*        G   9   0.063  11.501  -7.400
   96    H1*    G   9           H1*        G   9  -0.175   9.105  -5.405
   97    H8     G   9           H8         G   9  -3.617   7.938  -5.866
   98    H1     G   9           H1         G   9   0.695   3.406  -7.289
   99   1H2     G   9          1H2         G   9   2.988   5.979  -7.154
  100   2H2     G   9          2H2         G   9   2.699   4.275  -7.419
  101   1H5*    C  10          H5*         C  10   1.043  11.293  -8.937
  102   2H5*    C  10          2H5*        C  10   1.054  12.105 -10.515
  103    H4*    C  10           H4*        C  10   3.144  11.120 -10.364
  104    H3*    C  10           H3*        C  10   1.337   9.449 -12.076
  105    H2*    C  10          1H2*        C  10   3.117   7.850 -12.362
  106   2HO*    C  10          2HO*        C  10   5.167   8.412 -12.088
  107    H1*    C  10           H1*        C  10   3.840   7.767  -9.677
  108   1H4     C  10          1H4         C  10  -1.831   4.393 -10.206
  109   2H4     C  10          2H4         C  10  -0.538   3.224 -10.227
  110    H5     C  10           H5         C  10  -1.416   6.793 -10.159
  111    H6     C  10           H6         C  10   0.313   8.512 -10.175
  112   1H5*    U  11          H5*         U  11   4.291   9.262 -13.936
  113   2H5*    U  11          2H5*        U  11   4.435   9.771 -15.629
  114    H4*    U  11           H4*        U  11   5.098   7.542 -15.626
  115    H3*    U  11           H3*        U  11   2.265   7.787 -16.593
  116    H2*    U  11          1H2*        U  11   2.149   5.414 -16.823
  117   2HO*    U  11          2HO*        U  11   3.970   4.143 -16.872
  118    H1*    U  11           H1*        U  11   3.691   4.820 -14.507
  119    H3     U  11           H3         U  11  -0.477   3.077 -13.898
  120    H5     U  11           H5         U  11  -0.740   7.122 -12.762
  121    H6     U  11           H6         U  11   1.460   7.440 -13.677
  122   1H5*    U  12          H5*         U  12   3.492   7.052 -21.672
  123   2H5*    U  12          2H5*        U  12   1.947   6.184 -21.575
  124    H4*    U  12           H4*        U  12   3.404   4.691 -22.601
  125    H3*    U  12           H3*        U  12   2.248   3.777 -20.387
  126    H2*    U  12          1H2*        U  12   3.966   4.501 -18.830
  127   2HO*    U  12          2HO*        U  12   5.471   2.356 -19.010
  128    H1*    U  12           H1*        U  12   6.063   3.411 -20.787
  129    H3     U  12           H3         U  12   9.205   4.523 -17.787
  130    H5     U  12           H5         U  12   7.000   8.065 -18.261
  131    H6     U  12           H6         U  12   5.466   6.832 -19.644
  132   1H5*    C  13          H5*         C  13   3.264   0.272 -18.893
  133   2H5*    C  13          2H5*        C  13   2.343  -0.765 -20.000
  134    H4*    C  13           H4*        C  13   1.783  -1.128 -17.639
  135    H3*    C  13           H3*        C  13  -0.025  -1.243 -19.597
  136    H2*    C  13          1H2*        C  13  -0.706   1.078 -19.565
  137   2HO*    C  13          2HO*        C  13  -2.261  -0.511 -17.830
  138    H1*    C  13           H1*        C  13  -0.718   0.997 -16.503
  139   1H4     C  13          1H4         C  13   0.182   7.281 -18.330
  140   2H4     C  13          2H4         C  13  -1.221   7.242 -17.288
  141    H5     C  13           H5         C  13   1.353   5.271 -19.014
  142    H6     C  13           H6         C  13   1.423   2.843 -18.819
  143   1H5*    G  14          H5*         G  14   1.405  -2.912 -18.733
  144   2H5*    G  14          2H5*        G  14   1.330  -4.496 -19.529
  145    H4*    G  14           H4*        G  14   2.503  -5.531 -17.919
  146    H3*    G  14           H3*        G  14   1.131  -3.779 -15.897
  147    H2*    G  14          1H2*        G  14   2.980  -4.032 -14.422
  148   2HO*    G  14          2HO*        G  14   3.259  -6.221 -14.469
  149    H1*    G  14           H1*        G  14   4.974  -4.233 -16.489
  150    H8     G  14           H8         G  14   6.483  -2.341 -15.888
  151    H1     G  14           H1         G  14   1.561   1.469 -14.347
  152   1H2     G  14          1H2         G  14  -0.400  -1.249 -15.246
  153   2H2     G  14          2H2         G  14  -0.353   0.396 -14.650
  154   1H5*    G  15          H5*         G  15   1.509  -6.154 -11.471
  155   2H5*    G  15          2H5*        G  15   0.830  -4.662 -12.148
  156    H4*    G  15           H4*        G  15   3.753  -5.320 -11.821
  157    H3*    G  15           H3*        G  15   1.909  -3.694 -10.130
  158    H2*    G  15          1H2*        G  15   3.558  -1.954  -9.910
  159   2HO*    G  15          2HO*        G  15   5.262  -3.840 -10.079
  160    H1*    G  15           H1*        G  15   4.200  -1.804 -12.582
  161    H8     G  15           H8         G  15   0.647  -2.850 -12.609
  162    H1     G  15           H1         G  15   1.411   3.361 -11.262
  163   1H2     G  15          1H2         G  15   4.744   2.563 -10.924
  164   2H2     G  15          2H2         G  15   3.512   3.803 -10.877
  165   1H5*    C  16          H5*         C  16   5.896  -3.444  -8.355
  166   2H5*    C  16          2H5*        C  16   5.639  -3.606  -6.607
  167    H4*    C  16           H4*        C  16   6.909  -1.589  -7.257
  168    H3*    C  16           H3*        C  16   4.349  -1.294  -5.714
  169    H2*    C  16          1H2*        C  16   4.632   1.097  -5.755
  170   2HO*    C  16          2HO*        C  16   7.188   0.413  -5.875
  171    H1*    C  16           H1*        C  16   5.402   1.242  -8.442
  172   1H4     C  16          1H4         C  16  -1.162   0.518  -8.521
  173   2H4     C  16          2H4         C  16  -0.840   2.239  -8.607
  174    H5     C  16           H5         C  16   0.609  -1.114  -8.189
  175    H6     C  16           H6         C  16   3.012  -1.414  -7.896
  176   1H5*    C  17          H5*         C  17   7.231   1.377  -4.356
  177   2H5*    C  17          2H5*        C  17   7.714   0.812  -2.744
  178    H4*    C  17           H4*        C  17   7.723   3.172  -2.700
  179    H3*    C  17           H3*        C  17   5.508   1.917  -1.145
  180    H2*    C  17          1H2*        C  17   4.533   4.054  -0.665
  181   2HO*    C  17          2HO*        C  17   7.069   4.858  -1.053
  182    H1*    C  17           H1*        C  17   4.668   5.055  -3.226
  183   1H4     C  17          1H4         C  17   0.019   0.417  -3.774
  184   2H4     C  17          2H4         C  17  -0.814   1.810  -3.129
  185    H5     C  17           H5         C  17   2.416   0.342  -4.070
  186    H6     C  17           H6         C  17   4.497   1.578  -3.795
  187   1H5*    U  18          H5*         U  18   6.903   5.512   0.753
  188   2H5*    U  18          2H5*        U  18   8.127   4.713   1.760
  189    H4*    U  18           H4*        U  18   7.620   5.975   3.482
  190    H3*    U  18           H3*        U  18   5.541   4.364   3.779
  191    H2*    U  18          1H2*        U  18   4.005   5.379   2.254
  192   2HO*    U  18          2HO*        U  18   3.079   5.548   4.390
  193    H1*    U  18           H1*        U  18   4.766   8.190   3.133
  194    H3     U  18           H3         U  18   2.961  10.129  -0.428
  195    H5     U  18           H5         U  18   3.717   6.235  -1.796
  196    H6     U  18           H6         U  18   4.685   5.744   0.338
  197   1H5*    U  19          H5*         U  19   4.398   7.919   5.169
  198   2H5*    U  19          2H5*        U  19   5.240   8.208   6.702
  199    H4*    U  19           H4*        U  19   3.545   9.364   7.591
  200    H3*    U  19           H3*        U  19   1.648   7.433   6.299
  201    H2*    U  19          1H2*        U  19  -0.074   9.111   6.326
  202   2HO*    U  19          2HO*        U  19   0.246  11.081   7.444
  203    H1*    U  19           H1*        U  19   1.549  11.214   5.460
  204    H3     U  19           H3         U  19  -0.820  10.474   1.735
  205    H5     U  19           H5         U  19   1.645   7.088   2.010
  206    H6     U  19           H6         U  19   2.383   7.896   4.152
  207   1H5*    G  20          H5*         G  20  -0.808   9.629   8.283
  208   2H5*    G  20          2H5*        G  20  -1.343   8.682   9.683
  209    H4*    G  20           H4*        G  20  -3.210   9.780   8.619
  210    H3*    G  20           H3*        G  20  -3.160   6.791   8.599
  211    H2*    G  20          1H2*        G  20  -5.227   6.753   7.342
  212   2HO*    G  20          2HO*        G  20  -5.487   9.192   8.435
  213    H1*    G  20           H1*        G  20  -4.393   8.532   5.421
  214    H8     G  20           H8         G  20  -1.148   7.162   6.283
  215    H1     G  20           H1         G  20  -4.719   2.870   3.139
  216   1H2     G  20          1H2         G  20  -7.356   4.994   3.857
  217   2H2     G  20          2H2         G  20  -6.831   3.490   3.130
  218   1H5*    U  21          H5*         U  21  -6.537   6.957   9.174
  219   2H5*    U  21          2H5*        U  21  -7.264   6.149  10.576
  220    H4*    U  21           H4*        U  21  -8.206   5.157   8.665
  221    H3*    U  21           H3*        U  21  -6.196   3.403  10.028
  222    H2*    U  21          1H2*        U  21  -6.482   1.731   8.329
  223   2HO*    U  21          2HO*        U  21  -8.909   2.749   8.227
  224    H1*    U  21           H1*        U  21  -6.505   3.497   6.161
  225    H3     U  21           H3         U  21  -2.554   1.160   6.101
  226    H5     U  21           H5         U  21  -1.871   4.543   8.470
  227    H6     U  21           H6         U  21  -4.238   4.972   8.422
  228   1H5*    U  22          H5*         U  22  -9.726   0.918   9.422
  229   2H5*    U  22          2H5*        U  22 -10.186   0.357  11.041
  230    H4*    U  22           H4*        U  22 -10.293  -1.559   9.767
  231    H3*    U  22           H3*        U  22  -7.632  -1.515  11.169
  232    H2*    U  22          1H2*        U  22  -7.119  -3.631  10.110
  233   2HO*    U  22          2HO*        U  22  -9.794  -3.794  10.015
  234    H1*    U  22           H1*        U  22  -7.928  -2.826   7.576
  235    H3     U  22           H3         U  22  -3.417  -2.651   7.341
  236    H5     U  22           H5         U  22  -4.493   0.853   9.381
  237    H6     U  22           H6         U  22  -6.748   0.018   9.470
  238   1H5*    U  23          H5*         U  23  -9.385  -5.156  11.232
  239   2H5*    U  23          2H5*        U  23  -9.086  -6.182  12.648
  240    H4*    U  23           H4*        U  23  -8.415  -7.182  10.473
  241    H3*    U  23           H3*        U  23  -6.356  -6.877  12.650
  242    H2*    U  23          1H2*        U  23  -4.762  -7.941  11.192
  243   2HO*    U  23          2HO*        U  23  -6.816  -9.232  10.325
  244    H1*    U  23           H1*        U  23  -5.557  -6.540   8.884
  245    H3     U  23           H3         U  23  -1.379  -5.135  10.083
  246    H5     U  23           H5         U  23  -4.054  -2.790  12.311
  247    H6     U  23           H6         U  23  -5.824  -4.239  11.566
  248   1H5*    C  24          H5*         C  24  -6.278 -11.132  11.317
  249   2H5*    C  24          2H5*        C  24  -5.922 -12.078  12.775
  250    H4*    C  24           H4*        C  24  -4.381 -12.489  10.872
  251    H3*    C  24           H3*        C  24  -3.307 -11.612  13.533
  252    H2*    C  24          1H2*        C  24  -1.082 -11.597  12.634
  253   2HO*    C  24          2HO*        C  24  -0.706 -13.157  11.240
  254    H1*    C  24           H1*        C  24  -1.753 -10.399  10.191
  255   1H4     C  24          1H4         C  24  -1.521  -5.382  14.445
  256   2H4     C  24          2H4         C  24   0.126  -5.629  13.897
  257    H5     C  24           H5         C  24  -3.319  -6.914  13.859
  258    H6     C  24           H6         C  24  -3.885  -8.944  12.630
  259   1H5*    C  25          H5*         C  25  -0.676 -14.817  11.849
  260   2H5*    C  25          2H5*        C  25  -0.597 -15.972  13.194
  261    H4*    C  25           H4*        C  25   1.603 -15.544  12.289
  262    H3*    C  25           H3*        C  25   1.078 -14.711  15.114
  263    H2*    C  25          1H2*        C  25   3.278 -13.765  15.286
  264   2HO*    C  25          2HO*        C  25   3.830 -14.727  12.659
  265    H1*    C  25           H1*        C  25   3.264 -12.482  12.817
  266   1H4     C  25          1H4         C  25  -0.613  -8.787  16.674
  267   2H4     C  25          2H4         C  25   0.960  -8.025  16.687
  268    H5     C  25           H5         C  25  -1.045 -10.894  15.573
  269    H6     C  25           H6         C  25  -0.059 -12.696  14.261
  270    H3T    C  25           H3T        C  25   3.070 -16.434  14.414
  Start of MODEL   31
    1   1H5*    G   1          H5*         G   1   8.073  -0.828  16.239
    2   2H5*    G   1          2H5*        G   1   6.418  -1.462  16.211
    3    H4*    G   1           H4*        G   1   8.981  -2.858  16.162
    4    H3*    G   1           H3*        G   1   6.205  -3.418  15.182
    5    H2*    G   1          1H2*        G   1   6.661  -5.785  15.244
    6   2HO*    G   1          2HO*        G   1   8.669  -6.452  15.033
    7    H1*    G   1           H1*        G   1   7.686  -5.794  17.794
    8    H8     G   1           H8         G   1   5.312  -2.996  17.966
    9    H1     G   1           H1         G   1   2.345  -8.672  17.779
   10   1H2     G   1          1H2         G   1   5.451  -9.917  16.899
   11   2H2     G   1          2H2         G   1   3.765 -10.256  17.218
   12    H5T    G   1           H5T        G   1   7.314  -2.163  18.527
   13   1H5*    G   2          H5*         G   2   8.748  -5.887  13.250
   14   2H5*    G   2          2H5*        G   2   8.604  -5.791  11.484
   15    H4*    G   2           H4*        G   2   8.614  -8.082  12.149
   16    H3*    G   2           H3*        G   2   6.027  -7.072  11.034
   17    H2*    G   2          1H2*        G   2   4.999  -9.215  11.429
   18   2HO*    G   2          2HO*        G   2   7.400 -10.128  11.077
   19    H1*    G   2           H1*        G   2   5.911  -9.500  14.019
   20    H8     G   2           H8         G   2   5.569  -5.845  13.740
   21    H1     G   2           H1         G   2  -0.095  -8.772  14.318
   22   1H2     G   2          1H2         G   2   1.680 -11.676  13.625
   23   2H2     G   2          2H2         G   2   0.124 -10.948  13.959
   24   1H5*    A   3          H5*         A   3   6.627 -10.675   8.612
   25   2H5*    A   3          2H5*        A   3   6.990  -9.968   7.025
   26    H4*    A   3           H4*        A   3   5.506 -11.630   6.492
   27    H3*    A   3           H3*        A   3   4.065  -9.021   6.681
   28    H2*    A   3          1H2*        A   3   1.936 -10.115   6.378
   29   2HO*    A   3          2HO*        A   3   3.505 -11.989   5.238
   30    H1*    A   3           H1*        A   3   2.336 -12.050   8.279
   31    H8     A   3           H8         A   3   4.427  -9.268   9.575
   32   1H6     A   3          1H6         A   3   1.005  -6.664  11.825
   33   2H6     A   3          2H6         A   3  -0.746  -6.704  11.799
   34    H2     A   3           H2         A   3  -1.924 -10.046   9.061
   35   1H5*    A   4          H5*         A   4   2.364 -11.146   3.915
   36   2H5*    A   4          2H5*        A   4   2.565 -10.515   2.268
   37    H4*    A   4           H4*        A   4   0.354 -11.179   2.334
   38    H3*    A   4           H3*        A   4   0.594  -8.225   2.708
   39    H2*    A   4          1H2*        A   4  -1.777  -8.033   3.077
   40   2HO*    A   4          2HO*        A   4  -3.034  -9.441   2.123
   41    H1*    A   4           H1*        A   4  -1.957 -10.097   4.894
   42    H8     A   4           H8         A   4   1.479  -8.567   5.208
   43   1H6     A   4          1H6         A   4   0.436  -5.080   8.410
   44   2H6     A   4          2H6         A   4  -1.059  -4.438   9.056
   45    H2     A   4           H2         A   4  -4.371  -6.831   7.193
   46   1H5*    G   5          H5*         G   5  -2.390  -8.874   0.304
   47   2H5*    G   5          2H5*        G   5  -2.691  -7.786  -1.065
   48    H4*    G   5           H4*        G   5  -4.568  -7.846   0.484
   49    H3*    G   5           H3*        G   5  -3.142  -5.194   0.270
   50    H2*    G   5          1H2*        G   5  -4.913  -4.307   1.674
   51   2HO*    G   5          2HO*        G   5  -6.234  -6.433   0.683
   52    H1*    G   5           H1*        G   5  -4.729  -6.402   3.514
   53    H8     G   5           H8         G   5  -1.228  -5.978   2.573
   54    H1     G   5           H1         G   5  -3.384  -1.064   6.087
   55   1H2     G   5          1H2         G   5  -6.509  -2.333   5.405
   56   2H2     G   5          2H2         G   5  -5.555  -1.088   6.182
   57   1H5*    C   6          H5*         C   6  -6.996  -4.571   0.339
   58   2H5*    C   6          2H5*        C   6  -7.548  -4.176  -1.301
   59    H4*    C   6           H4*        C   6  -8.885  -2.840  -0.009
   60    H3*    C   6           H3*        C   6  -6.532  -1.218  -0.920
   61    H2*    C   6          1H2*        C   6  -7.389   0.671   0.313
   62   2HO*    C   6          2HO*        C   6  -9.697  -0.457  -0.148
   63    H1*    C   6           H1*        C   6  -7.917  -0.760   2.635
   64   1H4     C   6          1H4         C   6  -1.348  -0.329   2.615
   65   2H4     C   6          2H4         C   6  -1.893   1.189   3.288
   66    H5     C   6           H5         C   6  -2.856  -1.962   1.659
   67    H6     C   6           H6         C   6  -5.190  -2.477   1.179
   68   1H5*    A   7          H5*         A   7  -9.531   1.045  -1.622
   69   2H5*    A   7          2H5*        A   7  -9.556   2.035  -3.094
   70    H4*    A   7           H4*        A   7  -9.547   3.425  -1.118
   71    H3*    A   7           H3*        A   7  -7.020   3.595  -2.762
   72    H2*    A   7          1H2*        A   7  -6.345   5.370  -1.264
   73   2HO*    A   7          2HO*        A   7  -7.774   6.413  -0.010
   74    H1*    A   7           H1*        A   7  -7.145   3.976   1.045
   75    H8     A   7           H8         A   7  -5.625   1.248  -0.797
   76   1H6     A   7          1H6         A   7  -0.908   2.219  -0.112
   77   2H6     A   7          2H6         A   7  -0.048   3.630   0.470
   78    H2     A   7           H2         A   7  -3.129   6.746   1.383
   79   1H5*    G   8          H5*         G   8  -7.396   7.251  -1.610
   80   2H5*    G   8          2H5*        G   8  -8.267   8.015  -2.953
   81    H4*    G   8           H4*        G   8  -6.863   9.700  -2.503
   82    H3*    G   8           H3*        G   8  -5.336   7.962  -4.400
   83    H2*    G   8          1H2*        G   8  -3.380   9.337  -4.104
   84   2HO*    G   8          2HO*        G   8  -5.155  11.202  -3.594
   85    H1*    G   8           H1*        G   8  -3.484   9.395  -1.352
   86    H8     G   8           H8         G   8  -4.953   6.120  -2.159
   87    H1     G   8           H1         G   8   1.404   6.206  -2.942
   88   1H2     G   8          1H2         G   8   1.083   9.633  -2.685
   89   2H2     G   8          2H2         G   8   2.152   8.269  -2.919
   90   1H5*    G   9          H5*         G   9  -4.653  11.574  -5.738
   91   2H5*    G   9          2H5*        G   9  -5.068  11.918  -7.429
   92    H4*    G   9           H4*        G   9  -2.839  12.593  -7.144
   93    H3*    G   9           H3*        G   9  -3.030   9.989  -8.635
   94    H2*    G   9          1H2*        G   9  -0.622   9.982  -8.819
   95   2HO*    G   9          2HO*        G   9   0.511  11.792  -8.627
   96    H1*    G   9           H1*        G   9  -0.179  10.601  -6.145
   97    H8     G   9           H8         G   9  -3.184   8.527  -5.890
   98    H1     G   9           H1         G   9   2.001   5.088  -7.434
   99   1H2     G   9          1H2         G   9   3.470   8.150  -8.053
  100   2H2     G   9          2H2         G   9   3.649   6.411  -8.042
  101   1H5*    C  10          H5*         C  10  -0.140  12.296 -10.159
  102   2H5*    C  10          2H5*        C  10  -0.526  12.767 -11.825
  103    H4*    C  10           H4*        C  10   1.758  12.279 -11.813
  104    H3*    C  10           H3*        C  10   0.161  10.072 -13.065
  105    H2*    C  10          1H2*        C  10   2.186   8.822 -13.411
  106   2HO*    C  10          2HO*        C  10   3.235  11.252 -13.507
  107    H1*    C  10           H1*        C  10   3.281   9.345 -10.889
  108   1H4     C  10          1H4         C  10  -1.261   4.655  -9.915
  109   2H4     C  10          2H4         C  10   0.242   3.819 -10.207
  110    H5     C  10           H5         C  10  -1.481   7.064 -10.118
  111    H6     C  10           H6         C  10  -0.306   9.131 -10.656
  112   1H5*    U  11          H5*         U  11   2.635  10.331 -15.463
  113   2H5*    U  11          2H5*        U  11   2.418  10.646 -17.196
  114    H4*    U  11           H4*        U  11   3.416   8.555 -17.121
  115    H3*    U  11           H3*        U  11   0.456   8.269 -17.527
  116    H2*    U  11          1H2*        U  11   0.643   5.907 -17.407
  117   2HO*    U  11          2HO*        U  11   2.555   4.852 -17.834
  118    H1*    U  11           H1*        U  11   2.887   5.874 -15.588
  119    H3     U  11           H3         U  11  -0.274   3.272 -13.651
  120    H5     U  11           H5         U  11  -1.480   7.239 -12.902
  121    H6     U  11           H6         U  11   0.245   7.962 -14.413
  122   1H5*    U  12          H5*         U  12   1.149   6.992 -22.650
  123   2H5*    U  12          2H5*        U  12  -0.123   5.817 -22.263
  124    H4*    U  12           H4*        U  12   1.515   4.546 -23.286
  125    H3*    U  12           H3*        U  12   0.929   3.763 -20.801
  126    H2*    U  12          1H2*        U  12   2.637   5.058 -19.666
  127   2HO*    U  12          2HO*        U  12   4.547   3.212 -20.017
  128    H1*    U  12           H1*        U  12   4.614   4.192 -21.849
  129    H3     U  12           H3         U  12   7.821   6.391 -19.620
  130    H5     U  12           H5         U  12   4.748   9.231 -19.958
  131    H6     U  12           H6         U  12   3.371   7.511 -20.925
  132   1H5*    C  13          H5*         C  13   2.620   0.714 -19.097
  133   2H5*    C  13          2H5*        C  13   1.849  -0.587 -20.024
  134    H4*    C  13           H4*        C  13   1.506  -0.774 -17.599
  135    H3*    C  13           H3*        C  13  -0.345  -1.470 -19.385
  136    H2*    C  13          1H2*        C  13  -1.427   0.704 -19.560
  137   2HO*    C  13          2HO*        C  13  -2.609  -1.036 -17.718
  138    H1*    C  13           H1*        C  13  -1.296   0.909 -16.500
  139   1H4     C  13          1H4         C  13  -1.869   7.048 -18.883
  140   2H4     C  13          2H4         C  13  -3.173   6.809 -17.742
  141    H5     C  13           H5         C  13  -0.319   5.278 -19.478
  142    H6     C  13           H6         C  13   0.283   2.946 -19.094
  143   1H5*    G  14          H5*         G  14  -0.230  -3.638 -14.313
  144   2H5*    G  14          2H5*        G  14   0.270  -2.392 -15.470
  145    H4*    G  14           H4*        G  14   1.368  -5.179 -15.608
  146    H3*    G  14           H3*        G  14   2.226  -3.038 -13.687
  147    H2*    G  14          1H2*        G  14   4.526  -3.577 -14.134
  148   2HO*    G  14          2HO*        G  14   3.475  -5.965 -14.656
  149    H1*    G  14           H1*        G  14   4.221  -3.790 -16.903
  150    H8     G  14           H8         G  14   6.039  -1.932 -16.710
  151    H1     G  14           H1         G  14   1.575   2.216 -14.720
  152   1H2     G  14          1H2         G  14  -0.449  -0.584 -14.430
  153   2H2     G  14          2H2         G  14  -0.307   1.151 -14.258
  154   1H5*    G  15          H5*         G  15   4.773  -4.777 -12.460
  155   2H5*    G  15          2H5*        G  15   4.976  -4.626 -10.704
  156    H4*    G  15           H4*        G  15   6.609  -3.321 -11.999
  157    H3*    G  15           H3*        G  15   4.800  -1.909 -10.075
  158    H2*    G  15          1H2*        G  15   5.837   0.187 -10.667
  159   2HO*    G  15          2HO*        G  15   7.678  -1.530 -11.989
  160    H1*    G  15           H1*        G  15   5.658  -0.197 -13.395
  161    H8     G  15           H8         G  15   2.708  -1.998 -12.227
  162    H1     G  15           H1         G  15   1.958   4.335 -11.735
  163   1H2     G  15          1H2         G  15   5.362   4.474 -12.257
  164   2H2     G  15          2H2         G  15   3.877   5.354 -11.983
  165   1H5*    C  16          H5*         C  16   8.745  -0.087  -9.675
  166   2H5*    C  16          2H5*        C  16   9.020  -0.029  -7.923
  167    H4*    C  16           H4*        C  16   9.372   2.132  -9.057
  168    H3*    C  16           H3*        C  16   7.297   1.960  -6.887
  169    H2*    C  16          1H2*        C  16   6.851   4.307  -7.195
  170   2HO*    C  16          2HO*        C  16   9.391   4.220  -8.206
  171    H1*    C  16           H1*        C  16   6.881   4.216  -9.999
  172   1H4     C  16          1H4         C  16   0.943   1.892  -8.328
  173   2H4     C  16          2H4         C  16   0.781   3.635  -8.374
  174    H5     C  16           H5         C  16   3.098   0.788  -8.566
  175    H6     C  16           H6         C  16   5.487   1.136  -8.910
  176   1H5*    C  17          H5*         C  17   8.861   5.688  -6.659
  177   2H5*    C  17          2H5*        C  17  10.049   5.512  -5.353
  178    H4*    C  17           H4*        C  17   9.222   7.612  -4.978
  179    H3*    C  17           H3*        C  17   7.732   5.703  -3.207
  180    H2*    C  17          1H2*        C  17   6.382   7.530  -2.405
  181   2HO*    C  17          2HO*        C  17   8.550   8.931  -3.175
  182    H1*    C  17           H1*        C  17   5.878   8.617  -4.914
  183   1H4     C  17          1H4         C  17   2.135   3.181  -4.731
  184   2H4     C  17          2H4         C  17   1.088   4.503  -4.286
  185    H5     C  17           H5         C  17   4.516   3.440  -5.076
  186    H6     C  17           H6         C  17   6.368   5.026  -5.086
  187   1H5*    U  18          H5*         U  18   8.697   8.185  -0.199
  188   2H5*    U  18          2H5*        U  18  10.079   7.488   0.664
  189    H4*    U  18           H4*        U  18   8.763   6.745   2.438
  190    H3*    U  18           H3*        U  18   6.722   5.997   0.968
  191    H2*    U  18          1H2*        U  18   5.984   8.094   0.077
  192   2HO*    U  18          2HO*        U  18   4.209   7.399   1.327
  193    H1*    U  18           H1*        U  18   6.339   9.638   2.640
  194    H3     U  18           H3         U  18   7.298  13.557   0.767
  195    H5     U  18           H5         U  18   7.534  10.895  -2.469
  196    H6     U  18           H6         U  18   7.177   9.093  -0.921
  197   1H5*    U  19          H5*         U  19   5.841   7.003   5.182
  198   2H5*    U  19          2H5*        U  19   4.603   6.149   6.122
  199    H4*    U  19           H4*        U  19   4.776   8.609   6.538
  200    H3*    U  19           H3*        U  19   2.167   7.327   5.793
  201    H2*    U  19          1H2*        U  19   1.102   9.473   5.837
  202   2HO*    U  19          2HO*        U  19   2.820   9.924   7.739
  203    H1*    U  19           H1*        U  19   3.234  10.899   4.655
  204    H3     U  19           H3         U  19  -0.328  10.979   1.792
  205    H5     U  19           H5         U  19   1.722   7.407   0.981
  206    H6     U  19           H6         U  19   3.062   7.821   2.935
  207   1H5*    G  20          H5*         G  20   0.067   9.667   7.533
  208   2H5*    G  20          2H5*        G  20  -0.282   8.915   9.102
  209    H4*    G  20           H4*        G  20  -2.340   9.630   8.218
  210    H3*    G  20           H3*        G  20  -1.955   6.664   8.098
  211    H2*    G  20          1H2*        G  20  -4.110   6.426   7.024
  212   2HO*    G  20          2HO*        G  20  -5.545   7.920   7.517
  213    H1*    G  20           H1*        G  20  -3.595   8.269   5.067
  214    H8     G  20           H8         G  20  -0.157   7.310   5.687
  215    H1     G  20           H1         G  20  -3.455   2.522   2.981
  216   1H2     G  20          1H2         G  20  -6.238   4.391   3.802
  217   2H2     G  20          2H2         G  20  -5.611   2.926   3.082
  218   1H5*    U  21          H5*         U  21  -5.352   6.480   8.802
  219   2H5*    U  21          2H5*        U  21  -5.867   5.798  10.357
  220    H4*    U  21           H4*        U  21  -7.046   4.643   8.679
  221    H3*    U  21           H3*        U  21  -4.846   3.000   9.892
  222    H2*    U  21          1H2*        U  21  -5.428   1.181   8.427
  223   2HO*    U  21          2HO*        U  21  -7.804   2.021   8.662
  224    H1*    U  21           H1*        U  21  -5.710   2.751   6.133
  225    H3     U  21           H3         U  21  -1.835   0.324   5.753
  226    H5     U  21           H5         U  21  -0.803   3.835   7.793
  227    H6     U  21           H6         U  21  -3.148   4.333   7.987
  228   1H5*    U  22          H5*         U  22  -8.819   0.897  10.295
  229   2H5*    U  22          2H5*        U  22  -8.804   0.002  11.827
  230    H4*    U  22           H4*        U  22  -9.502  -1.333   9.854
  231    H3*    U  22           H3*        U  22  -7.155  -2.243  11.504
  232    H2*    U  22          1H2*        U  22  -6.949  -4.154  10.055
  233   2HO*    U  22          2HO*        U  22  -9.581  -3.684   9.729
  234    H1*    U  22           H1*        U  22  -7.405  -2.728   7.669
  235    H3     U  22           H3         U  22  -3.048  -4.240   7.949
  236    H5     U  22           H5         U  22  -3.096  -0.334   9.476
  237    H6     U  22           H6         U  22  -5.503  -0.448   9.480
  238   1H5*    U  23          H5*         U  23  -9.520  -5.395  10.337
  239   2H5*    U  23          2H5*        U  23 -10.289  -6.055  11.794
  240    H4*    U  23           H4*        U  23  -9.783  -7.949  10.607
  241    H3*    U  23           H3*        U  23  -7.567  -7.468  12.576
  242    H2*    U  23          1H2*        U  23  -6.455  -9.445  11.734
  243   2HO*    U  23          2HO*        U  23  -8.869 -10.223  11.169
  244    H1*    U  23           H1*        U  23  -6.719  -8.742   9.069
  245    H3     U  23           H3         U  23  -2.441  -7.575   9.912
  246    H5     U  23           H5         U  23  -4.696  -4.542  11.726
  247    H6     U  23           H6         U  23  -6.674  -5.822  11.235
  248   1H5*    C  24          H5*         C  24  -8.136 -11.160  12.830
  249   2H5*    C  24          2H5*        C  24  -8.177 -11.915  14.435
  250    H4*    C  24           H4*        C  24  -6.398 -12.872  13.166
  251    H3*    C  24           H3*        C  24  -5.430 -11.093  15.399
  252    H2*    C  24          1H2*        C  24  -3.181 -11.754  14.797
  253   2HO*    C  24          2HO*        C  24  -4.488 -13.895  13.837
  254    H1*    C  24           H1*        C  24  -3.588 -11.398  12.050
  255   1H4     C  24          1H4         C  24  -2.867  -5.285  14.393
  256   2H4     C  24          2H4         C  24  -1.240  -5.938  14.300
  257    H5     C  24           H5         C  24  -4.834  -6.660  13.991
  258    H6     C  24           H6         C  24  -5.615  -8.903  13.431
  259   1H5*    C  25          H5*         C  25  -3.134 -14.413  15.205
  260   2H5*    C  25          2H5*        C  25  -3.402 -15.366  16.678
  261    H4*    C  25           H4*        C  25  -1.111 -15.502  16.258
  262    H3*    C  25           H3*        C  25  -1.710 -13.576  18.475
  263    H2*    C  25          1H2*        C  25   0.624 -13.046  18.660
  264   2HO*    C  25          2HO*        C  25   0.986 -15.492  17.979
  265    H1*    C  25           H1*        C  25   1.108 -12.871  15.913
  266   1H4     C  25          1H4         C  25  -1.916  -7.222  17.515
  267   2H4     C  25          2H4         C  25  -0.196  -6.903  17.584
  268    H5     C  25           H5         C  25  -2.814  -9.445  17.120
  269    H6     C  25           H6         C  25  -2.243 -11.781  16.713
  270    H3T    C  25           H3T        C  25  -1.942 -15.746  18.834


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