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
6880 1jo7 4816 cing 1-original 9 MR format nomenclature mapping


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    A   1          1H5*        A   1  -4.001 -11.253   7.957
    2   2H5*    A   1          2H5*        A   1  -4.351 -12.980   7.760
    3    H4*    A   1           H4*        A   1  -1.676 -11.750   8.410
    4    H3*    A   1           H3*        A   1  -2.814 -12.730   5.820
    5    H2*    A   1           H2*        A   1  -0.715 -13.783   5.276
    6   2HO*    A   1          2HO*        A   1   0.201 -11.937   7.069
    7    H1*    A   1           H1*        A   1  -0.334 -14.973   7.745
    8    H8     A   1           H8         A   1  -3.936 -15.264   7.663
    9   1H6     A   1          H61         A   1  -3.424 -19.814   3.495
   10   2H6     A   1          H62         A   1  -4.500 -19.006   4.615
   11    H2     A   1           H2         A   1   0.540 -17.737   3.782
   12    H5T    A   1           H5T        A   1  -3.389 -13.119   9.992
   13   1H5*    G   2          1H5*        G   2   0.765 -10.458   4.610
   14   2H5*    G   2          2H5*        G   2   0.244  -9.372   3.307
   15    H4*    G   2           H4*        G   2   2.265 -10.719   2.792
   16    H3*    G   2           H3*        G   2  -0.140 -10.825   1.005
   17    H2*    G   2           H2*        G   2   0.954 -12.461  -0.380
   18   2HO*    G   2          2HO*        G   2   3.046 -11.492  -0.313
   19    H1*    G   2           H1*        G   2   1.966 -14.003   1.719
   20    H8     G   2           H8         G   2  -1.225 -13.209   3.187
   21    H1     G   2           H1         G   2  -1.901 -17.179  -1.805
   22   1H2     G   2          H21         G   2   1.346 -16.268  -2.592
   23   2H2     G   2          H22         G   2  -0.063 -17.220  -3.005
   24   1H5*    U   3          1H5*        U   3   3.200  -9.436  -1.833
   25   2H5*    U   3          2H5*        U   3   2.359  -8.218  -2.812
   26    H4*    U   3           H4*        U   3   3.464  -9.858  -4.210
   27    H3*    U   3           H3*        U   3   0.457  -9.824  -4.339
   28    H2*    U   3           H2*        U   3   0.591 -11.553  -6.025
   29   2HO*    U   3          2HO*        U   3   2.444 -10.796  -7.133
   30    H1*    U   3           H1*        U   3   2.445 -13.096  -4.624
   31    H3     U   3           H3         U   3  -1.445 -15.353  -4.111
   32    H5     U   3           H5         U   3  -1.694 -12.182  -1.368
   33    H6     U   3           H6         U   3   0.321 -11.289  -2.334
   34   1H5*    A   4          1H5*        A   4   1.456  -8.669  -8.646
   35   2H5*    A   4          2H5*        A   4   0.348  -7.306  -8.894
   36    H4*    A   4           H4*        A   4   0.151  -8.981 -10.651
   37    H3*    A   4           H3*        A   4  -2.250  -8.433  -8.946
   38    H2*    A   4           H2*        A   4  -3.489 -10.130 -10.164
   39   2HO*    A   4          2HO*        A   4  -2.883 -10.427 -12.186
   40    H1*    A   4           H1*        A   4  -1.578 -12.074  -9.870
   41    H8     A   4           H8         A   4  -0.829 -10.152  -6.862
   42   1H6     A   4          H61         A   4  -5.808 -12.617  -4.141
   43   2H6     A   4          H62         A   4  -4.328 -11.721  -3.887
   44    H2     A   4           H2         A   4  -6.064 -13.462  -8.542
   45   1H5*    G   5          1H5*        G   5  -4.286  -6.867 -12.475
   46   2H5*    G   5          2H5*        G   5  -5.010  -5.357 -11.888
   47    H4*    G   5           H4*        G   5  -6.650  -7.073 -12.593
   48    H3*    G   5           H3*        G   5  -6.760  -6.026  -9.772
   49    H2*    G   5           H2*        G   5  -8.700  -7.429  -9.415
   50   2HO*    G   5          2HO*        G   5  -9.738  -8.422 -11.102
   51    H1*    G   5           H1*        G   5  -7.560  -9.697 -10.566
   52    H8     G   5           H8         G   5  -4.614  -8.282  -8.980
   53    H1     G   5           H1         G   5  -8.793 -10.536  -4.663
   54   1H2     G   5          H21         G   5 -11.030 -10.584  -7.290
   55   2H2     G   5          H22         G   5 -10.734 -10.893  -5.593
   56   1H5*    A   6          1H5*        A   6 -10.492  -6.574 -10.747
   57   2H5*    A   6          2H5*        A   6 -11.344  -5.019 -10.770
   58    H4*    A   6           H4*        A   6 -12.548  -6.834  -9.592
   59    H3*    A   6           H3*        A   6 -12.593  -4.229  -8.872
   60    H2*    A   6           H2*        A   6 -10.863  -4.312  -7.191
   61   2HO*    A   6          2HO*        A   6 -13.160  -5.326  -5.825
   62    H1*    A   6           H1*        A   6 -11.935  -7.043  -6.288
   63    H8     A   6           H8         A   6  -8.475  -6.046  -7.619
   64   1H6     A   6          H61         A   6  -6.461  -6.984  -1.839
   65   2H6     A   6          H62         A   6  -5.994  -6.618  -3.489
   66    H2     A   6           H2         A   6 -10.922  -7.498  -1.863
   67   1H5*    A   7          1H5*        A   7 -15.201  -5.910  -5.366
   68   2H5*    A   7          2H5*        A   7 -16.536  -4.745  -5.275
   69    H4*    A   7           H4*        A   7 -15.707  -4.869  -3.104
   70    H3*    A   7           H3*        A   7 -14.624  -2.396  -4.438
   71    H2*    A   7           H2*        A   7 -13.294  -1.961  -2.533
   72   2HO*    A   7          2HO*        A   7 -15.431  -3.298  -1.273
   73    H1*    A   7           H1*        A   7 -13.286  -4.776  -1.631
   74    H8     A   7           H8         A   7 -11.451  -3.785  -4.822
   75   1H6     A   7          H61         A   7  -6.404  -3.443  -1.245
   76   2H6     A   7          H62         A   7  -7.000  -3.400  -2.891
   77    H2     A   7           H2         A   7  -9.963  -4.021   1.416
   78   1H5*    A   8          1H5*        A   8 -17.453   0.276  -0.824
   79   2H5*    A   8          2H5*        A   8 -16.291   1.534  -1.287
   80    H4*    A   8           H4*        A   8 -16.566   0.305   1.202
   81    H3*    A   8           H3*        A   8 -14.502   2.178   0.074
   82    H2*    A   8           H2*        A   8 -13.110   1.749   1.976
   83   2HO*    A   8          2HO*        A   8 -15.282   0.283   3.108
   84    H1*    A   8           H1*        A   8 -13.675  -1.015   2.135
   85    H8     A   8           H8         A   8 -13.060   0.174  -1.410
   86   1H6     A   8          H61         A   8  -7.088  -1.085  -0.357
   87   2H6     A   8          H62         A   8  -8.269  -0.645  -1.569
   88    H2     A   8           H2         A   8  -9.294  -1.437   3.534
   89   1H5*    C   9          1H5*        C   9 -15.506   4.025   4.906
   90   2H5*    C   9          2H5*        C   9 -14.707   5.487   4.293
   91    H4*    C   9           H4*        C   9 -13.823   4.072   6.391
   92    H3*    C   9           H3*        C   9 -12.338   5.832   4.484
   93    H2*    C   9           H2*        C   9 -10.227   5.079   5.360
   94   2HO*    C   9          2HO*        C   9 -11.581   3.453   7.251
   95    H1*    C   9           H1*        C   9 -10.846   2.377   5.410
   96   1H4     C   9          H41         C   9 -10.023   3.703  -1.005
   97   2H4     C   9          H42         C   9  -8.498   3.047  -0.425
   98    H5     C   9           H5         C   9 -11.897   4.167   0.478
   99    H6     C   9           H6         C   9 -12.672   4.080   2.784
  100   1H5*    A  10          1H5*        A  10  -9.720   9.316   7.333
  101   2H5*    A  10          2H5*        A  10  -9.519   8.789   5.650
  102    H4*    A  10           H4*        A  10  -8.054   7.906   8.109
  103    H3*    A  10           H3*        A  10  -7.218   9.129   5.503
  104    H2*    A  10           H2*        A  10  -5.207   7.823   5.514
  105   2HO*    A  10          2HO*        A  10  -4.508   7.917   7.593
  106    H1*    A  10           H1*        A  10  -6.378   5.443   6.443
  107    H8     A  10           H8         A  10  -8.912   6.489   4.070
  108   1H6     A  10          H61         A  10  -5.218   4.662  -0.549
  109   2H6     A  10          H62         A  10  -6.841   5.148  -0.116
  110    H2     A  10           H2         A  10  -2.775   4.815   3.209
  111   1H5*    A  11          1H5*        A  11  -3.192  12.239   6.512
  112   2H5*    A  11          2H5*        A  11  -3.637  11.580   4.925
  113    H4*    A  11           H4*        A  11  -1.477  10.748   6.809
  114    H3*    A  11           H3*        A  11  -1.578  11.523   3.925
  115    H2*    A  11           H2*        A  11   0.073   9.886   3.352
  116   2HO*    A  11          2HO*        A  11   0.473   9.799   6.173
  117    H1*    A  11           H1*        A  11  -0.879   7.828   4.990
  118    H8     A  11           H8         A  11  -4.039   9.136   3.761
  119   1H6     A  11          H61         A  11  -2.980   6.327  -1.653
  120   2H6     A  11          H62         A  11  -4.176   7.133  -0.663
  121    H2     A  11           H2         A  11   0.841   6.306   0.695
  122   1H5*    G  12          1H5*        G  12   2.815  11.581   4.684
  123   2H5*    G  12          2H5*        G  12   3.173  13.270   4.276
  124    H4*    G  12           H4*        G  12   4.731  11.795   3.186
  125    H3*    G  12           H3*        G  12   2.885  13.374   1.448
  126    H2*    G  12           H2*        G  12   3.717  12.270  -0.523
  127   2HO*    G  12          2HO*        G  12   5.591  11.139  -0.514
  128    H1*    G  12           H1*        G  12   3.599   9.710   0.468
  129    H8     G  12           H8         G  12   0.909  11.943   1.967
  130    H1     G  12           H1         G  12  -0.742   8.991  -3.483
  131   1H2     G  12          H21         G  12   2.583   8.045  -3.630
  132   2H2     G  12          H22         G  12   0.999   7.993  -4.370
  133   1H5*    G  13          1H5*        G  13   6.581  12.893  -0.609
  134   2H5*    G  13          2H5*        G  13   7.150  14.543  -0.931
  135    H4*    G  13           H4*        G  13   7.369  13.268  -2.926
  136    H3*    G  13           H3*        G  13   5.188  15.328  -3.029
  137    H2*    G  13           H2*        G  13   4.686  14.631  -5.285
  138   2HO*    G  13          2HO*        G  13   7.254  13.877  -5.229
  139    H1*    G  13           H1*        G  13   4.745  11.905  -4.737
  140    H8     G  13           H8         G  13   3.382  13.781  -1.768
  141    H1     G  13           H1         G  13  -0.975  12.354  -6.259
  142   1H2     G  13          H21         G  13   1.739  11.461  -8.196
  143   2H2     G  13          H22         G  13   0.001  11.621  -8.068
  144   1H5*    C  14          1H5*        C  14   6.889  16.404  -6.749
  145   2H5*    C  14          2H5*        C  14   7.507  18.034  -6.420
  146    H4*    C  14           H4*        C  14   6.280  18.335  -8.343
  147    H3*    C  14           H3*        C  14   4.484  19.049  -6.029
  148    H2*    C  14           H2*        C  14   2.791  19.618  -7.654
  149   2HO*    C  14          2HO*        C  14   3.965  18.953  -9.959
  150    H1*    C  14           H1*        C  14   3.223  17.332  -9.229
  151   1H4     C  14          H41         C  14  -0.371  15.348  -4.065
  152   2H4     C  14          H42         C  14  -1.535  15.955  -5.232
  153    H5     C  14           H5         C  14   2.014  15.521  -4.391
  154    H6     C  14           H6         C  14   3.773  16.317  -5.879
  155   1H5*    U  15          1H5*        U  15   3.352  22.595  -8.199
  156   2H5*    U  15          2H5*        U  15   3.556  23.770  -6.886
  157    H4*    U  15           H4*        U  15   1.260  23.657  -7.784
  158    H3*    U  15           H3*        U  15   1.737  23.130  -4.868
  159    H2*    U  15           H2*        U  15  -0.629  22.759  -4.576
  160   2HO*    U  15          2HO*        U  15  -1.448  22.935  -7.154
  161    H1*    U  15           H1*        U  15  -0.900  21.069  -6.741
  162    H3     U  15           H3         U  15  -0.790  18.357  -3.086
  163    H5     U  15           H5         U  15   3.233  19.097  -4.028
  164    H6     U  15           H6         U  15   2.480  20.734  -5.623
  165   1H5*    U  16          1H5*        U  16  -0.722  27.710  -3.352
  166   2H5*    U  16          2H5*        U  16  -1.053  26.471  -2.125
  167    H4*    U  16           H4*        U  16  -3.097  27.561  -2.640
  168    H3*    U  16           H3*        U  16  -3.124  24.945  -2.570
  169    H2*    U  16           H2*        U  16  -2.374  24.497  -4.827
  170   2HO*    U  16          2HO*        U  16  -4.383  24.130  -6.075
  171    H1*    U  16           H1*        U  16  -4.300  26.561  -5.975
  172    H3     U  16           H3         U  16  -2.222  25.212  -9.795
  173    H5     U  16           H5         U  16   0.745  27.163  -7.551
  174    H6     U  16           H6         U  16  -0.806  27.230  -5.707
  175   1H5*    C  17          1H5*        C  17  -6.309  23.304  -4.024
  176   2H5*    C  17          2H5*        C  17  -7.235  22.789  -2.601
  177    H4*    C  17           H4*        C  17  -6.245  21.002  -4.166
  178    H3*    C  17           H3*        C  17  -6.929  20.688  -1.541
  179    H2*    C  17           H2*        C  17  -4.732  21.244  -0.656
  180   2HO*    C  17          2HO*        C  17  -3.881  18.686  -1.133
  181    H1*    C  17           H1*        C  17  -3.605  19.566  -2.985
  182   1H4     C  17          H41         C  17   1.553  23.247  -1.360
  183   2H4     C  17          H42         C  17   1.898  21.700  -0.597
  184    H5     C  17           H5         C  17  -0.571  23.794  -2.341
  185    H6     C  17           H6         C  17  -2.771  22.933  -2.928
  186   1H5*    G  18          1H5*        G  18  -8.502  20.725  -3.105
  187   2H5*    G  18          2H5*        G  18  -9.932  20.192  -2.200
  188    H4*    G  18           H4*        G  18 -11.173  20.541  -3.987
  189    H3*    G  18           H3*        G  18  -9.581  18.269  -5.058
  190    H2*    G  18           H2*        G  18  -9.696  18.994  -7.263
  191   2HO*    G  18          2HO*        G  18 -12.311  19.908  -6.537
  192    H1*    G  18           H1*        G  18 -10.920  21.654  -6.547
  193    H8     G  18           H8         G  18 -10.243  22.581  -8.855
  194    H1     G  18           H1         G  18  -4.111  21.027  -7.756
  195   1H2     G  18          H21         G  18  -5.339  19.337  -5.009
  196   2H2     G  18          H22         G  18  -3.947  19.787  -5.967
  197   1H5*    G  19          1H5*        G  19  -9.590  14.579  -5.368
  198   2H5*    G  19          2H5*        G  19  -9.047  16.259  -5.217
  199    H4*    G  19           H4*        G  19 -10.142  15.526  -7.840
  200    H3*    G  19           H3*        G  19  -7.944  13.890  -6.756
  201    H2*    G  19           H2*        G  19  -6.366  14.462  -8.439
  202   2HO*    G  19          2HO*        G  19  -8.637  15.455  -9.861
  203    H1*    G  19           H1*        G  19  -7.004  17.135  -8.810
  204    H8     G  19           H8         G  19  -7.209  16.048  -5.167
  205    H1     G  19           H1         G  19  -1.447  18.126  -7.053
  206   1H2     G  19          H21         G  19  -2.773  18.076 -10.230
  207   2H2     G  19          H22         G  19  -1.380  18.384  -9.205
  208   1H5*    C  20          1H5*        C  20  -8.508  11.979 -10.735
  209   2H5*    C  20          2H5*        C  20  -8.530  10.232 -10.423
  210    H4*    C  20           H4*        C  20  -6.816  10.910 -12.050
  211    H3*    C  20           H3*        C  20  -6.038   9.474  -9.548
  212    H2*    C  20           H2*        C  20  -3.700   9.698 -10.087
  213   2HO*    C  20          2HO*        C  20  -4.363   9.480 -12.488
  214    H1*    C  20           H1*        C  20  -3.790  12.367 -10.775
  215   1H4     C  20          H41         C  20  -4.571  12.562  -4.251
  216   2H4     C  20          H42         C  20  -2.839  12.497  -4.484
  217    H5     C  20           H5         C  20  -6.149  12.332  -6.034
  218    H6     C  20           H6         C  20  -6.430  12.029  -8.419
  219   1H5*    C  21          1H5*        C  21  -3.230   8.111 -11.731
  220   2H5*    C  21          2H5*        C  21  -3.463   6.371 -11.986
  221    H4*    C  21           H4*        C  21  -1.231   6.694 -11.269
  222    H3*    C  21           H3*        C  21  -2.996   5.463  -9.176
  223    H2*    C  21           H2*        C  21  -1.178   5.464  -7.628
  224   2HO*    C  21          2HO*        C  21   0.309   5.627 -10.016
  225    H1*    C  21           H1*        C  21  -0.026   7.919  -8.501
  226   1H4     C  21          H41         C  21  -4.500   9.478  -3.910
  227   2H4     C  21          H42         C  21  -3.061   9.046  -3.000
  228    H5     C  21           H5         C  21  -4.662   9.209  -6.311
  229    H6     C  21           H6         C  21  -3.477   8.483  -8.322
  230   1H5*    U  22          1H5*        U  22   0.338   3.691  -8.731
  231   2H5*    U  22          2H5*        U  22   0.248   1.941  -8.456
  232    H4*    U  22           H4*        U  22   1.226   3.435  -6.614
  233    H3*    U  22           H3*        U  22  -0.697   1.183  -6.207
  234    H2*    U  22           H2*        U  22  -0.893   1.707  -3.869
  235   2HO*    U  22          2HO*        U  22   0.842   3.893  -3.994
  236    H1*    U  22           H1*        U  22  -1.182   4.442  -4.173
  237    H3     U  22           H3         U  22  -5.414   3.149  -3.342
  238    H5     U  22           H5         U  22  -4.790   2.095  -7.358
  239    H6     U  22           H6         U  22  -2.476   2.691  -7.076
  240   1H5*    G  23          1H5*        G  23   0.428  -1.515  -2.501
  241   2H5*    G  23          2H5*        G  23  -0.912  -0.491  -3.055
  242    H4*    G  23           H4*        G  23   0.990   0.269  -0.846
  243    H3*    G  23           H3*        G  23  -1.559  -1.297  -0.645
  244    H2*    G  23           H2*        G  23  -2.200  -0.006   1.284
  245   2HO*    G  23          2HO*        G  23   0.000   0.069   2.143
  246    H1*    G  23           H1*        G  23  -1.502   2.470   0.220
  247    H8     G  23           H8         G  23  -2.751   0.925  -2.798
  248    H1     G  23           H1         G  23  -7.493   2.087   1.360
  249   1H2     G  23          H21         G  23  -4.966   2.505   3.679
  250   2H2     G  23          H22         G  23  -6.684   2.505   3.348
  251   1H5*    C  24          1H5*        C  24  -2.264  -3.134   3.652
  252   2H5*    C  24          2H5*        C  24  -2.650  -1.568   2.914
  253    H4*    C  24           H4*        C  24  -0.697  -1.296   5.027
  254    H3*    C  24           H3*        C  24  -3.206  -2.775   5.770
  255    H2*    C  24           H2*        C  24  -3.386  -1.404   7.741
  256   2HO*    C  24          2HO*        C  24  -0.744  -1.292   7.474
  257    H1*    C  24           H1*        C  24  -2.779   1.004   6.447
  258   1H4     C  24          H41         C  24  -9.052  -0.147   4.830
  259   2H4     C  24          H42         C  24  -9.124   0.607   6.412
  260    H5     C  24           H5         C  24  -6.972  -0.803   3.783
  261    H6     C  24           H6         C  24  -4.546  -0.864   4.033
  262   1H5*    U  25          1H5*        U  25  -3.417  -4.160   8.080
  263   2H5*    U  25          2H5*        U  25  -3.544  -5.926   7.985
  264    H4*    U  25           H4*        U  25  -5.713  -4.764   8.236
  265    H3*    U  25           H3*        U  25  -5.281  -6.514   5.823
  266    H2*    U  25           H2*        U  25  -7.573  -6.050   5.201
  267   2HO*    U  25          2HO*        U  25  -7.714  -5.390   7.877
  268    H1*    U  25           H1*        U  25  -7.381  -3.309   5.669
  269    H3     U  25           H3         U  25  -7.403  -3.699   1.150
  270    H5     U  25           H5         U  25  -3.450  -4.543   2.281
  271    H6     U  25           H6         U  25  -4.183  -4.528   4.576
  272   1H5*    U  26          1H5*        U  26  -8.869  -8.419   7.449
  273   2H5*    U  26          2H5*        U  26  -8.643 -10.141   7.087
  274    H4*    U  26           H4*        U  26 -10.669  -9.131   6.071
  275    H3*    U  26           H3*        U  26  -8.618 -10.393   4.256
  276    H2*    U  26           H2*        U  26 -10.083  -9.913   2.412
  277   2HO*    U  26          2HO*        U  26 -12.158 -10.100   2.831
  278    H1*    U  26           H1*        U  26 -10.850  -7.355   3.380
  279    H3     U  26           H3         U  26  -8.557  -6.898  -0.564
  280    H5     U  26           H5         U  26  -5.661  -6.955   2.476
  281    H6     U  26           H6         U  26  -7.395  -7.613   4.009
  282   1H5*    U  27          1H5*        U  27 -12.515 -12.368   3.413
  283   2H5*    U  27          2H5*        U  27 -12.123 -14.044   2.986
  284    H4*    U  27           H4*        U  27 -13.487 -12.838   1.300
  285    H3*    U  27           H3*        U  27 -10.852 -14.046   0.508
  286    H2*    U  27           H2*        U  27 -11.246 -13.276  -1.754
  287   2HO*    U  27          2HO*        U  27 -13.334 -11.916  -1.898
  288    H1*    U  27           H1*        U  27 -11.927 -10.698  -1.004
  289    H3     U  27           H3         U  27  -7.640 -10.481  -2.491
  290    H5     U  27           H5         U  27  -7.339 -11.740   1.505
  291    H6     U  27           H6         U  27  -9.729 -12.023   1.511
  292   1H5*    U  28          1H5*        U  28 -13.871 -16.273  -2.177
  293   2H5*    U  28          2H5*        U  28 -13.173 -17.903  -2.248
  294    H4*    U  28           H4*        U  28 -13.630 -16.918  -4.461
  295    H3*    U  28           H3*        U  28 -10.796 -17.690  -3.802
  296    H2*    U  28           H2*        U  28 -10.194 -17.032  -6.057
  297   2HO*    U  28          2HO*        U  28 -12.891 -17.370  -6.424
  298    H1*    U  28           H1*        U  28 -11.513 -14.594  -5.918
  299    H3     U  28           H3         U  28  -7.040 -13.812  -5.367
  300    H5     U  28           H5         U  28  -8.541 -14.619  -1.528
  301    H6     U  28           H6         U  28 -10.603 -15.305  -2.562
  302   1H5*    G  29          1H5*        G  29 -11.004 -20.961  -6.638
  303   2H5*    G  29          2H5*        G  29 -10.321 -22.330  -5.739
  304    H4*    G  29           H4*        G  29  -8.975 -21.669  -7.693
  305    H3*    G  29           H3*        G  29  -7.675 -21.505  -4.978
  306    H2*    G  29           H2*        G  29  -5.681 -20.733  -6.033
  307   2HO*    G  29          2HO*        G  29  -5.137 -21.631  -7.876
  308    H1*    G  29           H1*        G  29  -7.043 -19.345  -8.173
  309    H8     G  29           H8         G  29  -8.330 -18.134  -4.921
  310    H1     G  29           H1         G  29  -2.650 -15.599  -6.485
  311   1H2     G  29          H21         G  29  -2.551 -18.064  -8.910
  312   2H2     G  29          H22         G  29  -1.757 -16.698  -8.161
  313   1H5*    C  30          1H5*        C  30  -4.671 -23.583  -7.198
  314   2H5*    C  30          2H5*        C  30  -4.188 -24.915  -6.130
  315    H4*    C  30           H4*        C  30  -2.273 -23.588  -6.768
  316    H3*    C  30           H3*        C  30  -3.022 -23.539  -3.859
  317    H2*    C  30           H2*        C  30  -1.181 -22.047  -3.437
  318   2HO*    C  30          2HO*        C  30  -0.427 -22.257  -6.171
  319    H1*    C  30           H1*        C  30  -1.619 -20.418  -5.673
  320   1H4     C  30          H41         C  30  -6.120 -18.557  -1.219
  321   2H4     C  30          H42         C  30  -4.795 -17.412  -1.089
  322    H5     C  30           H5         C  30  -6.041 -20.498  -2.655
  323    H6     C  30           H6         C  30  -4.685 -21.742  -4.256
  324   1H5*    U  31          1H5*        U  31   1.035 -23.653  -4.299
  325   2H5*    U  31          2H5*        U  31   1.789 -24.850  -3.228
  326    H4*    U  31           H4*        U  31   2.771 -22.575  -3.090
  327    H3*    U  31           H3*        U  31   1.661 -23.875  -0.616
  328    H2*    U  31           H2*        U  31   2.307 -21.933   0.644
  329   2HO*    U  31          2HO*        U  31   4.125 -21.738  -1.341
  330    H1*    U  31           H1*        U  31   1.448 -20.071  -1.284
  331    H3     U  31           H3         U  31  -1.406 -19.663   2.230
  332    H5     U  31           H5         U  31  -2.827 -22.948   0.032
  333    H6     U  31           H6         U  31  -0.818 -22.836  -1.288
  334    H3T    U  31           H3T        U  31   3.801 -24.141  -0.216
  Start of MODEL    2
    1   1H5*    A   1          1H5*        A   1  -3.934 -10.718   7.582
    2   2H5*    A   1          2H5*        A   1  -4.367 -12.377   7.128
    3    H4*    A   1           H4*        A   1  -1.721 -11.420   8.209
    4    H3*    A   1           H3*        A   1  -2.580 -12.161   5.429
    5    H2*    A   1           H2*        A   1  -0.440 -13.229   5.084
    6   2HO*    A   1          2HO*        A   1   0.501 -12.769   7.654
    7    H1*    A   1           H1*        A   1  -0.433 -14.599   7.496
    8    H8     A   1           H8         A   1  -4.012 -14.631   6.675
    9   1H6     A   1          H61         A   1  -2.891 -19.214   2.665
   10   2H6     A   1          H62         A   1  -4.134 -18.325   3.518
   11    H2     A   1           H2         A   1   1.042 -17.442   3.889
   12    H5T    A   1           H5T        A   1  -3.439 -12.559   9.553
   13   1H5*    G   2          1H5*        G   2   1.039  -9.943   4.433
   14   2H5*    G   2          2H5*        G   2   0.605  -8.925   3.046
   15    H4*    G   2           H4*        G   2   2.507 -10.474   2.650
   16    H3*    G   2           H3*        G   2   0.096 -10.557   0.861
   17    H2*    G   2           H2*        G   2   1.101 -12.354  -0.380
   18   2HO*    G   2          2HO*        G   2   3.443 -12.159   1.210
   19    H1*    G   2           H1*        G   2   2.072 -13.743   1.863
   20    H8     G   2           H8         G   2  -1.180 -12.749   3.113
   21    H1     G   2           H1         G   2  -1.669 -17.277  -1.401
   22   1H2     G   2          H21         G   2   1.619 -16.476  -2.139
   23   2H2     G   2          H22         G   2   0.221 -17.463  -2.506
   24   1H5*    U   3          1H5*        U   3   3.340  -9.439  -2.148
   25   2H5*    U   3          2H5*        U   3   2.512  -8.239  -3.159
   26    H4*    U   3           H4*        U   3   3.412 -10.003  -4.526
   27    H3*    U   3           H3*        U   3   0.400  -9.935  -4.406
   28    H2*    U   3           H2*        U   3   0.410 -11.751  -6.010
   29   2HO*    U   3          2HO*        U   3   2.109 -12.086  -7.270
   30    H1*    U   3           H1*        U   3   2.372 -13.213  -4.659
   31    H3     U   3           H3         U   3  -1.454 -15.472  -3.796
   32    H5     U   3           H5         U   3  -1.587 -12.155  -1.224
   33    H6     U   3           H6         U   3   0.367 -11.306  -2.342
   34   1H5*    A   4          1H5*        A   4   0.881  -9.049  -8.775
   35   2H5*    A   4          2H5*        A   4  -0.478  -7.962  -9.120
   36    H4*    A   4           H4*        A   4  -0.464 -10.072 -10.434
   37    H3*    A   4           H3*        A   4  -2.863  -9.397  -8.746
   38    H2*    A   4           H2*        A   4  -3.911 -11.428  -9.583
   39   2HO*    A   4          2HO*        A   4  -1.818 -11.220 -11.431
   40    H1*    A   4           H1*        A   4  -1.724 -13.023  -9.025
   41    H8     A   4           H8         A   4  -1.352 -10.618  -6.314
   42   1H6     A   4          H61         A   4  -6.031 -13.367  -3.343
   43   2H6     A   4          H62         A   4  -4.690 -12.252  -3.195
   44    H2     A   4           H2         A   4  -6.047 -14.803  -7.595
   45   1H5*    G   5          1H5*        G   5  -5.144  -8.742 -12.428
   46   2H5*    G   5          2H5*        G   5  -6.019  -7.235 -12.099
   47    H4*    G   5           H4*        G   5  -7.484  -9.191 -12.427
   48    H3*    G   5           H3*        G   5  -7.634  -7.733  -9.795
   49    H2*    G   5           H2*        G   5  -9.427  -9.241  -9.176
   50   2HO*    G   5          2HO*        G   5  -9.246  -9.977 -11.921
   51    H1*    G   5           H1*        G   5  -8.075 -11.535 -10.000
   52    H8     G   5           H8         G   5  -5.278  -9.583  -8.729
   53    H1     G   5           H1         G   5  -9.108 -11.636  -4.007
   54   1H2     G   5          H21         G   5 -11.377 -12.282  -6.525
   55   2H2     G   5          H22         G   5 -11.020 -12.297  -4.811
   56   1H5*    A   6          1H5*        A   6 -11.329  -8.667 -10.611
   57   2H5*    A   6          2H5*        A   6 -12.316  -7.205 -10.796
   58    H4*    A   6           H4*        A   6 -13.353  -8.929  -9.375
   59    H3*    A   6           H3*        A   6 -13.536  -6.268  -8.914
   60    H2*    A   6           H2*        A   6 -11.752  -6.090  -7.298
   61   2HO*    A   6          2HO*        A   6 -13.453  -7.136  -5.380
   62    H1*    A   6           H1*        A   6 -12.645  -8.777  -6.107
   63    H8     A   6           H8         A   6  -9.275  -7.684  -7.598
   64   1H6     A   6          H61         A   6  -7.105  -8.020  -1.810
   65   2H6     A   6          H62         A   6  -6.690  -7.762  -3.495
   66    H2     A   6           H2         A   6 -11.520  -8.816  -1.690
   67   1H5*    A   7          1H5*        A   7 -15.942  -7.882  -5.193
   68   2H5*    A   7          2H5*        A   7 -17.299  -6.747  -5.063
   69    H4*    A   7           H4*        A   7 -16.339  -6.812  -2.936
   70    H3*    A   7           H3*        A   7 -15.455  -4.316  -4.369
   71    H2*    A   7           H2*        A   7 -14.036  -3.788  -2.554
   72   2HO*    A   7          2HO*        A   7 -14.709  -5.283  -0.536
   73    H1*    A   7           H1*        A   7 -13.844  -6.581  -1.611
   74    H8     A   7           H8         A   7 -12.246  -5.531  -4.917
   75   1H6     A   7          H61         A   7  -7.021  -4.951  -1.642
   76   2H6     A   7          H62         A   7  -7.713  -4.945  -3.250
   77    H2     A   7           H2         A   7 -10.390  -5.674   1.223
   78   1H5*    A   8          1H5*        A   8 -17.758  -0.939  -1.000
   79   2H5*    A   8          2H5*        A   8 -16.255  -0.274  -1.669
   80    H4*    A   8           H4*        A   8 -16.875  -1.216   1.027
   81    H3*    A   8           H3*        A   8 -14.908   0.724  -0.150
   82    H2*    A   8           H2*        A   8 -13.504   0.443   1.786
   83   2HO*    A   8          2HO*        A   8 -14.649  -1.338   3.291
   84    H1*    A   8           H1*        A   8 -13.723  -2.336   1.895
   85    H8     A   8           H8         A   8 -13.652  -1.401  -1.725
   86   1H6     A   8          H61         A   8  -7.477  -1.327  -1.274
   87   2H6     A   8          H62         A   8  -8.835  -1.280  -2.374
   88    H2     A   8           H2         A   8  -9.172  -1.612   2.869
   89   1H5*    C   9          1H5*        C   9 -15.652   3.276   4.243
   90   2H5*    C   9          2H5*        C   9 -15.209   4.661   3.227
   91    H4*    C   9           H4*        C   9 -13.802   3.936   5.354
   92    H3*    C   9           H3*        C   9 -12.874   5.240   2.828
   93    H2*    C   9           H2*        C   9 -10.575   4.957   3.478
   94   2HO*    C   9          2HO*        C   9 -10.456   3.738   5.705
   95    H1*    C   9           H1*        C   9 -10.807   2.329   4.339
   96   1H4     C   9          H41         C   9 -11.043   1.839  -2.230
   97   2H4     C   9          H42         C   9  -9.342   1.726  -1.805
   98    H5     C   9           H5         C   9 -12.778   2.338  -0.603
   99    H6     C   9           H6         C   9 -13.223   2.818   1.744
  100   1H5*    A  10          1H5*        A  10 -10.683   7.245   6.094
  101   2H5*    A  10          2H5*        A  10 -10.279   8.869   5.502
  102    H4*    A  10           H4*        A  10  -8.421   7.093   6.065
  103    H3*    A  10           H3*        A  10  -8.412   9.225   3.982
  104    H2*    A  10           H2*        A  10  -6.466   8.327   2.921
  105   2HO*    A  10          2HO*        A  10  -5.029   7.242   4.065
  106    H1*    A  10           H1*        A  10  -7.187   5.650   3.023
  107    H8     A  10           H8         A  10 -10.482   6.987   2.366
  108   1H6     A  10          H61         A  10  -8.803   8.069  -3.493
  109   2H6     A  10          H62         A  10 -10.151   7.960  -2.383
  110    H2     A  10           H2         A  10  -5.094   7.234  -1.115
  111   1H5*    A  11          1H5*        A  11  -3.866  11.940   5.498
  112   2H5*    A  11          2H5*        A  11  -4.101  11.212   3.898
  113    H4*    A  11           H4*        A  11  -2.228  10.398   6.094
  114    H3*    A  11           H3*        A  11  -1.846  11.373   3.294
  115    H2*    A  11           H2*        A  11  -0.045   9.833   2.940
  116   2HO*    A  11          2HO*        A  11   0.392  10.233   5.473
  117    H1*    A  11           H1*        A  11  -1.210   7.637   4.223
  118    H8     A  11           H8         A  11  -4.137   8.945   2.522
  119   1H6     A  11          H61         A  11  -1.979   6.616  -2.791
  120   2H6     A  11          H62         A  11  -3.372   7.304  -1.986
  121    H2     A  11           H2         A  11   1.343   6.521   0.219
  122   1H5*    G  12          1H5*        G  12   2.189  11.436   4.445
  123   2H5*    G  12          2H5*        G  12   2.709  13.108   4.154
  124    H4*    G  12           H4*        G  12   4.153  11.491   3.043
  125    H3*    G  12           H3*        G  12   2.667  13.485   1.386
  126    H2*    G  12           H2*        G  12   3.486  12.473  -0.641
  127   2HO*    G  12          2HO*        G  12   5.544  11.864   0.803
  128    H1*    G  12           H1*        G  12   2.948   9.872   0.065
  129    H8     G  12           H8         G  12   0.480  12.326   1.610
  130    H1     G  12           H1         G  12  -1.141  10.121  -4.191
  131   1H2     G  12          H21         G  12   2.025   8.726  -4.218
  132   2H2     G  12          H22         G  12   0.509   8.965  -5.058
  133   1H5*    G  13          1H5*        G  13   6.478  12.790  -0.563
  134   2H5*    G  13          2H5*        G  13   7.160  14.420  -0.726
  135    H4*    G  13           H4*        G  13   7.291  13.268  -2.827
  136    H3*    G  13           H3*        G  13   5.385  15.588  -2.748
  137    H2*    G  13           H2*        G  13   4.849  15.177  -5.065
  138   2HO*    G  13          2HO*        G  13   6.991  14.631  -5.739
  139    H1*    G  13           H1*        G  13   4.575  12.420  -4.787
  140    H8     G  13           H8         G  13   3.347  14.169  -1.683
  141    H1     G  13           H1         G  13  -0.997  13.689  -6.381
  142   1H2     G  13          H21         G  13   1.653  12.645  -8.330
  143   2H2     G  13          H22         G  13  -0.057  13.003  -8.228
  144   1H5*    C  14          1H5*        C  14   7.475  16.918  -6.351
  145   2H5*    C  14          2H5*        C  14   8.120  18.463  -5.764
  146    H4*    C  14           H4*        C  14   7.017  18.975  -7.755
  147    H3*    C  14           H3*        C  14   5.255  19.711  -5.422
  148    H2*    C  14           H2*        C  14   3.666  20.567  -7.023
  149   2HO*    C  14          2HO*        C  14   5.849  20.230  -8.823
  150    H1*    C  14           H1*        C  14   3.919  18.379  -8.777
  151   1H4     C  14          H41         C  14  -0.081  16.383  -3.929
  152   2H4     C  14          H42         C  14  -1.120  17.237  -5.059
  153    H5     C  14           H5         C  14   2.319  16.291  -4.178
  154    H6     C  14           H6         C  14   4.214  17.011  -5.532
  155   1H5*    U  15          1H5*        U  15   4.691  23.641  -7.221
  156   2H5*    U  15          2H5*        U  15   4.981  24.607  -5.762
  157    H4*    U  15           H4*        U  15   2.733  24.906  -6.751
  158    H3*    U  15           H3*        U  15   3.010  24.007  -3.901
  159    H2*    U  15           H2*        U  15   0.603  23.925  -3.722
  160   2HO*    U  15          2HO*        U  15   0.678  25.098  -6.327
  161    H1*    U  15           H1*        U  15   0.217  22.519  -6.064
  162    H3     U  15           H3         U  15  -0.147  19.473  -2.687
  163    H5     U  15           H5         U  15   3.959  19.730  -3.516
  164    H6     U  15           H6         U  15   3.478  21.608  -4.944
  165   1H5*    U  16          1H5*        U  16   1.113  28.653  -1.870
  166   2H5*    U  16          2H5*        U  16   0.555  27.305  -0.860
  167    H4*    U  16           H4*        U  16  -1.284  28.767  -1.280
  168    H3*    U  16           H3*        U  16  -1.678  26.191  -1.525
  169    H2*    U  16           H2*        U  16  -0.908  25.900  -3.799
  170   2HO*    U  16          2HO*        U  16  -2.750  25.139  -4.533
  171    H1*    U  16           H1*        U  16  -2.466  28.341  -4.745
  172    H3     U  16           H3         U  16  -0.433  27.154  -8.638
  173    H5     U  16           H5         U  16   2.682  28.365  -6.094
  174    H6     U  16           H6         U  16   1.077  28.452  -4.300
  175   1H5*    C  17          1H5*        C  17  -4.978  25.165  -3.259
  176   2H5*    C  17          2H5*        C  17  -6.024  24.644  -1.924
  177    H4*    C  17           H4*        C  17  -5.225  22.903  -3.644
  178    H3*    C  17           H3*        C  17  -6.057  22.425  -1.088
  179    H2*    C  17           H2*        C  17  -3.845  22.578  -0.085
  180   2HO*    C  17          2HO*        C  17  -3.870  19.889  -1.043
  181    H1*    C  17           H1*        C  17  -2.854  20.998  -2.540
  182   1H4     C  17          H41         C  17   2.676  23.762  -0.415
  183   2H4     C  17          H42         C  17   2.780  22.120   0.206
  184    H5     C  17           H5         C  17   0.689  24.685  -1.395
  185    H6     C  17           H6         C  17  -1.581  24.193  -2.126
  186   1H5*    G  18          1H5*        G  18  -7.522  22.718  -2.752
  187   2H5*    G  18          2H5*        G  18  -9.044  22.386  -1.903
  188    H4*    G  18           H4*        G  18 -10.187  22.912  -3.712
  189    H3*    G  18           H3*        G  18  -8.791  20.556  -4.866
  190    H2*    G  18           H2*        G  18  -8.718  21.424  -7.020
  191   2HO*    G  18          2HO*        G  18 -11.343  21.926  -6.283
  192    H1*    G  18           H1*        G  18  -9.706  24.147  -6.184
  193    H8     G  18           H8         G  18  -8.842  25.126  -8.404
  194    H1     G  18           H1         G  18  -2.939  22.935  -7.154
  195   1H2     G  18          H21         G  18  -4.444  21.225  -4.558
  196   2H2     G  18          H22         G  18  -2.972  21.592  -5.429
  197   1H5*    G  19          1H5*        G  19  -9.196  16.920  -5.498
  198   2H5*    G  19          2H5*        G  19  -8.482  18.516  -5.205
  199    H4*    G  19           H4*        G  19  -9.568  18.129  -7.897
  200    H3*    G  19           H3*        G  19  -7.629  16.139  -6.918
  201    H2*    G  19           H2*        G  19  -5.939  16.644  -8.514
  202   2HO*    G  19          2HO*        G  19  -6.428  17.465 -10.465
  203    H1*    G  19           H1*        G  19  -6.215  19.403  -8.643
  204    H8     G  19           H8         G  19  -6.691  17.977  -5.139
  205    H1     G  19           H1         G  19  -0.674  19.608  -6.619
  206   1H2     G  19          H21         G  19  -1.869  20.034  -9.820
  207   2H2     G  19          H22         G  19  -0.494  20.080  -8.727
  208   1H5*    C  20          1H5*        C  20  -8.284  14.730 -11.061
  209   2H5*    C  20          2H5*        C  20  -8.637  12.995 -10.939
  210    H4*    C  20           H4*        C  20  -6.785  13.453 -12.458
  211    H3*    C  20           H3*        C  20  -6.295  11.769 -10.038
  212    H2*    C  20           H2*        C  20  -3.944  11.633 -10.562
  213   2HO*    C  20          2HO*        C  20  -3.730  13.229 -12.690
  214    H1*    C  20           H1*        C  20  -3.587  14.319 -11.053
  215   1H4     C  20          H41         C  20  -4.515  14.156  -4.541
  216   2H4     C  20          H42         C  20  -2.802  13.876  -4.753
  217    H5     C  20           H5         C  20  -6.065  14.276  -6.359
  218    H6     C  20           H6         C  20  -6.321  14.201  -8.765
  219   1H5*    C  21          1H5*        C  21  -3.698   9.847 -12.506
  220   2H5*    C  21          2H5*        C  21  -4.312   8.186 -12.614
  221    H4*    C  21           H4*        C  21  -1.978   8.198 -11.986
  222    H3*    C  21           H3*        C  21  -3.906   7.183  -9.916
  223    H2*    C  21           H2*        C  21  -2.076   6.812  -8.417
  224   2HO*    C  21          2HO*        C  21  -0.138   6.332  -9.182
  225    H1*    C  21           H1*        C  21  -0.627   9.142  -9.141
  226   1H4     C  21          H41         C  21  -4.927  11.090  -4.548
  227   2H4     C  21          H42         C  21  -3.609  10.370  -3.638
  228    H5     C  21           H5         C  21  -5.054  11.001  -6.963
  229    H6     C  21           H6         C  21  -3.943  10.219  -8.992
  230   1H5*    U  22          1H5*        U  22  -1.172   4.749  -9.411
  231   2H5*    U  22          2H5*        U  22  -1.669   3.051  -9.275
  232    H4*    U  22           H4*        U  22  -0.578   4.246  -7.254
  233    H3*    U  22           H3*        U  22  -2.852   2.315  -7.193
  234    H2*    U  22           H2*        U  22  -3.244   2.730  -4.863
  235   2HO*    U  22          2HO*        U  22  -1.754   4.080  -3.686
  236    H1*    U  22           H1*        U  22  -3.045   5.489  -4.962
  237    H3     U  22           H3         U  22  -7.432   4.017  -4.654
  238    H5     U  22           H5         U  22  -6.655   4.857  -8.695
  239    H6     U  22           H6         U  22  -4.322   5.030  -8.131
  240   1H5*    G  23          1H5*        G  23   1.205   0.785  -3.772
  241   2H5*    G  23          2H5*        G  23   0.077  -0.521  -3.359
  242    H4*    G  23           H4*        G  23   1.183   1.234  -1.592
  243    H3*    G  23           H3*        G  23  -1.205  -0.553  -1.398
  244    H2*    G  23           H2*        G  23  -1.927   0.558   0.614
  245   2HO*    G  23          2HO*        G  23   0.090   2.451   0.664
  246    H1*    G  23           H1*        G  23  -1.593   3.135  -0.319
  247    H8     G  23           H8         G  23  -2.480   1.147  -3.335
  248    H1     G  23           H1         G  23  -7.541   2.575   0.336
  249   1H2     G  23          H21         G  23  -5.190   3.534   2.687
  250   2H2     G  23          H22         G  23  -6.881   3.357   2.275
  251   1H5*    C  24          1H5*        C  24   1.020  -1.593   3.102
  252   2H5*    C  24          2H5*        C  24   0.302  -3.204   2.911
  253    H4*    C  24           H4*        C  24  -0.197  -1.841   5.040
  254    H3*    C  24           H3*        C  24  -2.228  -3.393   3.466
  255    H2*    C  24           H2*        C  24  -3.947  -2.634   4.976
  256   2HO*    C  24          2HO*        C  24  -1.703  -1.797   6.513
  257    H1*    C  24           H1*        C  24  -3.107   0.027   5.036
  258   1H4     C  24          H41         C  24  -6.128  -0.724  -0.786
  259   2H4     C  24          H42         C  24  -7.325  -0.044   0.303
  260    H5     C  24           H5         C  24  -3.920  -1.393  -0.061
  261    H6     C  24           H6         C  24  -2.407  -1.542   1.848
  262   1H5*    U  25          1H5*        U  25  -3.631  -4.265   7.246
  263   2H5*    U  25          2H5*        U  25  -3.693  -6.036   7.312
  264    H4*    U  25           H4*        U  25  -5.838  -4.942   7.846
  265    H3*    U  25           H3*        U  25  -5.689  -6.882   5.562
  266    H2*    U  25           H2*        U  25  -8.045  -6.512   5.136
  267   2HO*    U  25          2HO*        U  25  -8.247  -4.576   7.156
  268    H1*    U  25           H1*        U  25  -7.879  -3.761   5.194
  269    H3     U  25           H3         U  25  -7.945  -4.837   0.780
  270    H5     U  25           H5         U  25  -3.929  -5.224   1.937
  271    H6     U  25           H6         U  25  -4.637  -4.924   4.218
  272   1H5*    U  26          1H5*        U  26  -8.893  -8.938   7.664
  273   2H5*    U  26          2H5*        U  26  -8.505 -10.655   7.442
  274    H4*    U  26           H4*        U  26 -10.673  -9.957   6.462
  275    H3*    U  26           H3*        U  26  -8.588 -11.172   4.656
  276    H2*    U  26           H2*        U  26 -10.177 -11.015   2.856
  277   2HO*    U  26          2HO*        U  26 -12.354 -10.075   3.577
  278    H1*    U  26           H1*        U  26 -11.122  -8.452   3.593
  279    H3     U  26           H3         U  26  -8.916  -8.295  -0.441
  280    H5     U  26           H5         U  26  -6.032  -7.609   2.533
  281    H6     U  26           H6         U  26  -7.675  -8.253   4.168
  282   1H5*    U  27          1H5*        U  27 -12.313 -13.415   4.166
  283   2H5*    U  27          2H5*        U  27 -11.891 -15.103   3.818
  284    H4*    U  27           H4*        U  27 -13.374 -14.037   2.138
  285    H3*    U  27           H3*        U  27 -10.750 -15.228   1.290
  286    H2*    U  27           H2*        U  27 -11.251 -14.589  -0.991
  287   2HO*    U  27          2HO*        U  27 -13.329 -14.583  -1.474
  288    H1*    U  27           H1*        U  27 -11.950 -11.987  -0.361
  289    H3     U  27           H3         U  27  -7.706 -11.723  -1.962
  290    H5     U  27           H5         U  27  -7.273 -12.813   2.069
  291    H6     U  27           H6         U  27  -9.652 -13.163   2.149
  292   1H5*    U  28          1H5*        U  28 -13.656 -17.875  -1.051
  293   2H5*    U  28          2H5*        U  28 -12.810 -19.433  -1.120
  294    H4*    U  28           H4*        U  28 -13.375 -18.464  -3.332
  295    H3*    U  28           H3*        U  28 -10.498 -19.081  -2.693
  296    H2*    U  28           H2*        U  28  -9.938 -18.374  -4.938
  297   2HO*    U  28          2HO*        U  28 -12.211 -17.464  -5.913
  298    H1*    U  28           H1*        U  28 -11.454 -16.040  -4.818
  299    H3     U  28           H3         U  28  -7.079 -14.816  -4.392
  300    H5     U  28           H5         U  28  -8.354 -15.806  -0.515
  301    H6     U  28           H6         U  28 -10.377 -16.677  -1.485
  302   1H5*    G  29          1H5*        G  29 -10.518 -22.323  -5.548
  303   2H5*    G  29          2H5*        G  29  -9.735 -23.650  -4.668
  304    H4*    G  29           H4*        G  29  -8.444 -22.867  -6.615
  305    H3*    G  29           H3*        G  29  -7.165 -22.671  -3.896
  306    H2*    G  29           H2*        G  29  -5.251 -21.672  -4.891
  307   2HO*    G  29          2HO*        G  29  -4.626 -22.184  -6.906
  308    H1*    G  29           H1*        G  29  -6.702 -20.427  -7.077
  309    H8     G  29           H8         G  29  -8.008 -19.346  -3.760
  310    H1     G  29           H1         G  29  -2.745 -16.181  -5.608
  311   1H2     G  29          H21         G  29  -2.495 -18.616  -8.052
  312   2H2     G  29          H22         G  29  -1.826 -17.167  -7.336
  313   1H5*    C  30          1H5*        C  30  -4.027 -24.094  -6.354
  314   2H5*    C  30          2H5*        C  30  -3.356 -25.479  -5.471
  315    H4*    C  30           H4*        C  30  -1.609 -23.916  -6.001
  316    H3*    C  30           H3*        C  30  -2.264 -24.158  -3.076
  317    H2*    C  30           H2*        C  30  -0.544 -22.548  -2.600
  318   2HO*    C  30          2HO*        C  30   0.176 -22.468  -5.342
  319    H1*    C  30           H1*        C  30  -1.149 -20.851  -4.772
  320   1H4     C  30          H41         C  30  -5.424 -19.360   0.033
  321   2H4     C  30          H42         C  30  -4.183 -18.121   0.071
  322    H5     C  30           H5         C  30  -5.323 -21.278  -1.430
  323    H6     C  30           H6         C  30  -4.014 -22.408  -3.150
  324   1H5*    U  31          1H5*        U  31   2.004 -24.217  -3.099
  325   2H5*    U  31          2H5*        U  31   2.391 -25.782  -2.357
  326    H4*    U  31           H4*        U  31   3.724 -24.203  -1.257
  327    H3*    U  31           H3*        U  31   1.375 -25.019   0.429
  328    H2*    U  31           H2*        U  31   2.134 -23.531   2.155
  329   2HO*    U  31          2HO*        U  31   4.370 -22.618   0.788
  330    H1*    U  31           H1*        U  31   2.814 -21.425   0.416
  331    H3     U  31           H3         U  31  -0.814 -19.669   2.389
  332    H5     U  31           H5         U  31  -2.378 -22.761   0.017
  333    H6     U  31           H6         U  31  -0.117 -23.414  -0.489
  334    H3T    U  31           H3T        U  31   3.953 -25.449   1.184
  Start of MODEL    3
    1   1H5*    A   1          1H5*        A   1  -1.981 -14.797   9.585
    2   2H5*    A   1          2H5*        A   1  -2.614 -13.984   8.142
    3    H4*    A   1           H4*        A   1  -0.119 -13.836   8.586
    4    H3*    A   1           H3*        A   1  -1.344 -14.487   5.943
    5    H2*    A   1           H2*        A   1   0.823 -14.930   4.985
    6   2HO*    A   1          2HO*        A   1   1.805 -13.930   7.479
    7    H1*    A   1           H1*        A   1   1.743 -16.530   7.028
    8    H8     A   1           H8         A   1  -1.741 -17.447   7.333
    9   1H6     A   1          H61         A   1  -1.252 -20.875   2.204
   10   2H6     A   1          H62         A   1  -2.236 -20.520   3.606
   11    H2     A   1           H2         A   1   2.359 -18.224   2.455
   12    H5T    A   1           H5T        A   1  -2.648 -16.610   8.802
   13   1H5*    G   2          1H5*        G   2   1.542 -11.789   4.938
   14   2H5*    G   2          2H5*        G   2   1.024 -10.595   3.733
   15    H4*    G   2           H4*        G   2   2.958 -11.996   3.049
   16    H3*    G   2           H3*        G   2   0.488 -11.878   1.350
   17    H2*    G   2           H2*        G   2   1.479 -13.450  -0.184
   18   2HO*    G   2          2HO*        G   2   3.768 -12.477   0.960
   19    H1*    G   2           H1*        G   2   2.445 -15.187   1.773
   20    H8     G   2           H8         G   2  -0.651 -14.330   3.401
   21    H1     G   2           H1         G   2  -1.694 -17.857  -1.853
   22   1H2     G   2          H21         G   2   1.578 -17.073  -2.670
   23   2H2     G   2          H22         G   2   0.105 -17.909  -3.111
   24   1H5*    U   3          1H5*        U   3   3.587 -10.366  -1.626
   25   2H5*    U   3          2H5*        U   3   2.748  -8.973  -2.336
   26    H4*    U   3           H4*        U   3   3.510 -10.449  -4.071
   27    H3*    U   3           H3*        U   3   0.527 -10.285  -3.746
   28    H2*    U   3           H2*        U   3   0.296 -11.830  -5.593
   29   2HO*    U   3          2HO*        U   3   2.208 -12.546  -6.698
   30    H1*    U   3           H1*        U   3   2.183 -13.626  -4.643
   31    H3     U   3           H3         U   3  -1.788 -15.563  -3.619
   32    H5     U   3           H5         U   3  -1.208 -12.684  -0.620
   33    H6     U   3           H6         U   3   0.695 -11.886  -1.858
   34   1H5*    A   4          1H5*        A   4   1.127  -8.655  -8.000
   35   2H5*    A   4          2H5*        A   4  -0.136  -7.417  -8.125
   36    H4*    A   4           H4*        A   4  -0.181  -9.150  -9.907
   37    H3*    A   4           H3*        A   4  -2.614  -8.638  -8.227
   38    H2*    A   4           H2*        A   4  -3.781 -10.388  -9.446
   39   2HO*    A   4          2HO*        A   4  -2.995 -10.217 -11.513
   40    H1*    A   4           H1*        A   4  -1.796 -12.259  -9.120
   41    H8     A   4           H8         A   4  -1.206 -10.349  -6.073
   42   1H6     A   4          H61         A   4  -6.206 -12.968  -3.545
   43   2H6     A   4          H62         A   4  -4.758 -12.037  -3.232
   44    H2     A   4           H2         A   4  -6.294 -13.777  -7.957
   45   1H5*    G   5          1H5*        G   5  -4.626  -7.152 -11.829
   46   2H5*    G   5          2H5*        G   5  -5.399  -5.655 -11.274
   47    H4*    G   5           H4*        G   5  -6.981  -7.409 -12.011
   48    H3*    G   5           H3*        G   5  -7.186  -6.334  -9.208
   49    H2*    G   5           H2*        G   5  -9.094  -7.782  -8.868
   50   2HO*    G   5          2HO*        G   5  -8.932  -7.951 -11.678
   51    H1*    G   5           H1*        G   5  -7.881 -10.037  -9.961
   52    H8     G   5           H8         G   5  -4.987  -8.534  -8.368
   53    H1     G   5           H1         G   5  -9.162 -10.809  -4.058
   54   1H2     G   5          H21         G   5 -11.377 -10.920  -6.698
   55   2H2     G   5          H22         G   5 -11.089 -11.185  -4.991
   56   1H5*    A   6          1H5*        A   6 -10.859  -6.891 -10.315
   57   2H5*    A   6          2H5*        A   6 -11.775  -5.372 -10.327
   58    H4*    A   6           H4*        A   6 -12.924  -7.256  -9.204
   59    H3*    A   6           H3*        A   6 -13.095  -4.671  -8.440
   60    H2*    A   6           H2*        A   6 -11.385  -4.708  -6.737
   61   2HO*    A   6          2HO*        A   6 -13.103  -5.911  -4.970
   62    H1*    A   6           H1*        A   6 -12.356  -7.492  -5.886
   63    H8     A   6           H8         A   6  -8.926  -6.329  -7.156
   64   1H6     A   6          H61         A   6  -6.940  -7.274  -1.370
   65   2H6     A   6          H62         A   6  -6.471  -6.861  -3.009
   66    H2     A   6           H2         A   6 -11.375  -7.974  -1.454
   67   1H5*    A   7          1H5*        A   7 -15.527  -6.571  -4.986
   68   2H5*    A   7          2H5*        A   7 -16.965  -5.541  -4.846
   69    H4*    A   7           H4*        A   7 -16.154  -5.587  -2.691
   70    H3*    A   7           H3*        A   7 -15.105  -3.082  -3.989
   71    H2*    A   7           H2*        A   7 -13.794  -2.643  -2.074
   72   2HO*    A   7          2HO*        A   7 -15.171  -4.447  -0.425
   73    H1*    A   7           H1*        A   7 -13.760  -5.462  -1.186
   74    H8     A   7           H8         A   7 -11.890  -4.395  -4.340
   75   1H6     A   7          H61         A   7  -6.904  -4.061  -0.678
   76   2H6     A   7          H62         A   7  -7.473  -3.996  -2.333
   77    H2     A   7           H2         A   7 -10.493  -4.735   1.914
   78   1H5*    A   8          1H5*        A   8 -17.373   0.571  -0.968
   79   2H5*    A   8          2H5*        A   8 -15.655   0.810  -1.340
   80    H4*    A   8           H4*        A   8 -16.993   0.162   1.213
   81    H3*    A   8           H3*        A   8 -14.685   1.889   0.396
   82    H2*    A   8           H2*        A   8 -13.655   1.552   2.549
   83   2HO*    A   8          2HO*        A   8 -15.314   1.564   3.989
   84    H1*    A   8           H1*        A   8 -14.034  -1.189   2.631
   85    H8     A   8           H8         A   8 -13.492  -0.017  -0.939
   86   1H6     A   8          H61         A   8  -7.451  -0.878   0.118
   87   2H6     A   8          H62         A   8  -8.660  -0.523  -1.095
   88    H2     A   8           H2         A   8  -9.629  -1.351   4.012
   89   1H5*    C   9          1H5*        C   9 -15.589   4.567   4.628
   90   2H5*    C   9          2H5*        C   9 -14.820   5.828   3.644
   91    H4*    C   9           H4*        C   9 -13.752   4.835   5.890
   92    H3*    C   9           H3*        C   9 -12.425   6.057   3.501
   93    H2*    C   9           H2*        C   9 -10.263   5.417   4.342
   94   2HO*    C   9          2HO*        C   9  -9.964   4.824   6.440
   95    H1*    C   9           H1*        C   9 -10.964   2.829   5.063
   96   1H4     C   9          H41         C   9 -10.619   2.589  -1.517
   97   2H4     C   9          H42         C   9  -9.010   2.183  -0.938
   98    H5     C   9           H5         C   9 -12.409   3.312  -0.039
   99    H6     C   9           H6         C   9 -13.006   3.787   2.275
  100   1H5*    A  10          1H5*        A  10  -9.857  10.020   6.520
  101   2H5*    A  10          2H5*        A  10  -9.164   9.401   5.010
  102    H4*    A  10           H4*        A  10  -8.408   8.855   7.836
  103    H3*    A  10           H3*        A  10  -6.977   9.803   5.429
  104    H2*    A  10           H2*        A  10  -5.100   8.352   5.723
  105   2HO*    A  10          2HO*        A  10  -6.075   8.332   8.338
  106    H1*    A  10           H1*        A  10  -6.444   6.045   6.383
  107    H8     A  10           H8         A  10  -8.975   7.310   4.137
  108   1H6     A  10          H61         A  10  -5.388   5.813  -0.680
  109   2H6     A  10          H62         A  10  -6.998   6.281  -0.182
  110    H2     A  10           H2         A  10  -2.879   5.629   3.031
  111   1H5*    A  11          1H5*        A  11  -3.229  12.798   6.255
  112   2H5*    A  11          2H5*        A  11  -3.663  11.897   4.790
  113    H4*    A  11           H4*        A  11  -1.513  11.336   6.799
  114    H3*    A  11           H3*        A  11  -1.533  11.932   3.873
  115    H2*    A  11           H2*        A  11   0.196  10.323   3.461
  116   2HO*    A  11          2HO*        A  11   1.148  11.022   5.679
  117    H1*    A  11           H1*        A  11  -0.796   8.316   5.118
  118    H8     A  11           H8         A  11  -3.961   9.480   3.821
  119   1H6     A  11          H61         A  11  -2.699   6.712  -1.572
  120   2H6     A  11          H62         A  11  -3.947   7.463  -0.602
  121    H2     A  11           H2         A  11   1.086   6.881   0.823
  122   1H5*    G  12          1H5*        G  12   2.730  12.115   4.771
  123   2H5*    G  12          2H5*        G  12   3.094  13.822   4.449
  124    H4*    G  12           H4*        G  12   4.771  12.417   3.456
  125    H3*    G  12           H3*        G  12   3.041  13.995   1.599
  126    H2*    G  12           H2*        G  12   4.081  12.964  -0.316
  127   2HO*    G  12          2HO*        G  12   6.164  12.826   1.190
  128    H1*    G  12           H1*        G  12   3.928  10.378   0.598
  129    H8     G  12           H8         G  12   1.066  12.510   1.917
  130    H1     G  12           H1         G  12  -0.032   9.685  -3.736
  131   1H2     G  12          H21         G  12   3.316   8.815  -3.612
  132   2H2     G  12          H22         G  12   1.807   8.751  -4.494
  133   1H5*    G  13          1H5*        G  13   6.908  13.800  -0.263
  134   2H5*    G  13          2H5*        G  13   7.311  15.493  -0.609
  135    H4*    G  13           H4*        G  13   7.596  14.152  -2.585
  136    H3*    G  13           H3*        G  13   5.356  16.150  -2.693
  137    H2*    G  13           H2*        G  13   4.874  15.422  -4.940
  138   2HO*    G  13          2HO*        G  13   6.533  14.779  -6.101
  139    H1*    G  13           H1*        G  13   5.094  12.691  -4.388
  140    H8     G  13           H8         G  13   3.506  14.496  -1.491
  141    H1     G  13           H1         G  13  -0.576  12.835  -6.157
  142   1H2     G  13          H21         G  13   2.262  12.081  -7.971
  143   2H2     G  13          H22         G  13   0.514  12.148  -7.920
  144   1H5*    C  14          1H5*        C  14   7.322  17.311  -6.461
  145   2H5*    C  14          2H5*        C  14   7.749  18.988  -6.071
  146    H4*    C  14           H4*        C  14   6.684  19.127  -8.129
  147    H3*    C  14           H3*        C  14   4.715  19.846  -5.964
  148    H2*    C  14           H2*        C  14   3.099  20.274  -7.705
  149   2HO*    C  14          2HO*        C  14   3.712  20.335  -9.867
  150    H1*    C  14           H1*        C  14   3.722  17.957  -9.166
  151   1H4     C  14          H41         C  14  -0.055  15.947  -4.148
  152   2H4     C  14          H42         C  14  -1.182  16.503  -5.377
  153    H5     C  14           H5         C  14   2.337  16.182  -4.375
  154    H6     C  14           H6         C  14   4.135  17.022  -5.793
  155   1H5*    U  15          1H5*        U  15   3.538  23.215  -8.352
  156   2H5*    U  15          2H5*        U  15   3.630  24.466  -7.097
  157    H4*    U  15           H4*        U  15   1.387  24.218  -8.082
  158    H3*    U  15           H3*        U  15   1.746  23.831  -5.128
  159    H2*    U  15           H2*        U  15  -0.607  23.345  -4.922
  160   2HO*    U  15          2HO*        U  15  -1.702  23.328  -7.196
  161    H1*    U  15           H1*        U  15  -0.706  21.571  -7.035
  162    H3     U  15           H3         U  15  -0.633  18.974  -3.301
  163    H5     U  15           H5         U  15   3.388  19.921  -4.049
  164    H6     U  15           H6         U  15   2.632  21.461  -5.738
  165   1H5*    U  16          1H5*        U  16  -1.066  28.341  -4.032
  166   2H5*    U  16          2H5*        U  16  -1.356  27.197  -2.708
  167    H4*    U  16           H4*        U  16  -3.460  28.034  -3.352
  168    H3*    U  16           H3*        U  16  -3.274  25.430  -3.188
  169    H2*    U  16           H2*        U  16  -2.391  24.974  -5.394
  170   2HO*    U  16          2HO*        U  16  -5.076  25.062  -6.217
  171    H1*    U  16           H1*        U  16  -4.431  26.825  -6.697
  172    H3     U  16           H3         U  16  -2.076  25.524 -10.369
  173    H5     U  16           H5         U  16   0.611  27.803  -8.082
  174    H6     U  16           H6         U  16  -1.023  27.802  -6.309
  175   1H5*    C  17          1H5*        C  17  -6.348  23.616  -4.555
  176   2H5*    C  17          2H5*        C  17  -7.291  23.057  -3.160
  177    H4*    C  17           H4*        C  17  -6.129  21.320  -4.666
  178    H3*    C  17           H3*        C  17  -6.881  20.993  -2.058
  179    H2*    C  17           H2*        C  17  -4.755  21.706  -1.114
  180   2HO*    C  17          2HO*        C  17  -3.747  19.801  -0.469
  181    H1*    C  17           H1*        C  17  -3.449  20.073  -3.382
  182   1H4     C  17          H41         C  17   1.408  24.101  -1.640
  183   2H4     C  17          H42         C  17   1.814  22.593  -0.828
  184    H5     C  17           H5         C  17  -0.702  24.485  -2.729
  185    H6     C  17           H6         C  17  -2.824  23.475  -3.368
  186   1H5*    G  18          1H5*        G  18  -8.416  21.005  -3.643
  187   2H5*    G  18          2H5*        G  18  -9.830  20.340  -2.803
  188    H4*    G  18           H4*        G  18 -11.027  20.725  -4.615
  189    H3*    G  18           H3*        G  18  -9.351  18.502  -5.659
  190    H2*    G  18           H2*        G  18  -9.424  19.235  -7.859
  191   2HO*    G  18          2HO*        G  18 -11.889  18.865  -7.443
  192    H1*    G  18           H1*        G  18 -10.740  21.858  -7.168
  193    H8     G  18           H8         G  18 -10.030  22.810  -9.453
  194    H1     G  18           H1         G  18  -3.888  21.418  -8.202
  195   1H2     G  18          H21         G  18  -5.139  19.687  -5.494
  196   2H2     G  18          H22         G  18  -3.734  20.176  -6.415
  197   1H5*    G  19          1H5*        G  19  -9.247  14.806  -5.935
  198   2H5*    G  19          2H5*        G  19  -8.746  16.494  -5.739
  199    H4*    G  19           H4*        G  19  -9.682  15.750  -8.423
  200    H3*    G  19           H3*        G  19  -7.485  14.195  -7.223
  201    H2*    G  19           H2*        G  19  -5.851  14.820  -8.835
  202   2HO*    G  19          2HO*        G  19  -8.016  14.860 -10.409
  203    H1*    G  19           H1*        G  19  -6.573  17.471  -9.237
  204    H8     G  19           H8         G  19  -6.908  16.431  -5.601
  205    H1     G  19           H1         G  19  -1.102  18.581  -7.259
  206   1H2     G  19          H21         G  19  -2.273  18.430 -10.494
  207   2H2     G  19          H22         G  19  -0.934  18.785  -9.414
  208   1H5*    C  20          1H5*        C  20  -7.751  12.242 -11.212
  209   2H5*    C  20          2H5*        C  20  -7.753  10.500 -10.872
  210    H4*    C  20           H4*        C  20  -5.958  11.181 -12.401
  211    H3*    C  20           H3*        C  20  -5.290   9.839  -9.815
  212    H2*    C  20           H2*        C  20  -2.931  10.102 -10.243
  213   2HO*    C  20          2HO*        C  20  -3.864  10.828 -12.830
  214    H1*    C  20           H1*        C  20  -3.052  12.751 -10.998
  215   1H4     C  20          H41         C  20  -4.198  13.059  -4.530
  216   2H4     C  20          H42         C  20  -2.455  13.037  -4.669
  217    H5     C  20           H5         C  20  -5.667  12.749  -6.390
  218    H6     C  20           H6         C  20  -5.810  12.383  -8.777
  219   1H5*    C  21          1H5*        C  21  -2.357   8.473 -11.817
  220   2H5*    C  21          2H5*        C  21  -2.535   6.720 -12.028
  221    H4*    C  21           H4*        C  21  -0.351   7.108 -11.220
  222    H3*    C  21           H3*        C  21  -2.177   5.958  -9.125
  223    H2*    C  21           H2*        C  21  -0.366   6.008  -7.557
  224   2HO*    C  21          2HO*        C  21   1.784   6.631  -8.418
  225    H1*    C  21           H1*        C  21   0.699   8.487  -8.435
  226   1H4     C  21          H41         C  21  -4.059   9.974  -4.113
  227   2H4     C  21          H42         C  21  -2.656   9.603  -3.125
  228    H5     C  21           H5         C  21  -4.084   9.659  -6.518
  229    H6     C  21           H6         C  21  -2.776   8.937  -8.450
  230   1H5*    U  22          1H5*        U  22   0.405   3.905  -8.153
  231   2H5*    U  22          2H5*        U  22   0.057   2.180  -7.929
  232    H4*    U  22           H4*        U  22   0.597   3.524  -5.857
  233    H3*    U  22           H3*        U  22  -1.724   1.666  -6.104
  234    H2*    U  22           H2*        U  22  -2.590   2.337  -3.969
  235   2HO*    U  22          2HO*        U  22  -0.204   2.563  -3.236
  236    H1*    U  22           H1*        U  22  -2.250   5.062  -4.300
  237    H3     U  22           H3         U  22  -6.665   3.754  -4.828
  238    H5     U  22           H5         U  22  -4.981   4.082  -8.661
  239    H6     U  22           H6         U  22  -2.822   4.269  -7.612
  240   1H5*    G  23          1H5*        G  23   1.608   0.507  -2.115
  241   2H5*    G  23          2H5*        G  23   0.602  -0.876  -1.642
  242    H4*    G  23           H4*        G  23   1.421   1.005   0.069
  243    H3*    G  23           H3*        G  23  -1.038  -0.705   0.146
  244    H2*    G  23           H2*        G  23  -1.864   0.552   2.029
  245   2HO*    G  23          2HO*        G  23  -0.558   1.829   3.222
  246    H1*    G  23           H1*        G  23  -1.318   3.056   0.971
  247    H8     G  23           H8         G  23  -2.170   1.172  -2.055
  248    H1     G  23           H1         G  23  -7.323   2.469   1.541
  249   1H2     G  23          H21         G  23  -5.029   3.287   3.995
  250   2H2     G  23          H22         G  23  -6.711   3.149   3.533
  251   1H5*    C  24          1H5*        C  24  -2.132  -2.759   3.926
  252   2H5*    C  24          2H5*        C  24  -2.670  -1.165   3.363
  253    H4*    C  24           H4*        C  24  -1.114  -1.150   5.858
  254    H3*    C  24           H3*        C  24  -3.723  -2.645   5.765
  255    H2*    C  24           H2*        C  24  -4.352  -1.597   7.834
  256   2HO*    C  24          2HO*        C  24  -2.651  -1.462   9.144
  257    H1*    C  24           H1*        C  24  -3.379   0.956   7.147
  258   1H4     C  24          H41         C  24  -9.248   0.566   4.194
  259   2H4     C  24          H42         C  24  -9.595   1.075   5.838
  260    H5     C  24           H5         C  24  -7.030  -0.076   3.465
  261    H6     C  24           H6         C  24  -4.709  -0.368   4.159
  262   1H5*    U  25          1H5*        U  25  -4.214  -4.271   8.550
  263   2H5*    U  25          2H5*        U  25  -4.196  -6.029   8.313
  264    H4*    U  25           H4*        U  25  -6.429  -5.075   8.821
  265    H3*    U  25           H3*        U  25  -6.004  -6.680   6.319
  266    H2*    U  25           H2*        U  25  -8.334  -6.336   5.752
  267   2HO*    U  25          2HO*        U  25  -9.506  -6.319   7.572
  268    H1*    U  25           H1*        U  25  -8.296  -3.614   6.193
  269    H3     U  25           H3         U  25  -7.982  -4.057   1.683
  270    H5     U  25           H5         U  25  -4.055  -4.503   3.092
  271    H6     U  25           H6         U  25  -4.944  -4.556   5.330
  272   1H5*    U  26          1H5*        U  26  -9.475  -8.808   7.881
  273   2H5*    U  26          2H5*        U  26  -9.133 -10.509   7.514
  274    H4*    U  26           H4*        U  26 -11.219  -9.625   6.494
  275    H3*    U  26           H3*        U  26  -9.087 -10.779   4.703
  276    H2*    U  26           H2*        U  26 -10.555 -10.387   2.838
  277   2HO*    U  26          2HO*        U  26 -12.725  -9.927   3.140
  278    H1*    U  26           H1*        U  26 -11.452  -7.862   3.763
  279    H3     U  26           H3         U  26  -9.053  -7.370  -0.125
  280    H5     U  26           H5         U  26  -6.279  -7.162   3.021
  281    H6     U  26           H6         U  26  -8.025  -7.892   4.507
  282   1H5*    U  27          1H5*        U  27 -12.871 -12.931   3.832
  283   2H5*    U  27          2H5*        U  27 -12.414 -14.590   3.399
  284    H4*    U  27           H4*        U  27 -13.808 -13.422   1.708
  285    H3*    U  27           H3*        U  27 -11.133 -14.554   0.948
  286    H2*    U  27           H2*        U  27 -11.482 -13.762  -1.313
  287   2HO*    U  27          2HO*        U  27 -13.581 -13.902  -1.815
  288    H1*    U  27           H1*        U  27 -12.220 -11.206  -0.561
  289    H3     U  27           H3         U  27  -7.873 -10.880  -1.835
  290    H5     U  27           H5         U  27  -7.732 -12.232   2.137
  291    H6     U  27           H6         U  27 -10.114 -12.550   2.030
  292   1H5*    U  28          1H5*        U  28 -14.190 -16.689  -1.831
  293   2H5*    U  28          2H5*        U  28 -13.473 -18.304  -1.992
  294    H4*    U  28           H4*        U  28 -14.026 -17.217  -4.144
  295    H3*    U  28           H3*        U  28 -11.194 -18.070  -3.608
  296    H2*    U  28           H2*        U  28 -10.602 -17.274  -5.817
  297   2HO*    U  28          2HO*        U  28 -13.344 -17.462  -6.140
  298    H1*    U  28           H1*        U  28 -11.871 -14.828  -5.529
  299    H3     U  28           H3         U  28  -7.419 -14.070  -4.899
  300    H5     U  28           H5         U  28  -8.896 -15.243  -1.148
  301    H6     U  28           H6         U  28 -10.964 -15.826  -2.230
  302   1H5*    G  29          1H5*        G  29 -11.296 -21.014  -6.650
  303   2H5*    G  29          2H5*        G  29 -10.670 -22.469  -5.851
  304    H4*    G  29           H4*        G  29  -9.189 -21.647  -7.623
  305    H3*    G  29           H3*        G  29  -8.103 -21.706  -4.816
  306    H2*    G  29           H2*        G  29  -6.062 -20.778  -5.604
  307   2HO*    G  29          2HO*        G  29  -6.976 -21.707  -8.141
  308    H1*    G  29           H1*        G  29  -7.255 -19.282  -7.776
  309    H8     G  29           H8         G  29  -8.796 -18.342  -4.528
  310    H1     G  29           H1         G  29  -3.124 -15.535  -5.568
  311   1H2     G  29          H21         G  29  -2.813 -17.792  -8.172
  312   2H2     G  29          H22         G  29  -2.111 -16.465  -7.276
  313   1H5*    C  30          1H5*        C  30  -5.180 -23.544  -7.706
  314   2H5*    C  30          2H5*        C  30  -4.473 -24.893  -6.795
  315    H4*    C  30           H4*        C  30  -2.816 -23.361  -7.827
  316    H3*    C  30           H3*        C  30  -2.764 -23.887  -4.873
  317    H2*    C  30           H2*        C  30  -0.907 -22.368  -4.645
  318   2HO*    C  30          2HO*        C  30  -0.456 -23.103  -7.155
  319    H1*    C  30           H1*        C  30  -1.977 -20.362  -6.252
  320   1H4     C  30          H41         C  30  -5.389 -19.989  -0.623
  321   2H4     C  30          H42         C  30  -4.099 -18.811  -0.483
  322    H5     C  30           H5         C  30  -5.574 -21.527  -2.471
  323    H6     C  30           H6         C  30  -4.584 -22.233  -4.584
  324   1H5*    U  31          1H5*        U  31   1.194 -23.621  -6.374
  325   2H5*    U  31          2H5*        U  31   2.101 -25.013  -5.751
  326    H4*    U  31           H4*        U  31   3.228 -22.840  -5.406
  327    H3*    U  31           H3*        U  31   2.564 -24.535  -3.012
  328    H2*    U  31           H2*        U  31   3.581 -22.874  -1.609
  329   2HO*    U  31          2HO*        U  31   5.361 -22.130  -2.568
  330    H1*    U  31           H1*        U  31   2.510 -20.663  -3.000
  331    H3     U  31           H3         U  31   0.425 -20.582   1.019
  332    H5     U  31           H5         U  31  -1.544 -23.594  -1.149
  333    H6     U  31           H6         U  31   0.146 -23.372  -2.847
  334    H3T    U  31           H3T        U  31   4.381 -24.534  -4.874
  Start of MODEL    4
    1   1H5*    A   1          1H5*        A   1  -4.329  -9.844   6.654
    2   2H5*    A   1          2H5*        A   1  -4.259 -11.097   7.907
    3    H4*    A   1           H4*        A   1  -1.824  -9.494   7.689
    4    H3*    A   1           H3*        A   1  -2.768 -10.947   5.241
    5    H2*    A   1           H2*        A   1  -0.549 -11.849   4.939
    6   2HO*    A   1          2HO*        A   1   1.006 -10.523   5.553
    7    H1*    A   1           H1*        A   1  -0.199 -12.605   7.585
    8    H8     A   1           H8         A   1  -3.767 -13.259   7.273
    9   1H6     A   1          H61         A   1  -2.448 -18.385   4.061
   10   2H6     A   1          H62         A   1  -3.701 -17.507   4.909
   11    H2     A   1           H2         A   1   1.285 -15.918   4.337
   12    H5T    A   1           H5T        A   1  -3.737  -8.318   8.204
   13   1H5*    G   2          1H5*        G   2   0.470  -8.529   3.690
   14   2H5*    G   2          2H5*        G   2  -0.039  -7.803   2.153
   15    H4*    G   2           H4*        G   2   2.060  -9.126   2.035
   16    H3*    G   2           H3*        G   2  -0.256  -9.789   0.244
   17    H2*    G   2           H2*        G   2   1.007 -11.617  -0.690
   18   2HO*    G   2          2HO*        G   2   3.071 -10.063   0.099
   19    H1*    G   2           H1*        G   2   2.007 -12.549   1.756
   20    H8     G   2           H8         G   2  -1.320 -11.703   2.851
   21    H1     G   2           H1         G   2  -1.383 -16.793  -1.050
   22   1H2     G   2          H21         G   2   1.829 -15.817  -1.894
   23   2H2     G   2          H22         G   2   0.523 -16.957  -2.125
   24   1H5*    U   3          1H5*        U   3   2.931  -8.821  -2.850
   25   2H5*    U   3          2H5*        U   3   2.025  -7.839  -4.017
   26    H4*    U   3           H4*        U   3   3.097  -9.667  -5.145
   27    H3*    U   3           H3*        U   3   0.092  -9.879  -5.025
   28    H2*    U   3           H2*        U   3   0.296 -11.872  -6.392
   29   2HO*    U   3          2HO*        U   3   3.098 -11.744  -6.394
   30    H1*    U   3           H1*        U   3   2.339 -12.967  -4.842
   31    H3     U   3           H3         U   3  -1.345 -15.353  -3.711
   32    H5     U   3           H5         U   3  -1.693 -11.769  -1.550
   33    H6     U   3           H6         U   3   0.200 -10.934  -2.778
   34   1H5*    A   4          1H5*        A   4   0.653  -9.387  -9.530
   35   2H5*    A   4          2H5*        A   4  -0.691  -8.306  -9.946
   36    H4*    A   4           H4*        A   4  -0.671 -10.366 -11.274
   37    H3*    A   4           H3*        A   4  -3.060  -9.796  -9.550
   38    H2*    A   4           H2*        A   4  -4.059 -11.874 -10.325
   39   2HO*    A   4          2HO*        A   4  -3.469 -12.494 -12.277
   40    H1*    A   4           H1*        A   4  -1.844 -13.401  -9.760
   41    H8     A   4           H8         A   4  -1.371 -10.814  -7.235
   42   1H6     A   4          H61         A   4  -5.831 -13.413  -3.829
   43   2H6     A   4          H62         A   4  -4.511 -12.265  -3.834
   44    H2     A   4           H2         A   4  -6.029 -15.170  -7.954
   45   1H5*    G   5          1H5*        G   5  -5.476  -9.297 -13.135
   46   2H5*    G   5          2H5*        G   5  -6.380  -7.805 -12.812
   47    H4*    G   5           H4*        G   5  -7.798  -9.814 -13.010
   48    H3*    G   5           H3*        G   5  -7.874  -8.255 -10.435
   49    H2*    G   5           H2*        G   5  -9.570  -9.793  -9.652
   50   2HO*    G   5          2HO*        G   5 -10.057 -10.049 -12.241
   51    H1*    G   5           H1*        G   5  -8.200 -12.081 -10.467
   52    H8     G   5           H8         G   5  -5.395 -10.018  -9.422
   53    H1     G   5           H1         G   5  -8.929 -11.949  -4.426
   54   1H2     G   5          H21         G   5 -11.298 -12.770  -6.796
   55   2H2     G   5          H22         G   5 -10.856 -12.711  -5.104
   56   1H5*    A   6          1H5*        A   6 -11.538  -9.394 -10.961
   57   2H5*    A   6          2H5*        A   6 -12.615  -7.998 -11.146
   58    H4*    A   6           H4*        A   6 -13.423  -9.718  -9.558
   59    H3*    A   6           H3*        A   6 -13.808  -7.058  -9.280
   60    H2*    A   6           H2*        A   6 -11.952  -6.592  -7.814
   61   2HO*    A   6          2HO*        A   6 -14.191  -6.494  -6.682
   62    H1*    A   6           H1*        A   6 -12.485  -9.233  -6.346
   63    H8     A   6           H8         A   6  -9.381  -8.008  -8.244
   64   1H6     A   6          H61         A   6  -6.693  -7.534  -2.686
   65   2H6     A   6          H62         A   6  -6.458  -7.418  -4.420
   66    H2     A   6           H2         A   6 -10.980  -8.729  -2.066
   67   1H5*    A   7          1H5*        A   7 -15.835  -8.567  -5.294
   68   2H5*    A   7          2H5*        A   7 -17.273  -7.537  -5.155
   69    H4*    A   7           H4*        A   7 -16.154  -7.393  -3.097
   70    H3*    A   7           H3*        A   7 -15.680  -4.909  -4.731
   71    H2*    A   7           H2*        A   7 -14.206  -4.111  -3.068
   72   2HO*    A   7          2HO*        A   7 -15.071  -5.918  -1.106
   73    H1*    A   7           H1*        A   7 -13.632  -6.803  -1.985
   74    H8     A   7           H8         A   7 -12.365  -5.857  -5.444
   75   1H6     A   7          H61         A   7  -7.082  -4.338  -2.579
   76   2H6     A   7          H62         A   7  -7.852  -4.571  -4.135
   77    H2     A   7           H2         A   7 -10.178  -5.168   0.548
   78   1H5*    A   8          1H5*        A   8 -18.643  -2.640  -0.916
   79   2H5*    A   8          2H5*        A   8 -17.804  -1.165  -1.436
   80    H4*    A   8           H4*        A   8 -17.682  -2.371   1.059
   81    H3*    A   8           H3*        A   8 -16.110  -0.156  -0.205
   82    H2*    A   8           H2*        A   8 -14.471  -0.300   1.556
   83   2HO*    A   8          2HO*        A   8 -16.339  -0.886   3.099
   84    H1*    A   8           H1*        A   8 -14.239  -3.062   1.517
   85    H8     A   8           H8         A   8 -14.909  -2.109  -2.022
   86   1H6     A   8          H61         A   8  -8.859  -0.904  -2.558
   87   2H6     A   8          H62         A   8 -10.364  -1.111  -3.427
   88    H2     A   8           H2         A   8  -9.783  -1.485   1.792
   89   1H5*    C   9          1H5*        C   9 -16.622   2.365   4.406
   90   2H5*    C   9          2H5*        C   9 -16.180   3.645   3.259
   91    H4*    C   9           H4*        C   9 -14.650   2.754   5.351
   92    H3*    C   9           H3*        C   9 -13.994   4.395   2.938
   93    H2*    C   9           H2*        C   9 -11.639   4.127   3.351
   94   2HO*    C   9          2HO*        C   9 -10.976   3.860   5.355
   95    H1*    C   9           H1*        C   9 -11.717   1.405   3.872
   96   1H4     C   9          H41         C   9 -12.565   1.737  -2.657
   97   2H4     C   9          H42         C   9 -10.827   1.663  -2.407
   98    H5     C   9           H5         C   9 -14.153   1.934  -0.826
   99    H6     C   9           H6         C   9 -14.386   2.093   1.595
  100   1H5*    A  10          1H5*        A  10 -11.016   7.936   6.007
  101   2H5*    A  10          2H5*        A  10 -10.833   7.840   4.244
  102    H4*    A  10           H4*        A  10  -9.231   6.569   6.412
  103    H3*    A  10           H3*        A  10  -8.617   8.314   4.093
  104    H2*    A  10           H2*        A  10  -6.687   7.052   3.451
  105   2HO*    A  10          2HO*        A  10  -5.561   6.279   5.081
  106    H1*    A  10           H1*        A  10  -7.749   4.527   3.734
  107    H8     A  10           H8         A  10 -10.807   6.118   2.632
  108   1H6     A  10          H61         A  10  -8.542   6.344  -3.124
  109   2H6     A  10          H62         A  10  -9.979   6.503  -2.139
  110    H2     A  10           H2         A  10  -5.159   5.402  -0.335
  111   1H5*    A  11          1H5*        A  11  -4.127  10.854   5.869
  112   2H5*    A  11          2H5*        A  11  -4.583  10.584   4.176
  113    H4*    A  11           H4*        A  11  -2.546   9.175   5.852
  114    H3*    A  11           H3*        A  11  -2.463  10.666   3.264
  115    H2*    A  11           H2*        A  11  -0.897   9.106   2.335
  116   2HO*    A  11          2HO*        A  11   0.428   8.000   3.605
  117    H1*    A  11           H1*        A  11  -2.101   6.784   3.298
  118    H8     A  11           H8         A  11  -5.103   8.646   2.472
  119   1H6     A  11          H61         A  11  -4.069   7.486  -3.519
  120   2H6     A  11          H62         A  11  -5.238   8.052  -2.347
  121    H2     A  11           H2         A  11  -0.337   6.481  -1.245
  122   1H5*    G  12          1H5*        G  12   1.871  10.255   4.316
  123   2H5*    G  12          2H5*        G  12   2.469  11.907   4.066
  124    H4*    G  12           H4*        G  12   3.787  10.192   2.890
  125    H3*    G  12           H3*        G  12   2.509  12.423   1.359
  126    H2*    G  12           H2*        G  12   3.279  11.473  -0.718
  127   2HO*    G  12          2HO*        G  12   4.820   9.903  -0.777
  128    H1*    G  12           H1*        G  12   2.498   8.888  -0.180
  129    H8     G  12           H8         G  12   0.213  11.460   1.449
  130    H1     G  12           H1         G  12  -1.426   9.745  -4.511
  131   1H2     G  12          H21         G  12   1.606   8.080  -4.547
  132   2H2     G  12          H22         G  12   0.141   8.500  -5.406
  133   1H5*    G  13          1H5*        G  13   6.223  11.496  -0.588
  134   2H5*    G  13          2H5*        G  13   7.091  13.043  -0.625
  135    H4*    G  13           H4*        G  13   7.141  12.040  -2.800
  136    H3*    G  13           H3*        G  13   5.498  14.544  -2.581
  137    H2*    G  13           H2*        G  13   4.955  14.354  -4.924
  138   2HO*    G  13          2HO*        G  13   7.107  12.535  -4.848
  139    H1*    G  13           H1*        G  13   4.381  11.632  -4.849
  140    H8     G  13           H8         G  13   3.292  13.243  -1.626
  141    H1     G  13           H1         G  13  -0.982  13.649  -6.394
  142   1H2     G  13          H21         G  13   1.580  12.487  -8.397
  143   2H2     G  13          H22         G  13  -0.083  13.018  -8.285
  144   1H5*    C  14          1H5*        C  14   7.547  15.765  -6.043
  145   2H5*    C  14          2H5*        C  14   8.528  17.120  -5.452
  146    H4*    C  14           H4*        C  14   7.484  18.021  -7.293
  147    H3*    C  14           H3*        C  14   5.832  18.758  -4.882
  148    H2*    C  14           H2*        C  14   4.362  19.961  -6.366
  149   2HO*    C  14          2HO*        C  14   6.609  20.080  -7.860
  150    H1*    C  14           H1*        C  14   4.327  17.949  -8.337
  151   1H4     C  14          H41         C  14   0.109  16.003  -3.656
  152   2H4     C  14          H42         C  14  -0.827  17.039  -4.722
  153    H5     C  14           H5         C  14   2.491  15.691  -3.897
  154    H6     C  14           H6         C  14   4.461  16.299  -5.193
  155   1H5*    U  15          1H5*        U  15   5.605  22.768  -6.015
  156   2H5*    U  15          2H5*        U  15   5.716  23.515  -4.409
  157    H4*    U  15           H4*        U  15   3.486  23.603  -5.703
  158    H3*    U  15           H3*        U  15   3.762  22.999  -2.776
  159    H2*    U  15           H2*        U  15   1.365  22.709  -2.650
  160   2HO*    U  15          2HO*        U  15   1.266  24.396  -4.575
  161    H1*    U  15           H1*        U  15   1.214  21.022  -4.820
  162    H3     U  15           H3         U  15   1.116  18.443  -1.034
  163    H5     U  15           H5         U  15   5.166  18.828  -2.076
  164    H6     U  15           H6         U  15   4.515  20.495  -3.684
  165   1H5*    U  16          1H5*        U  16   2.145  27.668  -0.755
  166   2H5*    U  16          2H5*        U  16   1.483  26.321   0.192
  167    H4*    U  16           H4*        U  16  -0.213  27.973  -0.054
  168    H3*    U  16           H3*        U  16  -0.880  25.485  -0.481
  169    H2*    U  16           H2*        U  16  -0.179  25.277  -2.784
  170   2HO*    U  16          2HO*        U  16  -2.271  24.672  -3.043
  171    H1*    U  16           H1*        U  16  -1.474  27.920  -3.553
  172    H3     U  16           H3         U  16   0.491  26.706  -7.487
  173    H5     U  16           H5         U  16   3.656  27.628  -4.884
  174    H6     U  16           H6         U  16   2.044  27.752  -3.097
  175   1H5*    C  17          1H5*        C  17  -3.996  24.932  -2.287
  176   2H5*    C  17          2H5*        C  17  -5.253  24.455  -1.129
  177    H4*    C  17           H4*        C  17  -4.552  22.730  -2.842
  178    H3*    C  17           H3*        C  17  -5.495  22.195  -0.339
  179    H2*    C  17           H2*        C  17  -3.310  22.051   0.720
  180   2HO*    C  17          2HO*        C  17  -3.001  19.480  -0.114
  181    H1*    C  17           H1*        C  17  -2.415  20.533  -1.811
  182   1H4     C  17          H41         C  17   3.293  22.563   0.674
  183   2H4     C  17          H42         C  17   3.214  20.871   1.145
  184    H5     C  17           H5         C  17   1.440  23.759  -0.281
  185    H6     C  17           H6         C  17  -0.841  23.558  -1.113
  186   1H5*    G  18          1H5*        G  18  -6.830  22.788  -2.043
  187   2H5*    G  18          2H5*        G  18  -8.408  22.586  -1.260
  188    H4*    G  18           H4*        G  18  -9.434  23.341  -3.059
  189    H3*    G  18           H3*        G  18  -8.210  20.968  -4.366
  190    H2*    G  18           H2*        G  18  -7.981  22.003  -6.435
  191   2HO*    G  18          2HO*        G  18 -10.052  22.169  -7.038
  192    H1*    G  18           H1*        G  18  -8.735  24.728  -5.391
  193    H8     G  18           H8         G  18  -7.665  25.830  -7.465
  194    H1     G  18           H1         G  18  -2.109  22.843  -6.269
  195   1H2     G  18          H21         G  18  -3.904  21.085  -3.905
  196   2H2     G  18          H22         G  18  -2.365  21.357  -4.693
  197   1H5*    G  19          1H5*        G  19  -8.849  17.486  -5.308
  198   2H5*    G  19          2H5*        G  19  -8.050  19.013  -4.896
  199    H4*    G  19           H4*        G  19  -9.102  18.905  -7.619
  200    H3*    G  19           H3*        G  19  -7.368  16.679  -6.779
  201    H2*    G  19           H2*        G  19  -5.607  17.150  -8.305
  202   2HO*    G  19          2HO*        G  19  -7.427  17.638  -9.951
  203    H1*    G  19           H1*        G  19  -5.631  19.918  -8.234
  204    H8     G  19           H8         G  19  -6.298  18.272  -4.856
  205    H1     G  19           H1         G  19  -0.135  19.483  -6.130
  206   1H2     G  19          H21         G  19  -1.236  20.271  -9.298
  207   2H2     G  19          H22         G  19   0.124  20.113  -8.200
  208   1H5*    C  20          1H5*        C  20  -8.062  15.761 -10.983
  209   2H5*    C  20          2H5*        C  20  -8.546  14.059 -11.112
  210    H4*    C  20           H4*        C  20  -6.619  14.565 -12.510
  211    H3*    C  20           H3*        C  20  -6.330  12.549 -10.324
  212    H2*    C  20           H2*        C  20  -3.977  12.315 -10.782
  213   2HO*    C  20          2HO*        C  20  -4.636  13.841 -13.097
  214    H1*    C  20           H1*        C  20  -3.416  15.010 -10.952
  215   1H4     C  20          H41         C  20  -4.483  14.179  -4.516
  216   2H4     C  20          H42         C  20  -2.787  13.811  -4.742
  217    H5     C  20           H5         C  20  -5.988  14.605  -6.329
  218    H6     C  20           H6         C  20  -6.200  14.819  -8.733
  219   1H5*    C  21          1H5*        C  21  -3.771  11.007 -12.702
  220   2H5*    C  21          2H5*        C  21  -4.433   9.497 -13.360
  221    H4*    C  21           H4*        C  21  -2.272   8.977 -12.629
  222    H3*    C  21           H3*        C  21  -4.357   7.984 -10.709
  223    H2*    C  21           H2*        C  21  -2.625   7.136  -9.285
  224   2HO*    C  21          2HO*        C  21  -0.938   7.641 -11.535
  225    H1*    C  21           H1*        C  21  -0.863   9.319  -9.630
  226   1H4     C  21          H41         C  21  -5.107  11.197  -4.946
  227   2H4     C  21          H42         C  21  -3.875  10.275  -4.098
  228    H5     C  21           H5         C  21  -5.182  11.374  -7.362
  229    H6     C  21           H6         C  21  -4.090  10.708  -9.446
  230   1H5*    U  22          1H5*        U  22  -1.980   5.185 -10.736
  231   2H5*    U  22          2H5*        U  22  -2.626   3.533 -10.743
  232    H4*    U  22           H4*        U  22  -1.337   4.461  -8.672
  233    H3*    U  22           H3*        U  22  -3.699   2.632  -8.692
  234    H2*    U  22           H2*        U  22  -3.910   2.787  -6.303
  235   2HO*    U  22          2HO*        U  22  -2.298   3.761  -5.052
  236    H1*    U  22           H1*        U  22  -3.606   5.533  -6.124
  237    H3     U  22           H3         U  22  -8.042   4.376  -5.647
  238    H5     U  22           H5         U  22  -7.447   5.253  -9.711
  239    H6     U  22           H6         U  22  -5.080   5.280  -9.280
  240   1H5*    G  23          1H5*        G  23  -0.776  -0.666  -5.089
  241   2H5*    G  23          2H5*        G  23  -2.541  -0.512  -4.993
  242    H4*    G  23           H4*        G  23  -0.414   0.836  -3.384
  243    H3*    G  23           H3*        G  23  -2.773  -0.872  -2.739
  244    H2*    G  23           H2*        G  23  -3.292   0.444  -0.796
  245   2HO*    G  23          2HO*        G  23  -1.021   2.077  -1.282
  246    H1*    G  23           H1*        G  23  -3.019   2.920  -1.985
  247    H8     G  23           H8         G  23  -4.243   1.054  -4.858
  248    H1     G  23           H1         G  23  -8.849   1.968  -0.491
  249   1H2     G  23          H21         G  23  -6.257   2.833   1.632
  250   2H2     G  23          H22         G  23  -7.980   2.615   1.414
  251   1H5*    C  24          1H5*        C  24  -2.652  -2.499   1.789
  252   2H5*    C  24          2H5*        C  24  -3.356  -1.146   0.883
  253    H4*    C  24           H4*        C  24  -1.223  -0.313   2.675
  254    H3*    C  24           H3*        C  24  -3.493  -1.851   3.905
  255    H2*    C  24           H2*        C  24  -3.619  -0.188   5.646
  256   2HO*    C  24          2HO*        C  24  -1.778   0.734   6.182
  257    H1*    C  24           H1*        C  24  -3.457   1.999   3.922
  258   1H4     C  24          H41         C  24  -9.628  -0.108   3.088
  259   2H4     C  24          H42         C  24  -9.658   0.661   4.665
  260    H5     C  24           H5         C  24  -7.589  -0.469   1.842
  261    H6     C  24           H6         C  24  -5.169  -0.176   1.849
  262   1H5*    U  25          1H5*        U  25  -3.418  -2.668   6.383
  263   2H5*    U  25          2H5*        U  25  -3.450  -4.413   6.704
  264    H4*    U  25           H4*        U  25  -5.660  -3.293   6.845
  265    H3*    U  25           H3*        U  25  -5.287  -5.579   4.922
  266    H2*    U  25           H2*        U  25  -7.628  -5.367   4.350
  267   2HO*    U  25          2HO*        U  25  -9.021  -4.238   5.603
  268    H1*    U  25           H1*        U  25  -7.563  -2.585   4.128
  269    H3     U  25           H3         U  25  -7.851  -4.117  -0.135
  270    H5     U  25           H5         U  25  -3.769  -4.302   0.828
  271    H6     U  25           H6         U  25  -4.363  -3.813   3.109
  272   1H5*    U  26          1H5*        U  26  -8.561  -7.350   7.088
  273   2H5*    U  26          2H5*        U  26  -8.124  -9.067   7.194
  274    H4*    U  26           H4*        U  26 -10.223  -8.660   5.971
  275    H3*    U  26           H3*        U  26  -7.967  -9.977   4.463
  276    H2*    U  26           H2*        U  26  -9.461 -10.175   2.592
  277   2HO*    U  26          2HO*        U  26 -11.472  -9.426   4.481
  278    H1*    U  26           H1*        U  26 -10.654  -7.618   2.981
  279    H3     U  26           H3         U  26  -8.480  -7.744  -1.060
  280    H5     U  26           H5         U  26  -5.621  -6.574   1.785
  281    H6     U  26           H6         U  26  -7.212  -7.136   3.501
  282   1H5*    U  27          1H5*        U  27 -11.504 -12.606   4.313
  283   2H5*    U  27          2H5*        U  27 -10.948 -14.285   4.167
  284    H4*    U  27           H4*        U  27 -12.509 -13.551   2.382
  285    H3*    U  27           H3*        U  27  -9.791 -14.605   1.647
  286    H2*    U  27           H2*        U  27 -10.376 -14.312  -0.681
  287   2HO*    U  27          2HO*        U  27 -12.472 -13.749  -1.284
  288    H1*    U  27           H1*        U  27 -11.360 -11.734  -0.352
  289    H3     U  27           H3         U  27  -7.273 -11.197  -2.231
  290    H5     U  27           H5         U  27  -6.496 -11.798   1.851
  291    H6     U  27           H6         U  27  -8.812 -12.386   2.125
  292   1H5*    U  28          1H5*        U  28 -12.904 -17.418  -0.415
  293   2H5*    U  28          2H5*        U  28 -12.108 -18.990  -0.214
  294    H4*    U  28           H4*        U  28 -12.868 -18.625  -2.501
  295    H3*    U  28           H3*        U  28  -9.904 -18.920  -2.077
  296    H2*    U  28           H2*        U  28  -9.623 -18.737  -4.479
  297   2HO*    U  28          2HO*        U  28 -11.867 -19.818  -4.721
  298    H1*    U  28           H1*        U  28 -11.179 -16.461  -4.696
  299    H3     U  28           H3         U  28  -6.832 -15.080  -4.742
  300    H5     U  28           H5         U  28  -7.863 -15.380  -0.682
  301    H6     U  28           H6         U  28  -9.910 -16.449  -1.361
  302   1H5*    G  29          1H5*        G  29  -9.889 -22.682  -4.136
  303   2H5*    G  29          2H5*        G  29  -8.916 -23.724  -3.080
  304    H4*    G  29           H4*        G  29  -7.885 -23.269  -5.283
  305    H3*    G  29           H3*        G  29  -6.369 -22.442  -2.811
  306    H2*    G  29           H2*        G  29  -4.617 -21.649  -4.225
  307   2HO*    G  29          2HO*        G  29  -5.826 -23.439  -6.045
  308    H1*    G  29           H1*        G  29  -6.375 -20.826  -6.363
  309    H8     G  29           H8         G  29  -7.543 -19.232  -3.251
  310    H1     G  29           H1         G  29  -2.366 -16.367  -5.730
  311   1H2     G  29          H21         G  29  -2.125 -19.184  -7.721
  312   2H2     G  29          H22         G  29  -1.464 -17.625  -7.280
  313   1H5*    C  30          1H5*        C  30  -3.262 -24.298  -4.958
  314   2H5*    C  30          2H5*        C  30  -2.593 -25.471  -3.807
  315    H4*    C  30           H4*        C  30  -0.829 -24.087  -4.623
  316    H3*    C  30           H3*        C  30  -1.539 -23.669  -1.739
  317    H2*    C  30           H2*        C  30   0.120 -21.935  -1.581
  318   2HO*    C  30          2HO*        C  30   0.883 -22.668  -4.239
  319    H1*    C  30           H1*        C  30  -0.508 -20.699  -4.008
  320   1H4     C  30          H41         C  30  -5.237 -18.809   0.185
  321   2H4     C  30          H42         C  30  -4.065 -17.504   0.150
  322    H5     C  30           H5         C  30  -4.909 -20.904  -0.966
  323    H6     C  30           H6         C  30  -3.401 -22.180  -2.394
  324   1H5*    U  31          1H5*        U  31   2.636 -23.524  -1.676
  325   2H5*    U  31          2H5*        U  31   3.123 -24.936  -0.718
  326    H4*    U  31           H4*        U  31   4.388 -23.095   0.049
  327    H3*    U  31           H3*        U  31   2.220 -23.888   1.975
  328    H2*    U  31           H2*        U  31   2.945 -22.134   3.450
  329   2HO*    U  31          2HO*        U  31   5.288 -22.635   2.402
  330    H1*    U  31           H1*        U  31   3.307 -20.218   1.424
  331    H3     U  31           H3         U  31  -0.351 -18.579   3.445
  332    H5     U  31           H5         U  31  -1.743 -22.052   1.539
  333    H6     U  31           H6         U  31   0.537 -22.550   0.948
  334    H3T    U  31           H3T        U  31   3.897 -25.276   1.719
  Start of MODEL    5
    1   1H5*    A   1          1H5*        A   1  -3.067 -12.818   9.442
    2   2H5*    A   1          2H5*        A   1  -3.535 -12.259   7.826
    3    H4*    A   1           H4*        A   1  -1.075 -12.099   8.532
    4    H3*    A   1           H3*        A   1  -2.086 -13.011   5.876
    5    H2*    A   1           H2*        A   1   0.137 -13.641   5.180
    6   2HO*    A   1          2HO*        A   1   1.858 -12.760   6.102
    7    H1*    A   1           H1*        A   1   0.788 -15.037   7.458
    8    H8     A   1           H8         A   1  -2.759 -15.743   7.553
    9   1H6     A   1          H61         A   1  -2.041 -19.770   2.906
   10   2H6     A   1          H62         A   1  -3.118 -19.206   4.163
   11    H2     A   1           H2         A   1   1.685 -17.286   3.184
   12    H5T    A   1           H5T        A   1  -3.626 -14.764   8.915
   13   1H5*    G   2          1H5*        G   2   0.955 -10.477   4.758
   14   2H5*    G   2          2H5*        G   2   0.520  -9.461   3.370
   15    H4*    G   2           H4*        G   2   2.469 -10.957   3.000
   16    H3*    G   2           H3*        G   2   0.095 -11.076   1.165
   17    H2*    G   2           H2*        G   2   1.170 -12.836  -0.078
   18   2HO*    G   2          2HO*        G   2   3.308 -13.078  -0.043
   19    H1*    G   2           H1*        G   2   2.065 -14.259   2.160
   20    H8     G   2           H8         G   2  -1.166 -13.284   3.429
   21    H1     G   2           H1         G   2  -1.735 -17.585  -1.293
   22   1H2     G   2          H21         G   2   1.565 -16.820  -1.998
   23   2H2     G   2          H22         G   2   0.147 -17.761  -2.403
   24   1H5*    U   3          1H5*        U   3   3.387  -9.902  -1.767
   25   2H5*    U   3          2H5*        U   3   2.577  -8.662  -2.744
   26    H4*    U   3           H4*        U   3   3.498 -10.358  -4.170
   27    H3*    U   3           H3*        U   3   0.493 -10.265  -4.085
   28    H2*    U   3           H2*        U   3   0.462 -12.069  -5.701
   29   2HO*    U   3          2HO*        U   3   3.168 -11.321  -5.945
   30    H1*    U   3           H1*        U   3   2.337 -13.618  -4.361
   31    H3     U   3           H3         U   3  -1.599 -15.629  -3.382
   32    H5     U   3           H5         U   3  -1.472 -12.287  -0.847
   33    H6     U   3           H6         U   3   0.511 -11.575  -2.008
   34   1H5*    A   4          1H5*        A   4   1.106  -9.316  -8.454
   35   2H5*    A   4          2H5*        A   4  -0.196  -8.161  -8.800
   36    H4*    A   4           H4*        A   4  -0.219 -10.218 -10.196
   37    H3*    A   4           H3*        A   4  -2.643  -9.488  -8.574
   38    H2*    A   4           H2*        A   4  -3.753 -11.453  -9.478
   39   2HO*    A   4          2HO*        A   4  -2.416 -11.123 -11.561
   40    H1*    A   4           H1*        A   4  -1.653 -13.161  -8.919
   41    H8     A   4           H8         A   4  -1.212 -10.864  -6.141
   42   1H6     A   4          H61         A   4  -6.093 -13.401  -3.315
   43   2H6     A   4          H62         A   4  -4.694 -12.370  -3.119
   44    H2     A   4           H2         A   4  -6.114 -14.744  -7.599
   45   1H5*    G   5          1H5*        G   5  -4.757  -8.659 -12.317
   46   2H5*    G   5          2H5*        G   5  -5.569  -7.116 -11.993
   47    H4*    G   5           H4*        G   5  -7.113  -8.996 -12.404
   48    H3*    G   5           H3*        G   5  -7.286  -7.543  -9.773
   49    H2*    G   5           H2*        G   5  -9.149  -8.977  -9.196
   50   2HO*    G   5          2HO*        G   5 -10.041 -10.379 -10.729
   51    H1*    G   5           H1*        G   5  -7.892 -11.330 -10.005
   52    H8     G   5           H8         G   5  -5.033  -9.531  -8.658
   53    H1     G   5           H1         G   5  -9.082 -11.398  -4.042
   54   1H2     G   5          H21         G   5 -11.315 -11.910  -6.618
   55   2H2     G   5          H22         G   5 -11.004 -11.947  -4.895
   56   1H5*    A   6          1H5*        A   6 -10.974  -8.322 -10.704
   57   2H5*    A   6          2H5*        A   6 -11.928  -6.837 -10.881
   58    H4*    A   6           H4*        A   6 -12.996  -8.581  -9.486
   59    H3*    A   6           H3*        A   6 -13.198  -5.920  -9.054
   60    H2*    A   6           H2*        A   6 -11.433  -5.722  -7.415
   61   2HO*    A   6          2HO*        A   6 -13.574  -6.727  -5.819
   62    H1*    A   6           H1*        A   6 -12.357  -8.391  -6.207
   63    H8     A   6           H8         A   6  -8.949  -7.352  -7.638
   64   1H6     A   6          H61         A   6  -6.907  -7.632  -1.799
   65   2H6     A   6          H62         A   6  -6.451  -7.402  -3.477
   66    H2     A   6           H2         A   6 -11.337  -8.346  -1.761
   67   1H5*    A   7          1H5*        A   7 -15.589  -7.489  -5.335
   68   2H5*    A   7          2H5*        A   7 -16.992  -6.407  -5.258
   69    H4*    A   7           H4*        A   7 -16.088  -6.350  -3.117
   70    H3*    A   7           H3*        A   7 -15.197  -3.902  -4.626
   71    H2*    A   7           H2*        A   7 -13.837  -3.279  -2.793
   72   2HO*    A   7          2HO*        A   7 -14.387  -4.391  -0.674
   73    H1*    A   7           H1*        A   7 -13.614  -6.027  -1.742
   74    H8     A   7           H8         A   7 -11.978  -5.109  -5.063
   75   1H6     A   7          H61         A   7  -6.822  -4.260  -1.735
   76   2H6     A   7          H62         A   7  -7.487  -4.345  -3.351
   77    H2     A   7           H2         A   7 -10.228  -4.902   1.107
   78   1H5*    A   8          1H5*        A   8 -17.933  -0.832  -1.234
   79   2H5*    A   8          2H5*        A   8 -16.629   0.206  -1.844
   80    H4*    A   8           H4*        A   8 -17.037  -0.845   0.785
   81    H3*    A   8           H3*        A   8 -15.097   1.119  -0.408
   82    H2*    A   8           H2*        A   8 -13.731   0.898   1.560
   83   2HO*    A   8          2HO*        A   8 -14.817   0.622   3.368
   84    H1*    A   8           H1*        A   8 -13.968  -1.889   1.748
   85    H8     A   8           H8         A   8 -13.639  -0.737  -1.847
   86   1H6     A   8          H61         A   8  -7.519  -1.214  -1.023
   87   2H6     A   8          H62         A   8  -8.793  -0.955  -2.194
   88    H2     A   8           H2         A   8  -9.505  -1.738   2.964
   89   1H5*    C   9          1H5*        C   9 -16.006   2.923   4.222
   90   2H5*    C   9          2H5*        C   9 -15.620   4.539   3.598
   91    H4*    C   9           H4*        C   9 -14.276   3.505   5.585
   92    H3*    C   9           H3*        C   9 -13.233   5.220   3.370
   93    H2*    C   9           H2*        C   9 -10.970   4.868   4.094
   94   2HO*    C   9          2HO*        C   9 -10.860   3.386   6.110
   95    H1*    C   9           H1*        C   9 -11.194   2.132   4.560
   96   1H4     C   9          H41         C   9 -10.898   2.644  -2.012
   97   2H4     C   9          H42         C   9  -9.274   2.251  -1.466
   98    H5     C   9           H5         C   9 -12.730   3.098  -0.475
   99    H6     C   9           H6         C   9 -13.362   3.247   1.873
  100   1H5*    A  10          1H5*        A  10 -10.227   8.380   6.347
  101   2H5*    A  10          2H5*        A  10 -10.410   8.629   4.599
  102    H4*    A  10           H4*        A  10  -8.494   6.882   6.089
  103    H3*    A  10           H3*        A  10  -8.207   9.134   4.156
  104    H2*    A  10           H2*        A  10  -6.391   8.055   3.024
  105   2HO*    A  10          2HO*        A  10  -5.527   6.071   3.927
  106    H1*    A  10           H1*        A  10  -7.482   5.505   2.943
  107    H8     A  10           H8         A  10 -10.562   7.324   2.420
  108   1H6     A  10          H61         A  10  -8.768   8.581  -3.371
  109   2H6     A  10          H62         A  10 -10.112   8.582  -2.251
  110    H2     A  10           H2         A  10  -5.203   7.064  -1.108
  111   1H5*    A  11          1H5*        A  11  -3.667  11.584   5.614
  112   2H5*    A  11          2H5*        A  11  -3.980  10.790   4.059
  113    H4*    A  11           H4*        A  11  -2.059   9.972   6.223
  114    H3*    A  11           H3*        A  11  -1.689  11.051   3.459
  115    H2*    A  11           H2*        A  11   0.133   9.540   3.062
  116   2HO*    A  11          2HO*        A  11   1.359   9.194   4.767
  117    H1*    A  11           H1*        A  11  -1.048   7.290   4.216
  118    H8     A  11           H8         A  11  -3.998   8.624   2.613
  119   1H6     A  11          H61         A  11  -1.798   6.744  -2.860
  120   2H6     A  11          H62         A  11  -3.208   7.324  -2.003
  121    H2     A  11           H2         A  11   1.548   6.563   0.120
  122   1H5*    G  12          1H5*        G  12   2.416  11.519   4.757
  123   2H5*    G  12          2H5*        G  12   2.785  13.198   4.318
  124    H4*    G  12           H4*        G  12   4.334  11.549   3.340
  125    H3*    G  12           H3*        G  12   2.803  13.425   1.587
  126    H2*    G  12           H2*        G  12   3.703  12.369  -0.386
  127   2HO*    G  12          2HO*        G  12   5.169  10.531   1.176
  128    H1*    G  12           H1*        G  12   3.232   9.779   0.414
  129    H8     G  12           H8         G  12   0.651  12.185   1.831
  130    H1     G  12           H1         G  12  -0.761   9.787  -3.948
  131   1H2     G  12          H21         G  12   2.454   8.511  -3.876
  132   2H2     G  12          H22         G  12   0.949   8.676  -4.754
  133   1H5*    G  13          1H5*        G  13   6.271  12.636  -0.340
  134   2H5*    G  13          2H5*        G  13   7.164  14.159  -0.516
  135    H4*    G  13           H4*        G  13   7.196  13.115  -2.622
  136    H3*    G  13           H3*        G  13   5.274  15.420  -2.533
  137    H2*    G  13           H2*        G  13   4.714  14.991  -4.841
  138   2HO*    G  13          2HO*        G  13   5.889  13.190  -5.896
  139    H1*    G  13           H1*        G  13   4.479  12.230  -4.545
  140    H8     G  13           H8         G  13   3.242  14.011  -1.457
  141    H1     G  13           H1         G  13  -1.119  13.369  -6.123
  142   1H2     G  13          H21         G  13   1.542  12.348  -8.070
  143   2H2     G  13          H22         G  13  -0.174  12.675  -7.965
  144   1H5*    C  14          1H5*        C  14   7.679  17.014  -6.197
  145   2H5*    C  14          2H5*        C  14   7.925  18.619  -5.482
  146    H4*    C  14           H4*        C  14   6.932  18.800  -7.676
  147    H3*    C  14           H3*        C  14   5.130  19.643  -5.409
  148    H2*    C  14           H2*        C  14   3.519  20.299  -7.080
  149   2HO*    C  14          2HO*        C  14   4.492  19.705  -9.388
  150    H1*    C  14           H1*        C  14   3.905  17.997  -8.666
  151   1H4     C  14          H41         C  14  -0.151  16.169  -3.808
  152   2H4     C  14          H42         C  14  -1.182  16.975  -4.980
  153    H5     C  14           H5         C  14   2.251  16.096  -4.027
  154    H6     C  14           H6         C  14   4.155  16.806  -5.372
  155   1H5*    U  15          1H5*        U  15   4.600  23.555  -7.365
  156   2H5*    U  15          2H5*        U  15   4.770  24.551  -5.907
  157    H4*    U  15           H4*        U  15   2.576  24.754  -7.046
  158    H3*    U  15           H3*        U  15   2.706  23.937  -4.160
  159    H2*    U  15           H2*        U  15   0.295  23.792  -4.125
  160   2HO*    U  15          2HO*        U  15  -0.425  24.208  -6.621
  161    H1*    U  15           H1*        U  15   0.096  22.319  -6.451
  162    H3     U  15           H3         U  15  -0.418  19.390  -2.983
  163    H5     U  15           H5         U  15   3.723  19.697  -3.581
  164    H6     U  15           H6         U  15   3.294  21.514  -5.101
  165   1H5*    U  16          1H5*        U  16   0.528  28.488  -2.204
  166   2H5*    U  16          2H5*        U  16  -0.009  27.050  -1.313
  167    H4*    U  16           H4*        U  16  -1.869  28.528  -1.777
  168    H3*    U  16           H3*        U  16  -2.172  25.933  -1.983
  169    H2*    U  16           H2*        U  16  -1.349  25.626  -4.234
  170   2HO*    U  16          2HO*        U  16  -3.257  25.520  -5.595
  171    H1*    U  16           H1*        U  16  -2.952  28.010  -5.252
  172    H3     U  16           H3         U  16  -0.828  26.824  -9.090
  173    H5     U  16           H5         U  16   2.216  28.144  -6.513
  174    H6     U  16           H6         U  16   0.581  28.212  -4.745
  175   1H5*    C  17          1H5*        C  17  -5.393  24.684  -3.726
  176   2H5*    C  17          2H5*        C  17  -6.421  24.183  -2.369
  177    H4*    C  17           H4*        C  17  -5.516  22.400  -3.998
  178    H3*    C  17           H3*        C  17  -6.366  22.004  -1.433
  179    H2*    C  17           H2*        C  17  -4.177  22.314  -0.413
  180   2HO*    C  17          2HO*        C  17  -3.548  20.255   0.159
  181    H1*    C  17           H1*        C  17  -3.083  20.662  -2.776
  182   1H4     C  17          H41         C  17   2.286  23.772  -0.693
  183   2H4     C  17          H42         C  17   2.445  22.167   0.009
  184    H5     C  17           H5         C  17   0.281  24.552  -1.766
  185    H6     C  17           H6         C  17  -1.950  23.923  -2.510
  186   1H5*    G  18          1H5*        G  18  -7.997  22.277  -2.918
  187   2H5*    G  18          2H5*        G  18  -9.503  21.660  -2.211
  188    H4*    G  18           H4*        G  18 -10.541  22.384  -4.023
  189    H3*    G  18           H3*        G  18  -9.155  20.011  -5.161
  190    H2*    G  18           H2*        G  18  -9.051  20.881  -7.311
  191   2HO*    G  18          2HO*        G  18 -11.661  21.690  -6.579
  192    H1*    G  18           H1*        G  18 -10.012  23.614  -6.476
  193    H8     G  18           H8         G  18  -9.115  24.612  -8.665
  194    H1     G  18           H1         G  18  -3.253  22.314  -7.412
  195   1H2     G  18          H21         G  18  -4.805  20.570  -4.867
  196   2H2     G  18          H22         G  18  -3.321  20.931  -5.720
  197   1H5*    G  19          1H5*        G  19  -9.551  16.373  -5.696
  198   2H5*    G  19          2H5*        G  19  -8.837  17.964  -5.383
  199    H4*    G  19           H4*        G  19  -9.796  17.530  -8.124
  200    H3*    G  19           H3*        G  19  -7.863  15.602  -7.006
  201    H2*    G  19           H2*        G  19  -6.129  16.098  -8.563
  202   2HO*    G  19          2HO*        G  19  -7.530  17.897 -10.120
  203    H1*    G  19           H1*        G  19  -6.421  18.842  -8.727
  204    H8     G  19           H8         G  19  -7.078  17.507  -5.222
  205    H1     G  19           H1         G  19  -0.967  18.988  -6.448
  206   1H2     G  19          H21         G  19  -1.997  19.364  -9.711
  207   2H2     G  19          H22         G  19  -0.678  19.411  -8.551
  208   1H5*    C  20          1H5*        C  20  -8.372  14.019 -11.126
  209   2H5*    C  20          2H5*        C  20  -8.554  12.262 -10.961
  210    H4*    C  20           H4*        C  20  -6.694  12.903 -12.428
  211    H3*    C  20           H3*        C  20  -6.175  11.246  -9.995
  212    H2*    C  20           H2*        C  20  -3.800  11.313 -10.405
  213   2HO*    C  20          2HO*        C  20  -3.849  12.952 -12.605
  214    H1*    C  20           H1*        C  20  -3.647  14.022 -10.902
  215   1H4     C  20          H41         C  20  -4.766  13.851  -4.427
  216   2H4     C  20          H42         C  20  -3.027  13.732  -4.582
  217    H5     C  20           H5         C  20  -6.262  13.794  -6.290
  218    H6     C  20           H6         C  20  -6.435  13.682  -8.701
  219   1H5*    C  21          1H5*        C  21  -3.338   9.818 -12.148
  220   2H5*    C  21          2H5*        C  21  -3.738   8.144 -12.579
  221    H4*    C  21           H4*        C  21  -1.541   8.084 -11.772
  222    H3*    C  21           H3*        C  21  -3.486   7.075  -9.712
  223    H2*    C  21           H2*        C  21  -1.655   6.707  -8.208
  224   2HO*    C  21          2HO*        C  21   0.207   6.119  -9.043
  225    H1*    C  21           H1*        C  21  -0.255   9.068  -8.888
  226   1H4     C  21          H41         C  21  -4.800  10.772  -4.407
  227   2H4     C  21          H42         C  21  -3.435  10.183  -3.471
  228    H5     C  21           H5         C  21  -4.879  10.646  -6.828
  229    H6     C  21           H6         C  21  -3.670   9.925  -8.827
  230   1H5*    U  22          1H5*        U  22  -1.083   4.613  -9.024
  231   2H5*    U  22          2H5*        U  22  -1.687   2.974  -8.714
  232    H4*    U  22           H4*        U  22  -0.774   4.509  -6.787
  233    H3*    U  22           H3*        U  22  -2.919   2.453  -6.700
  234    H2*    U  22           H2*        U  22  -3.705   3.143  -4.562
  235   2HO*    U  22          2HO*        U  22  -2.250   5.125  -3.759
  236    H1*    U  22           H1*        U  22  -3.555   5.886  -4.962
  237    H3     U  22           H3         U  22  -7.903   4.281  -5.011
  238    H5     U  22           H5         U  22  -6.645   4.673  -8.998
  239    H6     U  22           H6         U  22  -4.406   5.004  -8.178
  240   1H5*    G  23          1H5*        G  23   1.624   3.215  -2.664
  241   2H5*    G  23          2H5*        G  23   1.446   1.450  -2.713
  242    H4*    G  23           H4*        G  23   1.261   2.653  -0.454
  243    H3*    G  23           H3*        G  23  -0.644   0.521  -1.386
  244    H2*    G  23           H2*        G  23  -1.860   0.771   0.674
  245   2HO*    G  23          2HO*        G  23  -0.083   0.991   2.084
  246    H1*    G  23           H1*        G  23  -1.773   3.578   0.700
  247    H8     G  23           H8         G  23  -2.306   2.447  -2.818
  248    H1     G  23           H1         G  23  -7.648   2.429   0.733
  249   1H2     G  23          H21         G  23  -5.513   2.898   3.415
  250   2H2     G  23          H22         G  23  -7.158   2.707   2.852
  251   1H5*    C  24          1H5*        C  24   1.378  -1.990   2.769
  252   2H5*    C  24          2H5*        C  24   0.246  -3.268   2.283
  253    H4*    C  24           H4*        C  24   0.211  -1.977   4.671
  254    H3*    C  24           H3*        C  24  -1.958  -3.462   3.220
  255    H2*    C  24           H2*        C  24  -3.541  -2.726   4.880
  256   2HO*    C  24          2HO*        C  24  -1.986  -1.158   6.428
  257    H1*    C  24           H1*        C  24  -2.653  -0.078   4.955
  258   1H4     C  24          H41         C  24  -6.168  -0.573  -0.609
  259   2H4     C  24          H42         C  24  -7.273   0.032   0.613
  260    H5     C  24           H5         C  24  -3.901  -1.251  -0.108
  261    H6     C  24           H6         C  24  -2.232  -1.481   1.657
  262   1H5*    U  25          1H5*        U  25  -3.098  -4.077   6.802
  263   2H5*    U  25          2H5*        U  25  -3.235  -5.811   7.151
  264    H4*    U  25           H4*        U  25  -5.307  -4.693   7.647
  265    H3*    U  25           H3*        U  25  -5.367  -6.644   5.369
  266    H2*    U  25           H2*        U  25  -7.712  -6.141   5.037
  267   2HO*    U  25          2HO*        U  25  -8.323  -5.891   7.222
  268    H1*    U  25           H1*        U  25  -7.397  -3.402   5.087
  269    H3     U  25           H3         U  25  -7.696  -4.374   0.669
  270    H5     U  25           H5         U  25  -3.700  -5.174   1.669
  271    H6     U  25           H6         U  25  -4.289  -4.837   3.978
  272   1H5*    U  26          1H5*        U  26  -8.712  -8.308   7.537
  273   2H5*    U  26          2H5*        U  26  -8.489 -10.061   7.385
  274    H4*    U  26           H4*        U  26 -10.608  -9.241   6.425
  275    H3*    U  26           H3*        U  26  -8.664 -10.639   4.596
  276    H2*    U  26           H2*        U  26 -10.276 -10.401   2.827
  277   2HO*    U  26          2HO*        U  26 -12.274 -10.690   3.541
  278    H1*    U  26           H1*        U  26 -11.011  -7.760   3.520
  279    H3     U  26           H3         U  26  -8.871  -7.777  -0.540
  280    H5     U  26           H5         U  26  -5.872  -7.391   2.375
  281    H6     U  26           H6         U  26  -7.536  -7.882   4.042
  282   1H5*    U  27          1H5*        U  27 -12.507 -12.728   4.217
  283   2H5*    U  27          2H5*        U  27 -12.147 -14.437   3.901
  284    H4*    U  27           H4*        U  27 -13.592 -13.353   2.200
  285    H3*    U  27           H3*        U  27 -11.013 -14.652   1.380
  286    H2*    U  27           H2*        U  27 -11.476 -14.035  -0.912
  287   2HO*    U  27          2HO*        U  27 -13.959 -14.204  -0.194
  288    H1*    U  27           H1*        U  27 -12.108 -11.402  -0.335
  289    H3     U  27           H3         U  27  -7.871 -11.263  -1.946
  290    H5     U  27           H5         U  27  -7.447 -12.348   2.088
  291    H6     U  27           H6         U  27  -9.835 -12.613   2.187
  292   1H5*    U  28          1H5*        U  28 -14.056 -17.140  -0.976
  293   2H5*    U  28          2H5*        U  28 -13.324 -18.757  -0.971
  294    H4*    U  28           H4*        U  28 -13.817 -17.866  -3.227
  295    H3*    U  28           H3*        U  28 -10.979 -18.613  -2.551
  296    H2*    U  28           H2*        U  28 -10.389 -18.060  -4.833
  297   2HO*    U  28          2HO*        U  28 -12.162 -18.763  -5.988
  298    H1*    U  28           H1*        U  28 -11.755 -15.633  -4.823
  299    H3     U  28           H3         U  28  -7.292 -14.711  -4.447
  300    H5     U  28           H5         U  28  -8.665 -15.336  -0.526
  301    H6     U  28           H6         U  28 -10.736 -16.130  -1.460
  302   1H5*    G  29          1H5*        G  29 -11.089 -21.937  -5.231
  303   2H5*    G  29          2H5*        G  29 -10.368 -23.254  -4.285
  304    H4*    G  29           H4*        G  29  -9.008 -22.573  -6.226
  305    H3*    G  29           H3*        G  29  -7.783 -22.324  -3.485
  306    H2*    G  29           H2*        G  29  -5.811 -21.439  -4.479
  307   2HO*    G  29          2HO*        G  29  -5.563 -21.675  -6.838
  308    H1*    G  29           H1*        G  29  -7.175 -20.183  -6.707
  309    H8     G  29           H8         G  29  -8.562 -18.983  -3.475
  310    H1     G  29           H1         G  29  -3.075 -16.103  -5.126
  311   1H2     G  29          H21         G  29  -2.831 -18.602  -7.508
  312   2H2     G  29          H22         G  29  -2.122 -17.171  -6.798
  313   1H5*    C  30          1H5*        C  30  -4.848 -24.147  -6.222
  314   2H5*    C  30          2H5*        C  30  -4.139 -25.466  -5.271
  315    H4*    C  30           H4*        C  30  -2.454 -23.991  -6.273
  316    H3*    C  30           H3*        C  30  -2.546 -24.246  -3.282
  317    H2*    C  30           H2*        C  30  -0.698 -22.711  -3.120
  318   2HO*    C  30          2HO*        C  30   0.630 -22.358  -4.792
  319    H1*    C  30           H1*        C  30  -1.676 -20.899  -5.014
  320   1H4     C  30          H41         C  30  -5.156 -19.771   0.477
  321   2H4     C  30          H42         C  30  -3.861 -18.588   0.470
  322    H5     C  30           H5         C  30  -5.339 -21.531  -1.164
  323    H6     C  30           H6         C  30  -4.325 -22.520  -3.148
  324   1H5*    U  31          1H5*        U  31   1.460 -24.175  -4.473
  325   2H5*    U  31          2H5*        U  31   2.319 -25.488  -3.644
  326    H4*    U  31           H4*        U  31   3.446 -23.357  -3.348
  327    H3*    U  31           H3*        U  31   2.310 -24.625  -0.866
  328    H2*    U  31           H2*        U  31   3.196 -22.797   0.410
  329   2HO*    U  31          2HO*        U  31   4.994 -22.780  -1.577
  330    H1*    U  31           H1*        U  31   2.523 -20.807  -1.490
  331    H3     U  31           H3         U  31  -0.212 -19.769   1.932
  332    H5     U  31           H5         U  31  -1.861 -23.290   0.342
  333    H6     U  31           H6         U  31   0.071 -23.461  -1.084
  334    H3T    U  31           H3T        U  31   4.905 -24.380  -0.918
  Start of MODEL    6
    1   1H5*    A   1          1H5*        A   1  -4.930 -12.443   8.760
    2   2H5*    A   1          2H5*        A   1  -4.651 -11.698   7.175
    3    H4*    A   1           H4*        A   1  -2.638 -12.558   8.498
    4    H3*    A   1           H3*        A   1  -3.103 -12.966   5.576
    5    H2*    A   1           H2*        A   1  -1.175 -14.410   5.423
    6   2HO*    A   1          2HO*        A   1  -0.426 -13.012   7.584
    7    H1*    A   1           H1*        A   1  -1.802 -15.977   7.593
    8    H8     A   1           H8         A   1  -5.210 -15.215   6.632
    9   1H6     A   1          H61         A   1  -4.691 -19.149   1.879
   10   2H6     A   1          H62         A   1  -5.804 -18.219   2.855
   11    H2     A   1           H2         A   1  -0.578 -18.345   3.476
   12    H5T    A   1           H5T        A   1  -6.009 -13.132   6.483
   13   1H5*    G   2          1H5*        G   2   1.042 -11.672   5.142
   14   2H5*    G   2          2H5*        G   2   0.879 -10.292   4.040
   15    H4*    G   2           H4*        G   2   2.483 -11.960   3.241
   16    H3*    G   2           H3*        G   2   0.070 -11.386   1.547
   17    H2*    G   2           H2*        G   2   0.841 -13.000  -0.055
   18   2HO*    G   2          2HO*        G   2   2.928 -13.494  -0.222
   19    H1*    G   2           H1*        G   2   1.707 -14.898   1.843
   20    H8     G   2           H8         G   2  -1.450 -13.880   3.301
   21    H1     G   2           H1         G   2  -2.330 -17.409  -1.980
   22   1H2     G   2          H21         G   2   1.027 -16.806  -2.588
   23   2H2     G   2          H22         G   2  -0.457 -17.567  -3.116
   24   1H5*    U   3          1H5*        U   3   3.609 -10.174  -1.148
   25   2H5*    U   3          2H5*        U   3   2.950  -8.789  -2.039
   26    H4*    U   3           H4*        U   3   3.843 -10.472  -3.542
   27    H3*    U   3           H3*        U   3   0.863 -10.038  -3.694
   28    H2*    U   3           H2*        U   3   0.841 -11.613  -5.530
   29   2HO*    U   3          2HO*        U   3   3.633 -11.979  -5.339
   30    H1*    U   3           H1*        U   3   2.529 -13.454  -4.250
   31    H3     U   3           H3         U   3  -1.499 -15.491  -4.122
   32    H5     U   3           H5         U   3  -1.740 -12.527  -1.158
   33    H6     U   3           H6         U   3   0.384 -11.695  -1.924
   34   1H5*    A   4          1H5*        A   4   2.022  -8.560  -7.819
   35   2H5*    A   4          2H5*        A   4   0.874  -7.237  -8.097
   36    H4*    A   4           H4*        A   4   0.810  -9.039  -9.801
   37    H3*    A   4           H3*        A   4  -1.683  -8.308  -8.296
   38    H2*    A   4           H2*        A   4  -2.883 -10.001  -9.561
   39   2HO*    A   4          2HO*        A   4  -1.414 -11.305 -11.038
   40    H1*    A   4           H1*        A   4  -1.039 -11.989  -9.073
   41    H8     A   4           H8         A   4  -0.596 -10.082  -5.998
   42   1H6     A   4          H61         A   4  -5.918 -12.417  -3.876
   43   2H6     A   4          H62         A   4  -4.452 -11.562  -3.449
   44    H2     A   4           H2         A   4  -5.692 -13.245  -8.281
   45   1H5*    G   5          1H5*        G   5  -3.371  -6.771 -12.024
   46   2H5*    G   5          2H5*        G   5  -4.069  -5.213 -11.543
   47    H4*    G   5           H4*        G   5  -5.733  -6.855 -12.329
   48    H3*    G   5           H3*        G   5  -6.000  -5.773  -9.531
   49    H2*    G   5           H2*        G   5  -8.030  -7.074  -9.314
   50   2HO*    G   5          2HO*        G   5  -9.051  -7.898 -11.051
   51    H1*    G   5           H1*        G   5  -6.918  -9.407 -10.359
   52    H8     G   5           H8         G   5  -4.046  -8.080  -8.555
   53    H1     G   5           H1         G   5  -8.606 -10.214  -4.574
   54   1H2     G   5          H21         G   5 -10.644 -10.166  -7.358
   55   2H2     G   5          H22         G   5 -10.487 -10.474  -5.643
   56   1H5*    A   6          1H5*        A   6  -9.668  -6.072 -10.806
   57   2H5*    A   6          2H5*        A   6 -10.457  -4.484 -10.825
   58    H4*    A   6           H4*        A   6 -11.792  -6.279  -9.766
   59    H3*    A   6           H3*        A   6 -11.770  -3.697  -8.964
   60    H2*    A   6           H2*        A   6 -10.119  -3.922  -7.211
   61   2HO*    A   6          2HO*        A   6 -12.735  -4.361  -6.309
   62    H1*    A   6           H1*        A   6 -11.402  -6.612  -6.464
   63    H8     A   6           H8         A   6  -7.803  -5.759  -7.498
   64   1H6     A   6          H61         A   6  -6.271  -7.076  -1.646
   65   2H6     A   6          H62         A   6  -5.664  -6.662  -3.239
   66    H2     A   6           H2         A   6 -10.738  -7.319  -2.003
   67   1H5*    A   7          1H5*        A   7 -14.437  -5.526  -5.669
   68   2H5*    A   7          2H5*        A   7 -15.812  -4.416  -5.510
   69    H4*    A   7           H4*        A   7 -15.073  -4.629  -3.340
   70    H3*    A   7           H3*        A   7 -13.830  -2.132  -4.472
   71    H2*    A   7           H2*        A   7 -12.557  -1.876  -2.497
   72   2HO*    A   7          2HO*        A   7 -14.174  -3.671  -1.042
   73    H1*    A   7           H1*        A   7 -12.722  -4.734  -1.765
   74    H8     A   7           H8         A   7 -10.696  -3.625  -4.803
   75   1H6     A   7          H61         A   7  -5.805  -3.799  -1.007
   76   2H6     A   7          H62         A   7  -6.326  -3.610  -2.667
   77    H2     A   7           H2         A   7  -9.504  -4.379   1.458
   78   1H5*    A   8          1H5*        A   8 -16.585   0.856  -0.982
   79   2H5*    A   8          2H5*        A   8 -15.089   1.756  -1.303
   80    H4*    A   8           H4*        A   8 -15.981   0.623   1.129
   81    H3*    A   8           H3*        A   8 -13.486   2.105   0.335
   82    H2*    A   8           H2*        A   8 -12.535   1.511   2.472
   83   2HO*    A   8          2HO*        A   8 -13.728   0.584   4.083
   84    H1*    A   8           H1*        A   8 -13.284  -1.160   2.302
   85    H8     A   8           H8         A   8 -12.462   0.019  -1.168
   86   1H6     A   8          H61         A   8  -6.549  -1.273   0.140
   87   2H6     A   8          H62         A   8  -7.677  -0.842  -1.126
   88    H2     A   8           H2         A   8  -8.908  -1.548   3.944
   89   1H5*    C   9          1H5*        C   9 -15.108   4.394   5.359
   90   2H5*    C   9          2H5*        C   9 -14.074   5.055   4.079
   91    H4*    C   9           H4*        C   9 -13.373   3.934   6.657
   92    H3*    C   9           H3*        C   9 -12.031   5.729   4.675
   93    H2*    C   9           H2*        C   9  -9.868   5.097   5.509
   94   2HO*    C   9          2HO*        C   9 -11.425   4.041   7.635
   95    H1*    C   9           H1*        C   9 -10.368   2.367   5.666
   96   1H4     C   9          H41         C   9  -9.651   3.481  -0.797
   97   2H4     C   9          H42         C   9  -8.099   2.895  -0.216
   98    H5     C   9           H5         C   9 -11.520   3.950   0.687
   99    H6     C   9           H6         C   9 -12.271   3.928   3.004
  100   1H5*    A  10          1H5*        A  10  -9.580   8.532   7.768
  101   2H5*    A  10          2H5*        A  10  -9.427   9.416   6.237
  102    H4*    A  10           H4*        A  10  -7.514   7.798   7.507
  103    H3*    A  10           H3*        A  10  -7.566   9.245   4.873
  104    H2*    A  10           H2*        A  10  -5.609   8.032   4.196
  105   2HO*    A  10          2HO*        A  10  -4.983   6.457   6.176
  106    H1*    A  10           H1*        A  10  -6.415   5.556   5.281
  107    H8     A  10           H8         A  10  -9.524   6.595   3.755
  108   1H6     A  10          H61         A  10  -7.174   5.220  -1.806
  109   2H6     A  10          H62         A  10  -8.635   5.588  -0.917
  110    H2     A  10           H2         A  10  -3.799   5.318   1.145
  111   1H5*    A  11          1H5*        A  11  -3.110  12.503   5.812
  112   2H5*    A  11          2H5*        A  11  -3.341  11.605   4.298
  113    H4*    A  11           H4*        A  11  -1.399  11.130   6.523
  114    H3*    A  11           H3*        A  11  -1.147  11.689   3.609
  115    H2*    A  11           H2*        A  11   0.608  10.080   3.339
  116   2HO*    A  11          2HO*        A  11   1.881  10.357   5.110
  117    H1*    A  11           H1*        A  11  -0.502   8.059   4.878
  118    H8     A  11           H8         A  11  -3.590   9.272   3.449
  119   1H6     A  11          H61         A  11  -2.079   6.620  -1.937
  120   2H6     A  11          H62         A  11  -3.367   7.358  -1.011
  121    H2     A  11           H2         A  11   1.583   6.697   0.652
  122   1H5*    G  12          1H5*        G  12   2.955  12.088   4.522
  123   2H5*    G  12          2H5*        G  12   3.334  13.777   4.133
  124    H4*    G  12           H4*        G  12   4.913  12.342   3.057
  125    H3*    G  12           H3*        G  12   3.045  13.838   1.271
  126    H2*    G  12           H2*        G  12   3.920  12.713  -0.671
  127   2HO*    G  12          2HO*        G  12   5.651  10.979   0.176
  128    H1*    G  12           H1*        G  12   3.861  10.171   0.378
  129    H8     G  12           H8         G  12   1.097  12.381   1.788
  130    H1     G  12           H1         G  12  -0.427   9.184  -3.561
  131   1H2     G  12          H21         G  12   2.924   8.331  -3.652
  132   2H2     G  12          H22         G  12   1.348   8.208  -4.400
  133   1H5*    G  13          1H5*        G  13   6.593  13.323  -0.794
  134   2H5*    G  13          2H5*        G  13   7.227  14.944  -1.136
  135    H4*    G  13           H4*        G  13   7.380  13.725  -3.140
  136    H3*    G  13           H3*        G  13   5.126  15.710  -3.186
  137    H2*    G  13           H2*        G  13   4.589  14.987  -5.427
  138   2HO*    G  13          2HO*        G  13   6.482  14.599  -6.437
  139    H1*    G  13           H1*        G  13   4.756  12.267  -4.871
  140    H8     G  13           H8         G  13   3.401  14.189  -1.909
  141    H1     G  13           H1         G  13  -1.004  12.401  -6.218
  142   1H2     G  13          H21         G  13   1.697  11.532  -8.183
  143   2H2     G  13          H22         G  13  -0.043  11.627  -8.019
  144   1H5*    C  14          1H5*        C  14   6.768  16.832  -6.964
  145   2H5*    C  14          2H5*        C  14   7.312  18.489  -6.642
  146    H4*    C  14           H4*        C  14   6.075  18.723  -8.569
  147    H3*    C  14           H3*        C  14   4.244  19.374  -6.262
  148    H2*    C  14           H2*        C  14   2.534  19.862  -7.899
  149   2HO*    C  14          2HO*        C  14   3.433  19.361 -10.224
  150    H1*    C  14           H1*        C  14   3.056  17.576  -9.440
  151   1H4     C  14          H41         C  14  -0.419  15.518  -4.223
  152   2H4     C  14          H42         C  14  -1.615  16.056  -5.394
  153    H5     C  14           H5         C  14   1.955  15.775  -4.573
  154    H6     C  14           H6         C  14   3.669  16.631  -6.079
  155   1H5*    U  15          1H5*        U  15   2.950  22.860  -8.416
  156   2H5*    U  15          2H5*        U  15   3.100  24.042  -7.102
  157    H4*    U  15           H4*        U  15   0.808  23.806  -7.996
  158    H3*    U  15           H3*        U  15   1.316  23.315  -5.076
  159    H2*    U  15           H2*        U  15  -1.038  22.859  -4.788
  160   2HO*    U  15          2HO*        U  15  -1.835  22.986  -7.381
  161    H1*    U  15           H1*        U  15  -1.226  21.141  -6.943
  162    H3     U  15           H3         U  15  -1.036  18.513  -3.216
  163    H5     U  15           H5         U  15   2.959  19.307  -4.231
  164    H6     U  15           H6         U  15   2.154  20.902  -5.843
  165   1H5*    U  16          1H5*        U  16  -1.270  27.852  -3.658
  166   2H5*    U  16          2H5*        U  16  -1.579  26.671  -2.370
  167    H4*    U  16           H4*        U  16  -3.652  27.652  -2.927
  168    H3*    U  16           H3*        U  16  -3.596  25.039  -2.819
  169    H2*    U  16           H2*        U  16  -2.807  24.586  -5.062
  170   2HO*    U  16          2HO*        U  16  -5.573  24.843  -5.637
  171    H1*    U  16           H1*        U  16  -4.793  26.566  -6.256
  172    H3     U  16           H3         U  16  -2.653  25.237 -10.044
  173    H5     U  16           H5         U  16   0.247  27.293  -7.805
  174    H6     U  16           H6         U  16  -1.317  27.341  -5.972
  175   1H5*    C  17          1H5*        C  17  -6.687  23.387  -4.266
  176   2H5*    C  17          2H5*        C  17  -7.689  22.852  -2.902
  177    H4*    C  17           H4*        C  17  -6.653  21.069  -4.408
  178    H3*    C  17           H3*        C  17  -7.354  20.766  -1.785
  179    H2*    C  17           H2*        C  17  -5.170  21.340  -0.882
  180   2HO*    C  17          2HO*        C  17  -5.064  18.556  -1.544
  181    H1*    C  17           H1*        C  17  -4.001  19.665  -3.192
  182   1H4     C  17          H41         C  17   1.088  23.442  -1.576
  183   2H4     C  17          H42         C  17   1.455  21.909  -0.796
  184    H5     C  17           H5         C  17  -1.039  23.945  -2.572
  185    H6     C  17           H6         C  17  -3.224  23.044  -3.157
  186   1H5*    G  18          1H5*        G  18  -8.869  20.679  -3.426
  187   2H5*    G  18          2H5*        G  18 -10.308  20.243  -2.484
  188    H4*    G  18           H4*        G  18 -11.564  20.390  -4.290
  189    H3*    G  18           H3*        G  18  -9.857  18.155  -5.245
  190    H2*    G  18           H2*        G  18  -9.954  18.788  -7.480
  191   2HO*    G  18          2HO*        G  18 -12.188  18.220  -7.507
  192    H1*    G  18           H1*        G  18 -11.320  21.412  -6.903
  193    H8     G  18           H8         G  18 -10.643  22.288  -9.223
  194    H1     G  18           H1         G  18  -4.470  21.040  -7.981
  195   1H2     G  18          H21         G  18  -5.669  19.404  -5.186
  196   2H2     G  18          H22         G  18  -4.281  19.877  -6.140
  197   1H5*    G  19          1H5*        G  19  -9.636  14.514  -5.432
  198   2H5*    G  19          2H5*        G  19  -9.223  16.236  -5.349
  199    H4*    G  19           H4*        G  19 -10.246  15.372  -7.945
  200    H3*    G  19           H3*        G  19  -7.996  13.833  -6.818
  201    H2*    G  19           H2*        G  19  -6.457  14.396  -8.546
  202   2HO*    G  19          2HO*        G  19  -7.435  15.629 -10.427
  203    H1*    G  19           H1*        G  19  -7.165  17.050  -8.948
  204    H8     G  19           H8         G  19  -7.329  16.029  -5.288
  205    H1     G  19           H1         G  19  -1.617  18.186  -7.237
  206   1H2     G  19          H21         G  19  -2.959  18.056 -10.406
  207   2H2     G  19          H22         G  19  -1.570  18.415  -9.393
  208   1H5*    C  20          1H5*        C  20  -8.488  11.890 -10.723
  209   2H5*    C  20          2H5*        C  20  -8.558  10.142 -10.423
  210    H4*    C  20           H4*        C  20  -6.824  10.731 -12.033
  211    H3*    C  20           H3*        C  20  -6.049   9.391  -9.477
  212    H2*    C  20           H2*        C  20  -3.712   9.583 -10.026
  213   2HO*    C  20          2HO*        C  20  -4.432   9.311 -12.434
  214    H1*    C  20           H1*        C  20  -3.789  12.223 -10.819
  215   1H4     C  20          H41         C  20  -4.562  12.659  -4.303
  216   2H4     C  20          H42         C  20  -2.831  12.592  -4.538
  217    H5     C  20           H5         C  20  -6.143  12.354  -6.070
  218    H6     C  20           H6         C  20  -6.431  11.983  -8.444
  219   1H5*    C  21          1H5*        C  21  -3.236   7.930 -11.600
  220   2H5*    C  21          2H5*        C  21  -3.515   6.192 -11.817
  221    H4*    C  21           H4*        C  21  -1.281   6.438 -11.114
  222    H3*    C  21           H3*        C  21  -3.062   5.409  -8.921
  223    H2*    C  21           H2*        C  21  -1.179   5.367  -7.441
  224   2HO*    C  21          2HO*        C  21   0.199   4.501  -9.232
  225    H1*    C  21           H1*        C  21  -0.003   7.767  -8.402
  226   1H4     C  21          H41         C  21  -4.388   9.615  -3.848
  227   2H4     C  21          H42         C  21  -2.948   9.186  -2.938
  228    H5     C  21           H5         C  21  -4.587   9.252  -6.235
  229    H6     C  21           H6         C  21  -3.444   8.424  -8.229
  230   1H5*    U  22          1H5*        U  22  -0.572   3.219  -8.065
  231   2H5*    U  22          2H5*        U  22  -1.017   1.531  -7.745
  232    H4*    U  22           H4*        U  22  -0.321   3.098  -5.794
  233    H3*    U  22           H3*        U  22  -2.462   1.017  -5.777
  234    H2*    U  22           H2*        U  22  -3.239   1.730  -3.620
  235   2HO*    U  22          2HO*        U  22  -0.749   2.336  -3.228
  236    H1*    U  22           H1*        U  22  -3.167   4.457  -4.116
  237    H3     U  22           H3         U  22  -7.490   2.821  -4.202
  238    H5     U  22           H5         U  22  -6.124   2.930  -8.172
  239    H6     U  22           H6         U  22  -3.914   3.353  -7.318
  240   1H5*    G  23          1H5*        G  23   1.164   1.349  -2.582
  241   2H5*    G  23          2H5*        G  23   1.331  -0.342  -2.073
  242    H4*    G  23           H4*        G  23   1.821   1.151  -0.244
  243    H3*    G  23           H3*        G  23  -0.542  -0.652   0.021
  244    H2*    G  23           H2*        G  23  -1.166   0.362   2.113
  245   2HO*    G  23          2HO*        G  23   0.241   1.546   3.277
  246    H1*    G  23           H1*        G  23  -0.903   2.982   1.293
  247    H8     G  23           H8         G  23  -1.895   1.231  -1.809
  248    H1     G  23           H1         G  23  -6.812   2.177   2.198
  249   1H2     G  23          H21         G  23  -4.386   2.970   4.526
  250   2H2     G  23          H22         G  23  -6.089   2.786   4.169
  251   1H5*    C  24          1H5*        C  24  -1.051  -3.139   3.631
  252   2H5*    C  24          2H5*        C  24  -1.789  -1.578   3.222
  253    H4*    C  24           H4*        C  24  -0.013  -1.650   5.590
  254    H3*    C  24           H3*        C  24  -2.627  -3.137   5.566
  255    H2*    C  24           H2*        C  24  -3.096  -2.245   7.752
  256   2HO*    C  24          2HO*        C  24  -0.383  -1.340   7.651
  257    H1*    C  24           H1*        C  24  -2.208   0.357   7.165
  258   1H4     C  24          H41         C  24  -8.232   0.109   4.545
  259   2H4     C  24          H42         C  24  -8.514   0.342   6.262
  260    H5     C  24           H5         C  24  -6.037  -0.316   3.622
  261    H6     C  24           H6         C  24  -3.672  -0.602   4.149
  262   1H5*    U  25          1H5*        U  25  -3.041  -4.572   8.065
  263   2H5*    U  25          2H5*        U  25  -3.133  -6.343   8.003
  264    H4*    U  25           H4*        U  25  -5.304  -5.303   8.426
  265    H3*    U  25           H3*        U  25  -4.977  -6.946   5.935
  266    H2*    U  25           H2*        U  25  -7.289  -6.486   5.379
  267   2HO*    U  25          2HO*        U  25  -7.334  -5.759   8.074
  268    H1*    U  25           H1*        U  25  -7.121  -3.766   5.836
  269    H3     U  25           H3         U  25  -6.915  -4.106   1.322
  270    H5     U  25           H5         U  25  -3.013  -4.928   2.634
  271    H6     U  25           H6         U  25  -3.858  -4.953   4.888
  272   1H5*    U  26          1H5*        U  26  -8.423  -8.897   7.556
  273   2H5*    U  26          2H5*        U  26  -8.270 -10.616   7.143
  274    H4*    U  26           H4*        U  26 -10.252  -9.483   6.162
  275    H3*    U  26           H3*        U  26  -8.268 -10.805   4.317
  276    H2*    U  26           H2*        U  26  -9.711 -10.215   2.486
  277   2HO*    U  26          2HO*        U  26 -11.586 -10.431   4.366
  278    H1*    U  26           H1*        U  26 -10.326  -7.637   3.490
  279    H3     U  26           H3         U  26  -7.961  -7.305  -0.433
  280    H5     U  26           H5         U  26  -5.121  -7.472   2.657
  281    H6     U  26           H6         U  26  -6.906  -8.052   4.162
  282   1H5*    U  27          1H5*        U  27 -12.243 -12.413   3.463
  283   2H5*    U  27          2H5*        U  27 -12.061 -14.088   2.905
  284    H4*    U  27           H4*        U  27 -13.284 -12.601   1.339
  285    H3*    U  27           H3*        U  27 -10.833 -14.072   0.422
  286    H2*    U  27           H2*        U  27 -11.101 -13.076  -1.766
  287   2HO*    U  27          2HO*        U  27 -12.982 -11.451  -1.818
  288    H1*    U  27           H1*        U  27 -11.434 -10.498  -0.822
  289    H3     U  27           H3         U  27  -7.114 -10.693  -2.213
  290    H5     U  27           H5         U  27  -7.082 -12.360   1.639
  291    H6     U  27           H6         U  27  -9.486 -12.339   1.585
  292   1H5*    U  28          1H5*        U  28 -14.076 -15.677  -2.424
  293   2H5*    U  28          2H5*        U  28 -13.612 -17.381  -2.584
  294    H4*    U  28           H4*        U  28 -13.871 -16.270  -4.746
  295    H3*    U  28           H3*        U  28 -11.137 -17.328  -4.064
  296    H2*    U  28           H2*        U  28 -10.412 -16.616  -6.265
  297   2HO*    U  28          2HO*        U  28 -12.736 -15.358  -7.004
  298    H1*    U  28           H1*        U  28 -11.511 -14.079  -6.035
  299    H3     U  28           H3         U  28  -7.043 -13.592  -5.298
  300    H5     U  28           H5         U  28  -8.659 -14.718  -1.590
  301    H6     U  28           H6         U  28 -10.740 -15.157  -2.717
  302   1H5*    G  29          1H5*        G  29 -11.474 -20.373  -7.077
  303   2H5*    G  29          2H5*        G  29 -10.918 -21.838  -6.245
  304    H4*    G  29           H4*        G  29  -9.446 -21.125  -8.094
  305    H3*    G  29           H3*        G  29  -8.268 -21.263  -5.323
  306    H2*    G  29           H2*        G  29  -6.180 -20.547  -6.227
  307   2HO*    G  29          2HO*        G  29  -6.415 -20.462  -8.810
  308    H1*    G  29           H1*        G  29  -7.346 -18.899  -8.295
  309    H8     G  29           H8         G  29  -8.721 -17.875  -5.018
  310    H1     G  29           H1         G  29  -2.819 -15.604  -6.091
  311   1H2     G  29          H21         G  29  -2.745 -17.864  -8.709
  312   2H2     G  29          H22         G  29  -1.910 -16.619  -7.808
  313   1H5*    C  30          1H5*        C  30  -5.367 -23.417  -7.697
  314   2H5*    C  30          2H5*        C  30  -4.949 -24.825  -6.701
  315    H4*    C  30           H4*        C  30  -2.983 -23.527  -7.324
  316    H3*    C  30           H3*        C  30  -3.645 -23.737  -4.402
  317    H2*    C  30           H2*        C  30  -1.721 -22.380  -3.895
  318   2HO*    C  30          2HO*        C  30  -1.006 -23.209  -6.454
  319    H1*    C  30           H1*        C  30  -2.163 -20.504  -5.922
  320   1H4     C  30          H41         C  30  -6.487 -18.994  -1.175
  321   2H4     C  30          H42         C  30  -5.114 -17.930  -0.936
  322    H5     C  30           H5         C  30  -6.521 -20.752  -2.826
  323    H6     C  30           H6         C  30  -5.251 -21.855  -4.591
  324   1H5*    U  31          1H5*        U  31   0.294 -23.714  -4.375
  325   2H5*    U  31          2H5*        U  31   0.854 -25.287  -3.774
  326    H4*    U  31           H4*        U  31   2.068 -23.714  -2.559
  327    H3*    U  31           H3*        U  31  -0.209 -24.771  -0.902
  328    H2*    U  31           H2*        U  31   0.497 -23.348   0.900
  329   2HO*    U  31          2HO*        U  31   2.813 -23.791   0.372
  330    H1*    U  31           H1*        U  31   1.044 -21.112  -0.729
  331    H3     U  31           H3         U  31  -2.601 -19.679   1.473
  332    H5     U  31           H5         U  31  -4.094 -22.614  -1.133
  333    H6     U  31           H6         U  31  -1.820 -23.138  -1.723
  334    H3T    U  31           H3T        U  31   1.586 -26.053  -1.494
  Start of MODEL    7
    1   1H5*    A   1          1H5*        A   1  -2.694  -9.273   7.042
    2   2H5*    A   1          2H5*        A   1  -3.216 -10.956   7.240
    3    H4*    A   1           H4*        A   1  -0.407  -9.907   7.555
    4    H3*    A   1           H3*        A   1  -1.742 -11.273   5.247
    5    H2*    A   1           H2*        A   1   0.237 -12.600   4.882
    6   2HO*    A   1          2HO*        A   1   2.163 -12.002   5.669
    7    H1*    A   1           H1*        A   1   0.617 -13.281   7.544
    8    H8     A   1           H8         A   1  -3.010 -13.278   7.527
    9   1H6     A   1          H61         A   1  -2.927 -18.658   4.458
   10   2H6     A   1          H62         A   1  -3.919 -17.536   5.364
   11    H2     A   1           H2         A   1   1.202 -16.912   4.321
   12    H5T    A   1           H5T        A   1  -2.873  -9.073   9.112
   13   1H5*    G   2          1H5*        G   2   1.839  -9.632   3.390
   14   2H5*    G   2          2H5*        G   2   1.336  -8.818   1.896
   15    H4*    G   2           H4*        G   2   3.148 -10.490   1.608
   16    H3*    G   2           H3*        G   2   0.600 -10.751   0.037
   17    H2*    G   2           H2*        G   2   1.484 -12.743  -0.998
   18   2HO*    G   2          2HO*        G   2   3.752 -11.573  -0.761
   19    H1*    G   2           H1*        G   2   2.522 -13.834   1.370
   20    H8     G   2           H8         G   2  -0.533 -12.514   2.732
   21    H1     G   2           H1         G   2  -1.681 -17.491  -1.148
   22   1H2     G   2          H21         G   2   1.554 -16.986  -2.268
   23   2H2     G   2          H22         G   2   0.079 -17.920  -2.384
   24   1H5*    U   3          1H5*        U   3   3.606 -10.246  -3.344
   25   2H5*    U   3          2H5*        U   3   2.755  -9.125  -4.423
   26    H4*    U   3           H4*        U   3   3.430 -11.075  -5.646
   27    H3*    U   3           H3*        U   3   0.449 -10.865  -5.238
   28    H2*    U   3           H2*        U   3   0.250 -12.845  -6.629
   29   2HO*    U   3          2HO*        U   3   3.050 -12.434  -7.024
   30    H1*    U   3           H1*        U   3   2.237 -14.237  -5.261
   31    H3     U   3           H3         U   3  -1.661 -16.052  -3.816
   32    H5     U   3           H5         U   3  -1.253 -12.501  -1.612
   33    H6     U   3           H6         U   3   0.628 -11.942  -3.007
   34   1H5*    A   4          1H5*        A   4   0.656 -10.279  -9.769
   35   2H5*    A   4          2H5*        A   4  -0.708  -9.188 -10.085
   36    H4*    A   4           H4*        A   4  -0.785 -11.342 -11.321
   37    H3*    A   4           H3*        A   4  -3.081 -10.572  -9.537
   38    H2*    A   4           H2*        A   4  -4.194 -12.626 -10.220
   39   2HO*    A   4          2HO*        A   4  -3.647 -13.016 -12.294
   40    H1*    A   4           H1*        A   4  -2.005 -14.222  -9.689
   41    H8     A   4           H8         A   4  -1.424 -11.647  -7.183
   42   1H6     A   4          H61         A   4  -5.929 -14.082  -3.715
   43   2H6     A   4          H62         A   4  -4.565 -12.986  -3.737
   44    H2     A   4           H2         A   4  -6.248 -15.829  -7.837
   45   1H5*    G   5          1H5*        G   5  -5.565 -10.059 -13.099
   46   2H5*    G   5          2H5*        G   5  -6.405  -8.527 -12.787
   47    H4*    G   5           H4*        G   5  -7.896 -10.495 -12.926
   48    H3*    G   5           H3*        G   5  -7.890  -8.871 -10.389
   49    H2*    G   5           H2*        G   5  -9.641 -10.326  -9.563
   50   2HO*    G   5          2HO*        G   5 -10.210 -12.134 -11.134
   51    H1*    G   5           H1*        G   5  -8.361 -12.682 -10.341
   52    H8     G   5           H8         G   5  -5.471 -10.728  -9.334
   53    H1     G   5           H1         G   5  -9.086 -12.398  -4.303
   54   1H2     G   5          H21         G   5 -11.499 -13.137  -6.656
   55   2H2     G   5          H22         G   5 -11.052 -13.064  -4.966
   56   1H5*    A   6          1H5*        A   6 -11.605  -9.774 -10.924
   57   2H5*    A   6          2H5*        A   6 -12.619  -8.330 -11.106
   58    H4*    A   6           H4*        A   6 -13.496 -10.003  -9.508
   59    H3*    A   6           H3*        A   6 -13.744  -7.327  -9.226
   60    H2*    A   6           H2*        A   6 -11.855  -6.958  -7.773
   61   2HO*    A   6          2HO*        A   6 -13.291  -7.900  -5.625
   62    H1*    A   6           H1*        A   6 -12.514  -9.572  -6.307
   63    H8     A   6           H8         A   6  -9.357  -8.513  -8.219
   64   1H6     A   6          H61         A   6  -6.616  -8.240  -2.675
   65   2H6     A   6          H62         A   6  -6.381  -8.126  -4.409
   66    H2     A   6           H2         A   6 -10.966  -9.151  -2.035
   67   1H5*    A   7          1H5*        A   7 -15.812  -8.687  -5.218
   68   2H5*    A   7          2H5*        A   7 -17.206  -7.597  -5.096
   69    H4*    A   7           H4*        A   7 -16.099  -7.428  -3.046
   70    H3*    A   7           H3*        A   7 -15.427  -5.042  -4.756
   71    H2*    A   7           H2*        A   7 -13.919  -4.294  -3.097
   72   2HO*    A   7          2HO*        A   7 -15.920  -5.108  -1.537
   73    H1*    A   7           H1*        A   7 -13.545  -6.984  -1.927
   74    H8     A   7           H8         A   7 -12.199  -6.212  -5.409
   75   1H6     A   7          H61         A   7  -6.822  -5.067  -2.549
   76   2H6     A   7          H62         A   7  -7.605  -5.265  -4.102
   77    H2     A   7           H2         A   7  -9.982  -5.602   0.581
   78   1H5*    A   8          1H5*        A   8 -18.270  -2.268  -1.153
   79   2H5*    A   8          2H5*        A   8 -17.210  -0.969  -1.732
   80    H4*    A   8           H4*        A   8 -17.331  -2.165   0.842
   81    H3*    A   8           H3*        A   8 -15.758   0.101  -0.339
   82    H2*    A   8           H2*        A   8 -14.239   0.005   1.532
   83   2HO*    A   8          2HO*        A   8 -14.704  -1.229   3.343
   84    H1*    A   8           H1*        A   8 -13.933  -2.753   1.506
   85    H8     A   8           H8         A   8 -14.415  -1.279  -1.981
   86   1H6     A   8          H61         A   8  -8.237  -0.902  -2.194
   87   2H6     A   8          H62         A   8  -9.717  -0.725  -3.111
   88    H2     A   8           H2         A   8  -9.415  -2.100   1.962
   89   1H5*    C   9          1H5*        C   9 -16.397   3.008   4.089
   90   2H5*    C   9          2H5*        C   9 -15.666   3.962   2.784
   91    H4*    C   9           H4*        C   9 -14.454   2.977   5.135
   92    H3*    C   9           H3*        C   9 -13.479   4.590   2.807
   93    H2*    C   9           H2*        C   9 -11.196   4.112   3.413
   94   2HO*    C   9          2HO*        C   9 -12.301   2.847   5.731
   95    H1*    C   9           H1*        C   9 -11.562   1.398   3.840
   96   1H4     C   9          H41         C   9 -11.846   1.944  -2.721
   97   2H4     C   9          H42         C   9 -10.142   1.750  -2.337
   98    H5     C   9           H5         C   9 -13.559   2.212  -1.014
   99    H6     C   9           H6         C   9 -13.972   2.334   1.385
  100   1H5*    A  10          1H5*        A  10 -11.365   8.566   5.667
  101   2H5*    A  10          2H5*        A  10 -10.535   8.365   4.111
  102    H4*    A  10           H4*        A  10  -9.701   7.485   6.846
  103    H3*    A  10           H3*        A  10  -8.827   9.659   5.644
  104    H2*    A  10           H2*        A  10  -8.103   8.818   3.529
  105   2HO*    A  10          2HO*        A  10  -5.870   7.766   4.865
  106    H1*    A  10           H1*        A  10  -6.960   6.239   4.569
  107    H8     A  10           H8         A  10 -10.416   6.245   3.109
  108   1H6     A  10          H61         A  10  -7.801   4.727  -2.292
  109   2H6     A  10          H62         A  10  -9.311   4.898  -1.425
  110    H2     A  10           H2         A  10  -4.532   5.833   0.575
  111   1H5*    A  11          1H5*        A  11  -4.166  11.371   6.564
  112   2H5*    A  11          2H5*        A  11  -4.992  10.704   5.142
  113    H4*    A  11           H4*        A  11  -2.592   9.527   6.538
  114    H3*    A  11           H3*        A  11  -2.794  11.196   4.055
  115    H2*    A  11           H2*        A  11  -1.179   9.791   2.965
  116   2HO*    A  11          2HO*        A  11  -0.846   8.214   5.283
  117    H1*    A  11           H1*        A  11  -2.224   7.360   3.876
  118    H8     A  11           H8         A  11  -5.352   9.032   3.185
  119   1H6     A  11          H61         A  11  -4.333   8.250  -2.873
  120   2H6     A  11          H62         A  11  -5.525   8.662  -1.660
  121    H2     A  11           H2         A  11  -0.494   7.449  -0.703
  122   1H5*    G  12          1H5*        G  12   1.588  11.047   4.977
  123   2H5*    G  12          2H5*        G  12   2.141  12.702   4.661
  124    H4*    G  12           H4*        G  12   3.427  10.941   3.480
  125    H3*    G  12           H3*        G  12   2.119  13.162   1.948
  126    H2*    G  12           H2*        G  12   2.900  12.187  -0.117
  127   2HO*    G  12          2HO*        G  12   4.771  11.170   1.506
  128    H1*    G  12           H1*        G  12   2.125   9.603   0.481
  129    H8     G  12           H8         G  12  -0.221  12.149   2.033
  130    H1     G  12           H1         G  12  -1.673  10.447  -3.980
  131   1H2     G  12          H21         G  12   1.388   8.841  -3.949
  132   2H2     G  12          H22         G  12  -0.062   9.242  -4.843
  133   1H5*    G  13          1H5*        G  13   5.769  12.192   0.039
  134   2H5*    G  13          2H5*        G  13   6.687  13.708  -0.039
  135    H4*    G  13           H4*        G  13   6.726  12.663  -2.185
  136    H3*    G  13           H3*        G  13   5.082  15.175  -2.057
  137    H2*    G  13           H2*        G  13   4.588  14.914  -4.405
  138   2HO*    G  13          2HO*        G  13   6.550  14.192  -5.204
  139    H1*    G  13           H1*        G  13   4.021  12.188  -4.248
  140    H8     G  13           H8         G  13   2.832  13.908  -1.123
  141    H1     G  13           H1         G  13  -1.298  14.149  -6.032
  142   1H2     G  13          H21         G  13   1.325  12.938  -7.920
  143   2H2     G  13          H22         G  13  -0.342  13.468  -7.872
  144   1H5*    C  14          1H5*        C  14   7.713  16.574  -5.534
  145   2H5*    C  14          2H5*        C  14   8.238  18.077  -4.753
  146    H4*    C  14           H4*        C  14   7.340  18.590  -6.905
  147    H3*    C  14           H3*        C  14   5.557  19.486  -4.643
  148    H2*    C  14           H2*        C  14   4.123  20.475  -6.311
  149   2HO*    C  14          2HO*        C  14   6.455  20.457  -7.724
  150    H1*    C  14           H1*        C  14   4.277  18.271  -8.066
  151   1H4     C  14          H41         C  14  -0.173  16.652  -3.481
  152   2H4     C  14          H42         C  14  -1.049  17.660  -4.622
  153    H5     C  14           H5         C  14   2.206  16.274  -3.634
  154    H6     C  14           H6         C  14   4.236  16.809  -4.874
  155   1H5*    U  15          1H5*        U  15   5.331  23.320  -6.672
  156   2H5*    U  15          2H5*        U  15   5.651  24.361  -5.271
  157    H4*    U  15           H4*        U  15   3.475  24.784  -6.349
  158    H3*    U  15           H3*        U  15   3.570  24.013  -3.453
  159    H2*    U  15           H2*        U  15   1.163  24.104  -3.363
  160   2HO*    U  15          2HO*        U  15   1.446  25.237  -5.967
  161    H1*    U  15           H1*        U  15   0.745  22.655  -5.679
  162    H3     U  15           H3         U  15  -0.051  19.686  -2.335
  163    H5     U  15           H5         U  15   4.125  19.739  -2.759
  164    H6     U  15           H6         U  15   3.874  21.598  -4.266
  165   1H5*    U  16          1H5*        U  16   1.846  28.915  -1.858
  166   2H5*    U  16          2H5*        U  16   1.213  27.688  -0.743
  167    H4*    U  16           H4*        U  16  -0.580  29.120  -1.319
  168    H3*    U  16           H3*        U  16  -1.029  26.547  -1.482
  169    H2*    U  16           H2*        U  16  -0.174  26.148  -3.709
  170   2HO*    U  16          2HO*        U  16  -2.942  26.757  -3.783
  171    H1*    U  16           H1*        U  16  -1.629  28.588  -4.811
  172    H3     U  16           H3         U  16   0.524  27.200  -8.569
  173    H5     U  16           H5         U  16   3.567  28.430  -5.947
  174    H6     U  16           H6         U  16   1.894  28.624  -4.224
  175   1H5*    C  17          1H5*        C  17  -4.369  25.669  -3.145
  176   2H5*    C  17          2H5*        C  17  -5.477  25.213  -1.837
  177    H4*    C  17           H4*        C  17  -4.693  23.418  -3.514
  178    H3*    C  17           H3*        C  17  -5.644  23.006  -0.985
  179    H2*    C  17           H2*        C  17  -3.465  23.072   0.097
  180   2HO*    C  17          2HO*        C  17  -4.469  20.586  -0.464
  181    H1*    C  17           H1*        C  17  -2.463  21.421  -2.307
  182   1H4     C  17          H41         C  17   3.113  23.936   0.017
  183   2H4     C  17          H42         C  17   3.116  22.294   0.645
  184    H5     C  17           H5         C  17   1.211  24.945  -1.048
  185    H6     C  17           H6         C  17  -1.049  24.555  -1.866
  186   1H5*    G  18          1H5*        G  18  -7.094  23.640  -2.561
  187   2H5*    G  18          2H5*        G  18  -8.677  23.160  -1.919
  188    H4*    G  18           H4*        G  18  -9.582  24.137  -3.684
  189    H3*    G  18           H3*        G  18  -8.476  21.694  -4.969
  190    H2*    G  18           H2*        G  18  -8.218  22.686  -7.051
  191   2HO*    G  18          2HO*        G  18 -10.758  23.057  -6.616
  192    H1*    G  18           H1*        G  18  -8.850  25.457  -6.046
  193    H8     G  18           H8         G  18  -7.777  26.460  -8.164
  194    H1     G  18           H1         G  18  -2.293  23.359  -6.932
  195   1H2     G  18          H21         G  18  -4.117  21.698  -4.517
  196   2H2     G  18          H22         G  18  -2.579  21.910  -5.322
  197   1H5*    G  19          1H5*        G  19  -9.270  18.175  -5.713
  198   2H5*    G  19          2H5*        G  19  -8.387  19.649  -5.280
  199    H4*    G  19           H4*        G  19  -9.296  19.494  -8.067
  200    H3*    G  19           H3*        G  19  -7.629  17.298  -7.017
  201    H2*    G  19           H2*        G  19  -5.810  17.676  -8.510
  202   2HO*    G  19          2HO*        G  19  -7.498  19.497  -9.919
  203    H1*    G  19           H1*        G  19  -5.805  20.446  -8.541
  204    H8     G  19           H8         G  19  -6.640  19.068  -5.101
  205    H1     G  19           H1         G  19  -0.381  19.824  -6.250
  206   1H2     G  19          H21         G  19  -1.332  20.408  -9.507
  207   2H2     G  19          H22         G  19  -0.022  20.259  -8.348
  208   1H5*    C  20          1H5*        C  20  -8.099  16.200 -11.145
  209   2H5*    C  20          2H5*        C  20  -8.602  14.502 -11.268
  210    H4*    C  20           H4*        C  20  -6.587  14.909 -12.546
  211    H3*    C  20           H3*        C  20  -6.426  13.022 -10.234
  212    H2*    C  20           H2*        C  20  -4.051  12.764 -10.554
  213   2HO*    C  20          2HO*        C  20  -4.705  13.845 -13.048
  214    H1*    C  20           H1*        C  20  -3.481  15.448 -10.833
  215   1H4     C  20          H41         C  20  -4.908  14.978  -4.434
  216   2H4     C  20          H42         C  20  -3.208  14.583  -4.538
  217    H5     C  20           H5         C  20  -6.302  15.310  -6.345
  218    H6     C  20           H6         C  20  -6.384  15.389  -8.761
  219   1H5*    C  21          1H5*        C  21  -3.741  11.345 -12.377
  220   2H5*    C  21          2H5*        C  21  -4.360   9.786 -12.956
  221    H4*    C  21           H4*        C  21  -2.228   9.363 -12.067
  222    H3*    C  21           H3*        C  21  -4.420   8.437 -10.231
  223    H2*    C  21           H2*        C  21  -2.771   7.702  -8.658
  224   2HO*    C  21          2HO*        C  21  -1.194   7.721 -10.964
  225    H1*    C  21           H1*        C  21  -0.993   9.877  -9.063
  226   1H4     C  21          H41         C  21  -5.380  11.953  -4.601
  227   2H4     C  21          H42         C  21  -4.183  11.059  -3.676
  228    H5     C  21           H5         C  21  -5.370  12.030  -7.025
  229    H6     C  21           H6         C  21  -4.210  11.275  -9.041
  230   1H5*    U  22          1H5*        U  22  -1.685   5.782 -10.091
  231   2H5*    U  22          2H5*        U  22  -2.206   4.099  -9.878
  232    H4*    U  22           H4*        U  22  -0.907   5.411  -7.996
  233    H3*    U  22           H3*        U  22  -2.990   3.291  -7.717
  234    H2*    U  22           H2*        U  22  -3.142   3.662  -5.345
  235   2HO*    U  22          2HO*        U  22  -0.967   5.490  -5.671
  236    H1*    U  22           H1*        U  22  -3.238   6.422  -5.449
  237    H3     U  22           H3         U  22  -7.415   4.521  -4.749
  238    H5     U  22           H5         U  22  -7.106   5.450  -8.833
  239    H6     U  22           H6         U  22  -4.758   5.849  -8.485
  240   1H5*    G  23          1H5*        G  23   0.241   0.326  -4.234
  241   2H5*    G  23          2H5*        G  23  -1.530   0.243  -4.196
  242    H4*    G  23           H4*        G  23   0.360   1.719  -2.429
  243    H3*    G  23           H3*        G  23  -1.894  -0.183  -1.996
  244    H2*    G  23           H2*        G  23  -2.642   1.012  -0.049
  245   2HO*    G  23          2HO*        G  23  -1.355   2.849   0.680
  246    H1*    G  23           H1*        G  23  -2.498   3.544  -1.129
  247    H8     G  23           H8         G  23  -3.356   1.704  -4.151
  248    H1     G  23           H1         G  23  -8.313   2.067  -0.098
  249   1H2     G  23          H21         G  23  -5.955   3.052   2.234
  250   2H2     G  23          H22         G  23  -7.634   2.708   1.885
  251   1H5*    C  24          1H5*        C  24   0.102  -0.006   2.043
  252   2H5*    C  24          2H5*        C  24   0.572  -1.708   2.219
  253    H4*    C  24           H4*        C  24  -0.387  -1.067   4.264
  254    H3*    C  24           H3*        C  24  -2.181  -2.822   2.630
  255    H2*    C  24           H2*        C  24  -3.913  -2.629   4.290
  256   2HO*    C  24          2HO*        C  24  -3.500  -1.785   6.312
  257    H1*    C  24           H1*        C  24  -3.681   0.117   4.649
  258   1H4     C  24          H41         C  24  -6.696  -0.662  -1.181
  259   2H4     C  24          H42         C  24  -7.944  -0.244  -0.019
  260    H5     C  24           H5         C  24  -4.387  -1.019  -0.555
  261    H6     C  24           H6         C  24  -2.806  -1.052   1.302
  262   1H5*    U  25          1H5*        U  25  -2.875  -4.011   6.122
  263   2H5*    U  25          2H5*        U  25  -3.067  -5.761   6.343
  264    H4*    U  25           H4*        U  25  -5.104  -4.459   6.836
  265    H3*    U  25           H3*        U  25  -5.175  -6.605   4.739
  266    H2*    U  25           H2*        U  25  -7.508  -6.099   4.342
  267   2HO*    U  25          2HO*        U  25  -7.686  -3.955   6.055
  268    H1*    U  25           H1*        U  25  -7.158  -3.362   4.189
  269    H3     U  25           H3         U  25  -7.569  -4.890  -0.092
  270    H5     U  25           H5         U  25  -3.480  -5.129   0.818
  271    H6     U  25           H6         U  25  -4.039  -4.650   3.110
  272   1H5*    U  26          1H5*        U  26  -8.470  -8.112   7.007
  273   2H5*    U  26          2H5*        U  26  -8.219  -9.867   7.064
  274    H4*    U  26           H4*        U  26 -10.326  -9.222   5.972
  275    H3*    U  26           H3*        U  26  -8.301 -10.734   4.331
  276    H2*    U  26           H2*        U  26  -9.873 -10.718   2.512
  277   2HO*    U  26          2HO*        U  26 -11.727 -11.157   3.869
  278    H1*    U  26           H1*        U  26 -10.724  -8.050   2.949
  279    H3     U  26           H3         U  26  -8.537  -8.419  -1.079
  280    H5     U  26           H5         U  26  -5.609  -7.532   1.800
  281    H6     U  26           H6         U  26  -7.270  -7.923   3.497
  282   1H5*    U  27          1H5*        U  27 -11.990 -13.108   4.157
  283   2H5*    U  27          2H5*        U  27 -11.520 -14.813   4.009
  284    H4*    U  27           H4*        U  27 -12.983 -13.978   2.186
  285    H3*    U  27           H3*        U  27 -10.309 -15.183   1.539
  286    H2*    U  27           H2*        U  27 -10.760 -14.817  -0.807
  287   2HO*    U  27          2HO*        U  27 -12.957 -15.263  -0.913
  288    H1*    U  27           H1*        U  27 -11.596 -12.190  -0.491
  289    H3     U  27           H3         U  27  -7.372 -11.875  -2.108
  290    H5     U  27           H5         U  27  -6.891 -12.570   2.005
  291    H6     U  27           H6         U  27  -9.251 -13.019   2.126
  292   1H5*    U  28          1H5*        U  28 -13.447 -17.805  -0.695
  293   2H5*    U  28          2H5*        U  28 -12.738 -19.421  -0.510
  294    H4*    U  28           H4*        U  28 -13.355 -18.916  -2.823
  295    H3*    U  28           H3*        U  28 -10.452 -19.440  -2.240
  296    H2*    U  28           H2*        U  28 -10.000 -19.174  -4.603
  297   2HO*    U  28          2HO*        U  28 -11.832 -18.719  -6.013
  298    H1*    U  28           H1*        U  28 -11.450 -16.820  -4.847
  299    H3     U  28           H3         U  28  -7.072 -15.587  -4.723
  300    H5     U  28           H5         U  28  -8.205 -16.022  -0.703
  301    H6     U  28           H6         U  28 -10.276 -16.980  -1.471
  302   1H5*    G  29          1H5*        G  29 -10.616 -23.121  -4.460
  303   2H5*    G  29          2H5*        G  29  -9.793 -24.280  -3.398
  304    H4*    G  29           H4*        G  29  -8.601 -23.846  -5.518
  305    H3*    G  29           H3*        G  29  -7.177 -23.214  -2.938
  306    H2*    G  29           H2*        G  29  -5.299 -22.479  -4.204
  307   2HO*    G  29          2HO*        G  29  -6.506 -23.797  -6.437
  308    H1*    G  29           H1*        G  29  -6.867 -21.543  -6.460
  309    H8     G  29           H8         G  29  -8.006 -19.897  -3.340
  310    H1     G  29           H1         G  29  -2.677 -17.292  -5.782
  311   1H2     G  29          H21         G  29  -2.577 -20.105  -7.790
  312   2H2     G  29          H22         G  29  -1.836 -18.586  -7.336
  313   1H5*    C  30          1H5*        C  30  -4.147 -24.884  -4.999
  314   2H5*    C  30          2H5*        C  30  -3.534 -26.224  -4.010
  315    H4*    C  30           H4*        C  30  -1.692 -24.843  -4.523
  316    H3*    C  30           H3*        C  30  -2.587 -24.526  -1.668
  317    H2*    C  30           H2*        C  30  -0.819 -22.932  -1.340
  318   2HO*    C  30          2HO*        C  30   0.104 -23.973  -3.826
  319    H1*    C  30           H1*        C  30  -1.151 -21.644  -3.834
  320   1H4     C  30          H41         C  30  -5.635 -19.054   0.264
  321   2H4     C  30          H42         C  30  -4.319 -17.896   0.166
  322    H5     C  30           H5         C  30  -5.562 -21.219  -0.810
  323    H6     C  30           H6         C  30  -4.218 -22.718  -2.188
  324   1H5*    U  31          1H5*        U  31   1.384 -24.320  -1.722
  325   2H5*    U  31          2H5*        U  31   2.043 -25.752  -0.908
  326    H4*    U  31           H4*        U  31   3.351 -23.984  -0.148
  327    H3*    U  31           H3*        U  31   1.281 -24.679   1.923
  328    H2*    U  31           H2*        U  31   2.179 -22.949   3.326
  329   2HO*    U  31          2HO*        U  31   4.172 -22.151   1.565
  330    H1*    U  31           H1*        U  31   2.532 -21.082   1.236
  331    H3     U  31           H3         U  31  -0.801 -19.191   3.595
  332    H5     U  31           H5         U  31  -2.624 -22.479   1.725
  333    H6     U  31           H6         U  31  -0.444 -23.159   0.963
  334    H3T    U  31           H3T        U  31   3.011 -26.076   1.376
  Start of MODEL    8
    1   1H5*    A   1          1H5*        A   1  -4.155 -11.361   7.674
    2   2H5*    A   1          2H5*        A   1  -4.216 -13.113   7.412
    3    H4*    A   1           H4*        A   1  -1.821 -11.505   8.287
    4    H3*    A   1           H3*        A   1  -2.600 -12.577   5.602
    5    H2*    A   1           H2*        A   1  -0.325 -13.270   5.201
    6   2HO*    A   1          2HO*        A   1   1.318 -12.402   6.292
    7    H1*    A   1           H1*        A   1   0.054 -14.467   7.665
    8    H8     A   1           H8         A   1  -3.448 -15.288   7.315
    9   1H6     A   1          H61         A   1  -1.975 -19.599   3.125
   10   2H6     A   1          H62         A   1  -3.235 -18.988   4.176
   11    H2     A   1           H2         A   1   1.607 -16.969   3.730
   12    H5T    A   1           H5T        A   1  -3.243 -12.244   9.870
   13   1H5*    G   2          1H5*        G   2   0.517 -10.145   4.462
   14   2H5*    G   2          2H5*        G   2   0.138  -9.266   2.968
   15    H4*    G   2           H4*        G   2   2.083 -10.803   2.807
   16    H3*    G   2           H3*        G   2  -0.239 -11.129   0.924
   17    H2*    G   2           H2*        G   2   0.918 -12.974  -0.108
   18   2HO*    G   2          2HO*        G   2   3.017 -12.025  -0.062
   19    H1*    G   2           H1*        G   2   1.787 -14.123   2.307
   20    H8     G   2           H8         G   2  -1.548 -13.208   3.314
   21    H1     G   2           H1         G   2  -1.648 -17.985  -0.963
   22   1H2     G   2          H21         G   2   1.635 -17.102  -1.597
   23   2H2     G   2          H22         G   2   0.289 -18.158  -1.965
   24   1H5*    U   3          1H5*        U   3   3.069 -10.260  -2.063
   25   2H5*    U   3          2H5*        U   3   2.283  -9.079  -3.128
   26    H4*    U   3           H4*        U   3   3.158 -10.863  -4.451
   27    H3*    U   3           H3*        U   3   0.156 -10.786  -4.307
   28    H2*    U   3           H2*        U   3   0.099 -12.710  -5.775
   29   2HO*    U   3          2HO*        U   3   1.741 -13.079  -7.085
   30    H1*    U   3           H1*        U   3   2.006 -14.146  -4.360
   31    H3     U   3           H3         U   3  -1.881 -16.078  -3.081
   32    H5     U   3           H5         U   3  -1.696 -12.524  -0.854
   33    H6     U   3           H6         U   3   0.244 -11.910  -2.137
   34   1H5*    A   4          1H5*        A   4   0.770 -10.034  -8.778
   35   2H5*    A   4          2H5*        A   4  -0.522  -8.876  -9.149
   36    H4*    A   4           H4*        A   4  -0.560 -10.928 -10.533
   37    H3*    A   4           H3*        A   4  -2.966 -10.181  -8.902
   38    H2*    A   4           H2*        A   4  -4.095 -12.164  -9.743
   39   2HO*    A   4          2HO*        A   4  -3.001 -12.011 -11.868
   40    H1*    A   4           H1*        A   4  -2.034 -13.870  -9.114
   41    H8     A   4           H8         A   4  -1.461 -11.388  -6.508
   42   1H6     A   4          H61         A   4  -6.278 -13.677  -3.373
   43   2H6     A   4          H62         A   4  -4.867 -12.648  -3.287
   44    H2     A   4           H2         A   4  -6.438 -15.301  -7.554
   45   1H5*    G   5          1H5*        G   5  -5.146  -9.450 -12.622
   46   2H5*    G   5          2H5*        G   5  -5.956  -7.901 -12.320
   47    H4*    G   5           H4*        G   5  -7.509  -9.782 -12.654
   48    H3*    G   5           H3*        G   5  -7.618  -8.304 -10.033
   49    H2*    G   5           H2*        G   5  -9.478  -9.728  -9.413
   50   2HO*    G   5          2HO*        G   5  -9.774 -11.472 -11.283
   51    H1*    G   5           H1*        G   5  -8.226 -12.087 -10.204
   52    H8     G   5           H8         G   5  -5.360 -10.211  -8.953
   53    H1     G   5           H1         G   5  -9.246 -12.113  -4.213
   54   1H2     G   5          H21         G   5 -11.528 -12.727  -6.727
   55   2H2     G   5          H22         G   5 -11.174 -12.742  -5.014
   56   1H5*    A   6          1H5*        A   6 -11.386  -9.178 -10.764
   57   2H5*    A   6          2H5*        A   6 -12.285  -7.663 -10.971
   58    H4*    A   6           H4*        A   6 -13.374  -9.300  -9.470
   59    H3*    A   6           H3*        A   6 -13.450  -6.620  -9.134
   60    H2*    A   6           H2*        A   6 -11.620  -6.432  -7.568
   61   2HO*    A   6          2HO*        A   6 -13.875  -6.041  -6.552
   62    H1*    A   6           H1*        A   6 -12.592  -9.008  -6.212
   63    H8     A   6           H8         A   6  -9.228  -8.134  -7.851
   64   1H6     A   6          H61         A   6  -6.899  -8.255  -2.116
   65   2H6     A   6          H62         A   6  -6.526  -8.097  -3.822
   66    H2     A   6           H2         A   6 -11.335  -8.887  -1.832
   67   1H5*    A   7          1H5*        A   7 -15.826  -7.952  -5.287
   68   2H5*    A   7          2H5*        A   7 -17.148  -6.772  -5.198
   69    H4*    A   7           H4*        A   7 -16.149  -6.746  -3.088
   70    H3*    A   7           H3*        A   7 -15.226  -4.360  -4.678
   71    H2*    A   7           H2*        A   7 -13.762  -3.770  -2.918
   72   2HO*    A   7          2HO*        A   7 -15.894  -4.467  -1.497
   73    H1*    A   7           H1*        A   7 -13.637  -6.513  -1.821
   74    H8     A   7           H8         A   7 -12.050  -5.707  -5.198
   75   1H6     A   7          H61         A   7  -6.766  -5.106  -2.017
   76   2H6     A   7          H62         A   7  -7.479  -5.171  -3.616
   77    H2     A   7           H2         A   7 -10.120  -5.548   0.921
   78   1H5*    A   8          1H5*        A   8 -17.816  -1.376  -1.108
   79   2H5*    A   8          2H5*        A   8 -16.645  -0.208  -1.750
   80    H4*    A   8           H4*        A   8 -16.805  -1.299   0.852
   81    H3*    A   8           H3*        A   8 -14.947   0.655  -0.471
   82    H2*    A   8           H2*        A   8 -13.419   0.415   1.367
   83   2HO*    A   8          2HO*        A   8 -15.389  -1.220   2.631
   84    H1*    A   8           H1*        A   8 -13.642  -2.366   1.571
   85    H8     A   8           H8         A   8 -13.671  -1.344  -2.058
   86   1H6     A   8          H61         A   8  -7.488  -1.561  -1.800
   87   2H6     A   8          H62         A   8  -8.876  -1.407  -2.854
   88    H2     A   8           H2         A   8  -9.069  -1.955   2.378
   89   1H5*    C   9          1H5*        C   9 -15.673   2.444   4.273
   90   2H5*    C   9          2H5*        C   9 -15.260   4.051   3.644
   91    H4*    C   9           H4*        C   9 -13.918   2.971   5.619
   92    H3*    C   9           H3*        C   9 -12.869   4.706   3.419
   93    H2*    C   9           H2*        C   9 -10.609   4.331   4.156
   94   2HO*    C   9          2HO*        C   9 -11.862   3.088   6.405
   95    H1*    C   9           H1*        C   9 -10.850   1.589   4.521
   96   1H4     C   9          H41         C   9 -10.674   2.309  -2.036
   97   2H4     C   9          H42         C   9  -9.030   1.946  -1.533
   98    H5     C   9           H5         C   9 -12.485   2.669  -0.453
   99    H6     C   9           H6         C   9 -13.074   2.738   1.909
  100   1H5*    A  10          1H5*        A  10 -10.380   6.166   6.699
  101   2H5*    A  10          2H5*        A  10 -10.116   7.850   6.205
  102    H4*    A  10           H4*        A  10  -8.151   6.119   6.231
  103    H3*    A  10           H3*        A  10  -8.604   8.294   4.210
  104    H2*    A  10           H2*        A  10  -6.720   7.507   2.954
  105   2HO*    A  10          2HO*        A  10  -5.106   6.894   4.211
  106    H1*    A  10           H1*        A  10  -7.247   4.756   3.315
  107    H8     A  10           H8         A  10 -10.575   5.980   2.534
  108   1H6     A  10          H61         A  10  -8.911   6.407  -3.414
  109   2H6     A  10          H62         A  10 -10.257   6.414  -2.297
  110    H2     A  10           H2         A  10  -5.195   5.865  -0.966
  111   1H5*    A  11          1H5*        A  11  -4.261  11.512   5.865
  112   2H5*    A  11          2H5*        A  11  -4.354  10.946   4.185
  113    H4*    A  11           H4*        A  11  -2.398  10.287   6.329
  114    H3*    A  11           H3*        A  11  -2.209  11.245   3.524
  115    H2*    A  11           H2*        A  11  -0.364   9.811   3.007
  116   2HO*    A  11          2HO*        A  11   0.399  10.242   5.370
  117    H1*    A  11           H1*        A  11  -1.287   7.518   4.248
  118    H8     A  11           H8         A  11  -4.506   8.701   3.110
  119   1H6     A  11          H61         A  11  -3.032   6.988  -2.654
  120   2H6     A  11          H62         A  11  -4.330   7.488  -1.593
  121    H2     A  11           H2         A  11   0.713   6.945  -0.191
  122   1H5*    G  12          1H5*        G  12   1.697  11.931   4.788
  123   2H5*    G  12          2H5*        G  12   2.228  13.567   4.354
  124    H4*    G  12           H4*        G  12   3.642  11.748   3.440
  125    H3*    G  12           H3*        G  12   2.412  13.801   1.647
  126    H2*    G  12           H2*        G  12   3.278  12.663  -0.298
  127   2HO*    G  12          2HO*        G  12   4.452  10.684   1.351
  128    H1*    G  12           H1*        G  12   2.458  10.146   0.437
  129    H8     G  12           H8         G  12   0.135  12.822   1.812
  130    H1     G  12           H1         G  12  -1.346  10.709  -4.057
  131   1H2     G  12          H21         G  12   1.685   9.046  -3.903
  132   2H2     G  12          H22         G  12   0.243   9.407  -4.826
  133   1H5*    G  13          1H5*        G  13   6.160  12.868  -0.146
  134   2H5*    G  13          2H5*        G  13   6.948  14.440  -0.384
  135    H4*    G  13           H4*        G  13   6.943  13.204  -2.444
  136    H3*    G  13           H3*        G  13   5.201  15.653  -2.418
  137    H2*    G  13           H2*        G  13   4.615  15.195  -4.714
  138   2HO*    G  13          2HO*        G  13   6.001  14.150  -5.942
  139    H1*    G  13           H1*        G  13   4.181  12.466  -4.326
  140    H8     G  13           H8         G  13   3.042  14.407  -1.306
  141    H1     G  13           H1         G  13  -1.284  14.028  -6.031
  142   1H2     G  13          H21         G  13   1.311  12.750  -7.912
  143   2H2     G  13          H22         G  13  -0.374  13.216  -7.840
  144   1H5*    C  14          1H5*        C  14   7.453  16.736  -6.091
  145   2H5*    C  14          2H5*        C  14   8.139  18.274  -5.533
  146    H4*    C  14           H4*        C  14   7.109  18.739  -7.583
  147    H3*    C  14           H3*        C  14   5.348  19.675  -5.320
  148    H2*    C  14           H2*        C  14   3.846  20.550  -6.997
  149   2HO*    C  14          2HO*        C  14   5.221  19.685  -9.210
  150    H1*    C  14           H1*        C  14   3.992  18.264  -8.630
  151   1H4     C  14          H41         C  14  -0.158  16.762  -3.729
  152   2H4     C  14          H42         C  14  -1.132  17.641  -4.898
  153    H5     C  14           H5         C  14   2.227  16.479  -3.970
  154    H6     C  14           H6         C  14   4.172  17.013  -5.341
  155   1H5*    U  15          1H5*        U  15   5.007  23.480  -7.419
  156   2H5*    U  15          2H5*        U  15   5.298  24.545  -6.031
  157    H4*    U  15           H4*        U  15   3.093  24.845  -7.134
  158    H3*    U  15           H3*        U  15   3.256  24.237  -4.200
  159    H2*    U  15           H2*        U  15   0.846  24.285  -4.085
  160   2HO*    U  15          2HO*        U  15  -0.150  24.618  -6.365
  161    H1*    U  15           H1*        U  15   0.448  22.674  -6.292
  162    H3     U  15           H3         U  15  -0.192  20.040  -2.618
  163    H5     U  15           H5         U  15   3.937  19.934  -3.374
  164    H6     U  15           H6         U  15   3.609  21.684  -4.992
  165   1H5*    U  16          1H5*        U  16   1.614  29.259  -3.076
  166   2H5*    U  16          2H5*        U  16   1.008  28.301  -1.711
  167    H4*    U  16           H4*        U  16  -0.815  29.565  -2.439
  168    H3*    U  16           H3*        U  16  -1.256  26.987  -2.287
  169    H2*    U  16           H2*        U  16  -0.436  26.351  -4.477
  170   2HO*    U  16          2HO*        U  16  -2.358  25.452  -4.811
  171    H1*    U  16           H1*        U  16  -1.974  28.646  -5.778
  172    H3     U  16           H3         U  16  -0.038  27.093  -9.563
  173    H5     U  16           H5         U  16   3.192  28.119  -7.079
  174    H6     U  16           H6         U  16   1.601  28.497  -5.305
  175   1H5*    C  17          1H5*        C  17  -4.727  26.084  -3.755
  176   2H5*    C  17          2H5*        C  17  -5.789  25.701  -2.387
  177    H4*    C  17           H4*        C  17  -5.074  23.823  -4.003
  178    H3*    C  17           H3*        C  17  -5.946  23.539  -1.430
  179    H2*    C  17           H2*        C  17  -3.732  23.636  -0.421
  180   2HO*    C  17          2HO*        C  17  -4.065  20.906  -1.221
  181    H1*    C  17           H1*        C  17  -2.818  21.864  -2.775
  182   1H4     C  17          H41         C  17   2.844  24.433  -0.733
  183   2H4     C  17          H42         C  17   2.834  22.834  -0.003
  184    H5     C  17           H5         C  17   0.927  25.399  -1.828
  185    H6     C  17           H6         C  17  -1.361  24.990  -2.554
  186   1H5*    G  18          1H5*        G  18  -7.404  23.739  -3.096
  187   2H5*    G  18          2H5*        G  18  -8.943  23.551  -2.234
  188    H4*    G  18           H4*        G  18 -10.059  23.963  -4.089
  189    H3*    G  18           H3*        G  18  -8.740  21.476  -5.040
  190    H2*    G  18           H2*        G  18  -8.621  22.170  -7.256
  191   2HO*    G  18          2HO*        G  18 -11.226  22.662  -6.621
  192    H1*    G  18           H1*        G  18  -9.517  24.983  -6.644
  193    H8     G  18           H8         G  18  -8.598  25.770  -8.916
  194    H1     G  18           H1         G  18  -2.796  23.441  -7.460
  195   1H2     G  18          H21         G  18  -4.385  21.979  -4.765
  196   2H2     G  18          H22         G  18  -2.894  22.224  -5.645
  197   1H5*    G  19          1H5*        G  19  -9.237  17.841  -5.453
  198   2H5*    G  19          2H5*        G  19  -8.488  19.434  -5.244
  199    H4*    G  19           H4*        G  19  -9.542  18.950  -7.925
  200    H3*    G  19           H3*        G  19  -7.715  16.911  -6.824
  201    H2*    G  19           H2*        G  19  -6.010  17.240  -8.456
  202   2HO*    G  19          2HO*        G  19  -6.504  17.886 -10.442
  203    H1*    G  19           H1*        G  19  -6.120  19.999  -8.687
  204    H8     G  19           H8         G  19  -6.714  18.826  -5.120
  205    H1     G  19           H1         G  19  -0.568  19.796  -6.649
  206   1H2     G  19          H21         G  19  -1.713  20.116  -9.881
  207   2H2     G  19          H22         G  19  -0.341  20.108  -8.786
  208   1H5*    C  20          1H5*        C  20  -8.423  15.379 -10.858
  209   2H5*    C  20          2H5*        C  20  -8.846  13.661 -10.719
  210    H4*    C  20           H4*        C  20  -6.955  14.022 -12.212
  211    H3*    C  20           H3*        C  20  -6.568  12.362  -9.757
  212    H2*    C  20           H2*        C  20  -4.216  12.130 -10.232
  213   2HO*    C  20          2HO*        C  20  -3.362  12.924 -12.203
  214    H1*    C  20           H1*        C  20  -3.749  14.791 -10.778
  215   1H4     C  20          H41         C  20  -4.748  14.838  -4.279
  216   2H4     C  20          H42         C  20  -3.058  14.427  -4.461
  217    H5     C  20           H5         C  20  -6.262  15.019  -6.121
  218    H6     C  20           H6         C  20  -6.495  14.902  -8.526
  219   1H5*    C  21          1H5*        C  21  -4.003  10.492 -11.949
  220   2H5*    C  21          2H5*        C  21  -4.639   8.870 -12.287
  221    H4*    C  21           H4*        C  21  -2.422   8.603 -11.522
  222    H3*    C  21           H3*        C  21  -4.463   7.802  -9.466
  223    H2*    C  21           H2*        C  21  -2.694   7.269  -7.943
  224   2HO*    C  21          2HO*        C  21  -1.276   7.084 -10.338
  225    H1*    C  21           H1*        C  21  -1.019   9.440  -8.668
  226   1H4     C  21          H41         C  21  -5.187  11.804  -4.141
  227   2H4     C  21          H42         C  21  -3.938  10.989  -3.213
  228    H5     C  21           H5         C  21  -5.298  11.701  -6.559
  229    H6     C  21           H6         C  21  -4.240  10.800  -8.568
  230   1H5*    U  22          1H5*        U  22  -1.610   5.252  -9.242
  231   2H5*    U  22          2H5*        U  22  -2.059   3.592  -8.805
  232    H4*    U  22           H4*        U  22  -0.694   5.195  -7.182
  233    H3*    U  22           H3*        U  22  -2.577   2.971  -6.531
  234    H2*    U  22           H2*        U  22  -2.583   3.579  -4.202
  235   2HO*    U  22          2HO*        U  22  -0.473   4.145  -3.818
  236    H1*    U  22           H1*        U  22  -2.942   6.288  -4.576
  237    H3     U  22           H3         U  22  -6.882   4.145  -3.403
  238    H5     U  22           H5         U  22  -6.887   4.598  -7.579
  239    H6     U  22           H6         U  22  -4.571   5.236  -7.436
  240   1H5*    G  23          1H5*        G  23   1.578   1.320  -3.632
  241   2H5*    G  23          2H5*        G  23   0.505  -0.084  -3.464
  242    H4*    G  23           H4*        G  23   1.415   1.497  -1.423
  243    H3*    G  23           H3*        G  23  -0.843  -0.462  -1.585
  244    H2*    G  23           H2*        G  23  -1.684   0.301   0.540
  245   2HO*    G  23          2HO*        G  23   0.729   1.838   0.637
  246    H1*    G  23           H1*        G  23  -1.488   3.005  -0.020
  247    H8     G  23           H8         G  23  -2.246   1.473  -3.306
  248    H1     G  23           H1         G  23  -7.387   1.901   0.505
  249   1H2     G  23          H21         G  23  -5.109   2.598   3.011
  250   2H2     G  23          H22         G  23  -6.783   2.376   2.555
  251   1H5*    C  24          1H5*        C  24   1.465  -2.474   2.716
  252   2H5*    C  24          2H5*        C  24   0.324  -3.784   2.353
  253    H4*    C  24           H4*        C  24   0.348  -2.404   4.659
  254    H3*    C  24           H3*        C  24  -1.931  -3.809   3.297
  255    H2*    C  24           H2*        C  24  -3.429  -2.940   4.975
  256   2HO*    C  24          2HO*        C  24  -1.995  -3.169   6.772
  257    H1*    C  24           H1*        C  24  -2.421  -0.341   4.913
  258   1H4     C  24          H41         C  24  -6.026  -0.931  -0.585
  259   2H4     C  24          H42         C  24  -7.097  -0.245   0.625
  260    H5     C  24           H5         C  24  -3.775  -1.659  -0.084
  261    H6     C  24           H6         C  24  -2.094  -1.881   1.670
  262   1H5*    U  25          1H5*        U  25  -3.249  -4.564   6.944
  263   2H5*    U  25          2H5*        U  25  -3.491  -6.320   7.037
  264    H4*    U  25           H4*        U  25  -5.528  -4.981   7.474
  265    H3*    U  25           H3*        U  25  -5.514  -7.021   5.270
  266    H2*    U  25           H2*        U  25  -7.813  -6.445   4.781
  267   2HO*    U  25          2HO*        U  25  -8.785  -6.024   6.688
  268    H1*    U  25           H1*        U  25  -7.396  -3.711   4.792
  269    H3     U  25           H3         U  25  -7.627  -4.902   0.407
  270    H5     U  25           H5         U  25  -3.635  -5.558   1.521
  271    H6     U  25           H6         U  25  -4.284  -5.155   3.804
  272   1H5*    U  26          1H5*        U  26  -8.931  -8.669   7.396
  273   2H5*    U  26          2H5*        U  26  -8.699 -10.424   7.269
  274    H4*    U  26           H4*        U  26 -10.783  -9.608   6.222
  275    H3*    U  26           H3*        U  26  -8.777 -11.042   4.489
  276    H2*    U  26           H2*        U  26 -10.329 -10.834   2.664
  277   2HO*    U  26          2HO*        U  26 -12.443  -9.730   3.300
  278    H1*    U  26           H1*        U  26 -11.096  -8.183   3.302
  279    H3     U  26           H3         U  26  -8.869  -8.306  -0.717
  280    H5     U  26           H5         U  26  -5.948  -7.764   2.251
  281    H6     U  26           H6         U  26  -7.641  -8.232   3.895
  282   1H5*    U  27          1H5*        U  27 -12.603 -13.225   4.009
  283   2H5*    U  27          2H5*        U  27 -12.159 -14.927   3.772
  284    H4*    U  27           H4*        U  27 -13.575 -13.968   1.975
  285    H3*    U  27           H3*        U  27 -10.907 -15.174   1.304
  286    H2*    U  27           H2*        U  27 -11.329 -14.676  -1.029
  287   2HO*    U  27          2HO*        U  27 -13.429 -13.420  -1.361
  288    H1*    U  27           H1*        U  27 -12.051 -12.047  -0.574
  289    H3     U  27           H3         U  27  -7.736 -11.901  -2.003
  290    H5     U  27           H5         U  27  -7.491 -12.713   2.109
  291    H6     U  27           H6         U  27  -9.872 -13.059   2.103
  292   1H5*    U  28          1H5*        U  28 -13.853 -17.846  -1.045
  293   2H5*    U  28          2H5*        U  28 -13.080 -19.439  -0.933
  294    H4*    U  28           H4*        U  28 -13.590 -18.769  -3.238
  295    H3*    U  28           H3*        U  28 -10.702 -19.249  -2.534
  296    H2*    U  28           H2*        U  28 -10.171 -18.836  -4.865
  297   2HO*    U  28          2HO*        U  28 -13.004 -18.609  -5.208
  298    H1*    U  28           H1*        U  28 -11.645 -16.491  -4.993
  299    H3     U  28           H3         U  28  -7.254 -15.306  -4.579
  300    H5     U  28           H5         U  28  -8.643 -15.871  -0.656
  301    H6     U  28           H6         U  28 -10.660 -16.799  -1.586
  302   1H5*    G  29          1H5*        G  29 -10.616 -22.811  -4.954
  303   2H5*    G  29          2H5*        G  29  -9.786 -23.986  -3.915
  304    H4*    G  29           H4*        G  29  -8.525 -23.380  -5.954
  305    H3*    G  29           H3*        G  29  -7.252 -22.853  -3.275
  306    H2*    G  29           H2*        G  29  -5.347 -21.959  -4.400
  307   2HO*    G  29          2HO*        G  29  -4.720 -22.840  -6.234
  308    H1*    G  29           H1*        G  29  -6.833 -20.867  -6.616
  309    H8     G  29           H8         G  29  -8.313 -19.610  -3.467
  310    H1     G  29           H1         G  29  -2.907 -16.570  -5.098
  311   1H2     G  29          H21         G  29  -2.492 -19.144  -7.371
  312   2H2     G  29          H22         G  29  -1.868 -17.657  -6.693
  313   1H5*    C  30          1H5*        C  30  -4.193 -24.987  -5.667
  314   2H5*    C  30          2H5*        C  30  -3.436 -26.083  -4.495
  315    H4*    C  30           H4*        C  30  -1.831 -24.643  -5.690
  316    H3*    C  30           H3*        C  30  -1.976 -24.543  -2.696
  317    H2*    C  30           H2*        C  30  -0.278 -22.835  -2.671
  318   2HO*    C  30          2HO*        C  30   0.199 -23.883  -5.193
  319    H1*    C  30           H1*        C  30  -1.366 -21.313  -4.731
  320   1H4     C  30          H41         C  30  -5.260 -20.154   0.464
  321   2H4     C  30          H42         C  30  -4.078 -18.860   0.452
  322    H5     C  30           H5         C  30  -5.179 -22.028  -1.053
  323    H6     C  30           H6         C  30  -3.956 -23.046  -2.901
  324   1H5*    U  31          1H5*        U  31   1.981 -23.934  -3.807
  325   2H5*    U  31          2H5*        U  31   2.925 -25.223  -3.034
  326    H4*    U  31           H4*        U  31   4.011 -23.127  -2.664
  327    H3*    U  31           H3*        U  31   2.769 -24.324  -0.200
  328    H2*    U  31           H2*        U  31   3.588 -22.455   1.067
  329   2HO*    U  31          2HO*        U  31   5.650 -22.419  -0.103
  330    H1*    U  31           H1*        U  31   2.943 -20.517  -0.877
  331    H3     U  31           H3         U  31  -0.048 -19.540   2.335
  332    H5     U  31           H5         U  31  -1.436 -23.167   0.733
  333    H6     U  31           H6         U  31   0.582 -23.275  -0.574
  334    H3T    U  31           H3T        U  31   4.471 -25.402  -0.922
  Start of MODEL    9
    1   1H5*    A   1          1H5*        A   1  -2.062 -11.598   7.262
    2   2H5*    A   1          2H5*        A   1  -2.588 -13.218   7.753
    3    H4*    A   1           H4*        A   1   0.318 -12.764   7.794
    4    H3*    A   1           H3*        A   1  -1.177 -12.540   5.197
    5    H2*    A   1           H2*        A   1   0.526 -13.920   4.167
    6   2HO*    A   1          2HO*        A   1   2.014 -12.944   6.143
    7    H1*    A   1           H1*        A   1   0.505 -15.849   6.155
    8    H8     A   1           H8         A   1  -3.014 -14.778   6.152
    9   1H6     A   1          H61         A   1  -3.914 -18.279   1.126
   10   2H6     A   1          H62         A   1  -4.693 -17.364   2.396
   11    H2     A   1           H2         A   1   0.507 -17.931   1.806
   12    H5T    A   1           H5T        A   1  -1.754 -11.221   9.288
   13   1H5*    G   2          1H5*        G   2   2.649 -11.115   3.786
   14   2H5*    G   2          2H5*        G   2   2.277  -9.655   2.849
   15    H4*    G   2           H4*        G   2   3.492 -11.309   1.531
   16    H3*    G   2           H3*        G   2   0.705 -10.611   0.637
   17    H2*    G   2           H2*        G   2   0.928 -12.154  -1.172
   18   2HO*    G   2          2HO*        G   2   2.903 -11.767  -2.013
   19    H1*    G   2           H1*        G   2   2.464 -14.078   0.276
   20    H8     G   2           H8         G   2  -0.406 -13.290   2.422
   21    H1     G   2           H1         G   2  -2.016 -17.037  -2.526
   22   1H2     G   2          H21         G   2   1.079 -16.179  -3.812
   23   2H2     G   2          H22         G   2  -0.412 -17.074  -4.014
   24   1H5*    U   3          1H5*        U   3   3.746  -9.920  -2.747
   25   2H5*    U   3          2H5*        U   3   3.062  -8.575  -3.680
   26    H4*    U   3           H4*        U   3   3.695 -10.469  -5.091
   27    H3*    U   3           H3*        U   3   0.773  -9.732  -5.023
   28    H2*    U   3           H2*        U   3   0.400 -11.459  -6.674
   29   2HO*    U   3          2HO*        U   3   2.700 -10.886  -7.551
   30    H1*    U   3           H1*        U   3   2.001 -13.359  -5.379
   31    H3     U   3           H3         U   3  -2.157 -14.911  -4.583
   32    H5     U   3           H5         U   3  -1.791 -11.610  -2.015
   33    H6     U   3           H6         U   3   0.310 -11.113  -3.078
   34   1H5*    A   4          1H5*        A   4   1.402  -9.104  -9.377
   35   2H5*    A   4          2H5*        A   4   0.742  -7.471  -9.592
   36    H4*    A   4           H4*        A   4  -0.264  -9.014 -11.150
   37    H3*    A   4           H3*        A   4  -2.088  -7.844  -9.075
   38    H2*    A   4           H2*        A   4  -3.927  -9.105 -10.035
   39   2HO*    A   4          2HO*        A   4  -2.412  -9.021 -12.212
   40    H1*    A   4           H1*        A   4  -2.579 -11.503 -10.021
   41    H8     A   4           H8         A   4  -0.938  -9.941  -7.160
   42   1H6     A   4          H61         A   4  -5.962 -11.146  -3.750
   43   2H6     A   4          H62         A   4  -4.277 -10.679  -3.707
   44    H2     A   4           H2         A   4  -7.039 -11.710  -8.068
   45   1H5*    G   5          1H5*        G   5  -4.121  -5.697 -12.311
   46   2H5*    G   5          2H5*        G   5  -4.362  -4.077 -11.630
   47    H4*    G   5           H4*        G   5  -6.458  -5.282 -12.109
   48    H3*    G   5           H3*        G   5  -5.946  -4.442  -9.259
   49    H2*    G   5           H2*        G   5  -8.137  -5.324  -8.718
   50   2HO*    G   5          2HO*        G   5  -8.511  -6.093 -11.419
   51    H1*    G   5           H1*        G   5  -7.764  -7.713 -10.116
   52    H8     G   5           H8         G   5  -4.422  -7.051  -8.722
   53    H1     G   5           H1         G   5  -8.650  -8.941  -4.279
   54   1H2     G   5          H21         G   5 -11.020  -8.340  -6.707
   55   2H2     G   5          H22         G   5 -10.680  -8.859  -5.071
   56   1H5*    A   6          1H5*        A   6  -9.559  -3.890 -10.200
   57   2H5*    A   6          2H5*        A   6 -10.298  -2.303  -9.923
   58    H4*    A   6           H4*        A   6 -11.618  -4.230  -9.077
   59    H3*    A   6           H3*        A   6 -11.496  -1.787  -7.903
   60    H2*    A   6           H2*        A   6  -9.776  -2.318  -6.284
   61   2HO*    A   6          2HO*        A   6 -11.596  -1.762  -5.032
   62    H1*    A   6           H1*        A   6 -11.133  -5.059  -5.928
   63    H8     A   6           H8         A   6  -7.517  -4.151  -6.856
   64   1H6     A   6          H61         A   6  -5.974  -6.464  -1.324
   65   2H6     A   6          H62         A   6  -5.372  -5.816  -2.838
   66    H2     A   6           H2         A   6 -10.454  -6.488  -1.641
   67   1H5*    A   7          1H5*        A   7 -14.109  -3.983  -4.759
   68   2H5*    A   7          2H5*        A   7 -15.407  -2.833  -4.383
   69    H4*    A   7           H4*        A   7 -14.571  -3.359  -2.302
   70    H3*    A   7           H3*        A   7 -13.231  -0.810  -3.186
   71    H2*    A   7           H2*        A   7 -11.872  -0.874  -1.249
   72   2HO*    A   7          2HO*        A   7 -14.188  -2.029  -0.231
   73    H1*    A   7           H1*        A   7 -12.149  -3.795  -0.895
   74    H8     A   7           H8         A   7 -10.224  -2.380  -3.874
   75   1H6     A   7          H61         A   7  -5.160  -3.263  -0.425
   76   2H6     A   7          H62         A   7  -5.760  -2.832  -2.010
   77    H2     A   7           H2         A   7  -8.752  -4.033   2.151
   78   1H5*    A   8          1H5*        A   8 -14.810   2.444   0.236
   79   2H5*    A   8          2H5*        A   8 -13.088   2.826   0.043
   80    H4*    A   8           H4*        A   8 -14.467   1.248   2.094
   81    H3*    A   8           H3*        A   8 -11.941   2.877   2.000
   82    H2*    A   8           H2*        A   8 -11.115   1.631   3.880
   83   2HO*    A   8          2HO*        A   8 -13.756   0.544   4.024
   84    H1*    A   8           H1*        A   8 -12.069  -0.870   2.990
   85    H8     A   8           H8         A   8 -10.663   0.681  -0.045
   86   1H6     A   8          H61         A   8  -5.043  -0.989   1.958
   87   2H6     A   8          H62         A   8  -5.954  -0.391   0.590
   88    H2     A   8           H2         A   8  -7.936  -1.510   5.337
   89   1H5*    C   9          1H5*        C   9 -12.841   4.396   6.891
   90   2H5*    C   9          2H5*        C   9 -12.146   5.843   6.133
   91    H4*    C   9           H4*        C   9 -10.957   4.584   8.130
   92    H3*    C   9           H3*        C   9  -9.695   6.034   5.831
   93    H2*    C   9           H2*        C   9  -7.519   5.296   6.549
   94   2HO*    C   9          2HO*        C   9  -8.263   5.525   8.881
   95    H1*    C   9           H1*        C   9  -8.247   2.654   7.037
   96   1H4     C   9          H41         C   9  -7.965   3.023   0.464
   97   2H4     C   9          H42         C   9  -6.329   2.646   0.982
   98    H5     C   9           H5         C   9  -9.756   3.538   2.024
   99    H6     C   9           H6         C   9 -10.333   3.780   4.380
  100   1H5*    A  10          1H5*        A  10  -6.661   9.628   7.719
  101   2H5*    A  10          2H5*        A  10  -7.237   9.653   6.041
  102    H4*    A  10           H4*        A  10  -4.765   8.575   7.190
  103    H3*    A  10           H3*        A  10  -5.564   9.789   4.578
  104    H2*    A  10           H2*        A  10  -3.904   8.519   3.408
  105   2HO*    A  10          2HO*        A  10  -2.192   7.626   4.437
  106    H1*    A  10           H1*        A  10  -4.332   6.099   4.715
  107    H8     A  10           H8         A  10  -7.783   7.139   4.511
  108   1H6     A  10          H61         A  10  -7.765   5.813  -1.537
  109   2H6     A  10          H62         A  10  -8.769   6.171  -0.149
  110    H2     A  10           H2         A  10  -3.512   5.903  -0.120
  111   1H5*    A  11          1H5*        A  11  -1.142  11.794   6.279
  112   2H5*    A  11          2H5*        A  11  -0.863  12.869   4.895
  113    H4*    A  11           H4*        A  11   1.029  11.306   5.878
  114    H3*    A  11           H3*        A  11   0.604  12.179   3.048
  115    H2*    A  11           H2*        A  11   2.325  10.689   2.288
  116   2HO*    A  11          2HO*        A  11   3.958  10.681   3.686
  117    H1*    A  11           H1*        A  11   1.592   8.508   3.869
  118    H8     A  11           H8         A  11  -1.728   9.643   3.007
  119   1H6     A  11          H61         A  11  -0.960   7.365  -2.698
  120   2H6     A  11          H62         A  11  -2.119   7.982  -1.543
  121    H2     A  11           H2         A  11   3.054   7.500  -0.702
  122   1H5*    G  12          1H5*        G  12   4.925  12.899   3.226
  123   2H5*    G  12          2H5*        G  12   5.022  14.609   2.765
  124    H4*    G  12           H4*        G  12   6.492  13.290   1.392
  125    H3*    G  12           H3*        G  12   4.166  14.569  -0.004
  126    H2*    G  12           H2*        G  12   4.874  13.559  -2.081
  127   2HO*    G  12          2HO*        G  12   7.046  12.267  -0.847
  128    H1*    G  12           H1*        G  12   5.292  11.035  -1.033
  129    H8     G  12           H8         G  12   2.450  12.824   0.737
  130    H1     G  12           H1         G  12   0.746   9.548  -4.508
  131   1H2     G  12          H21         G  12   4.148   9.198  -5.028
  132   2H2     G  12          H22         G  12   2.528   8.858  -5.589
  133   1H5*    G  13          1H5*        G  13   7.273  14.762  -2.687
  134   2H5*    G  13          2H5*        G  13   7.396  16.431  -3.277
  135    H4*    G  13           H4*        G  13   7.239  14.936  -5.141
  136    H3*    G  13           H3*        G  13   4.804  16.655  -4.726
  137    H2*    G  13           H2*        G  13   3.864  15.656  -6.724
  138   2HO*    G  13          2HO*        G  13   5.596  15.403  -8.076
  139    H1*    G  13           H1*        G  13   4.489  13.050  -5.979
  140    H8     G  13           H8         G  13   3.679  14.976  -2.864
  141    H1     G  13           H1         G  13  -1.463  12.828  -6.039
  142   1H2     G  13          H21         G  13   0.775  12.089  -8.568
  143   2H2     G  13          H22         G  13  -0.883  12.071  -8.012
  144   1H5*    C  14          1H5*        C  14   5.454  18.277  -8.829
  145   2H5*    C  14          2H5*        C  14   5.030  19.968  -8.504
  146    H4*    C  14           H4*        C  14   3.584  18.827 -10.178
  147    H3*    C  14           H3*        C  14   2.244  19.957  -7.714
  148    H2*    C  14           H2*        C  14   0.157  19.392  -8.797
  149   2HO*    C  14          2HO*        C  14   1.184  18.210 -11.038
  150    H1*    C  14           H1*        C  14   1.091  16.861  -9.650
  151   1H4     C  14          H41         C  14  -0.751  16.159  -3.363
  152   2H4     C  14          H42         C  14  -2.257  16.139  -4.263
  153    H5     C  14           H5         C  14   1.376  16.642  -4.386
  154    H6     C  14           H6         C  14   2.508  17.213  -6.461
  155   1H5*    U  15          1H5*        U  15  -0.317  22.422 -10.217
  156   2H5*    U  15          2H5*        U  15  -0.669  23.674  -9.010
  157    H4*    U  15           H4*        U  15  -2.510  21.989  -9.732
  158    H3*    U  15           H3*        U  15  -2.016  22.917  -6.918
  159    H2*    U  15           H2*        U  15  -3.866  21.511  -6.212
  160   2HO*    U  15          2HO*        U  15  -5.232  21.688  -8.006
  161    H1*    U  15           H1*        U  15  -2.886  19.280  -7.474
  162    H3     U  15           H3         U  15  -1.582  18.937  -3.111
  163    H5     U  15           H5         U  15   1.455  21.102  -5.037
  164    H6     U  15           H6         U  15   0.023  21.246  -6.967
  165   1H5*    U  16          1H5*        U  16  -5.792  26.602  -6.408
  166   2H5*    U  16          2H5*        U  16  -5.469  25.784  -4.866
  167    H4*    U  16           H4*        U  16  -7.809  25.993  -5.042
  168    H3*    U  16           H3*        U  16  -6.934  23.612  -4.443
  169    H2*    U  16           H2*        U  16  -6.400  22.878  -6.704
  170   2HO*    U  16          2HO*        U  16  -8.357  21.673  -5.511
  171    H1*    U  16           H1*        U  16  -9.151  23.797  -7.665
  172    H3     U  16           H3         U  16  -7.598  22.329 -11.679
  173    H5     U  16           H5         U  16  -4.964  25.409 -10.569
  174    H6     U  16           H6         U  16  -6.067  25.459  -8.420
  175   1H5*    C  17          1H5*        C  17  -9.781  20.964  -4.588
  176   2H5*    C  17          2H5*        C  17 -10.211  20.573  -2.912
  177    H4*    C  17           H4*        C  17  -9.024  18.806  -4.407
  178    H3*    C  17           H3*        C  17  -9.169  18.853  -1.677
  179    H2*    C  17           H2*        C  17  -7.118  20.116  -1.350
  180   2HO*    C  17          2HO*        C  17  -6.272  17.396  -1.648
  181    H1*    C  17           H1*        C  17  -5.923  18.380  -3.603
  182   1H4     C  17          H41         C  17  -1.972  23.610  -3.516
  183   2H4     C  17          H42         C  17  -1.072  22.417  -2.590
  184    H5     C  17           H5         C  17  -4.244  23.301  -4.226
  185    H6     C  17           H6         C  17  -6.130  21.760  -4.246
  186   1H5*    G  18          1H5*        G  18 -10.899  17.925  -2.641
  187   2H5*    G  18          2H5*        G  18 -11.945  17.173  -1.422
  188    H4*    G  18           H4*        G  18 -13.388  16.574  -2.976
  189    H3*    G  18           H3*        G  18 -11.103  15.038  -4.122
  190    H2*    G  18           H2*        G  18 -11.908  15.222  -6.304
  191   2HO*    G  18          2HO*        G  18 -14.079  14.353  -4.993
  192    H1*    G  18           H1*        G  18 -13.983  17.274  -5.567
  193    H8     G  18           H8         G  18 -14.147  18.158  -7.966
  194    H1     G  18           H1         G  18  -7.772  18.917  -8.250
  195   1H2     G  18          H21         G  18  -7.738  17.265  -5.229
  196   2H2     G  18          H22         G  18  -6.823  18.041  -6.502
  197   1H5*    G  19          1H5*        G  19  -9.451  11.973  -3.224
  198   2H5*    G  19          2H5*        G  19 -10.096  13.598  -3.512
  199    H4*    G  19           H4*        G  19 -10.867  11.859  -5.647
  200    H3*    G  19           H3*        G  19  -8.060  11.461  -4.832
  201    H2*    G  19           H2*        G  19  -7.163  12.075  -6.961
  202   2HO*    G  19          2HO*        G  19  -9.863  12.024  -7.895
  203    H1*    G  19           H1*        G  19  -8.757  14.242  -7.507
  204    H8     G  19           H8         G  19  -8.376  14.341  -3.813
  205    H1     G  19           H1         G  19  -3.266  16.618  -6.934
  206   1H2     G  19          H21         G  19  -4.711  15.219  -9.732
  207   2H2     G  19          H22         G  19  -3.368  16.128  -9.060
  208   1H5*    C  20          1H5*        C  20  -8.768   9.039  -8.223
  209   2H5*    C  20          2H5*        C  20  -8.118   7.393  -8.085
  210    H4*    C  20           H4*        C  20  -7.298   8.477 -10.080
  211    H3*    C  20           H3*        C  20  -5.312   7.737  -7.974
  212    H2*    C  20           H2*        C  20  -3.530   8.789  -9.214
  213   2HO*    C  20          2HO*        C  20  -3.720   8.705 -11.329
  214    H1*    C  20           H1*        C  20  -4.887  11.116  -9.802
  215   1H4     C  20          H41         C  20  -3.705  11.745  -3.365
  216   2H4     C  20          H42         C  20  -2.303  12.425  -4.151
  217    H5     C  20           H5         C  20  -5.457  10.639  -4.540
  218    H6     C  20           H6         C  20  -6.298   9.984  -6.700
  219   1H5*    C  21          1H5*        C  21  -3.050   6.694 -11.065
  220   2H5*    C  21          2H5*        C  21  -2.983   4.921 -11.115
  221    H4*    C  21           H4*        C  21  -0.772   5.581 -11.341
  222    H3*    C  21           H3*        C  21  -1.351   4.696  -8.544
  223    H2*    C  21           H2*        C  21   0.866   5.307  -7.847
  224   2HO*    C  21          2HO*        C  21   2.479   5.395  -9.259
  225    H1*    C  21           H1*        C  21   0.943   7.756  -9.156
  226   1H4     C  21          H41         C  21  -3.015   8.882  -4.005
  227   2H4     C  21          H42         C  21  -1.389   8.914  -3.337
  228    H5     C  21           H5         C  21  -3.464   8.236  -6.307
  229    H6     C  21           H6         C  21  -2.440   7.476  -8.401
  230   1H5*    U  22          1H5*        U  22   2.092   3.444  -7.321
  231   2H5*    U  22          2H5*        U  22   1.648   1.785  -6.877
  232    H4*    U  22           H4*        U  22   2.184   3.505  -5.027
  233    H3*    U  22           H3*        U  22  -0.026   1.489  -4.986
  234    H2*    U  22           H2*        U  22  -0.875   2.401  -2.935
  235   2HO*    U  22          2HO*        U  22   0.746   4.436  -2.415
  236    H1*    U  22           H1*        U  22  -0.595   5.089  -3.629
  237    H3     U  22           H3         U  22  -5.057   4.227  -3.715
  238    H5     U  22           H5         U  22  -3.615   2.951  -7.448
  239    H6     U  22           H6         U  22  -1.382   3.295  -6.618
  240   1H5*    G  23          1H5*        G  23   3.788   1.624  -1.201
  241   2H5*    G  23          2H5*        G  23   3.019   0.296  -0.309
  242    H4*    G  23           H4*        G  23   3.827   2.597   0.816
  243    H3*    G  23           H3*        G  23   1.758   0.625   1.663
  244    H2*    G  23           H2*        G  23   0.859   2.139   3.298
  245   2HO*    G  23          2HO*        G  23   2.543   3.162   4.219
  246    H1*    G  23           H1*        G  23   0.835   4.400   1.703
  247    H8     G  23           H8         G  23   0.093   1.975  -0.874
  248    H1     G  23           H1         G  23  -4.841   2.670   3.163
  249   1H2     G  23          H21         G  23  -2.553   4.249   5.223
  250   2H2     G  23          H22         G  23  -4.201   3.711   4.983
  251   1H5*    C  24          1H5*        C  24   1.935  -2.659   3.805
  252   2H5*    C  24          2H5*        C  24   0.281  -2.044   3.627
  253    H4*    C  24           H4*        C  24   2.117  -1.948   5.980
  254    H3*    C  24           H3*        C  24  -0.686  -2.903   5.527
  255    H2*    C  24           H2*        C  24  -1.286  -2.235   7.764
  256   2HO*    C  24          2HO*        C  24   0.208  -2.052   9.283
  257    H1*    C  24           H1*        C  24  -0.127   0.272   7.631
  258   1H4     C  24          H41         C  24  -5.365   0.874   3.694
  259   2H4     C  24          H42         C  24  -6.032   0.942   5.317
  260    H5     C  24           H5         C  24  -3.044   0.357   3.252
  261    H6     C  24           H6         C  24  -0.896  -0.192   4.265
  262   1H5*    U  25          1H5*        U  25  -1.567  -4.503   8.155
  263   2H5*    U  25          2H5*        U  25  -1.469  -6.267   7.994
  264    H4*    U  25           H4*        U  25  -3.700  -5.644   8.588
  265    H3*    U  25           H3*        U  25  -3.369  -6.746   5.816
  266    H2*    U  25           H2*        U  25  -5.738  -6.456   5.450
  267   2HO*    U  25          2HO*        U  25  -6.991  -5.548   7.272
  268    H1*    U  25           H1*        U  25  -5.852  -3.877   6.429
  269    H3     U  25           H3         U  25  -5.923  -3.300   1.945
  270    H5     U  25           H5         U  25  -1.880  -3.982   2.855
  271    H6     U  25           H6         U  25  -2.555  -4.510   5.107
  272   1H5*    U  26          1H5*        U  26  -6.938  -8.707   7.684
  273   2H5*    U  26          2H5*        U  26  -6.789 -10.399   7.170
  274    H4*    U  26           H4*        U  26  -8.996  -9.461   6.691
  275    H3*    U  26           H3*        U  26  -7.337 -10.356   4.345
  276    H2*    U  26           H2*        U  26  -9.180  -9.761   2.908
  277   2HO*    U  26          2HO*        U  26 -10.858  -8.784   4.848
  278    H1*    U  26           H1*        U  26  -9.715  -7.325   4.187
  279    H3     U  26           H3         U  26  -7.896  -6.181   0.189
  280    H5     U  26           H5         U  26  -4.623  -7.194   2.616
  281    H6     U  26           H6         U  26  -6.188  -7.977   4.268
  282   1H5*    U  27          1H5*        U  27 -11.119 -11.410   4.059
  283   2H5*    U  27          2H5*        U  27 -11.459 -13.097   3.627
  284    H4*    U  27           H4*        U  27 -12.757 -11.628   2.247
  285    H3*    U  27           H3*        U  27 -10.603 -13.161   0.824
  286    H2*    U  27           H2*        U  27 -11.278 -12.110  -1.246
  287   2HO*    U  27          2HO*        U  27 -13.605 -12.126  -0.456
  288    H1*    U  27           H1*        U  27 -11.365  -9.539  -0.206
  289    H3     U  27           H3         U  27  -7.467  -9.676  -2.502
  290    H5     U  27           H5         U  27  -6.605 -11.535   1.157
  291    H6     U  27           H6         U  27  -8.957 -11.519   1.634
  292   1H5*    U  28          1H5*        U  28 -14.167 -14.360  -1.530
  293   2H5*    U  28          2H5*        U  28 -13.887 -16.076  -1.883
  294    H4*    U  28           H4*        U  28 -14.223 -14.749  -3.906
  295    H3*    U  28           H3*        U  28 -11.524 -16.055  -3.587
  296    H2*    U  28           H2*        U  28 -11.006 -15.238  -5.812
  297   2HO*    U  28          2HO*        U  28 -12.567 -14.645  -7.167
  298    H1*    U  28           H1*        U  28 -11.913 -12.656  -5.277
  299    H3     U  28           H3         U  28  -7.379 -12.385  -5.174
  300    H5     U  28           H5         U  28  -8.460 -13.868  -1.397
  301    H6     U  28           H6         U  28 -10.710 -14.106  -2.218
  302   1H5*    G  29          1H5*        G  29 -12.507 -18.899  -6.698
  303   2H5*    G  29          2H5*        G  29 -11.952 -20.444  -6.025
  304    H4*    G  29           H4*        G  29 -10.707 -19.746  -8.032
  305    H3*    G  29           H3*        G  29  -9.136 -20.054  -5.477
  306    H2*    G  29           H2*        G  29  -7.176 -19.426  -6.675
  307   2HO*    G  29          2HO*        G  29  -8.416 -20.797  -8.607
  308    H1*    G  29           H1*        G  29  -8.594 -17.715  -8.560
  309    H8     G  29           H8         G  29  -9.159 -16.654  -5.040
  310    H1     G  29           H1         G  29  -3.597 -14.584  -7.472
  311   1H2     G  29          H21         G  29  -4.237 -16.800 -10.050
  312   2H2     G  29          H22         G  29  -3.163 -15.600  -9.365
  313   1H5*    C  30          1H5*        C  30  -6.720 -21.570  -8.135
  314   2H5*    C  30          2H5*        C  30  -6.323 -23.247  -7.713
  315    H4*    C  30           H4*        C  30  -4.267 -22.203  -8.052
  316    H3*    C  30           H3*        C  30  -4.827 -22.426  -5.102
  317    H2*    C  30           H2*        C  30  -2.710 -21.370  -4.679
  318   2HO*    C  30          2HO*        C  30  -2.231 -21.657  -7.485
  319    H1*    C  30           H1*        C  30  -2.933 -19.492  -6.793
  320   1H4     C  30          H41         C  30  -6.192 -16.967  -1.634
  321   2H4     C  30          H42         C  30  -4.661 -16.113  -1.732
  322    H5     C  30           H5         C  30  -6.758 -18.817  -3.085
  323    H6     C  30           H6         C  30  -5.977 -20.227  -4.915
  324   1H5*    U  31          1H5*        U  31  -0.988 -23.290  -5.400
  325   2H5*    U  31          2H5*        U  31  -0.794 -25.038  -5.165
  326    H4*    U  31           H4*        U  31   0.983 -24.156  -3.993
  327    H3*    U  31           H3*        U  31  -1.255 -24.734  -2.080
  328    H2*    U  31           H2*        U  31   0.065 -23.841  -0.280
  329   2HO*    U  31          2HO*        U  31   2.234 -23.527  -0.474
  330    H1*    U  31           H1*        U  31   0.963 -21.595  -1.679
  331    H3     U  31           H3         U  31  -2.060 -19.821   1.165
  332    H5     U  31           H5         U  31  -4.389 -21.665  -1.805
  333    H6     U  31           H6         U  31  -2.363 -22.599  -2.708
  334    H3T    U  31           H3T        U  31   0.666 -26.067  -3.225
  Start of MODEL   10
    1   1H5*    A   1          1H5*        A   1  -2.254 -10.371   7.476
    2   2H5*    A   1          2H5*        A   1  -2.610 -12.104   7.368
    3    H4*    A   1           H4*        A   1   0.077 -10.853   7.918
    4    H3*    A   1           H3*        A   1  -1.104 -11.939   5.391
    5    H2*    A   1           H2*        A   1   0.977 -13.029   4.860
    6   2HO*    A   1          2HO*        A   1   2.746 -12.700   6.495
    7    H1*    A   1           H1*        A   1   1.408 -14.099   7.379
    8    H8     A   1           H8         A   1  -2.196 -14.394   7.364
    9   1H6     A   1          H61         A   1  -1.736 -19.155   3.433
   10   2H6     A   1          H62         A   1  -2.798 -18.291   4.522
   11    H2     A   1           H2         A   1   2.230 -17.066   3.559
   12    H5T    A   1           H5T        A   1  -2.346 -10.519   9.556
   13   1H5*    G   2          1H5*        G   2   2.317 -10.016   3.725
   14   2H5*    G   2          2H5*        G   2   1.741  -9.019   2.376
   15    H4*    G   2           H4*        G   2   3.507 -10.655   1.774
   16    H3*    G   2           H3*        G   2   0.865 -10.694   0.345
   17    H2*    G   2           H2*        G   2   1.643 -12.553  -0.980
   18   2HO*    G   2          2HO*        G   2   3.898 -13.271  -0.560
   19    H1*    G   2           H1*        G   2   2.778 -13.954   1.164
   20    H8     G   2           H8         G   2  -0.134 -12.733   2.882
   21    H1     G   2           H1         G   2  -1.707 -17.136  -1.508
   22   1H2     G   2          H21         G   2   1.471 -16.589  -2.766
   23   2H2     G   2          H22         G   2  -0.041 -17.457  -2.901
   24   1H5*    U   3          1H5*        U   3   3.672  -9.800  -3.128
   25   2H5*    U   3          2H5*        U   3   2.775  -8.546  -4.007
   26    H4*    U   3           H4*        U   3   3.353 -10.343  -5.492
   27    H3*    U   3           H3*        U   3   0.405 -10.115  -4.911
   28    H2*    U   3           H2*        U   3   0.070 -11.920  -6.498
   29   2HO*    U   3          2HO*        U   3   1.667 -11.369  -8.024
   30    H1*    U   3           H1*        U   3   2.076 -13.515  -5.411
   31    H3     U   3           H3         U   3  -1.798 -15.358  -3.933
   32    H5     U   3           H5         U   3  -1.123 -12.092  -1.380
   33    H6     U   3           H6         U   3   0.692 -11.439  -2.820
   34   1H5*    A   4          1H5*        A   4   0.495  -9.069  -9.312
   35   2H5*    A   4          2H5*        A   4  -0.857  -7.944  -9.539
   36    H4*    A   4           H4*        A   4  -0.952 -10.018 -10.919
   37    H3*    A   4           H3*        A   4  -3.257  -9.323  -9.113
   38    H2*    A   4           H2*        A   4  -4.390 -11.313  -9.934
   39   2HO*    A   4          2HO*        A   4  -3.225 -12.624 -11.520
   40    H1*    A   4           H1*        A   4  -2.197 -12.969  -9.552
   41    H8     A   4           H8         A   4  -1.618 -10.707  -6.788
   42   1H6     A   4          H61         A   4  -6.234 -13.345  -3.637
   43   2H6     A   4          H62         A   4  -4.840 -12.293  -3.536
   44    H2     A   4           H2         A   4  -6.552 -14.655  -7.919
   45   1H5*    G   5          1H5*        G   5  -5.629  -8.524 -12.726
   46   2H5*    G   5          2H5*        G   5  -6.464  -7.009 -12.335
   47    H4*    G   5           H4*        G   5  -7.967  -8.942 -12.683
   48    H3*    G   5           H3*        G   5  -8.053  -7.481 -10.055
   49    H2*    G   5           H2*        G   5  -9.823  -8.976  -9.360
   50   2HO*    G   5          2HO*        G   5  -9.999 -10.689 -11.380
   51    H1*    G   5           H1*        G   5  -8.543 -11.293 -10.237
   52    H8     G   5           H8         G   5  -5.668  -9.399  -9.067
   53    H1     G   5           H1         G   5  -9.361 -11.393  -4.212
   54   1H2     G   5          H21         G   5 -11.732 -11.984  -6.645
   55   2H2     G   5          H22         G   5 -11.313 -12.011  -4.946
   56   1H5*    A   6          1H5*        A   6 -11.729  -8.353 -10.773
   57   2H5*    A   6          2H5*        A   6 -12.772  -6.921 -10.863
   58    H4*    A   6           H4*        A   6 -13.626  -8.725  -9.396
   59    H3*    A   6           H3*        A   6 -13.940  -6.080  -8.933
   60    H2*    A   6           H2*        A   6 -12.058  -5.783  -7.449
   61   2HO*    A   6          2HO*        A   6 -13.759  -6.932  -5.518
   62    H1*    A   6           H1*        A   6 -12.721  -8.501  -6.177
   63    H8     A   6           H8         A   6  -9.515  -7.276  -7.896
   64   1H6     A   6          H61         A   6  -6.968  -7.370  -2.254
   65   2H6     A   6          H62         A   6  -6.677  -7.137  -3.968
   66    H2     A   6           H2         A   6 -11.333  -8.353  -1.833
   67   1H5*    A   7          1H5*        A   7 -15.740  -7.781  -5.042
   68   2H5*    A   7          2H5*        A   7 -17.243  -6.874  -4.783
   69    H4*    A   7           H4*        A   7 -16.163  -6.662  -2.762
   70    H3*    A   7           H3*        A   7 -15.530  -4.195  -4.366
   71    H2*    A   7           H2*        A   7 -14.039  -3.486  -2.674
   72   2HO*    A   7          2HO*        A   7 -15.959  -3.993  -1.142
   73    H1*    A   7           H1*        A   7 -13.634  -6.211  -1.598
   74    H8     A   7           H8         A   7 -12.265  -5.255  -5.030
   75   1H6     A   7          H61         A   7  -6.916  -4.234  -2.076
   76   2H6     A   7          H62         A   7  -7.688  -4.352  -3.643
   77    H2     A   7           H2         A   7 -10.091  -4.957   1.001
   78   1H5*    A   8          1H5*        A   8 -17.928  -0.849  -1.001
   79   2H5*    A   8          2H5*        A   8 -16.508  -0.087  -1.745
   80    H4*    A   8           H4*        A   8 -16.958  -0.971   1.000
   81    H3*    A   8           H3*        A   8 -15.100   0.995  -0.317
   82    H2*    A   8           H2*        A   8 -13.732   0.921   1.674
   83   2HO*    A   8          2HO*        A   8 -14.990   0.641   3.424
   84    H1*    A   8           H1*        A   8 -13.708  -1.852   1.800
   85    H8     A   8           H8         A   8 -13.835  -0.713  -1.811
   86   1H6     A   8          H61         A   8  -7.648  -0.612  -1.586
   87   2H6     A   8          H62         A   8  -9.048  -0.490  -2.628
   88    H2     A   8           H2         A   8  -9.182  -1.260   2.578
   89   1H5*    C   9          1H5*        C   9 -16.158   3.878   4.144
   90   2H5*    C   9          2H5*        C   9 -15.387   3.976   2.550
   91    H4*    C   9           H4*        C   9 -14.190   3.655   5.245
   92    H3*    C   9           H3*        C   9 -13.547   5.282   2.809
   93    H2*    C   9           H2*        C   9 -11.215   5.219   3.374
   94   2HO*    C   9          2HO*        C   9 -11.114   5.481   5.539
   95    H1*    C   9           H1*        C   9 -11.153   2.515   4.109
   96   1H4     C   9          H41         C   9 -11.082   2.498  -2.490
   97   2H4     C   9          H42         C   9  -9.419   2.270  -1.971
   98    H5     C   9           H5         C   9 -12.898   2.940  -0.936
   99    H6     C   9           H6         C   9 -13.477   3.233   1.413
  100   1H5*    A  10          1H5*        A  10 -10.891   9.000   4.915
  101   2H5*    A  10          2H5*        A  10 -10.861   8.960   3.141
  102    H4*    A  10           H4*        A  10  -9.056   7.615   5.111
  103    H3*    A  10           H3*        A  10  -8.640   9.533   2.854
  104    H2*    A  10           H2*        A  10  -6.593   8.445   2.241
  105   2HO*    A  10          2HO*        A  10  -5.939   8.139   4.492
  106    H1*    A  10           H1*        A  10  -7.504   5.824   2.533
  107    H8     A  10           H8         A  10 -10.495   7.220   1.070
  108   1H6     A  10          H61         A  10  -7.654   7.396  -4.427
  109   2H6     A  10          H62         A  10  -9.192   7.508  -3.603
  110    H2     A  10           H2         A  10  -4.539   6.720  -1.273
  111   1H5*    A  11          1H5*        A  11  -4.365  11.957   5.033
  112   2H5*    A  11          2H5*        A  11  -4.117  11.689   3.296
  113    H4*    A  11           H4*        A  11  -2.823  10.426   5.637
  114    H3*    A  11           H3*        A  11  -1.903  11.421   2.971
  115    H2*    A  11           H2*        A  11  -0.205   9.731   2.867
  116   2HO*    A  11          2HO*        A  11  -0.843   9.425   5.625
  117    H1*    A  11           H1*        A  11  -1.763   7.623   3.823
  118    H8     A  11           H8         A  11  -4.279   9.220   1.778
  119   1H6     A  11          H61         A  11  -1.469   7.024  -3.282
  120   2H6     A  11          H62         A  11  -2.926   7.761  -2.656
  121    H2     A  11           H2         A  11   1.337   6.551   0.183
  122   1H5*    G  12          1H5*        G  12   1.900  11.265   4.701
  123   2H5*    G  12          2H5*        G  12   2.507  12.929   4.602
  124    H4*    G  12           H4*        G  12   4.103  11.454   3.616
  125    H3*    G  12           H3*        G  12   2.720  13.334   1.753
  126    H2*    G  12           H2*        G  12   3.808  12.328  -0.148
  127   2HO*    G  12          2HO*        G  12   5.254  10.414   0.495
  128    H1*    G  12           H1*        G  12   3.311   9.719   0.544
  129    H8     G  12           H8         G  12   0.591  12.070   1.797
  130    H1     G  12           H1         G  12  -0.347   9.727  -4.099
  131   1H2     G  12          H21         G  12   2.865   8.478  -3.793
  132   2H2     G  12          H22         G  12   1.429   8.637  -4.780
  133   1H5*    G  13          1H5*        G  13   6.646  12.762   0.177
  134   2H5*    G  13          2H5*        G  13   7.307  14.402   0.039
  135    H4*    G  13           H4*        G  13   7.619  13.233  -2.028
  136    H3*    G  13           H3*        G  13   5.655  15.501  -2.121
  137    H2*    G  13           H2*        G  13   5.276  15.039  -4.459
  138   2HO*    G  13          2HO*        G  13   7.601  13.452  -4.116
  139    H1*    G  13           H1*        G  13   5.077  12.277  -4.164
  140    H8     G  13           H8         G  13   3.579  14.027  -1.179
  141    H1     G  13           H1         G  13  -0.417  13.304  -6.145
  142   1H2     G  13          H21         G  13   2.396  12.329  -7.893
  143   2H2     G  13          H22         G  13   0.671  12.621  -7.913
  144   1H5*    C  14          1H5*        C  14   7.694  16.780  -5.575
  145   2H5*    C  14          2H5*        C  14   8.426  18.302  -5.031
  146    H4*    C  14           H4*        C  14   7.341  18.929  -6.958
  147    H3*    C  14           H3*        C  14   5.477  19.522  -4.665
  148    H2*    C  14           H2*        C  14   3.917  20.401  -6.282
  149   2HO*    C  14          2HO*        C  14   6.148  20.169  -8.048
  150    H1*    C  14           H1*        C  14   4.297  18.306  -8.127
  151   1H4     C  14          H41         C  14   0.192  15.956  -3.533
  152   2H4     C  14          H42         C  14  -0.838  16.772  -4.698
  153    H5     C  14           H5         C  14   2.601  16.023  -3.646
  154    H6     C  14           H6         C  14   4.518  16.860  -4.894
  155   1H5*    U  15          1H5*        U  15   4.644  23.322  -6.163
  156   2H5*    U  15          2H5*        U  15   4.587  24.227  -4.638
  157    H4*    U  15           H4*        U  15   2.415  23.884  -5.961
  158    H3*    U  15           H3*        U  15   2.675  23.521  -2.993
  159    H2*    U  15           H2*        U  15   0.345  22.886  -2.905
  160   2HO*    U  15          2HO*        U  15   0.401  23.916  -5.531
  161    H1*    U  15           H1*        U  15   0.513  21.061  -4.961
  162    H3     U  15           H3         U  15   0.653  18.724  -1.027
  163    H5     U  15           H5         U  15   4.640  19.665  -1.954
  164    H6     U  15           H6         U  15   3.814  21.108  -3.694
  165   1H5*    U  16          1H5*        U  16   0.159  28.077  -1.577
  166   2H5*    U  16          2H5*        U  16  -0.298  26.779  -0.457
  167    H4*    U  16           H4*        U  16  -2.257  28.010  -0.985
  168    H3*    U  16           H3*        U  16  -2.420  25.407  -1.107
  169    H2*    U  16           H2*        U  16  -1.550  25.067  -3.339
  170   2HO*    U  16          2HO*        U  16  -4.339  25.560  -3.743
  171    H1*    U  16           H1*        U  16  -3.285  27.294  -4.478
  172    H3     U  16           H3         U  16  -0.932  26.044  -8.181
  173    H5     U  16           H5         U  16   1.876  27.828  -5.616
  174    H6     U  16           H6         U  16   0.181  27.847  -3.904
  175   1H5*    C  17          1H5*        C  17  -5.330  24.139  -2.968
  176   2H5*    C  17          2H5*        C  17  -6.553  23.561  -1.819
  177    H4*    C  17           H4*        C  17  -5.493  21.833  -3.328
  178    H3*    C  17           H3*        C  17  -6.451  21.373  -0.816
  179    H2*    C  17           H2*        C  17  -4.329  21.701   0.324
  180   2HO*    C  17          2HO*        C  17  -4.904  19.059  -0.344
  181    H1*    C  17           H1*        C  17  -3.066  20.135  -2.012
  182   1H4     C  17          H41         C  17   2.074  23.363   0.459
  183   2H4     C  17          H42         C  17   2.280  21.723   1.058
  184    H5     C  17           H5         C  17   0.081  24.130  -0.642
  185    H6     C  17           H6         C  17  -2.085  23.455  -1.532
  186   1H5*    G  18          1H5*        G  18  -7.791  21.654  -2.600
  187   2H5*    G  18          2H5*        G  18  -9.354  21.210  -1.890
  188    H4*    G  18           H4*        G  18 -10.372  21.712  -3.780
  189    H3*    G  18           H3*        G  18  -8.742  19.470  -4.852
  190    H2*    G  18           H2*        G  18  -8.560  20.385  -6.983
  191   2HO*    G  18          2HO*        G  18 -11.231  20.540  -6.503
  192    H1*    G  18           H1*        G  18  -9.763  23.029  -6.180
  193    H8     G  18           H8         G  18  -8.761  24.140  -8.278
  194    H1     G  18           H1         G  18  -2.897  22.097  -6.649
  195   1H2     G  18          H21         G  18  -4.532  20.255  -4.234
  196   2H2     G  18          H22         G  18  -3.012  20.700  -4.978
  197   1H5*    G  19          1H5*        G  19  -8.774  15.899  -5.571
  198   2H5*    G  19          2H5*        G  19  -8.255  17.563  -5.248
  199    H4*    G  19           H4*        G  19  -9.142  17.100  -7.991
  200    H3*    G  19           H3*        G  19  -7.128  15.236  -6.928
  201    H2*    G  19           H2*        G  19  -5.387  15.878  -8.413
  202   2HO*    G  19          2HO*        G  19  -5.848  17.022 -10.325
  203    H1*    G  19           H1*        G  19  -5.844  18.605  -8.554
  204    H8     G  19           H8         G  19  -6.409  17.109  -5.087
  205    H1     G  19           H1         G  19  -0.460  19.209  -6.219
  206   1H2     G  19          H21         G  19  -1.518  19.602  -9.473
  207   2H2     G  19          H22         G  19  -0.207  19.741  -8.315
  208   1H5*    C  20          1H5*        C  20  -7.511  13.862 -11.118
  209   2H5*    C  20          2H5*        C  20  -7.696  12.098 -11.055
  210    H4*    C  20           H4*        C  20  -5.835  12.802 -12.478
  211    H3*    C  20           H3*        C  20  -5.317  11.040 -10.122
  212    H2*    C  20           H2*        C  20  -2.940  11.139 -10.504
  213   2HO*    C  20          2HO*        C  20  -3.424  11.204 -12.934
  214    H1*    C  20           H1*        C  20  -2.792  13.866 -10.887
  215   1H4     C  20          H41         C  20  -3.972  13.412  -4.435
  216   2H4     C  20          H42         C  20  -2.236  13.254  -4.582
  217    H5     C  20           H5         C  20  -5.449  13.484  -6.317
  218    H6     C  20           H6         C  20  -5.595  13.477  -8.734
  219   1H5*    C  21          1H5*        C  21  -2.471   9.689 -12.268
  220   2H5*    C  21          2H5*        C  21  -2.882   8.045 -12.798
  221    H4*    C  21           H4*        C  21  -0.702   7.923 -11.944
  222    H3*    C  21           H3*        C  21  -2.720   6.792 -10.027
  223    H2*    C  21           H2*        C  21  -0.966   6.344  -8.459
  224   2HO*    C  21          2HO*        C  21   1.106   6.111  -9.091
  225    H1*    C  21           H1*        C  21   0.503   8.713  -8.968
  226   1H4     C  21          H41         C  21  -4.104  10.351  -4.545
  227   2H4     C  21          H42         C  21  -2.796   9.663  -3.597
  228    H5     C  21           H5         C  21  -4.115  10.341  -6.967
  229    H6     C  21           H6         C  21  -2.873   9.678  -8.965
  230   1H5*    U  22          1H5*        U  22  -0.498   4.255  -9.368
  231   2H5*    U  22          2H5*        U  22  -1.113   2.590  -9.347
  232    H4*    U  22           H4*        U  22  -0.405   3.680  -7.134
  233    H3*    U  22           H3*        U  22  -2.850   2.025  -7.578
  234    H2*    U  22           H2*        U  22  -3.664   2.509  -5.373
  235   2HO*    U  22          2HO*        U  22  -2.330   3.565  -3.852
  236    H1*    U  22           H1*        U  22  -3.103   5.226  -5.389
  237    H3     U  22           H3         U  22  -7.620   4.523  -5.928
  238    H5     U  22           H5         U  22  -5.974   4.797  -9.781
  239    H6     U  22           H6         U  22  -3.791   4.686  -8.773
  240   1H5*    G  23          1H5*        G  23   0.199   2.194  -4.301
  241   2H5*    G  23          2H5*        G  23   0.639   0.518  -3.918
  242    H4*    G  23           H4*        G  23   0.974   1.850  -1.976
  243    H3*    G  23           H3*        G  23  -1.275  -0.109  -1.828
  244    H2*    G  23           H2*        G  23  -1.931   0.719   0.337
  245   2HO*    G  23          2HO*        G  23  -0.299   2.771   0.745
  246    H1*    G  23           H1*        G  23  -1.854   3.395  -0.315
  247    H8     G  23           H8         G  23  -2.732   1.617  -3.476
  248    H1     G  23           H1         G  23  -7.712   2.379   0.493
  249   1H2     G  23          H21         G  23  -5.339   3.312   2.825
  250   2H2     G  23          H22         G  23  -7.030   3.044   2.460
  251   1H5*    C  24          1H5*        C  24  -1.389  -2.743   2.037
  252   2H5*    C  24          2H5*        C  24  -2.200  -1.286   1.431
  253    H4*    C  24           H4*        C  24  -0.362  -0.937   3.722
  254    H3*    C  24           H3*        C  24  -2.904  -2.522   4.013
  255    H2*    C  24           H2*        C  24  -3.336  -1.342   6.063
  256   2HO*    C  24          2HO*        C  24  -0.731  -1.298   6.234
  257    H1*    C  24           H1*        C  24  -2.527   1.178   5.083
  258   1H4     C  24          H41         C  24  -8.695   0.504   2.918
  259   2H4     C  24          H42         C  24  -8.868   1.016   4.588
  260    H5     C  24           H5         C  24  -6.559  -0.071   1.936
  261    H6     C  24           H6         C  24  -4.162  -0.266   2.348
  262   1H5*    U  25          1H5*        U  25  -3.058  -3.654   6.790
  263   2H5*    U  25          2H5*        U  25  -3.174  -5.420   6.926
  264    H4*    U  25           H4*        U  25  -5.297  -4.242   7.364
  265    H3*    U  25           H3*        U  25  -5.174  -6.264   5.144
  266    H2*    U  25           H2*        U  25  -7.519  -5.853   4.717
  267   2HO*    U  25          2HO*        U  25  -8.261  -3.941   6.277
  268    H1*    U  25           H1*        U  25  -7.304  -3.087   4.784
  269    H3     U  25           H3         U  25  -7.662  -4.106   0.380
  270    H5     U  25           H5         U  25  -3.607  -4.686   1.301
  271    H6     U  25           H6         U  25  -4.172  -4.397   3.623
  272   1H5*    U  26          1H5*        U  26  -8.746  -7.428   7.155
  273   2H5*    U  26          2H5*        U  26  -8.611  -9.184   7.367
  274    H4*    U  26           H4*        U  26 -10.675  -8.646   6.261
  275    H3*    U  26           H3*        U  26  -8.666 -10.079   4.533
  276    H2*    U  26           H2*        U  26 -10.300 -10.076   2.764
  277   2HO*    U  26          2HO*        U  26 -11.999  -9.770   4.921
  278    H1*    U  26           H1*        U  26 -11.154  -7.426   3.225
  279    H3     U  26           H3         U  26  -9.006  -7.454  -0.792
  280    H5     U  26           H5         U  26  -5.969  -7.158   2.092
  281    H6     U  26           H6         U  26  -7.634  -7.578   3.777
  282   1H5*    U  27          1H5*        U  27 -12.391 -12.388   4.331
  283   2H5*    U  27          2H5*        U  27 -11.941 -14.092   4.118
  284    H4*    U  27           H4*        U  27 -13.437 -13.186   2.355
  285    H3*    U  27           H3*        U  27 -10.784 -14.379   1.594
  286    H2*    U  27           H2*        U  27 -11.325 -13.950  -0.723
  287   2HO*    U  27          2HO*        U  27 -13.364 -13.409  -1.355
  288    H1*    U  27           H1*        U  27 -12.167 -11.335  -0.290
  289    H3     U  27           H3         U  27  -8.056 -10.952  -2.148
  290    H5     U  27           H5         U  27  -7.317 -11.780   1.901
  291    H6     U  27           H6         U  27  -9.666 -12.228   2.157
  292   1H5*    U  28          1H5*        U  28 -13.928 -16.909  -0.672
  293   2H5*    U  28          2H5*        U  28 -13.213 -18.531  -0.579
  294    H4*    U  28           H4*        U  28 -13.853 -17.877  -2.860
  295    H3*    U  28           H3*        U  28 -10.956 -18.491  -2.323
  296    H2*    U  28           H2*        U  28 -10.530 -18.128  -4.681
  297   2HO*    U  28          2HO*        U  28 -13.346 -17.697  -4.932
  298    H1*    U  28           H1*        U  28 -11.918 -15.727  -4.782
  299    H3     U  28           H3         U  28  -7.486 -14.657  -4.657
  300    H5     U  28           H5         U  28  -8.622 -15.183  -0.646
  301    H6     U  28           H6         U  28 -10.725 -16.045  -1.435
  302   1H5*    G  29          1H5*        G  29 -11.164 -22.051  -4.690
  303   2H5*    G  29          2H5*        G  29 -10.361 -23.268  -3.679
  304    H4*    G  29           H4*        G  29  -9.140 -22.759  -5.757
  305    H3*    G  29           H3*        G  29  -7.742 -22.216  -3.143
  306    H2*    G  29           H2*        G  29  -5.855 -21.431  -4.362
  307   2HO*    G  29          2HO*        G  29  -6.664 -23.364  -6.043
  308    H1*    G  29           H1*        G  29  -7.402 -20.444  -6.614
  309    H8     G  29           H8         G  29  -8.537 -18.879  -3.443
  310    H1     G  29           H1         G  29  -3.229 -16.200  -5.851
  311   1H2     G  29          H21         G  29  -3.140 -18.959  -7.936
  312   2H2     G  29          H22         G  29  -2.397 -17.452  -7.448
  313   1H5*    C  30          1H5*        C  30  -4.842 -24.430  -5.523
  314   2H5*    C  30          2H5*        C  30  -4.096 -25.553  -4.370
  315    H4*    C  30           H4*        C  30  -2.451 -24.168  -5.537
  316    H3*    C  30           H3*        C  30  -2.640 -23.912  -2.548
  317    H2*    C  30           H2*        C  30  -0.861 -22.293  -2.613
  318   2HO*    C  30          2HO*        C  30   0.591 -22.400  -4.167
  319    H1*    C  30           H1*        C  30  -1.836 -20.909  -4.852
  320   1H4     C  30          H41         C  30  -5.449 -18.824   0.260
  321   2H4     C  30          H42         C  30  -4.199 -17.617   0.018
  322    H5     C  30           H5         C  30  -5.539 -20.890  -0.987
  323    H6     C  30           H6         C  30  -4.461 -22.222  -2.722
  324   1H5*    U  31          1H5*        U  31   1.410 -24.172  -3.663
  325   2H5*    U  31          2H5*        U  31   2.224 -25.378  -2.648
  326    H4*    U  31           H4*        U  31   3.445 -23.257  -2.777
  327    H3*    U  31           H3*        U  31   2.478 -24.181  -0.086
  328    H2*    U  31           H2*        U  31   3.468 -22.227   0.904
  329   2HO*    U  31          2HO*        U  31   4.869 -20.907  -0.280
  330    H1*    U  31           H1*        U  31   2.605 -20.450  -1.095
  331    H3     U  31           H3         U  31   0.168 -19.423   2.598
  332    H5     U  31           H5         U  31  -1.774 -22.731   0.889
  333    H6     U  31           H6         U  31   0.092 -22.954  -0.614
  334    H3T    U  31           H3T        U  31   4.747 -24.456   0.103
  Start of MODEL   11
    1   1H5*    A   1          1H5*        A   1  -2.372 -11.006   7.739
    2   2H5*    A   1          2H5*        A   1  -2.735 -12.727   7.519
    3    H4*    A   1           H4*        A   1  -0.024 -11.472   7.918
    4    H3*    A   1           H3*        A   1  -1.383 -12.530   5.467
    5    H2*    A   1           H2*        A   1   0.679 -13.548   4.747
    6   2HO*    A   1          2HO*        A   1   2.477 -12.566   5.308
    7    H1*    A   1           H1*        A   1   1.326 -14.669   7.197
    8    H8     A   1           H8         A   1  -2.271 -15.034   7.431
    9   1H6     A   1          H61         A   1  -1.991 -19.713   3.384
   10   2H6     A   1          H62         A   1  -2.993 -18.890   4.560
   11    H2     A   1           H2         A   1   1.933 -17.548   3.282
   12    H5T    A   1           H5T        A   1  -1.233 -12.100   9.760
   13   1H5*    G   2          1H5*        G   2   1.822 -10.572   3.785
   14   2H5*    G   2          2H5*        G   2   1.369  -9.659   2.332
   15    H4*    G   2           H4*        G   2   3.071 -11.431   1.959
   16    H3*    G   2           H3*        G   2   0.500 -11.488   0.392
   17    H2*    G   2           H2*        G   2   1.323 -13.447  -0.755
   18   2HO*    G   2          2HO*        G   2   3.434 -13.338  -1.105
   19    H1*    G   2           H1*        G   2   2.324 -14.685   1.566
   20    H8     G   2           H8         G   2  -0.732 -13.385   2.948
   21    H1     G   2           H1         G   2  -1.893 -18.141  -1.196
   22   1H2     G   2          H21         G   2   1.367 -17.629  -2.241
   23   2H2     G   2          H22         G   2  -0.118 -18.534  -2.428
   24   1H5*    U   3          1H5*        U   3   3.482 -10.895  -2.993
   25   2H5*    U   3          2H5*        U   3   2.665  -9.668  -3.980
   26    H4*    U   3           H4*        U   3   3.231 -11.547  -5.351
   27    H3*    U   3           H3*        U   3   0.272 -11.258  -4.853
   28    H2*    U   3           H2*        U   3  -0.039 -13.140  -6.359
   29   2HO*    U   3          2HO*        U   3   2.198 -14.080  -7.030
   30    H1*    U   3           H1*        U   3   1.896 -14.700  -5.118
   31    H3     U   3           H3         U   3  -2.061 -16.359  -3.637
   32    H5     U   3           H5         U   3  -1.371 -12.962  -1.268
   33    H6     U   3           H6         U   3   0.498 -12.443  -2.692
   34   1H5*    A   4          1H5*        A   4   0.397 -10.356  -9.336
   35   2H5*    A   4          2H5*        A   4  -0.976  -9.255  -9.564
   36    H4*    A   4           H4*        A   4  -1.069 -11.355 -10.900
   37    H3*    A   4           H3*        A   4  -3.342 -10.663  -9.055
   38    H2*    A   4           H2*        A   4  -4.463 -12.687  -9.816
   39   2HO*    A   4          2HO*        A   4  -2.417 -12.565 -11.751
   40    H1*    A   4           H1*        A   4  -2.267 -14.300  -9.373
   41    H8     A   4           H8         A   4  -1.672 -11.818  -6.772
   42   1H6     A   4          H61         A   4  -6.137 -14.399  -3.360
   43   2H6     A   4          H62         A   4  -4.779 -13.296  -3.358
   44    H2     A   4           H2         A   4  -6.481 -15.999  -7.542
   45   1H5*    G   5          1H5*        G   5  -5.860 -10.027 -12.575
   46   2H5*    G   5          2H5*        G   5  -6.707  -8.513 -12.204
   47    H4*    G   5           H4*        G   5  -8.178 -10.498 -12.411
   48    H3*    G   5           H3*        G   5  -8.200  -8.913  -9.852
   49    H2*    G   5           H2*        G   5  -9.925 -10.400  -9.037
   50   2HO*    G   5          2HO*        G   5 -11.046 -11.704 -10.381
   51    H1*    G   5           H1*        G   5  -8.629 -12.734  -9.852
   52    H8     G   5           H8         G   5  -5.733 -10.815  -8.842
   53    H1     G   5           H1         G   5  -9.335 -12.485  -3.802
   54   1H2     G   5          H21         G   5 -11.776 -13.163  -6.144
   55   2H2     G   5          H22         G   5 -11.318 -13.102  -4.456
   56   1H5*    A   6          1H5*        A   6 -11.914  -9.854 -10.414
   57   2H5*    A   6          2H5*        A   6 -12.943  -8.417 -10.570
   58    H4*    A   6           H4*        A   6 -13.798 -10.125  -8.995
   59    H3*    A   6           H3*        A   6 -14.078  -7.456  -8.678
   60    H2*    A   6           H2*        A   6 -12.189  -7.081  -7.227
   61   2HO*    A   6          2HO*        A   6 -14.439  -6.966  -6.068
   62    H1*    A   6           H1*        A   6 -12.813  -9.722  -5.792
   63    H8     A   6           H8         A   6  -9.675  -8.605  -7.698
   64   1H6     A   6          H61         A   6  -6.920  -8.370  -2.161
   65   2H6     A   6          H62         A   6  -6.691  -8.236  -3.895
   66    H2     A   6           H2         A   6 -11.259  -9.326  -1.518
   67   1H5*    A   7          1H5*        A   7 -16.092  -8.858  -4.664
   68   2H5*    A   7          2H5*        A   7 -17.505  -7.794  -4.533
   69    H4*    A   7           H4*        A   7 -16.402  -7.578  -2.494
   70    H3*    A   7           H3*        A   7 -15.735  -5.217  -4.237
   71    H2*    A   7           H2*        A   7 -14.219  -4.443  -2.597
   72   2HO*    A   7          2HO*        A   7 -16.212  -5.307  -1.014
   73    H1*    A   7           H1*        A   7 -13.837  -7.108  -1.382
   74    H8     A   7           H8         A   7 -12.520  -6.368  -4.887
   75   1H6     A   7          H61         A   7  -7.107  -5.236  -2.101
   76   2H6     A   7          H62         A   7  -7.914  -5.434  -3.642
   77    H2     A   7           H2         A   7 -10.227  -5.764   1.075
   78   1H5*    A   8          1H5*        A   8 -18.264  -2.177  -0.666
   79   2H5*    A   8          2H5*        A   8 -17.153  -1.021  -1.427
   80    H4*    A   8           H4*        A   8 -17.152  -1.999   1.232
   81    H3*    A   8           H3*        A   8 -15.409  -0.052  -0.257
   82    H2*    A   8           H2*        A   8 -13.825  -0.161   1.556
   83   2HO*    A   8          2HO*        A   8 -14.533  -0.585   3.516
   84    H1*    A   8           H1*        A   8 -13.944  -2.945   1.842
   85    H8     A   8           H8         A   8 -14.130  -2.239  -1.816
   86   1H6     A   8          H61         A   8  -7.950  -1.861  -1.768
   87   2H6     A   8          H62         A   8  -9.374  -1.953  -2.779
   88    H2     A   8           H2         A   8  -9.373  -1.936   2.485
   89   1H5*    C   9          1H5*        C   9 -15.846   2.140   4.146
   90   2H5*    C   9          2H5*        C   9 -15.819   3.726   3.351
   91    H4*    C   9           H4*        C   9 -14.098   3.257   5.177
   92    H3*    C   9           H3*        C   9 -13.479   4.515   2.531
   93    H2*    C   9           H2*        C   9 -11.134   4.543   3.069
   94   2HO*    C   9          2HO*        C   9 -12.146   4.462   5.605
   95    H1*    C   9           H1*        C   9 -11.023   1.955   4.088
   96   1H4     C   9          H41         C   9 -11.400   1.122  -2.445
   97   2H4     C   9          H42         C   9  -9.689   1.075  -2.043
   98    H5     C   9           H5         C   9 -13.127   1.643  -0.814
   99    H6     C   9           H6         C   9 -13.551   2.204   1.519
  100   1H5*    A  10          1H5*        A  10 -11.191   6.207   5.384
  101   2H5*    A  10          2H5*        A  10 -10.860   7.932   5.133
  102    H4*    A  10           H4*        A  10  -8.908   6.237   5.140
  103    H3*    A  10           H3*        A  10  -9.228   8.529   3.230
  104    H2*    A  10           H2*        A  10  -7.255   7.827   2.058
  105   2HO*    A  10          2HO*        A  10  -6.856   6.347   4.437
  106    H1*    A  10           H1*        A  10  -7.811   5.072   2.150
  107    H8     A  10           H8         A  10 -11.112   6.300   1.339
  108   1H6     A  10          H61         A  10  -9.207   7.383  -4.454
  109   2H6     A  10          H62         A  10 -10.600   7.240  -3.404
  110    H2     A  10           H2         A  10  -5.586   6.688  -1.904
  111   1H5*    A  11          1H5*        A  11  -4.998  11.597   5.379
  112   2H5*    A  11          2H5*        A  11  -5.031  11.219   3.646
  113    H4*    A  11           H4*        A  11  -3.146  10.333   5.770
  114    H3*    A  11           H3*        A  11  -2.870  11.579   3.087
  115    H2*    A  11           H2*        A  11  -0.998  10.209   2.490
  116   2HO*    A  11          2HO*        A  11  -0.636  10.218   5.144
  117    H1*    A  11           H1*        A  11  -1.961   7.798   3.441
  118    H8     A  11           H8         A  11  -5.143   9.113   2.328
  119   1H6     A  11          H61         A  11  -3.464   8.036  -3.534
  120   2H6     A  11          H62         A  11  -4.798   8.428  -2.473
  121    H2     A  11           H2         A  11   0.190   7.710  -0.960
  122   1H5*    G  12          1H5*        G  12   1.183  11.849   4.713
  123   2H5*    G  12          2H5*        G  12   1.703  13.517   4.403
  124    H4*    G  12           H4*        G  12   3.257  11.777   3.560
  125    H3*    G  12           H3*        G  12   2.149  13.879   1.746
  126    H2*    G  12           H2*        G  12   3.224  12.857  -0.156
  127   2HO*    G  12          2HO*        G  12   4.376  10.708   0.597
  128    H1*    G  12           H1*        G  12   2.427  10.281   0.392
  129    H8     G  12           H8         G  12  -0.109  12.827   1.630
  130    H1     G  12           H1         G  12  -0.935  10.917  -4.435
  131   1H2     G  12          H21         G  12   2.124   9.345  -4.045
  132   2H2     G  12          H22         G  12   0.769   9.698  -5.093
  133   1H5*    G  13          1H5*        G  13   5.764  12.973   0.256
  134   2H5*    G  13          2H5*        G  13   6.769  14.436   0.225
  135    H4*    G  13           H4*        G  13   6.914  13.453  -1.912
  136    H3*    G  13           H3*        G  13   5.195  15.916  -1.894
  137    H2*    G  13           H2*        G  13   4.822  15.622  -4.261
  138   2HO*    G  13          2HO*        G  13   6.962  14.926  -4.786
  139    H1*    G  13           H1*        G  13   4.318  12.886  -4.106
  140    H8     G  13           H8         G  13   2.964  14.653  -1.061
  141    H1     G  13           H1         G  13  -0.988  14.603  -6.119
  142   1H2     G  13          H21         G  13   1.739  13.407  -7.865
  143   2H2     G  13          H22         G  13   0.057  13.890  -7.900
  144   1H5*    C  14          1H5*        C  14   7.621  17.146  -5.252
  145   2H5*    C  14          2H5*        C  14   8.405  18.588  -4.578
  146    H4*    C  14           H4*        C  14   7.527  19.326  -6.588
  147    H3*    C  14           H3*        C  14   5.596  20.077  -4.396
  148    H2*    C  14           H2*        C  14   4.250  21.147  -6.092
  149   2HO*    C  14          2HO*        C  14   6.582  21.452  -7.286
  150    H1*    C  14           H1*        C  14   4.493  19.034  -7.931
  151   1H4     C  14          H41         C  14  -0.053  17.156  -3.537
  152   2H4     C  14          H42         C  14  -0.925  18.121  -4.718
  153    H5     C  14           H5         C  14   2.343  16.887  -3.585
  154    H6     C  14           H6         C  14   4.398  17.506  -4.742
  155   1H5*    U  15          1H5*        U  15   5.425  24.009  -6.217
  156   2H5*    U  15          2H5*        U  15   5.632  24.977  -4.745
  157    H4*    U  15           H4*        U  15   3.512  25.393  -5.954
  158    H3*    U  15           H3*        U  15   3.463  24.539  -3.079
  159    H2*    U  15           H2*        U  15   1.055  24.584  -3.124
  160   2HO*    U  15          2HO*        U  15   0.425  25.115  -5.614
  161    H1*    U  15           H1*        U  15   0.798  23.193  -5.497
  162    H3     U  15           H3         U  15  -0.129  20.163  -2.235
  163    H5     U  15           H5         U  15   4.060  20.238  -2.494
  164    H6     U  15           H6         U  15   3.860  22.126  -3.973
  165   1H5*    U  16          1H5*        U  16   1.583  29.400  -1.536
  166   2H5*    U  16          2H5*        U  16   0.916  28.193  -0.419
  167    H4*    U  16           H4*        U  16  -0.874  29.570  -1.096
  168    H3*    U  16           H3*        U  16  -1.276  26.990  -1.274
  169    H2*    U  16           H2*        U  16  -0.296  26.611  -3.455
  170   2HO*    U  16          2HO*        U  16  -2.252  25.749  -3.878
  171    H1*    U  16           H1*        U  16  -1.761  29.020  -4.617
  172    H3     U  16           H3         U  16   0.550  27.697  -8.305
  173    H5     U  16           H5         U  16   3.478  28.941  -5.560
  174    H6     U  16           H6         U  16   1.739  29.099  -3.899
  175   1H5*    C  17          1H5*        C  17  -4.520  26.027  -3.199
  176   2H5*    C  17          2H5*        C  17  -5.668  25.543  -1.936
  177    H4*    C  17           H4*        C  17  -4.777  23.773  -3.591
  178    H3*    C  17           H3*        C  17  -5.839  23.329  -1.118
  179    H2*    C  17           H2*        C  17  -3.719  23.441   0.073
  180   2HO*    C  17          2HO*        C  17  -4.652  20.940  -0.527
  181    H1*    C  17           H1*        C  17  -2.560  21.811  -2.275
  182   1H4     C  17          H41         C  17   2.820  24.452   0.362
  183   2H4     C  17          H42         C  17   2.825  22.805   0.979
  184    H5     C  17           H5         C  17   0.956  25.420  -0.808
  185    H6     C  17           H6         C  17  -1.245  24.980  -1.752
  186   1H5*    G  18          1H5*        G  18  -7.215  23.867  -2.781
  187   2H5*    G  18          2H5*        G  18  -8.819  23.389  -2.192
  188    H4*    G  18           H4*        G  18  -9.682  24.262  -4.026
  189    H3*    G  18           H3*        G  18  -8.384  21.873  -5.230
  190    H2*    G  18           H2*        G  18  -8.057  22.871  -7.300
  191   2HO*    G  18          2HO*        G  18  -9.753  24.039  -8.237
  192    H1*    G  18           H1*        G  18  -8.883  25.609  -6.346
  193    H8     G  18           H8         G  18  -7.729  26.687  -8.382
  194    H1     G  18           H1         G  18  -2.199  23.797  -6.871
  195   1H2     G  18          H21         G  18  -4.083  22.042  -4.573
  196   2H2     G  18          H22         G  18  -2.513  22.328  -5.289
  197   1H5*    G  19          1H5*        G  19  -9.012  18.319  -6.057
  198   2H5*    G  19          2H5*        G  19  -8.205  19.830  -5.606
  199    H4*    G  19           H4*        G  19  -9.032  19.641  -8.414
  200    H3*    G  19           H3*        G  19  -7.345  17.488  -7.325
  201    H2*    G  19           H2*        G  19  -5.463  17.929  -8.708
  202   2HO*    G  19          2HO*        G  19  -6.770  19.872 -10.250
  203    H1*    G  19           H1*        G  19  -5.548  20.701  -8.768
  204    H8     G  19           H8         G  19  -6.467  19.238  -5.373
  205    H1     G  19           H1         G  19  -0.226  20.416  -6.222
  206   1H2     G  19          H21         G  19  -1.063  20.988  -9.513
  207   2H2     G  19          H22         G  19   0.198  20.906  -8.294
  208   1H5*    C  20          1H5*        C  20  -7.744  16.122 -11.597
  209   2H5*    C  20          2H5*        C  20  -8.050  14.379 -11.467
  210    H4*    C  20           H4*        C  20  -6.064  14.967 -12.822
  211    H3*    C  20           H3*        C  20  -5.849  13.128 -10.475
  212    H2*    C  20           H2*        C  20  -3.456  13.001 -10.745
  213   2HO*    C  20          2HO*        C  20  -2.454  13.963 -12.560
  214    H1*    C  20           H1*        C  20  -3.036  15.708 -11.038
  215   1H4     C  20          H41         C  20  -4.610  15.255  -4.675
  216   2H4     C  20          H42         C  20  -2.898  14.906  -4.725
  217    H5     C  20           H5         C  20  -5.961  15.516  -6.629
  218    H6     C  20           H6         C  20  -5.976  15.564  -9.049
  219   1H5*    C  21          1H5*        C  21  -3.036  11.555 -12.537
  220   2H5*    C  21          2H5*        C  21  -3.577   9.970 -13.124
  221    H4*    C  21           H4*        C  21  -1.450   9.625 -12.207
  222    H3*    C  21           H3*        C  21  -3.620   8.639 -10.378
  223    H2*    C  21           H2*        C  21  -1.955   7.980  -8.784
  224   2HO*    C  21          2HO*        C  21   0.201   8.725 -10.404
  225    H1*    C  21           H1*        C  21  -0.286  10.232  -9.155
  226   1H4     C  21          H41         C  21  -4.936  12.163  -4.901
  227   2H4     C  21          H42         C  21  -3.751  11.321  -3.916
  228    H5     C  21           H5         C  21  -4.821  12.229  -7.318
  229    H6     C  21           H6         C  21  -3.553  11.496  -9.275
  230   1H5*    U  22          1H5*        U  22  -1.041   5.959  -9.971
  231   2H5*    U  22          2H5*        U  22  -1.655   4.296  -9.885
  232    H4*    U  22           H4*        U  22  -0.539   5.447  -7.812
  233    H3*    U  22           H3*        U  22  -2.809   3.508  -7.852
  234    H2*    U  22           H2*        U  22  -3.218   3.840  -5.507
  235   2HO*    U  22          2HO*        U  22  -0.607   4.508  -5.547
  236    H1*    U  22           H1*        U  22  -3.053   6.601  -5.531
  237    H3     U  22           H3         U  22  -7.439   5.133  -5.332
  238    H5     U  22           H5         U  22  -6.581   5.971  -9.357
  239    H6     U  22           H6         U  22  -4.261   6.157  -8.744
  240   1H5*    G  23          1H5*        G  23   0.939   2.424  -4.464
  241   2H5*    G  23          2H5*        G  23   0.278   0.821  -4.081
  242    H4*    G  23           H4*        G  23   0.776   2.756  -2.259
  243    H3*    G  23           H3*        G  23  -1.092   0.415  -2.161
  244    H2*    G  23           H2*        G  23  -2.051   1.256  -0.119
  245   2HO*    G  23          2HO*        G  23   0.365   2.581  -0.039
  246    H1*    G  23           H1*        G  23  -2.261   3.903  -0.956
  247    H8     G  23           H8         G  23  -2.971   2.044  -4.045
  248    H1     G  23           H1         G  23  -7.854   1.860   0.110
  249   1H2     G  23          H21         G  23  -5.558   3.069   2.399
  250   2H2     G  23          H22         G  23  -7.201   2.553   2.089
  251   1H5*    C  24          1H5*        C  24  -0.016  -2.749   1.445
  252   2H5*    C  24          2H5*        C  24  -1.667  -2.288   0.985
  253    H4*    C  24           H4*        C  24  -0.126  -1.561   3.460
  254    H3*    C  24           H3*        C  24  -2.622  -3.151   2.971
  255    H2*    C  24           H2*        C  24  -3.566  -2.291   5.009
  256   2HO*    C  24          2HO*        C  24  -2.215  -1.894   6.598
  257    H1*    C  24           H1*        C  24  -2.733   0.354   4.626
  258   1H4     C  24          H41         C  24  -7.976  -0.253   0.699
  259   2H4     C  24          H42         C  24  -8.639   0.078   2.290
  260    H5     C  24           H5         C  24  -5.622  -0.653   0.317
  261    H6     C  24           H6         C  24  -3.429  -0.810   1.372
  262   1H5*    U  25          1H5*        U  25  -2.834  -4.268   6.318
  263   2H5*    U  25          2H5*        U  25  -3.032  -6.026   6.465
  264    H4*    U  25           H4*        U  25  -5.013  -4.704   7.154
  265    H3*    U  25           H3*        U  25  -5.247  -6.806   5.027
  266    H2*    U  25           H2*        U  25  -7.595  -6.266   4.781
  267   2HO*    U  25          2HO*        U  25  -7.427  -5.565   7.275
  268    H1*    U  25           H1*        U  25  -7.215  -3.542   4.603
  269    H3     U  25           H3         U  25  -7.780  -5.069   0.339
  270    H5     U  25           H5         U  25  -3.664  -5.347   1.115
  271    H6     U  25           H6         U  25  -4.144  -4.856   3.423
  272   1H5*    U  26          1H5*        U  26  -8.425  -8.397   7.484
  273   2H5*    U  26          2H5*        U  26  -8.154 -10.150   7.435
  274    H4*    U  26           H4*        U  26 -10.338  -9.437   6.516
  275    H3*    U  26           H3*        U  26  -8.439 -10.948   4.731
  276    H2*    U  26           H2*        U  26 -10.106 -10.865   3.000
  277   2HO*    U  26          2HO*        U  26 -11.815 -11.162   4.779
  278    H1*    U  26           H1*        U  26 -10.868  -8.191   3.510
  279    H3     U  26           H3         U  26  -8.822  -8.592  -0.597
  280    H5     U  26           H5         U  26  -5.794  -7.731   2.182
  281    H6     U  26           H6         U  26  -7.401  -8.106   3.934
  282   1H5*    U  27          1H5*        U  27 -12.170 -13.343   4.602
  283   2H5*    U  27          2H5*        U  27 -11.633 -15.027   4.450
  284    H4*    U  27           H4*        U  27 -13.157 -14.256   2.647
  285    H3*    U  27           H3*        U  27 -10.452 -15.369   1.972
  286    H2*    U  27           H2*        U  27 -10.925 -15.008  -0.372
  287   2HO*    U  27          2HO*        U  27 -13.201 -15.561  -0.197
  288    H1*    U  27           H1*        U  27 -11.825 -12.409  -0.050
  289    H3     U  27           H3         U  27  -7.590 -12.025  -1.633
  290    H5     U  27           H5         U  27  -7.139 -12.650   2.493
  291    H6     U  27           H6         U  27  -9.490 -13.153   2.594
  292   1H5*    U  28          1H5*        U  28 -13.691 -17.926  -0.286
  293   2H5*    U  28          2H5*        U  28 -12.968 -19.543  -0.180
  294    H4*    U  28           H4*        U  28 -13.732 -18.971  -2.442
  295    H3*    U  28           H3*        U  28 -10.819 -19.577  -2.028
  296    H2*    U  28           H2*        U  28 -10.460 -19.229  -4.397
  297   2HO*    U  28          2HO*        U  28 -13.304 -19.213  -4.426
  298    H1*    U  28           H1*        U  28 -11.830 -16.827  -4.491
  299    H3     U  28           H3         U  28  -7.418 -15.722  -4.395
  300    H5     U  28           H5         U  28  -8.495 -16.302  -0.377
  301    H6     U  28           H6         U  28 -10.605 -17.165  -1.148
  302   1H5*    G  29          1H5*        G  29 -11.058 -23.095  -4.408
  303   2H5*    G  29          2H5*        G  29 -10.308 -24.341  -3.393
  304    H4*    G  29           H4*        G  29  -9.033 -23.905  -5.433
  305    H3*    G  29           H3*        G  29  -7.663 -23.295  -2.820
  306    H2*    G  29           H2*        G  29  -5.745 -22.579  -4.038
  307   2HO*    G  29          2HO*        G  29  -5.195 -23.611  -5.824
  308    H1*    G  29           H1*        G  29  -7.234 -21.608  -6.323
  309    H8     G  29           H8         G  29  -8.449 -19.986  -3.213
  310    H1     G  29           H1         G  29  -3.045 -17.390  -5.491
  311   1H2     G  29          H21         G  29  -2.915 -20.177  -7.535
  312   2H2     G  29          H22         G  29  -2.175 -18.671  -7.042
  313   1H5*    C  30          1H5*        C  30  -4.751 -25.619  -5.085
  314   2H5*    C  30          2H5*        C  30  -4.042 -26.717  -3.885
  315    H4*    C  30           H4*        C  30  -2.359 -25.390  -5.071
  316    H3*    C  30           H3*        C  30  -2.583 -25.064  -2.092
  317    H2*    C  30           H2*        C  30  -0.792 -23.456  -2.164
  318   2HO*    C  30          2HO*        C  30  -0.528 -24.293  -4.886
  319    H1*    C  30           H1*        C  30  -1.730 -22.099  -4.429
  320   1H4     C  30          H41         C  30  -5.461 -19.968   0.577
  321   2H4     C  30          H42         C  30  -4.202 -18.766   0.355
  322    H5     C  30           H5         C  30  -5.524 -22.046  -0.654
  323    H6     C  30           H6         C  30  -4.406 -23.392  -2.353
  324   1H5*    U  31          1H5*        U  31   1.750 -25.635  -2.969
  325   2H5*    U  31          2H5*        U  31   2.285 -26.731  -1.680
  326    H4*    U  31           H4*        U  31   3.650 -24.678  -1.900
  327    H3*    U  31           H3*        U  31   2.287 -25.268   0.716
  328    H2*    U  31           H2*        U  31   3.266 -23.271   1.625
  329   2HO*    U  31          2HO*        U  31   5.099 -22.509   0.835
  330    H1*    U  31           H1*        U  31   2.789 -21.687  -0.654
  331    H3     U  31           H3         U  31  -0.043 -20.031   2.466
  332    H5     U  31           H5         U  31  -1.895 -23.547   1.110
  333    H6     U  31           H6         U  31   0.116 -24.044  -0.114
  334    H3T    U  31           H3T        U  31   3.867 -26.594   0.445
  Start of MODEL   12
    1   1H5*    A   1          1H5*        A   1   0.507 -12.569   8.669
    2   2H5*    A   1          2H5*        A   1  -0.077 -14.236   8.522
    3    H4*    A   1           H4*        A   1   2.648 -13.295   7.644
    4    H3*    A   1           H3*        A   1   0.105 -13.468   6.046
    5    H2*    A   1           H2*        A   1   1.408 -14.283   4.181
    6   2HO*    A   1          2HO*        A   1   3.626 -13.611   5.852
    7    H1*    A   1           H1*        A   1   2.856 -16.125   5.684
    8    H8     A   1           H8         A   1  -0.575 -16.013   7.164
    9   1H6     A   1          H61         A   1  -2.298 -20.017   2.764
   10   2H6     A   1          H62         A   1  -2.773 -19.231   4.253
   11    H2     A   1           H2         A   1   1.804 -18.517   1.753
   12    H5T    A   1           H5T        A   1   1.801 -14.855   9.765
   13   1H5*    G   2          1H5*        G   2   3.017 -11.389   3.883
   14   2H5*    G   2          2H5*        G   2   2.392 -10.092   2.847
   15    H4*    G   2           H4*        G   2   3.752 -11.814   1.671
   16    H3*    G   2           H3*        G   2   0.924 -11.318   0.748
   17    H2*    G   2           H2*        G   2   1.302 -12.926  -0.989
   18   2HO*    G   2          2HO*        G   2   3.316 -12.373  -1.725
   19    H1*    G   2           H1*        G   2   2.866 -14.676   0.641
   20    H8     G   2           H8         G   2  -0.070 -13.945   2.681
   21    H1     G   2           H1         G   2  -1.440 -17.901  -2.175
   22   1H2     G   2          H21         G   2   1.633 -16.946  -3.443
   23   2H2     G   2          H22         G   2   0.189 -17.912  -3.640
   24   1H5*    U   3          1H5*        U   3   3.614  -9.969  -2.802
   25   2H5*    U   3          2H5*        U   3   2.621  -8.728  -3.590
   26    H4*    U   3           H4*        U   3   3.366 -10.469  -5.139
   27    H3*    U   3           H3*        U   3   0.394 -10.198  -4.723
   28    H2*    U   3           H2*        U   3   0.111 -11.914  -6.406
   29   2HO*    U   3          2HO*        U   3   1.736 -12.501  -7.735
   30    H1*    U   3           H1*        U   3   2.058 -13.595  -5.328
   31    H3     U   3           H3         U   3  -1.825 -15.593  -4.152
   32    H5     U   3           H5         U   3  -1.431 -12.401  -1.452
   33    H6     U   3           H6         U   3   0.452 -11.642  -2.743
   34   1H5*    A   4          1H5*        A   4   0.885  -9.124  -9.199
   35   2H5*    A   4          2H5*        A   4  -0.230  -7.750  -9.327
   36    H4*    A   4           H4*        A   4  -0.629  -9.412 -11.057
   37    H3*    A   4           H3*        A   4  -2.839  -8.894  -9.099
   38    H2*    A   4           H2*        A   4  -4.196 -10.557 -10.239
   39   2HO*    A   4          2HO*        A   4  -2.001 -11.004 -12.001
   40    H1*    A   4           H1*        A   4  -2.257 -12.499 -10.185
   41    H8     A   4           H8         A   4  -1.309 -10.541  -7.239
   42   1H6     A   4          H61         A   4  -5.847 -13.245  -4.036
   43   2H6     A   4          H62         A   4  -4.403 -12.262  -3.938
   44    H2     A   4           H2         A   4  -6.480 -14.166  -8.387
   45   1H5*    G   5          1H5*        G   5  -5.259  -7.339 -12.311
   46   2H5*    G   5          2H5*        G   5  -5.959  -5.858 -11.630
   47    H4*    G   5           H4*        G   5  -7.603  -7.642 -12.153
   48    H3*    G   5           H3*        G   5  -7.439  -6.559  -9.351
   49    H2*    G   5           H2*        G   5  -9.249  -8.041  -8.743
   50   2HO*    G   5          2HO*        G   5  -9.427  -9.177 -11.291
   51    H1*    G   5           H1*        G   5  -8.186 -10.276 -10.034
   52    H8     G   5           H8         G   5  -5.119  -8.789  -8.796
   53    H1     G   5           H1         G   5  -8.695 -11.180  -4.034
   54   1H2     G   5          H21         G   5 -11.236 -11.239  -6.364
   55   2H2     G   5          H22         G   5 -10.725 -11.548  -4.719
   56   1H5*    A   6          1H5*        A   6 -11.158  -7.249  -9.866
   57   2H5*    A   6          2H5*        A   6 -12.164  -5.805  -9.652
   58    H4*    A   6           H4*        A   6 -12.909  -7.786  -8.360
   59    H3*    A   6           H3*        A   6 -13.126  -5.226  -7.529
   60    H2*    A   6           H2*        A   6 -11.062  -5.158  -6.259
   61   2HO*    A   6          2HO*        A   6 -12.822  -6.402  -4.392
   62    H1*    A   6           H1*        A   6 -11.758  -7.986  -5.258
   63    H8     A   6           H8         A   6  -8.595  -6.697  -7.012
   64   1H6     A   6          H61         A   6  -5.729  -7.713  -1.616
   65   2H6     A   6          H62         A   6  -5.525  -7.258  -3.298
   66    H2     A   6           H2         A   6 -10.121  -8.452  -1.027
   67   1H5*    A   7          1H5*        A   7 -14.324  -7.410  -3.718
   68   2H5*    A   7          2H5*        A   7 -15.841  -6.668  -3.173
   69    H4*    A   7           H4*        A   7 -14.546  -6.617  -1.273
   70    H3*    A   7           H3*        A   7 -14.438  -3.955  -2.619
   71    H2*    A   7           H2*        A   7 -12.551  -3.284  -1.397
   72   2HO*    A   7          2HO*        A   7 -14.149  -3.928   0.523
   73    H1*    A   7           H1*        A   7 -12.005  -6.034  -0.340
   74    H8     A   7           H8         A   7 -10.893  -4.936  -3.824
   75   1H6     A   7          H61         A   7  -5.329  -4.058  -1.257
   76   2H6     A   7          H62         A   7  -6.219  -4.099  -2.766
   77    H2     A   7           H2         A   7  -8.243  -4.935   2.021
   78   1H5*    A   8          1H5*        A   8 -16.094  -0.615   1.034
   79   2H5*    A   8          2H5*        A   8 -14.538  -0.438   0.200
   80    H4*    A   8           H4*        A   8 -15.111  -1.014   3.075
   81    H3*    A   8           H3*        A   8 -13.531   1.063   1.611
   82    H2*    A   8           H2*        A   8 -11.865   1.074   3.336
   83   2HO*    A   8          2HO*        A   8 -12.987   0.959   5.219
   84    H1*    A   8           H1*        A   8 -11.739  -1.684   3.697
   85    H8     A   8           H8         A   8 -12.200  -0.567   0.062
   86   1H6     A   8          H61         A   8  -6.017  -0.810  -0.286
   87   2H6     A   8          H62         A   8  -7.492  -0.588  -1.200
   88    H2     A   8           H2         A   8  -7.199  -1.466   3.986
   89   1H5*    C   9          1H5*        C   9 -14.177   2.980   6.707
   90   2H5*    C   9          2H5*        C   9 -13.396   4.340   5.877
   91    H4*    C   9           H4*        C   9 -12.331   2.757   7.902
   92    H3*    C   9           H3*        C   9 -11.182   4.884   6.140
   93    H2*    C   9           H2*        C   9  -8.947   4.219   6.725
   94   2HO*    C   9          2HO*        C   9  -9.907   2.214   8.466
   95    H1*    C   9           H1*        C   9  -9.349   1.481   6.486
   96   1H4     C   9          H41         C   9  -9.125   3.668   0.260
   97   2H4     C   9          H42         C   9  -7.516   3.068   0.638
   98    H5     C   9           H5         C   9 -10.906   3.784   1.910
   99    H6     C   9           H6         C   9 -11.491   3.350   4.234
  100   1H5*    A  10          1H5*        A  10  -8.338   7.856   9.194
  101   2H5*    A  10          2H5*        A  10  -8.654   8.149   7.473
  102    H4*    A  10           H4*        A  10  -6.393   6.807   8.805
  103    H3*    A  10           H3*        A  10  -6.725   8.642   6.486
  104    H2*    A  10           H2*        A  10  -4.973   7.585   5.243
  105   2HO*    A  10          2HO*        A  10  -4.215   5.645   6.976
  106    H1*    A  10           H1*        A  10  -5.642   4.956   5.798
  107    H8     A  10           H8         A  10  -9.017   6.231   5.581
  108   1H6     A  10          H61         A  10  -8.441   6.548  -0.574
  109   2H6     A  10          H62         A  10  -9.562   6.592   0.768
  110    H2     A  10           H2         A  10  -4.350   5.985   1.179
  111   1H5*    A  11          1H5*        A  11  -2.236  11.699   7.919
  112   2H5*    A  11          2H5*        A  11  -2.625  11.620   6.190
  113    H4*    A  11           H4*        A  11  -0.272  10.695   7.645
  114    H3*    A  11           H3*        A  11  -0.831  11.749   4.941
  115    H2*    A  11           H2*        A  11   0.689  10.284   3.826
  116   2HO*    A  11          2HO*        A  11   2.253   9.133   4.963
  117    H1*    A  11           H1*        A  11   0.096   7.950   5.156
  118    H8     A  11           H8         A  11  -3.245   9.345   5.271
  119   1H6     A  11          H61         A  11  -3.945   7.974  -0.726
  120   2H6     A  11          H62         A  11  -4.769   8.453   0.740
  121    H2     A  11           H2         A  11   0.407   7.610   0.285
  122   1H5*    G  12          1H5*        G  12   3.299  11.283   4.770
  123   2H5*    G  12          2H5*        G  12   3.953  12.923   4.599
  124    H4*    G  12           H4*        G  12   4.994  11.557   2.974
  125    H3*    G  12           H3*        G  12   3.080  13.575   1.903
  126    H2*    G  12           H2*        G  12   3.266  12.694  -0.323
  127   2HO*    G  12          2HO*        G  12   5.668  11.946   0.571
  128    H1*    G  12           H1*        G  12   3.048  10.041   0.319
  129    H8     G  12           H8         G  12   1.068  12.339   2.648
  130    H1     G  12           H1         G  12  -2.131  10.196  -2.482
  131   1H2     G  12          H21         G  12   0.928   8.916  -3.478
  132   2H2     G  12          H22         G  12  -0.774   9.115  -3.829
  133   1H5*    G  13          1H5*        G  13   6.163  12.926  -0.973
  134   2H5*    G  13          2H5*        G  13   6.925  14.512  -1.203
  135    H4*    G  13           H4*        G  13   6.587  13.583  -3.343
  136    H3*    G  13           H3*        G  13   4.746  15.849  -2.697
  137    H2*    G  13           H2*        G  13   3.587  15.549  -4.780
  138   2HO*    G  13          2HO*        G  13   5.402  15.122  -6.098
  139    H1*    G  13           H1*        G  13   3.391  12.797  -4.656
  140    H8     G  13           H8         G  13   3.175  14.457  -1.246
  141    H1     G  13           H1         G  13  -2.432  13.757  -4.282
  142   1H2     G  13          H21         G  13  -0.508  12.800  -6.996
  143   2H2     G  13          H22         G  13  -2.108  13.095  -6.354
  144   1H5*    C  14          1H5*        C  14   6.707  16.385  -6.684
  145   2H5*    C  14          2H5*        C  14   6.779  18.111  -7.091
  146    H4*    C  14           H4*        C  14   5.656  16.681  -8.791
  147    H3*    C  14           H3*        C  14   4.206  19.019  -7.583
  148    H2*    C  14           H2*        C  14   2.292  18.490  -8.956
  149   2HO*    C  14          2HO*        C  14   2.426  16.759 -10.475
  150    H1*    C  14           H1*        C  14   2.248  15.815  -8.289
  151   1H4     C  14          H41         C  14   0.381  19.091  -2.874
  152   2H4     C  14          H42         C  14  -1.073  18.942  -3.848
  153    H5     C  14           H5         C  14   2.559  18.392  -3.656
  154    H6     C  14           H6         C  14   3.784  17.400  -5.520
  155   1H5*    U  15          1H5*        U  15   2.460  19.444 -10.959
  156   2H5*    U  15          2H5*        U  15   2.403  21.180 -11.317
  157    H4*    U  15           H4*        U  15   0.205  19.985 -10.831
  158    H3*    U  15           H3*        U  15   1.006  22.590  -9.591
  159    H2*    U  15           H2*        U  15  -1.068  22.615  -8.345
  160   2HO*    U  15          2HO*        U  15  -2.301  20.439  -8.710
  161    H1*    U  15           H1*        U  15  -0.802  20.044  -7.402
  162    H3     U  15           H3         U  15   0.597  23.031  -4.172
  163    H5     U  15           H5         U  15   4.010  21.788  -6.279
  164    H6     U  15           H6         U  15   2.552  20.791  -7.902
  165   1H5*    U  16          1H5*        U  16  -2.130  24.888 -13.247
  166   2H5*    U  16          2H5*        U  16  -1.905  26.294 -12.190
  167    H4*    U  16           H4*        U  16  -4.165  26.297 -12.422
  168    H3*    U  16           H3*        U  16  -3.456  25.666  -9.884
  169    H2*    U  16           H2*        U  16  -3.692  23.262 -10.134
  170   2HO*    U  16          2HO*        U  16  -5.152  23.272  -8.585
  171    H1*    U  16           H1*        U  16  -6.224  23.891 -11.788
  172    H3     U  16           H3         U  16  -7.138  19.478 -11.863
  173    H5     U  16           H5         U  16  -3.189  19.712 -13.270
  174    H6     U  16           H6         U  16  -3.219  22.060 -12.747
  175   1H5*    C  17          1H5*        C  17  -6.424  24.478  -8.097
  176   2H5*    C  17          2H5*        C  17  -7.301  25.887  -7.467
  177    H4*    C  17           H4*        C  17  -6.973  24.129  -5.784
  178    H3*    C  17           H3*        C  17  -6.987  26.631  -5.104
  179    H2*    C  17           H2*        C  17  -4.665  27.143  -5.707
  180   2HO*    C  17          2HO*        C  17  -5.242  26.850  -3.072
  181    H1*    C  17           H1*        C  17  -3.764  24.646  -4.198
  182   1H4     C  17          H41         C  17   0.797  25.763  -8.828
  183   2H4     C  17          H42         C  17   1.504  26.366  -7.339
  184    H5     C  17           H5         C  17  -1.492  24.989  -8.974
  185    H6     C  17           H6         C  17  -3.560  24.631  -7.727
  186   1H5*    G  18          1H5*        G  18  -8.948  25.308  -5.397
  187   2H5*    G  18          2H5*        G  18 -10.488  25.574  -4.559
  188    H4*    G  18           H4*        G  18 -11.282  23.593  -5.160
  189    H3*    G  18           H3*        G  18  -8.650  22.333  -4.391
  190    H2*    G  18           H2*        G  18  -9.423  20.374  -5.595
  191   2HO*    G  18          2HO*        G  18 -11.784  21.915  -6.089
  192    H1*    G  18           H1*        G  18  -9.953  21.844  -7.871
  193    H8     G  18           H8         G  18  -7.955  21.728  -9.299
  194    H1     G  18           H1         G  18  -3.969  21.762  -4.283
  195   1H2     G  18          H21         G  18  -6.832  22.256  -2.381
  196   2H2     G  18          H22         G  18  -5.094  22.062  -2.408
  197   1H5*    G  19          1H5*        G  19 -10.410  17.534  -2.510
  198   2H5*    G  19          2H5*        G  19  -8.851  18.332  -2.247
  199    H4*    G  19           H4*        G  19 -10.455  18.679  -4.760
  200    H3*    G  19           H3*        G  19  -8.602  16.415  -4.149
  201    H2*    G  19           H2*        G  19  -7.515  16.690  -6.287
  202   2HO*    G  19          2HO*        G  19  -8.610  18.712  -7.463
  203    H1*    G  19           H1*        G  19  -7.339  19.479  -6.172
  204    H8     G  19           H8         G  19  -6.845  18.833  -2.681
  205    H1     G  19           H1         G  19  -1.733  16.961  -6.068
  206   1H2     G  19          H21         G  19  -3.809  17.189  -8.794
  207   2H2     G  19          H22         G  19  -2.221  16.768  -8.177
  208   1H5*    C  20          1H5*        C  20 -10.178  15.082  -7.764
  209   2H5*    C  20          2H5*        C  20 -10.551  13.349  -7.685
  210    H4*    C  20           H4*        C  20  -8.915  13.756  -9.392
  211    H3*    C  20           H3*        C  20  -8.045  12.158  -7.025
  212    H2*    C  20           H2*        C  20  -5.776  12.111  -7.805
  213   2HO*    C  20          2HO*        C  20  -5.676  13.461 -10.006
  214    H1*    C  20           H1*        C  20  -5.609  14.763  -8.566
  215   1H4     C  20          H41         C  20  -5.298  14.990  -1.992
  216   2H4     C  20          H42         C  20  -3.652  15.166  -2.561
  217    H5     C  20           H5         C  20  -7.152  14.558  -3.434
  218    H6     C  20           H6         C  20  -7.864  14.232  -5.722
  219   1H5*    C  21          1H5*        C  21  -5.747  10.905 -10.092
  220   2H5*    C  21          2H5*        C  21  -6.117   9.195 -10.387
  221    H4*    C  21           H4*        C  21  -3.780   9.355 -10.342
  222    H3*    C  21           H3*        C  21  -4.897   8.132  -7.847
  223    H2*    C  21           H2*        C  21  -2.689   7.994  -6.904
  224   2HO*    C  21          2HO*        C  21  -1.308   9.157  -8.972
  225    H1*    C  21           H1*        C  21  -1.867  10.543  -7.668
  226   1H4     C  21          H41         C  21  -5.966  11.430  -2.551
  227   2H4     C  21          H42         C  21  -4.339  11.500  -1.894
  228    H5     C  21           H5         C  21  -6.430  10.899  -4.870
  229    H6     C  21           H6         C  21  -5.417  10.346  -7.031
  230   1H5*    U  22          1H5*        U  22  -1.401   6.261  -7.743
  231   2H5*    U  22          2H5*        U  22  -1.797   4.531  -7.764
  232    H4*    U  22           H4*        U  22  -0.460   5.460  -5.787
  233    H3*    U  22           H3*        U  22  -2.774   3.573  -5.579
  234    H2*    U  22           H2*        U  22  -2.715   3.700  -3.185
  235   2HO*    U  22          2HO*        U  22  -0.488   5.421  -3.184
  236    H1*    U  22           H1*        U  22  -2.336   6.458  -3.011
  237    H3     U  22           H3         U  22  -6.632   5.738  -1.717
  238    H5     U  22           H5         U  22  -6.743   5.766  -5.915
  239    H6     U  22           H6         U  22  -4.337   5.785  -5.904
  240   1H5*    G  23          1H5*        G  23   1.451   2.925  -3.113
  241   2H5*    G  23          2H5*        G  23   1.432   1.151  -3.084
  242    H4*    G  23           H4*        G  23   2.126   2.267  -0.954
  243    H3*    G  23           H3*        G  23  -0.066   0.226  -1.034
  244    H2*    G  23           H2*        G  23  -0.440   0.532   1.336
  245   2HO*    G  23          2HO*        G  23   1.698   2.421   1.318
  246    H1*    G  23           H1*        G  23  -0.525   3.287   1.238
  247    H8     G  23           H8         G  23  -1.741   1.974  -2.067
  248    H1     G  23           H1         G  23  -6.216   2.024   2.525
  249   1H2     G  23          H21         G  23  -3.592   2.714   4.669
  250   2H2     G  23          H22         G  23  -5.308   2.441   4.480
  251   1H5*    C  24          1H5*        C  24   0.238  -3.508   1.567
  252   2H5*    C  24          2H5*        C  24  -1.287  -2.649   1.860
  253    H4*    C  24           H4*        C  24   1.394  -2.026   3.098
  254    H3*    C  24           H3*        C  24  -1.010  -3.449   4.209
  255    H2*    C  24           H2*        C  24  -0.584  -2.401   6.334
  256   2HO*    C  24          2HO*        C  24   1.474  -2.113   6.787
  257    H1*    C  24           H1*        C  24  -0.044   0.136   5.262
  258   1H4     C  24          H41         C  24  -6.605  -0.195   5.195
  259   2H4     C  24          H42         C  24  -6.209   0.044   6.887
  260    H5     C  24           H5         C  24  -4.921  -0.614   3.503
  261    H6     C  24           H6         C  24  -2.532  -0.886   3.092
  262   1H5*    U  25          1H5*        U  25  -1.170  -4.419   7.407
  263   2H5*    U  25          2H5*        U  25  -1.121  -6.189   7.316
  264    H4*    U  25           H4*        U  25  -3.319  -5.346   7.970
  265    H3*    U  25           H3*        U  25  -3.114  -6.901   5.407
  266    H2*    U  25           H2*        U  25  -5.493  -6.623   5.103
  267   2HO*    U  25          2HO*        U  25  -6.790  -6.145   6.757
  268    H1*    U  25           H1*        U  25  -5.527  -3.921   5.710
  269    H3     U  25           H3         U  25  -5.870  -3.679   1.234
  270    H5     U  25           H5         U  25  -1.919  -4.947   1.850
  271    H6     U  25           H6         U  25  -2.425  -5.140   4.195
  272   1H5*    U  26          1H5*        U  26  -6.442  -8.906   7.720
  273   2H5*    U  26          2H5*        U  26  -6.173 -10.625   7.374
  274    H4*    U  26           H4*        U  26  -8.464  -9.919   6.891
  275    H3*    U  26           H3*        U  26  -6.811 -10.912   4.580
  276    H2*    U  26           H2*        U  26  -8.739 -10.614   3.164
  277   2HO*    U  26          2HO*        U  26 -10.508  -9.565   4.904
  278    H1*    U  26           H1*        U  26  -9.437  -8.111   4.220
  279    H3     U  26           H3         U  26  -7.832  -7.386   0.014
  280    H5     U  26           H5         U  26  -4.443  -7.604   2.484
  281    H6     U  26           H6         U  26  -5.884  -8.336   4.266
  282   1H5*    U  27          1H5*        U  27 -10.487 -13.253   4.746
  283   2H5*    U  27          2H5*        U  27 -10.178 -14.895   4.150
  284    H4*    U  27           H4*        U  27 -11.997 -13.687   2.968
  285    H3*    U  27           H3*        U  27  -9.655 -14.774   1.434
  286    H2*    U  27           H2*        U  27 -10.640 -13.918  -0.603
  287   2HO*    U  27          2HO*        U  27 -12.714 -13.120  -0.642
  288    H1*    U  27           H1*        U  27 -11.144 -11.396   0.412
  289    H3     U  27           H3         U  27  -7.383 -11.048  -2.115
  290    H5     U  27           H5         U  27  -6.055 -12.346   1.654
  291    H6     U  27           H6         U  27  -8.361 -12.679   2.260
  292   1H5*    U  28          1H5*        U  28 -13.273 -16.604  -0.704
  293   2H5*    U  28          2H5*        U  28 -12.744 -18.293  -0.833
  294    H4*    U  28           H4*        U  28 -13.557 -17.433  -2.958
  295    H3*    U  28           H3*        U  28 -10.656 -18.215  -2.835
  296    H2*    U  28           H2*        U  28 -10.481 -17.649  -5.186
  297   2HO*    U  28          2HO*        U  28 -12.675 -18.385  -5.688
  298    H1*    U  28           H1*        U  28 -11.685 -15.178  -4.899
  299    H3     U  28           H3         U  28  -7.170 -14.477  -5.078
  300    H5     U  28           H5         U  28  -8.040 -15.238  -1.038
  301    H6     U  28           H6         U  28 -10.262 -15.868  -1.714
  302   1H5*    G  29          1H5*        G  29 -11.391 -21.554  -5.470
  303   2H5*    G  29          2H5*        G  29 -10.541 -22.894  -4.677
  304    H4*    G  29           H4*        G  29  -9.589 -22.271  -6.866
  305    H3*    G  29           H3*        G  29  -7.807 -22.065  -4.445
  306    H2*    G  29           H2*        G  29  -6.050 -21.300  -5.859
  307   2HO*    G  29          2HO*        G  29  -7.132 -23.049  -7.517
  308    H1*    G  29           H1*        G  29  -7.801 -19.987  -7.757
  309    H8     G  29           H8         G  29  -8.411 -18.673  -4.349
  310    H1     G  29           H1         G  29  -3.192 -16.176  -7.117
  311   1H2     G  29          H21         G  29  -3.579 -18.699  -9.452
  312   2H2     G  29          H22         G  29  -2.659 -17.312  -8.911
  313   1H5*    C  30          1H5*        C  30  -5.261 -23.768  -7.321
  314   2H5*    C  30          2H5*        C  30  -4.652 -25.241  -6.543
  315    H4*    C  30           H4*        C  30  -2.795 -23.983  -7.333
  316    H3*    C  30           H3*        C  30  -3.077 -24.038  -4.347
  317    H2*    C  30           H2*        C  30  -1.168 -22.602  -4.133
  318   2HO*    C  30          2HO*        C  30  -0.801 -22.958  -6.946
  319    H1*    C  30           H1*        C  30  -1.815 -20.903  -6.279
  320   1H4     C  30          H41         C  30  -5.476 -18.865  -1.178
  321   2H4     C  30          H42         C  30  -4.145 -17.730  -1.329
  322    H5     C  30           H5         C  30  -5.669 -20.850  -2.542
  323    H6     C  30           H6         C  30  -4.635 -22.152  -4.324
  324   1H5*    U  31          1H5*        U  31   0.653 -24.309  -5.257
  325   2H5*    U  31          2H5*        U  31   1.583 -25.651  -4.560
  326    H4*    U  31           H4*        U  31   2.789 -23.653  -4.158
  327    H3*    U  31           H3*        U  31   1.473 -24.721  -1.671
  328    H2*    U  31           H2*        U  31   2.444 -22.904  -0.443
  329   2HO*    U  31          2HO*        U  31   4.347 -23.143  -2.265
  330    H1*    U  31           H1*        U  31   1.997 -20.966  -2.464
  331    H3     U  31           H3         U  31  -0.794 -19.486   0.724
  332    H5     U  31           H5         U  31  -2.575 -23.062  -0.572
  333    H6     U  31           H6         U  31  -0.626 -23.451  -1.931
  334    H3T    U  31           H3T        U  31   3.130 -25.873  -1.715
  Start of MODEL   13
    1   1H5*    A   1          1H5*        A   1   1.186  -7.139   6.046
    2   2H5*    A   1          2H5*        A   1   0.710  -8.820   6.345
    3    H4*    A   1           H4*        A   1   3.502  -7.816   5.808
    4    H3*    A   1           H3*        A   1   1.510  -9.150   4.000
    5    H2*    A   1           H2*        A   1   3.315 -10.411   3.004
    6   2HO*    A   1          2HO*        A   1   4.755  -8.358   3.572
    7    H1*    A   1           H1*        A   1   4.473 -11.150   5.417
    8    H8     A   1           H8         A   1   0.909 -11.134   6.304
    9   1H6     A   1          H61         A   1   0.347 -16.629   3.507
   10   2H6     A   1          H62         A   1  -0.426 -15.472   4.567
   11    H2     A   1           H2         A   1   4.325 -14.892   2.376
   12    H5T    A   1           H5T        A   1   2.432  -7.200   7.927
   13   1H5*    G   2          1H5*        G   2   4.553  -8.726   1.733
   14   2H5*    G   2          2H5*        G   2   4.189  -7.921   0.195
   15    H4*    G   2           H4*        G   2   5.259 -10.042  -0.204
   16    H3*    G   2           H3*        G   2   2.357  -9.964  -1.038
   17    H2*    G   2           H2*        G   2   2.689 -12.180  -1.929
   18   2HO*    G   2          2HO*        G   2   5.014 -11.394  -2.537
   19    H1*    G   2           H1*        G   2   4.284 -13.043   0.265
   20    H8     G   2           H8         G   2   1.561 -11.383   1.980
   21    H1     G   2           H1         G   2  -0.342 -16.888  -0.707
   22   1H2     G   2          H21         G   2   2.625 -16.704  -2.476
   23   2H2     G   2          H22         G   2   1.150 -17.588  -2.156
   24   1H5*    U   3          1H5*        U   3   4.280 -10.380  -5.126
   25   2H5*    U   3          2H5*        U   3   3.315  -9.249  -6.094
   26    H4*    U   3           H4*        U   3   3.284 -11.386  -7.149
   27    H3*    U   3           H3*        U   3   0.646 -10.649  -5.893
   28    H2*    U   3           H2*        U   3  -0.239 -12.718  -6.799
   29   2HO*    U   3          2HO*        U   3   1.461 -14.078  -7.931
   30    H1*    U   3           H1*        U   3   1.878 -14.262  -5.879
   31    H3     U   3           H3         U   3  -1.502 -15.108  -2.975
   32    H5     U   3           H5         U   3   0.084 -11.428  -1.720
   33    H6     U   3           H6         U   3   1.443 -11.423  -3.706
   34   1H5*    A   4          1H5*        A   4  -0.293 -10.984 -10.255
   35   2H5*    A   4          2H5*        A   4  -1.677  -9.921 -10.577
   36    H4*    A   4           H4*        A   4  -2.005 -12.334 -11.151
   37    H3*    A   4           H3*        A   4  -3.946 -11.042  -9.231
   38    H2*    A   4           H2*        A   4  -5.177 -13.141  -9.318
   39   2HO*    A   4          2HO*        A   4  -3.304 -13.726 -11.391
   40    H1*    A   4           H1*        A   4  -2.864 -14.683  -8.949
   41    H8     A   4           H8         A   4  -2.048 -11.884  -6.810
   42   1H6     A   4          H61         A   4  -6.087 -13.901  -2.588
   43   2H6     A   4          H62         A   4  -4.743 -12.822  -2.889
   44    H2     A   4           H2         A   4  -6.894 -16.075  -6.429
   45   1H5*    G   5          1H5*        G   5  -6.929 -11.113 -12.445
   46   2H5*    G   5          2H5*        G   5  -7.728  -9.537 -12.294
   47    H4*    G   5           H4*        G   5  -9.221 -11.454 -11.888
   48    H3*    G   5           H3*        G   5  -8.846  -9.468  -9.652
   49    H2*    G   5           H2*        G   5 -10.479 -10.737  -8.393
   50   2HO*    G   5          2HO*        G   5 -10.854 -12.753 -10.214
   51    H1*    G   5           H1*        G   5  -9.349 -13.224  -9.008
   52    H8     G   5           H8         G   5  -6.381 -11.112  -8.603
   53    H1     G   5           H1         G   5  -9.287 -12.375  -3.022
   54   1H2     G   5          H21         G   5 -11.921 -13.440  -4.972
   55   2H2     G   5          H22         G   5 -11.277 -13.190  -3.364
   56   1H5*    A   6          1H5*        A   6 -12.541 -10.388  -9.713
   57   2H5*    A   6          2H5*        A   6 -13.673  -9.028  -9.828
   58    H4*    A   6           H4*        A   6 -14.172 -10.639  -8.011
   59    H3*    A   6           H3*        A   6 -14.593  -7.969  -7.870
   60    H2*    A   6           H2*        A   6 -12.519  -7.398  -6.757
   61   2HO*    A   6          2HO*        A   6 -13.487  -8.128  -4.328
   62    H1*    A   6           H1*        A   6 -12.873  -9.930  -5.044
   63    H8     A   6           H8         A   6  -9.971  -8.796  -7.290
   64   1H6     A   6          H61         A   6  -6.739  -8.115  -2.052
   65   2H6     A   6          H62         A   6  -6.684  -8.075  -3.803
   66    H2     A   6           H2         A   6 -10.966  -9.205  -0.956
   67   1H5*    A   7          1H5*        A   7 -15.884  -9.286  -3.517
   68   2H5*    A   7          2H5*        A   7 -17.285  -8.256  -3.166
   69    H4*    A   7           H4*        A   7 -15.799  -8.028  -1.353
   70    H3*    A   7           H3*        A   7 -15.709  -5.602  -3.136
   71    H2*    A   7           H2*        A   7 -13.964  -4.715  -1.812
   72   2HO*    A   7          2HO*        A   7 -15.547  -5.525   0.104
   73    H1*    A   7           H1*        A   7 -13.165  -7.365  -0.742
   74    H8     A   7           H8         A   7 -12.483  -6.525  -4.390
   75   1H6     A   7          H61         A   7  -6.817  -4.907  -2.430
   76   2H6     A   7          H62         A   7  -7.809  -5.191  -3.847
   77    H2     A   7           H2         A   7  -9.389  -5.614   1.155
   78   1H5*    A   8          1H5*        A   8 -17.819  -2.087  -0.610
   79   2H5*    A   8          2H5*        A   8 -16.500  -1.225  -1.422
   80    H4*    A   8           H4*        A   8 -16.537  -2.696   1.125
   81    H3*    A   8           H3*        A   8 -15.127  -0.275   0.068
   82    H2*    A   8           H2*        A   8 -13.268  -0.672   1.520
   83   2HO*    A   8          2HO*        A   8 -13.880  -1.333   3.452
   84    H1*    A   8           H1*        A   8 -13.193  -3.460   1.229
   85    H8     A   8           H8         A   8 -13.767  -2.425  -2.221
   86   1H6     A   8          H61         A   8  -7.792  -0.836  -2.586
   87   2H6     A   8          H62         A   8  -9.256  -1.140  -3.492
   88    H2     A   8           H2         A   8  -8.815  -1.469   1.744
   89   1H5*    C   9          1H5*        C   9 -15.716   1.381   4.358
   90   2H5*    C   9          2H5*        C   9 -15.907   3.097   3.947
   91    H4*    C   9           H4*        C   9 -13.949   2.503   5.414
   92    H3*    C   9           H3*        C   9 -13.694   4.165   2.939
   93    H2*    C   9           H2*        C   9 -11.302   4.241   3.192
   94   2HO*    C   9          2HO*        C   9 -11.419   2.693   5.552
   95    H1*    C   9           H1*        C   9 -10.964   1.543   3.742
   96   1H4     C   9          H41         C   9 -12.315   1.712  -2.716
   97   2H4     C   9          H42         C   9 -10.566   1.820  -2.590
   98    H5     C   9           H5         C   9 -13.781   1.748  -0.779
   99    H6     C   9           H6         C   9 -13.860   1.894   1.651
  100   1H5*    A  10          1H5*        A  10 -10.817   8.061   4.766
  101   2H5*    A  10          2H5*        A  10 -11.172   7.862   3.038
  102    H4*    A  10           H4*        A  10  -8.894   6.772   4.650
  103    H3*    A  10           H3*        A  10  -9.102   8.671   2.376
  104    H2*    A  10           H2*        A  10  -7.281   7.669   1.186
  105   2HO*    A  10          2HO*        A  10  -5.755   6.536   2.210
  106    H1*    A  10           H1*        A  10  -7.963   5.022   1.590
  107    H8     A  10           H8         A  10 -11.343   6.270   1.323
  108   1H6     A  10          H61         A  10 -10.566   6.899  -4.787
  109   2H6     A  10          H62         A  10 -11.734   6.862  -3.486
  110    H2     A  10           H2         A  10  -6.531   6.298  -2.927
  111   1H5*    A  11          1H5*        A  11  -4.559  10.379   4.697
  112   2H5*    A  11          2H5*        A  11  -4.262  11.217   3.161
  113    H4*    A  11           H4*        A  11  -2.723   9.195   4.393
  114    H3*    A  11           H3*        A  11  -2.454  10.787   1.873
  115    H2*    A  11           H2*        A  11  -0.876   9.204   0.998
  116   2HO*    A  11          2HO*        A  11  -0.017   8.969   3.323
  117    H1*    A  11           H1*        A  11  -2.234   6.904   1.812
  118    H8     A  11           H8         A  11  -5.108   8.847   0.812
  119   1H6     A  11          H61         A  11  -3.622   7.889  -5.122
  120   2H6     A  11          H62         A  11  -4.872   8.432  -4.025
  121    H2     A  11           H2         A  11  -0.092   6.748  -2.602
  122   1H5*    G  12          1H5*        G  12   1.487  10.090   3.062
  123   2H5*    G  12          2H5*        G  12   2.437  11.586   2.961
  124    H4*    G  12           H4*        G  12   3.447   9.750   1.707
  125    H3*    G  12           H3*        G  12   2.654  12.248   0.277
  126    H2*    G  12           H2*        G  12   3.239  11.282  -1.851
  127   2HO*    G  12          2HO*        G  12   4.900   9.951  -1.775
  128    H1*    G  12           H1*        G  12   1.988   8.861  -1.461
  129    H8     G  12           H8         G  12   0.236  11.751   0.312
  130    H1     G  12           H1         G  12  -1.787  10.556  -5.655
  131   1H2     G  12          H21         G  12   0.886   8.363  -5.797
  132   2H2     G  12          H22         G  12  -0.489   9.069  -6.618
  133   1H5*    G  13          1H5*        G  13   6.136  11.335  -1.789
  134   2H5*    G  13          2H5*        G  13   7.043  12.854  -1.930
  135    H4*    G  13           H4*        G  13   6.546  11.936  -4.111
  136    H3*    G  13           H3*        G  13   5.232  14.551  -3.430
  137    H2*    G  13           H2*        G  13   4.201  14.557  -5.605
  138   2HO*    G  13          2HO*        G  13   5.188  12.166  -6.516
  139    H1*    G  13           H1*        G  13   3.488  11.849  -5.577
  140    H8     G  13           H8         G  13   3.001  13.333  -2.161
  141    H1     G  13           H1         G  13  -1.884  14.310  -6.206
  142   1H2     G  13          H21         G  13   0.264  13.108  -8.629
  143   2H2     G  13          H22         G  13  -1.319  13.739  -8.239
  144   1H5*    C  14          1H5*        C  14   7.037  15.709  -7.232
  145   2H5*    C  14          2H5*        C  14   8.117  17.022  -6.724
  146    H4*    C  14           H4*        C  14   6.938  17.927  -8.500
  147    H3*    C  14           H3*        C  14   5.620  18.827  -5.942
  148    H2*    C  14           H2*        C  14   4.105  20.125  -7.306
  149   2HO*    C  14          2HO*        C  14   6.166  19.881  -9.092
  150    H1*    C  14           H1*        C  14   3.663  18.055  -9.151
  151   1H4     C  14          H41         C  14  -0.030  16.613  -3.879
  152   2H4     C  14          H42         C  14  -0.993  17.718  -4.847
  153    H5     C  14           H5         C  14   2.257  16.060  -4.441
  154    H6     C  14           H6         C  14   4.086  16.481  -5.987
  155   1H5*    U  15          1H5*        U  15   6.536  23.125  -6.775
  156   2H5*    U  15          2H5*        U  15   6.611  23.626  -5.075
  157    H4*    U  15           H4*        U  15   4.680  24.482  -6.513
  158    H3*    U  15           H3*        U  15   4.323  23.340  -3.757
  159    H2*    U  15           H2*        U  15   1.940  23.728  -3.965
  160   2HO*    U  15          2HO*        U  15   1.270  25.235  -5.307
  161    H1*    U  15           H1*        U  15   1.740  22.481  -6.405
  162    H3     U  15           H3         U  15   0.507  19.553  -3.059
  163    H5     U  15           H5         U  15   4.597  18.924  -3.748
  164    H6     U  15           H6         U  15   4.596  20.909  -5.110
  165   1H5*    U  16          1H5*        U  16   3.294  27.937  -1.143
  166   2H5*    U  16          2H5*        U  16   2.426  26.533  -0.492
  167    H4*    U  16           H4*        U  16   1.019  28.534  -0.674
  168    H3*    U  16           H3*        U  16   0.070  26.122  -1.075
  169    H2*    U  16           H2*        U  16   0.733  25.871  -3.397
  170   2HO*    U  16          2HO*        U  16  -1.584  25.592  -3.243
  171    H1*    U  16           H1*        U  16  -0.356  28.661  -4.023
  172    H3     U  16           H3         U  16   1.061  27.646  -8.210
  173    H5     U  16           H5         U  16   4.544  27.593  -5.866
  174    H6     U  16           H6         U  16   3.144  27.839  -3.919
  175   1H5*    C  17          1H5*        C  17  -3.386  26.085  -2.681
  176   2H5*    C  17          2H5*        C  17  -4.542  25.721  -1.385
  177    H4*    C  17           H4*        C  17  -4.226  23.994  -3.247
  178    H3*    C  17           H3*        C  17  -5.045  23.495  -0.682
  179    H2*    C  17           H2*        C  17  -2.823  23.026   0.187
  180   2HO*    C  17          2HO*        C  17  -3.905  21.130   0.642
  181    H1*    C  17           H1*        C  17  -2.348  21.499  -2.450
  182   1H4     C  17          H41         C  17   3.769  22.665  -0.387
  183   2H4     C  17          H42         C  17   3.482  20.996   0.083
  184    H5     C  17           H5         C  17   2.032  24.114  -1.233
  185    H6     C  17           H6         C  17  -0.317  24.242  -1.865
  186   1H5*    G  18          1H5*        G  18  -6.657  24.152  -1.967
  187   2H5*    G  18          2H5*        G  18  -8.217  23.992  -1.140
  188    H4*    G  18           H4*        G  18  -9.257  24.870  -2.875
  189    H3*    G  18           H3*        G  18  -8.204  22.483  -4.304
  190    H2*    G  18           H2*        G  18  -8.045  23.584  -6.353
  191   2HO*    G  18          2HO*        G  18 -10.565  24.199  -5.583
  192    H1*    G  18           H1*        G  18  -8.575  26.299  -5.171
  193    H8     G  18           H8         G  18  -7.475  27.567  -7.075
  194    H1     G  18           H1         G  18  -2.258  23.839  -6.781
  195   1H2     G  18          H21         G  18  -4.064  21.994  -4.487
  196   2H2     G  18          H22         G  18  -2.574  22.193  -5.375
  197   1H5*    G  19          1H5*        G  19  -9.172  18.976  -4.395
  198   2H5*    G  19          2H5*        G  19  -8.520  20.607  -4.158
  199    H4*    G  19           H4*        G  19  -9.605  20.342  -6.802
  200    H3*    G  19           H3*        G  19  -7.951  18.023  -5.987
  201    H2*    G  19           H2*        G  19  -6.419  18.302  -7.812
  202   2HO*    G  19          2HO*        G  19  -7.026  20.209  -9.286
  203    H1*    G  19           H1*        G  19  -6.108  21.029  -7.653
  204    H8     G  19           H8         G  19  -6.733  19.587  -4.205
  205    H1     G  19           H1         G  19  -0.590  19.583  -6.028
  206   1H2     G  19          H21         G  19  -1.798  20.466  -9.127
  207   2H2     G  19          H22         G  19  -0.408  20.097  -8.113
  208   1H5*    C  20          1H5*        C  20  -9.408  16.833 -10.018
  209   2H5*    C  20          2H5*        C  20  -9.745  15.092  -9.958
  210    H4*    C  20           H4*        C  20  -8.073  15.760 -11.662
  211    H3*    C  20           H3*        C  20  -7.442  13.705  -9.586
  212    H2*    C  20           H2*        C  20  -5.160  13.558 -10.361
  213   2HO*    C  20          2HO*        C  20  -4.891  13.869 -12.448
  214    H1*    C  20           H1*        C  20  -4.708  16.271 -10.506
  215   1H4     C  20          H41         C  20  -4.930  15.279  -4.025
  216   2H4     C  20          H42         C  20  -3.311  14.797  -4.466
  217    H5     C  20           H5         C  20  -6.609  15.855  -5.601
  218    H6     C  20           H6         C  20  -7.133  16.146  -7.934
  219   1H5*    C  21          1H5*        C  21  -5.538  12.087 -12.586
  220   2H5*    C  21          2H5*        C  21  -6.476  10.707 -13.193
  221    H4*    C  21           H4*        C  21  -4.307   9.911 -13.125
  222    H3*    C  21           H3*        C  21  -5.865   8.964 -10.760
  223    H2*    C  21           H2*        C  21  -3.912   7.973  -9.785
  224   2HO*    C  21          2HO*        C  21  -2.083   7.580 -10.980
  225    H1*    C  21           H1*        C  21  -2.146  10.051 -10.368
  226   1H4     C  21          H41         C  21  -5.565  12.309  -5.208
  227   2H4     C  21          H42         C  21  -4.377  11.216  -4.512
  228    H5     C  21           H5         C  21  -5.882  12.540  -7.606
  229    H6     C  21           H6         C  21  -5.120  11.753  -9.803
  230   1H5*    U  22          1H5*        U  22  -3.180   6.055 -11.231
  231   2H5*    U  22          2H5*        U  22  -3.993   4.485 -11.080
  232    H4*    U  22           H4*        U  22  -2.174   5.352  -9.342
  233    H3*    U  22           H3*        U  22  -4.480   3.500  -8.945
  234    H2*    U  22           H2*        U  22  -4.216   3.564  -6.558
  235   2HO*    U  22          2HO*        U  22  -1.860   3.567  -6.665
  236    H1*    U  22           H1*        U  22  -3.910   6.300  -6.327
  237    H3     U  22           H3         U  22  -8.168   5.019  -5.104
  238    H5     U  22           H5         U  22  -8.348   6.177  -9.137
  239    H6     U  22           H6         U  22  -5.941   6.213  -9.154
  240   1H5*    G  23          1H5*        G  23  -0.868  -0.084  -6.187
  241   2H5*    G  23          2H5*        G  23  -2.616   0.059  -5.918
  242    H4*    G  23           H4*        G  23  -0.350   1.357  -4.458
  243    H3*    G  23           H3*        G  23  -2.601  -0.437  -3.660
  244    H2*    G  23           H2*        G  23  -2.894   0.758  -1.590
  245   2HO*    G  23          2HO*        G  23  -0.324   1.277  -1.906
  246    H1*    G  23           H1*        G  23  -2.843   3.289  -2.681
  247    H8     G  23           H8         G  23  -4.335   1.555  -5.500
  248    H1     G  23           H1         G  23  -8.388   1.927  -0.545
  249   1H2     G  23          H21         G  23  -5.593   2.793   1.294
  250   2H2     G  23          H22         G  23  -7.317   2.498   1.278
  251   1H5*    C  24          1H5*        C  24  -1.168  -2.699   0.498
  252   2H5*    C  24          2H5*        C  24  -2.844  -2.140   0.664
  253    H4*    C  24           H4*        C  24  -0.344  -0.683   1.511
  254    H3*    C  24           H3*        C  24  -2.429  -2.160   3.089
  255    H2*    C  24           H2*        C  24  -2.280  -0.476   4.809
  256   2HO*    C  24          2HO*        C  24  -0.499   0.670   5.037
  257    H1*    C  24           H1*        C  24  -2.342   1.694   3.066
  258   1H4     C  24          H41         C  24  -8.589  -0.329   3.086
  259   2H4     C  24          H42         C  24  -8.386   0.424   4.658
  260    H5     C  24           H5         C  24  -6.740  -0.708   1.567
  261    H6     C  24           H6         C  24  -4.340  -0.444   1.247
  262   1H5*    U  25          1H5*        U  25  -2.544  -2.285   6.122
  263   2H5*    U  25          2H5*        U  25  -2.436  -3.985   6.615
  264    H4*    U  25           H4*        U  25  -4.727  -3.019   6.676
  265    H3*    U  25           H3*        U  25  -4.223  -5.456   4.970
  266    H2*    U  25           H2*        U  25  -6.597  -5.471   4.513
  267   2HO*    U  25          2HO*        U  25  -7.614  -3.397   5.665
  268    H1*    U  25           H1*        U  25  -6.742  -2.710   4.053
  269    H3     U  25           H3         U  25  -7.253  -4.338  -0.100
  270    H5     U  25           H5         U  25  -3.166  -4.862   0.695
  271    H6     U  25           H6         U  25  -3.599  -4.188   2.969
  272   1H5*    U  26          1H5*        U  26  -7.583  -6.738   7.593
  273   2H5*    U  26          2H5*        U  26  -7.169  -8.421   7.976
  274    H4*    U  26           H4*        U  26  -9.403  -8.246   7.042
  275    H3*    U  26           H3*        U  26  -7.396  -9.742   5.364
  276    H2*    U  26           H2*        U  26  -9.175 -10.204   3.806
  277   2HO*    U  26          2HO*        U  26 -11.284  -9.990   4.358
  278    H1*    U  26           H1*        U  26 -10.263  -7.605   3.914
  279    H3     U  26           H3         U  26  -8.480  -8.057  -0.242
  280    H5     U  26           H5         U  26  -5.240  -7.095   2.247
  281    H6     U  26           H6         U  26  -6.707  -7.371   4.133
  282   1H5*    U  27          1H5*        U  27 -10.877 -12.218   6.059
  283   2H5*    U  27          2H5*        U  27 -10.461 -13.941   5.980
  284    H4*    U  27           H4*        U  27 -12.222 -13.220   4.382
  285    H3*    U  27           H3*        U  27  -9.716 -14.508   3.312
  286    H2*    U  27           H2*        U  27 -10.714 -14.382   1.111
  287   2HO*    U  27          2HO*        U  27 -12.857 -14.796   1.460
  288    H1*    U  27           H1*        U  27 -11.522 -11.726   1.401
  289    H3     U  27           H3         U  27  -7.944 -11.587  -1.366
  290    H5     U  27           H5         U  27  -6.295 -11.906   2.479
  291    H6     U  27           H6         U  27  -8.505 -12.354   3.307
  292   1H5*    U  28          1H5*        U  28 -12.839 -17.640   2.148
  293   2H5*    U  28          2H5*        U  28 -11.940 -19.159   2.326
  294    H4*    U  28           H4*        U  28 -12.927 -18.863   0.094
  295    H3*    U  28           H3*        U  28  -9.926 -19.090   0.262
  296    H2*    U  28           H2*        U  28  -9.908 -19.056  -2.163
  297   2HO*    U  28          2HO*        U  28 -12.084 -18.738  -3.176
  298    H1*    U  28           H1*        U  28 -11.557 -16.827  -2.324
  299    H3     U  28           H3         U  28  -7.230 -15.535  -3.088
  300    H5     U  28           H5         U  28  -7.775 -15.326   1.073
  301    H6     U  28           H6         U  28  -9.880 -16.454   0.775
  302   1H5*    G  29          1H5*        G  29  -9.999 -22.960  -1.564
  303   2H5*    G  29          2H5*        G  29  -8.871 -23.902  -0.570
  304    H4*    G  29           H4*        G  29  -8.126 -23.526  -2.909
  305    H3*    G  29           H3*        G  29  -6.350 -22.530  -0.680
  306    H2*    G  29           H2*        G  29  -4.796 -21.823  -2.355
  307   2HO*    G  29          2HO*        G  29  -6.221 -23.714  -3.899
  308    H1*    G  29           H1*        G  29  -6.843 -21.126  -4.274
  309    H8     G  29           H8         G  29  -7.661 -19.358  -1.167
  310    H1     G  29           H1         G  29  -2.783 -16.643  -4.329
  311   1H2     G  29          H21         G  29  -2.716 -19.584  -6.148
  312   2H2     G  29          H22         G  29  -2.027 -17.999  -5.877
  313   1H5*    C  30          1H5*        C  30  -3.616 -24.955  -3.032
  314   2H5*    C  30          2H5*        C  30  -2.539 -25.701  -1.835
  315    H4*    C  30           H4*        C  30  -1.366 -24.338  -3.529
  316    H3*    C  30           H3*        C  30  -1.084 -23.584  -0.626
  317    H2*    C  30           H2*        C  30   0.405 -21.821  -1.296
  318   2HO*    C  30          2HO*        C  30   1.189 -23.433  -3.092
  319    H1*    C  30           H1*        C  30  -1.102 -21.066  -3.571
  320   1H4     C  30          H41         C  30  -3.869 -18.042   1.603
  321   2H4     C  30          H42         C  30  -2.800 -16.865   0.858
  322    H5     C  30           H5         C  30  -4.002 -20.345   0.866
  323    H6     C  30           H6         C  30  -3.142 -21.982  -0.726
  324   1H5*    U  31          1H5*        U  31   2.875 -23.506  -2.132
  325   2H5*    U  31          2H5*        U  31   3.708 -24.785  -1.228
  326    H4*    U  31           H4*        U  31   5.198 -23.016  -1.174
  327    H3*    U  31           H3*        U  31   3.651 -23.061   1.405
  328    H2*    U  31           H2*        U  31   4.894 -21.137   2.129
  329   2HO*    U  31          2HO*        U  31   6.621 -20.368   0.655
  330    H1*    U  31           H1*        U  31   4.793 -19.812  -0.361
  331    H3     U  31           H3         U  31   2.106 -17.195   2.119
  332    H5     U  31           H5         U  31  -0.131 -20.709   1.577
  333    H6     U  31           H6         U  31   1.808 -21.694   0.547
  334    H3T    U  31           H3T        U  31   5.745 -23.694   2.096
  Start of MODEL   14
    1   1H5*    A   1          1H5*        A   1  -1.508 -10.380   9.201
    2   2H5*    A   1          2H5*        A   1  -1.986  -9.757   7.611
    3    H4*    A   1           H4*        A   1   0.483  -9.997   8.036
    4    H3*    A   1           H3*        A   1  -0.881 -11.070   5.601
    5    H2*    A   1           H2*        A   1   1.181 -12.069   4.847
    6   2HO*    A   1          2HO*        A   1   2.521 -10.290   5.603
    7    H1*    A   1           H1*        A   1   1.849 -13.227   7.262
    8    H8     A   1           H8         A   1  -1.833 -13.350   7.389
    9   1H6     A   1          H61         A   1  -1.615 -18.316   3.698
   10   2H6     A   1          H62         A   1  -2.631 -17.347   4.741
   11    H2     A   1           H2         A   1   2.452 -16.425   3.730
   12    H5T    A   1           H5T        A   1  -2.710 -12.026   8.754
   13   1H5*    G   2          1H5*        G   2   2.236  -9.102   3.752
   14   2H5*    G   2          2H5*        G   2   1.675  -8.255   2.297
   15    H4*    G   2           H4*        G   2   3.358 -10.038   1.883
   16    H3*    G   2           H3*        G   2   0.680 -10.193   0.510
   17    H2*    G   2           H2*        G   2   1.473 -12.174  -0.620
   18   2HO*    G   2          2HO*        G   2   3.915 -11.071   0.093
   19    H1*    G   2           H1*        G   2   2.653 -13.291   1.684
   20    H8     G   2           H8         G   2  -0.365 -12.032   3.186
   21    H1     G   2           H1         G   2  -1.586 -16.968  -0.725
   22   1H2     G   2          H21         G   2   1.596 -16.397  -1.956
   23   2H2     G   2          H22         G   2   0.132 -17.352  -2.032
   24   1H5*    U   3          1H5*        U   3   3.355  -9.718  -3.125
   25   2H5*    U   3          2H5*        U   3   2.445  -8.535  -4.084
   26    H4*    U   3           H4*        U   3   2.914 -10.462  -5.424
   27    H3*    U   3           H3*        U   3   0.007 -10.146  -4.708
   28    H2*    U   3           H2*        U   3  -0.438 -12.105  -6.068
   29   2HO*    U   3          2HO*        U   3   1.579 -13.134  -6.987
   30    H1*    U   3           H1*        U   3   1.586 -13.617  -4.923
   31    H3     U   3           H3         U   3  -2.230 -15.125  -2.978
   32    H5     U   3           H5         U   3  -1.265 -11.620  -0.875
   33    H6     U   3           H6         U   3   0.457 -11.208  -2.505
   34   1H5*    A   4          1H5*        A   4   0.078  -9.670  -9.246
   35   2H5*    A   4          2H5*        A   4  -1.307  -8.631  -9.632
   36    H4*    A   4           H4*        A   4  -1.277 -10.846 -10.779
   37    H3*    A   4           H3*        A   4  -3.671 -10.063  -9.131
   38    H2*    A   4           H2*        A   4  -4.694 -12.172  -9.791
   39   2HO*    A   4          2HO*        A   4  -2.410 -12.306 -11.495
   40    H1*    A   4           H1*        A   4  -2.473 -13.679  -9.115
   41    H8     A   4           H8         A   4  -2.136 -11.014  -6.660
   42   1H6     A   4          H61         A   4  -6.726 -13.505  -3.354
   43   2H6     A   4          H62         A   4  -5.410 -12.353  -3.349
   44    H2     A   4           H2         A   4  -6.746 -15.416  -7.418
   45   1H5*    G   5          1H5*        G   5  -5.953  -9.753 -12.869
   46   2H5*    G   5          2H5*        G   5  -6.881  -8.256 -12.652
   47    H4*    G   5           H4*        G   5  -8.272 -10.286 -12.840
   48    H3*    G   5           H3*        G   5  -8.498  -8.611 -10.350
   49    H2*    G   5           H2*        G   5 -10.204 -10.139  -9.568
   50   2HO*    G   5          2HO*        G   5 -10.484 -12.044 -11.193
   51    H1*    G   5           H1*        G   5  -8.771 -12.443 -10.202
   52    H8     G   5           H8         G   5  -6.061 -10.233  -9.154
   53    H1     G   5           H1         G   5  -9.705 -12.108  -4.216
   54   1H2     G   5          H21         G   5 -11.951 -13.105  -6.634
   55   2H2     G   5          H22         G   5 -11.577 -12.956  -4.931
   56   1H5*    A   6          1H5*        A   6 -12.120  -9.822 -11.011
   57   2H5*    A   6          2H5*        A   6 -13.222  -8.455 -11.261
   58    H4*    A   6           H4*        A   6 -14.031 -10.143  -9.640
   59    H3*    A   6           H3*        A   6 -14.473  -7.483  -9.448
   60    H2*    A   6           H2*        A   6 -12.639  -6.959  -7.965
   61   2HO*    A   6          2HO*        A   6 -14.612  -6.469  -6.834
   62    H1*    A   6           H1*        A   6 -13.225  -9.564  -6.443
   63    H8     A   6           H8         A   6 -10.030  -8.350  -8.196
   64   1H6     A   6          H61         A   6  -7.633  -7.809  -2.514
   65   2H6     A   6          H62         A   6  -7.309  -7.714  -4.235
   66    H2     A   6           H2         A   6 -11.954  -8.973  -2.101
   67   1H5*    A   7          1H5*        A   7 -16.483  -8.971  -5.443
   68   2H5*    A   7          2H5*        A   7 -17.942  -7.970  -5.314
   69    H4*    A   7           H4*        A   7 -16.843  -7.780  -3.255
   70    H3*    A   7           H3*        A   7 -16.390  -5.311  -4.914
   71    H2*    A   7           H2*        A   7 -14.926  -4.472  -3.261
   72   2HO*    A   7          2HO*        A   7 -16.809  -5.140  -1.695
   73    H1*    A   7           H1*        A   7 -14.322  -7.134  -2.132
   74    H8     A   7           H8         A   7 -13.082  -6.190  -5.613
   75   1H6     A   7          H61         A   7  -7.775  -4.680  -2.796
   76   2H6     A   7          H62         A   7  -8.562  -4.908  -4.343
   77    H2     A   7           H2         A   7 -10.837  -5.524   0.362
   78   1H5*    A   8          1H5*        A   8 -17.247  -1.332  -2.410
   79   2H5*    A   8          2H5*        A   8 -15.969  -2.413  -2.997
   80    H4*    A   8           H4*        A   8 -16.677  -2.388  -0.096
   81    H3*    A   8           H3*        A   8 -15.139  -0.190  -1.449
   82    H2*    A   8           H2*        A   8 -13.554  -0.227   0.370
   83   2HO*    A   8          2HO*        A   8 -15.596  -1.769   1.585
   84    H1*    A   8           H1*        A   8 -13.321  -3.005   0.466
   85    H8     A   8           H8         A   8 -13.668  -2.382  -3.142
   86   1H6     A   8          H61         A   8  -7.705  -0.724  -3.250
   87   2H6     A   8          H62         A   8  -9.097  -1.142  -4.221
   88    H2     A   8           H2         A   8  -9.009  -0.957   1.039
   89   1H5*    C   9          1H5*        C   9 -15.930   2.282   3.019
   90   2H5*    C   9          2H5*        C   9 -15.382   3.668   2.056
   91    H4*    C   9           H4*        C   9 -14.077   2.652   4.204
   92    H3*    C   9           H3*        C   9 -13.101   4.328   1.922
   93    H2*    C   9           H2*        C   9 -10.823   3.990   2.626
   94   2HO*    C   9          2HO*        C   9 -11.624   4.035   4.966
   95    H1*    C   9           H1*        C   9 -11.047   1.258   3.075
   96   1H4     C   9          H41         C   9 -10.960   1.732  -3.498
   97   2H4     C   9          H42         C   9  -9.279   1.580  -3.008
   98    H5     C   9           H5         C   9 -12.781   1.970  -1.903
   99    H6     C   9           H6         C   9 -13.345   2.101   0.465
  100   1H5*    A  10          1H5*        A  10 -11.246   6.378   5.726
  101   2H5*    A  10          2H5*        A  10 -10.728   7.925   5.026
  102    H4*    A  10           H4*        A  10  -9.043   6.042   5.947
  103    H3*    A  10           H3*        A  10  -8.621   8.187   3.902
  104    H2*    A  10           H2*        A  10  -6.506   7.231   3.286
  105   2HO*    A  10          2HO*        A  10  -6.843   5.937   5.765
  106    H1*    A  10           H1*        A  10  -7.341   4.568   3.284
  107    H8     A  10           H8         A  10 -10.304   6.037   1.813
  108   1H6     A  10          H61         A  10  -7.209   6.792  -3.494
  109   2H6     A  10          H62         A  10  -8.788   6.793  -2.739
  110    H2     A  10           H2         A  10  -4.233   5.873  -0.268
  111   1H5*    A  11          1H5*        A  11  -4.524  10.933   5.553
  112   2H5*    A  11          2H5*        A  11  -4.997  10.644   3.868
  113    H4*    A  11           H4*        A  11  -2.819   9.340   5.469
  114    H3*    A  11           H3*        A  11  -2.840  11.069   3.026
  115    H2*    A  11           H2*        A  11  -1.077   9.770   2.044
  116   2HO*    A  11          2HO*        A  11  -0.659   9.131   4.704
  117    H1*    A  11           H1*        A  11  -2.066   7.262   2.779
  118    H8     A  11           H8         A  11  -5.207   8.829   1.898
  119   1H6     A  11          H61         A  11  -3.703   8.316  -4.087
  120   2H6     A  11          H62         A  11  -4.997   8.642  -2.955
  121    H2     A  11           H2         A  11  -0.013   7.557  -1.656
  122   1H5*    G  12          1H5*        G  12   1.457  10.781   4.492
  123   2H5*    G  12          2H5*        G  12   2.068  12.428   4.242
  124    H4*    G  12           H4*        G  12   3.494  10.659   3.268
  125    H3*    G  12           H3*        G  12   2.425  12.883   1.583
  126    H2*    G  12           H2*        G  12   3.358  11.887  -0.404
  127   2HO*    G  12          2HO*        G  12   4.426   9.640   0.283
  128    H1*    G  12           H1*        G  12   2.487   9.323   0.086
  129    H8     G  12           H8         G  12   0.121  11.967   1.478
  130    H1     G  12           H1         G  12  -1.076  10.126  -4.549
  131   1H2     G  12          H21         G  12   1.925   8.421  -4.311
  132   2H2     G  12          H22         G  12   0.538   8.840  -5.291
  133   1H5*    G  13          1H5*        G  13   5.907  11.875  -0.089
  134   2H5*    G  13          2H5*        G  13   6.987  13.283  -0.131
  135    H4*    G  13           H4*        G  13   6.968  12.384  -2.304
  136    H3*    G  13           H3*        G  13   5.350  14.906  -2.104
  137    H2*    G  13           H2*        G  13   4.825  14.710  -4.451
  138   2HO*    G  13          2HO*        G  13   6.867  12.731  -4.361
  139    H1*    G  13           H1*        G  13   4.248  11.982  -4.364
  140    H8     G  13           H8         G  13   3.114  13.733  -1.212
  141    H1     G  13           H1         G  13  -1.125  13.815  -6.030
  142   1H2     G  13          H21         G  13   1.466  12.576  -7.943
  143   2H2     G  13          H22         G  13  -0.204  13.096  -7.874
  144   1H5*    C  14          1H5*        C  14   7.550  16.221  -5.527
  145   2H5*    C  14          2H5*        C  14   8.453  17.589  -4.847
  146    H4*    C  14           H4*        C  14   7.452  18.512  -6.702
  147    H3*    C  14           H3*        C  14   5.661  19.113  -4.350
  148    H2*    C  14           H2*        C  14   4.240  20.328  -5.879
  149   2HO*    C  14          2HO*        C  14   5.701  19.789  -8.161
  150    H1*    C  14           H1*        C  14   4.345  18.360  -7.885
  151   1H4     C  14          H41         C  14   0.017  16.224  -3.385
  152   2H4     C  14          H42         C  14  -0.907  17.251  -4.470
  153    H5     C  14           H5         C  14   2.409  15.965  -3.556
  154    H6     C  14           H6         C  14   4.408  16.643  -4.773
  155   1H5*    U  15          1H5*        U  15   5.352  23.067  -6.030
  156   2H5*    U  15          2H5*        U  15   5.637  24.011  -4.556
  157    H4*    U  15           H4*        U  15   3.446  24.428  -5.630
  158    H3*    U  15           H3*        U  15   3.555  23.505  -2.774
  159    H2*    U  15           H2*        U  15   1.144  23.577  -2.700
  160   2HO*    U  15          2HO*        U  15   0.398  24.158  -5.142
  161    H1*    U  15           H1*        U  15   0.772  22.237  -5.090
  162    H3     U  15           H3         U  15  -0.060  19.134  -1.875
  163    H5     U  15           H5         U  15   4.119  19.186  -2.281
  164    H6     U  15           H6         U  15   3.881  21.114  -3.702
  165   1H5*    U  16          1H5*        U  16   1.861  28.309  -0.902
  166   2H5*    U  16          2H5*        U  16   1.217  27.036   0.153
  167    H4*    U  16           H4*        U  16  -0.554  28.529  -0.353
  168    H3*    U  16           H3*        U  16  -1.048  25.971  -0.600
  169    H2*    U  16           H2*        U  16  -0.210  25.644  -2.848
  170   2HO*    U  16          2HO*        U  16  -2.045  24.957  -3.666
  171    H1*    U  16           H1*        U  16  -1.653  28.140  -3.839
  172    H3     U  16           H3         U  16   0.411  26.883  -7.691
  173    H5     U  16           H5         U  16   3.524  27.923  -5.069
  174    H6     U  16           H6         U  16   1.883  28.079  -3.310
  175   1H5*    C  17          1H5*        C  17  -4.308  25.230  -2.448
  176   2H5*    C  17          2H5*        C  17  -5.495  24.750  -1.219
  177    H4*    C  17           H4*        C  17  -4.753  23.003  -2.928
  178    H3*    C  17           H3*        C  17  -5.707  22.512  -0.422
  179    H2*    C  17           H2*        C  17  -3.533  22.469   0.666
  180   2HO*    C  17          2HO*        C  17  -4.004  20.471   1.297
  181    H1*    C  17           H1*        C  17  -2.554  20.895  -1.797
  182   1H4     C  17          H41         C  17   3.040  23.226   0.683
  183   2H4     C  17          H42         C  17   3.010  21.555   1.231
  184    H5     C  17           H5         C  17   1.163  24.313  -0.353
  185    H6     C  17           H6         C  17  -1.096  23.995  -1.209
  186   1H5*    G  18          1H5*        G  18  -7.087  23.031  -2.097
  187   2H5*    G  18          2H5*        G  18  -8.672  22.747  -1.353
  188    H4*    G  18           H4*        G  18  -9.669  23.484  -3.174
  189    H3*    G  18           H3*        G  18  -8.397  21.099  -4.414
  190    H2*    G  18           H2*        G  18  -8.161  22.088  -6.503
  191   2HO*    G  18          2HO*        G  18 -10.475  22.055  -6.698
  192    H1*    G  18           H1*        G  18  -8.974  24.825  -5.531
  193    H8     G  18           H8         G  18  -7.915  25.897  -7.620
  194    H1     G  18           H1         G  18  -2.304  23.058  -6.325
  195   1H2     G  18          H21         G  18  -4.076  21.311  -3.935
  196   2H2     G  18          H22         G  18  -2.539  21.600  -4.720
  197   1H5*    G  19          1H5*        G  19  -9.008  17.567  -5.279
  198   2H5*    G  19          2H5*        G  19  -8.215  19.100  -4.878
  199    H4*    G  19           H4*        G  19  -9.218  18.933  -7.620
  200    H3*    G  19           H3*        G  19  -7.472  16.748  -6.697
  201    H2*    G  19           H2*        G  19  -5.691  17.209  -8.205
  202   2HO*    G  19          2HO*        G  19  -7.752  18.558  -9.588
  203    H1*    G  19           H1*        G  19  -5.736  19.974  -8.171
  204    H8     G  19           H8         G  19  -6.489  18.393  -4.780
  205    H1     G  19           H1         G  19  -0.296  19.581  -5.916
  206   1H2     G  19          H21         G  19  -1.309  20.281  -9.133
  207   2H2     G  19          H22         G  19   0.018  20.143  -7.993
  208   1H5*    C  20          1H5*        C  20  -8.093  15.712 -10.897
  209   2H5*    C  20          2H5*        C  20  -8.493  13.986 -10.994
  210    H4*    C  20           H4*        C  20  -6.556  14.572 -12.361
  211    H3*    C  20           H3*        C  20  -6.247  12.579 -10.157
  212    H2*    C  20           H2*        C  20  -3.875  12.434 -10.553
  213   2HO*    C  20          2HO*        C  20  -3.031  12.980 -12.452
  214    H1*    C  20           H1*        C  20  -3.413  15.148 -10.731
  215   1H4     C  20          H41         C  20  -4.588  14.345  -4.314
  216   2H4     C  20          H42         C  20  -2.876  14.035  -4.500
  217    H5     C  20           H5         C  20  -6.068  14.696  -6.163
  218    H6     C  20           H6         C  20  -6.234  14.879  -8.572
  219   1H5*    C  21          1H5*        C  21  -3.561  11.137 -12.475
  220   2H5*    C  21          2H5*        C  21  -4.140   9.593 -13.132
  221    H4*    C  21           H4*        C  21  -1.970   9.188 -12.345
  222    H3*    C  21           H3*        C  21  -4.068   8.086 -10.504
  223    H2*    C  21           H2*        C  21  -2.369   7.353  -8.989
  224   2HO*    C  21          2HO*        C  21  -0.511   7.977 -11.072
  225    H1*    C  21           H1*        C  21  -0.657   9.587  -9.336
  226   1H4     C  21          H41         C  21  -5.033  11.325  -4.710
  227   2H4     C  21          H42         C  21  -3.771  10.462  -3.844
  228    H5     C  21           H5         C  21  -5.082  11.487  -7.131
  229    H6     C  21           H6         C  21  -3.939  10.843  -9.197
  230   1H5*    U  22          1H5*        U  22  -1.321   5.491 -10.460
  231   2H5*    U  22          2H5*        U  22  -1.829   3.795 -10.335
  232    H4*    U  22           H4*        U  22  -0.581   4.964  -8.366
  233    H3*    U  22           H3*        U  22  -2.786   2.960  -8.208
  234    H2*    U  22           H2*        U  22  -3.005   3.278  -5.838
  235   2HO*    U  22          2HO*        U  22  -1.471   4.755  -4.788
  236    H1*    U  22           H1*        U  22  -2.926   6.040  -5.856
  237    H3     U  22           H3         U  22  -7.223   4.375  -5.324
  238    H5     U  22           H5         U  22  -6.746   5.392  -9.371
  239    H6     U  22           H6         U  22  -4.390   5.643  -8.950
  240   1H5*    G  23          1H5*        G  23   1.165   2.360  -5.022
  241   2H5*    G  23          2H5*        G  23   0.798   0.656  -4.688
  242    H4*    G  23           H4*        G  23   1.146   2.370  -2.745
  243    H3*    G  23           H3*        G  23  -0.793   0.093  -2.841
  244    H2*    G  23           H2*        G  23  -1.774   0.807  -0.759
  245   2HO*    G  23          2HO*        G  23   0.554   1.606  -0.148
  246    H1*    G  23           H1*        G  23  -1.962   3.489  -1.418
  247    H8     G  23           H8         G  23  -2.394   1.458  -4.553
  248    H1     G  23           H1         G  23  -7.743   2.061  -1.066
  249   1H2     G  23          H21         G  23  -5.657   3.345   1.375
  250   2H2     G  23          H22         G  23  -7.284   2.907   0.901
  251   1H5*    C  24          1H5*        C  24   1.087  -1.765   1.603
  252   2H5*    C  24          2H5*        C  24  -0.140  -2.961   1.144
  253    H4*    C  24           H4*        C  24  -0.226  -1.201   3.291
  254    H3*    C  24           H3*        C  24  -2.278  -3.016   2.064
  255    H2*    C  24           H2*        C  24  -3.983  -1.956   3.403
  256   2HO*    C  24          2HO*        C  24  -3.468  -0.950   5.222
  257    H1*    C  24           H1*        C  24  -3.169   0.645   2.863
  258   1H4     C  24          H41         C  24  -6.037  -1.452  -2.703
  259   2H4     C  24          H42         C  24  -7.303  -0.667  -1.773
  260    H5     C  24           H5         C  24  -3.799  -1.790  -1.848
  261    H6     C  24           H6         C  24  -2.325  -1.460   0.068
  262   1H5*    U  25          1H5*        U  25  -3.772  -2.799   5.576
  263   2H5*    U  25          2H5*        U  25  -3.805  -4.409   6.320
  264    H4*    U  25           H4*        U  25  -5.982  -3.433   6.455
  265    H3*    U  25           H3*        U  25  -5.787  -5.751   4.546
  266    H2*    U  25           H2*        U  25  -8.164  -5.511   4.143
  267   2HO*    U  25          2HO*        U  25  -9.084  -3.530   5.364
  268    H1*    U  25           H1*        U  25  -8.057  -2.761   3.785
  269    H3     U  25           H3         U  25  -8.467  -4.414  -0.415
  270    H5     U  25           H5         U  25  -4.390  -4.820   0.501
  271    H6     U  25           H6         U  25  -4.910  -4.168   2.760
  272   1H5*    U  26          1H5*        U  26  -8.965  -7.360   7.054
  273   2H5*    U  26          2H5*        U  26  -8.605  -9.096   7.131
  274    H4*    U  26           H4*        U  26 -10.804  -8.566   6.133
  275    H3*    U  26           H3*        U  26  -8.805 -10.070   4.448
  276    H2*    U  26           H2*        U  26 -10.492 -10.211   2.740
  277   2HO*    U  26          2HO*        U  26 -12.421  -8.902   4.302
  278    H1*    U  26           H1*        U  26 -11.437  -7.562   3.129
  279    H3     U  26           H3         U  26  -9.589  -7.969  -1.051
  280    H5     U  26           H5         U  26  -6.438  -6.964   1.539
  281    H6     U  26           H6         U  26  -7.935  -7.347   3.384
  282   1H5*    U  27          1H5*        U  27 -12.513 -12.472   4.560
  283   2H5*    U  27          2H5*        U  27 -12.019 -14.172   4.444
  284    H4*    U  27           H4*        U  27 -13.639 -13.440   2.710
  285    H3*    U  27           H3*        U  27 -10.994 -14.606   1.874
  286    H2*    U  27           H2*        U  27 -11.699 -14.371  -0.428
  287   2HO*    U  27          2HO*        U  27 -14.204 -13.799   0.796
  288    H1*    U  27           H1*        U  27 -12.589 -11.754  -0.130
  289    H3     U  27           H3         U  27  -8.614 -11.421  -2.273
  290    H5     U  27           H5         U  27  -7.604 -11.895   1.775
  291    H6     U  27           H6         U  27  -9.917 -12.389   2.212
  292   1H5*    U  28          1H5*        U  28 -13.896 -17.696   0.146
  293   2H5*    U  28          2H5*        U  28 -12.998 -19.214   0.334
  294    H4*    U  28           H4*        U  28 -13.724 -18.750  -1.982
  295    H3*    U  28           H3*        U  28 -10.777 -19.070  -1.444
  296    H2*    U  28           H2*        U  28 -10.425 -18.851  -3.832
  297   2HO*    U  28          2HO*        U  28 -12.883 -18.250  -4.692
  298    H1*    U  28           H1*        U  28 -12.037 -16.596  -4.064
  299    H3     U  28           H3         U  28  -7.647 -15.275  -4.185
  300    H5     U  28           H5         U  28  -8.746 -15.292  -0.130
  301    H6     U  28           H6         U  28 -10.781 -16.408  -0.765
  302   1H5*    G  29          1H5*        G  29 -10.633 -22.758  -3.556
  303   2H5*    G  29          2H5*        G  29  -9.678 -23.806  -2.489
  304    H4*    G  29           H4*        G  29  -8.567 -23.259  -4.632
  305    H3*    G  29           H3*        G  29  -7.180 -22.470  -2.074
  306    H2*    G  29           H2*        G  29  -5.400 -21.571  -3.381
  307   2HO*    G  29          2HO*        G  29  -6.412 -22.636  -5.783
  308    H1*    G  29           H1*        G  29  -7.095 -20.778  -5.594
  309    H8     G  29           H8         G  29  -8.392 -19.258  -2.490
  310    H1     G  29           H1         G  29  -3.279 -16.180  -4.844
  311   1H2     G  29          H21         G  29  -2.890 -18.970  -6.848
  312   2H2     G  29          H22         G  29  -2.298 -17.391  -6.381
  313   1H5*    C  30          1H5*        C  30  -4.144 -24.611  -4.433
  314   2H5*    C  30          2H5*        C  30  -3.266 -25.574  -3.229
  315    H4*    C  30           H4*        C  30  -1.808 -24.128  -4.588
  316    H3*    C  30           H3*        C  30  -1.850 -23.763  -1.606
  317    H2*    C  30           H2*        C  30  -0.221 -22.003  -1.832
  318   2HO*    C  30          2HO*        C  30   0.820 -23.276  -3.661
  319    H1*    C  30           H1*        C  30  -1.454 -20.773  -4.024
  320   1H4     C  30          H41         C  30  -5.001 -18.959   1.237
  321   2H4     C  30          H42         C  30  -3.848 -17.665   0.955
  322    H5     C  30           H5         C  30  -4.989 -21.025  -0.021
  323    H6     C  30           H6         C  30  -3.876 -22.272  -1.797
  324   1H5*    U  31          1H5*        U  31   2.480 -23.816  -2.541
  325   2H5*    U  31          2H5*        U  31   3.026 -25.133  -1.485
  326    H4*    U  31           H4*        U  31   4.464 -23.246  -1.194
  327    H3*    U  31           H3*        U  31   2.699 -23.854   1.159
  328    H2*    U  31           H2*        U  31   3.668 -21.995   2.334
  329   2HO*    U  31          2HO*        U  31   5.797 -21.991   1.864
  330    H1*    U  31           H1*        U  31   3.610 -20.234   0.153
  331    H3     U  31           H3         U  31   0.353 -18.598   2.809
  332    H5     U  31           H5         U  31  -1.344 -22.036   1.092
  333    H6     U  31           H6         U  31   0.818 -22.547   0.165
  334    H3T    U  31           H3T        U  31   4.414 -25.212   0.524
  Start of MODEL   15
    1   1H5*    A   1          1H5*        A   1   0.703 -10.916   8.000
    2   2H5*    A   1          2H5*        A   1  -0.025 -10.171   6.565
    3    H4*    A   1           H4*        A   1   2.504 -10.402   6.631
    4    H3*    A   1           H3*        A   1   0.794 -11.137   4.291
    5    H2*    A   1           H2*        A   1   2.725 -11.989   3.113
    6   2HO*    A   1          2HO*        A   1   4.489 -10.858   3.568
    7    H1*    A   1           H1*        A   1   3.680 -13.511   5.196
    8    H8     A   1           H8         A   1  -0.092 -13.216   5.460
    9   1H6     A   1          H61         A   1  -0.372 -18.272   1.897
   10   2H6     A   1          H62         A   1  -1.291 -17.158   2.881
   11    H2     A   1           H2         A   1   3.895 -16.890   2.021
   12    H5T    A   1           H5T        A   1  -1.044 -12.149   7.292
   13   1H5*    G   2          1H5*        G   2   3.598  -8.753   2.246
   14   2H5*    G   2          2H5*        G   2   2.745  -7.798   1.018
   15    H4*    G   2           H4*        G   2   4.416  -9.403   0.117
   16    H3*    G   2           H3*        G   2   1.552  -9.563  -0.793
   17    H2*    G   2           H2*        G   2   2.165 -11.400  -2.224
   18   2HO*    G   2          2HO*        G   2   4.104 -11.246  -3.082
   19    H1*    G   2           H1*        G   2   3.819 -12.670  -0.333
   20    H8     G   2           H8         G   2   1.042 -11.659   1.781
   21    H1     G   2           H1         G   2  -0.599 -16.447  -2.156
   22   1H2     G   2          H21         G   2   2.317 -15.675  -3.850
   23   2H2     G   2          H22         G   2   0.898 -16.691  -3.738
   24   1H5*    U   3          1H5*        U   3   3.594  -8.557  -4.739
   25   2H5*    U   3          2H5*        U   3   2.467  -7.381  -5.443
   26    H4*    U   3           H4*        U   3   2.849  -9.161  -6.999
   27    H3*    U   3           H3*        U   3   0.071  -9.164  -5.827
   28    H2*    U   3           H2*        U   3  -0.417 -11.011  -7.328
   29   2HO*    U   3          2HO*        U   3   0.679 -10.707  -9.173
   30    H1*    U   3           H1*        U   3   1.876 -12.422  -6.640
   31    H3     U   3           H3         U   3  -1.468 -14.516  -4.397
   32    H5     U   3           H5         U   3  -0.578 -11.135  -2.072
   33    H6     U   3           H6         U   3   0.861 -10.386  -3.849
   34   1H5*    A   4          1H5*        A   4  -0.875  -8.266 -10.121
   35   2H5*    A   4          2H5*        A   4  -2.358  -7.292 -10.075
   36    H4*    A   4           H4*        A   4  -2.518  -9.448 -11.331
   37    H3*    A   4           H3*        A   4  -4.451  -8.922  -9.077
   38    H2*    A   4           H2*        A   4  -5.499 -11.043  -9.637
   39   2HO*    A   4          2HO*        A   4  -5.144 -12.007 -11.542
   40    H1*    A   4           H1*        A   4  -3.065 -12.416  -9.784
   41    H8     A   4           H8         A   4  -2.253 -10.151  -7.102
   42   1H6     A   4          H61         A   4  -5.789 -13.375  -3.200
   43   2H6     A   4          H62         A   4  -4.540 -12.158  -3.342
   44    H2     A   4           H2         A   4  -6.795 -14.678  -7.380
   45   1H5*    G   5          1H5*        G   5  -7.591  -8.468 -12.121
   46   2H5*    G   5          2H5*        G   5  -8.501  -7.053 -11.558
   47    H4*    G   5           H4*        G   5  -9.810  -9.150 -11.606
   48    H3*    G   5           H3*        G   5  -9.520  -7.694  -8.986
   49    H2*    G   5           H2*        G   5 -10.978  -9.367  -8.008
   50   2HO*    G   5          2HO*        G   5 -12.006  -9.522 -10.364
   51    H1*    G   5           H1*        G   5  -9.606 -11.521  -9.118
   52    H8     G   5           H8         G   5  -6.814  -9.267  -8.514
   53    H1     G   5           H1         G   5  -9.254 -11.586  -3.050
   54   1H2     G   5          H21         G   5 -11.937 -12.535  -4.995
   55   2H2     G   5          H22         G   5 -11.210 -12.474  -3.405
   56   1H5*    A   6          1H5*        A   6 -13.144  -8.735  -9.069
   57   2H5*    A   6          2H5*        A   6 -14.340  -7.438  -8.888
   58    H4*    A   6           H4*        A   6 -14.704  -9.335  -7.365
   59    H3*    A   6           H3*        A   6 -15.123  -6.750  -6.690
   60    H2*    A   6           H2*        A   6 -12.974  -6.367  -5.635
   61   2HO*    A   6          2HO*        A   6 -14.468  -5.992  -3.980
   62    H1*    A   6           H1*        A   6 -13.218  -9.181  -4.410
   63    H8     A   6           H8         A   6 -10.433  -7.698  -6.588
   64   1H6     A   6          H61         A   6  -6.905  -8.016  -1.509
   65   2H6     A   6          H62         A   6  -6.930  -7.674  -3.232
   66    H2     A   6           H2         A   6 -11.100  -9.115  -0.362
   67   1H5*    A   7          1H5*        A   7 -15.871  -8.576  -2.509
   68   2H5*    A   7          2H5*        A   7 -17.394  -7.822  -1.997
   69    H4*    A   7           H4*        A   7 -15.989  -7.384  -0.229
   70    H3*    A   7           H3*        A   7 -16.065  -4.980  -2.013
   71    H2*    A   7           H2*        A   7 -14.226  -4.013  -0.912
   72   2HO*    A   7          2HO*        A   7 -14.814  -5.541   1.413
   73    H1*    A   7           H1*        A   7 -13.404  -6.555   0.411
   74    H8     A   7           H8         A   7 -12.653  -5.938  -3.269
   75   1H6     A   7          H61         A   7  -7.034  -4.171  -1.355
   76   2H6     A   7          H62         A   7  -8.016  -4.540  -2.756
   77    H2     A   7           H2         A   7  -9.624  -4.720   2.253
   78   1H5*    A   8          1H5*        A   8 -17.902  -1.419   1.268
   79   2H5*    A   8          2H5*        A   8 -16.444  -0.810   0.462
   80    H4*    A   8           H4*        A   8 -16.937  -1.437   3.278
   81    H3*    A   8           H3*        A   8 -15.179   0.468   1.782
   82    H2*    A   8           H2*        A   8 -13.606   0.485   3.603
   83   2HO*    A   8          2HO*        A   8 -14.445   0.253   5.541
   84    H1*    A   8           H1*        A   8 -13.533  -2.251   3.971
   85    H8     A   8           H8         A   8 -14.133  -1.198   0.348
   86   1H6     A   8          H61         A   8  -7.993  -1.553  -0.348
   87   2H6     A   8          H62         A   8  -9.520  -1.320  -1.168
   88    H2     A   8           H2         A   8  -8.933  -2.119   4.001
   89   1H5*    C   9          1H5*        C   9 -15.299   2.879   5.952
   90   2H5*    C   9          2H5*        C   9 -15.035   4.404   5.083
   91    H4*    C   9           H4*        C   9 -13.276   3.544   6.789
   92    H3*    C   9           H3*        C   9 -12.718   4.856   4.156
   93    H2*    C   9           H2*        C   9 -10.365   4.468   4.435
   94   2HO*    C   9          2HO*        C   9 -11.172   4.103   7.101
   95    H1*    C   9           H1*        C   9 -10.584   1.847   5.368
   96   1H4     C   9          H41         C   9 -11.597   1.410  -1.139
   97   2H4     C   9          H42         C   9  -9.915   0.976  -0.871
   98    H5     C   9           H5         C   9 -13.057   2.199   0.632
   99    H6     C   9           H6         C   9 -13.197   2.723   3.007
  100   1H5*    A  10          1H5*        A  10  -9.989   6.284   6.979
  101   2H5*    A  10          2H5*        A  10  -9.469   7.944   6.630
  102    H4*    A  10           H4*        A  10  -7.735   6.032   6.602
  103    H3*    A  10           H3*        A  10  -7.912   8.260   4.604
  104    H2*    A  10           H2*        A  10  -6.141   7.274   3.325
  105   2HO*    A  10          2HO*        A  10  -4.610   6.402   4.519
  106    H1*    A  10           H1*        A  10  -7.000   4.612   3.595
  107    H8     A  10           H8         A  10 -10.188   6.214   2.970
  108   1H6     A  10          H61         A  10  -8.630   6.812  -2.992
  109   2H6     A  10          H62         A  10  -9.941   6.887  -1.835
  110    H2     A  10           H2         A  10  -4.930   5.758  -0.686
  111   1H5*    A  11          1H5*        A  11  -3.539   9.870   7.316
  112   2H5*    A  11          2H5*        A  11  -3.076  10.733   5.836
  113    H4*    A  11           H4*        A  11  -1.560   8.880   7.213
  114    H3*    A  11           H3*        A  11  -1.271  10.142   4.516
  115    H2*    A  11           H2*        A  11   0.369   8.512   3.877
  116   2HO*    A  11          2HO*        A  11   0.933   8.556   6.439
  117    H1*    A  11           H1*        A  11  -0.921   6.287   4.970
  118    H8     A  11           H8         A  11  -3.819   8.013   3.657
  119   1H6     A  11          H61         A  11  -2.200   6.242  -2.049
  120   2H6     A  11          H62         A  11  -3.479   6.916  -1.065
  121    H2     A  11           H2         A  11   1.291   5.527   0.671
  122   1H5*    G  12          1H5*        G  12   2.465   9.769   5.048
  123   2H5*    G  12          2H5*        G  12   3.276  11.339   5.207
  124    H4*    G  12           H4*        G  12   4.431  10.152   3.544
  125    H3*    G  12           H3*        G  12   2.733  12.362   2.462
  126    H2*    G  12           H2*        G  12   3.280  11.729   0.207
  127   2HO*    G  12          2HO*        G  12   4.957  10.383  -0.253
  128    H1*    G  12           H1*        G  12   2.908   9.021   0.529
  129    H8     G  12           H8         G  12   0.570  11.165   2.659
  130    H1     G  12           H1         G  12  -1.646   9.607  -3.158
  131   1H2     G  12          H21         G  12   1.525   8.329  -3.688
  132   2H2     G  12          H22         G  12  -0.080   8.618  -4.328
  133   1H5*    G  13          1H5*        G  13   6.067  11.888   0.040
  134   2H5*    G  13          2H5*        G  13   6.975  13.411   0.107
  135    H4*    G  13           H4*        G  13   6.900  12.795  -2.152
  136    H3*    G  13           H3*        G  13   5.068  15.064  -1.494
  137    H2*    G  13           H2*        G  13   4.198  15.068  -3.731
  138   2HO*    G  13          2HO*        G  13   5.297  14.193  -5.388
  139    H1*    G  13           H1*        G  13   3.896  12.333  -3.979
  140    H8     G  13           H8         G  13   3.256  13.607  -0.451
  141    H1     G  13           H1         G  13  -1.886  13.476  -4.281
  142   1H2     G  13          H21         G  13   0.377  12.739  -6.795
  143   2H2     G  13          H22         G  13  -1.289  13.028  -6.350
  144   1H5*    C  14          1H5*        C  14   7.589  15.928  -5.081
  145   2H5*    C  14          2H5*        C  14   7.804  17.681  -5.262
  146    H4*    C  14           H4*        C  14   6.879  16.530  -7.265
  147    H3*    C  14           H3*        C  14   5.371  18.796  -5.991
  148    H2*    C  14           H2*        C  14   3.670  18.557  -7.685
  149   2HO*    C  14          2HO*        C  14   5.623  17.656  -9.152
  150    H1*    C  14           H1*        C  14   3.426  15.820  -7.398
  151   1H4     C  14          H41         C  14   0.774  18.505  -1.979
  152   2H4     C  14          H42         C  14  -0.508  18.515  -3.178
  153    H5     C  14           H5         C  14   3.041  17.829  -2.490
  154    H6     C  14           H6         C  14   4.527  16.994  -4.237
  155   1H5*    U  15          1H5*        U  15   4.238  19.764  -9.501
  156   2H5*    U  15          2H5*        U  15   4.195  21.534  -9.589
  157    H4*    U  15           H4*        U  15   1.978  20.268  -9.590
  158    H3*    U  15           H3*        U  15   2.553  22.683  -7.922
  159    H2*    U  15           H2*        U  15   0.357  22.526  -6.929
  160   2HO*    U  15          2HO*        U  15  -1.158  21.045  -7.711
  161    H1*    U  15           H1*        U  15   0.521  19.833  -6.359
  162    H3     U  15           H3         U  15   1.431  22.214  -2.524
  163    H5     U  15           H5         U  15   5.114  21.413  -4.378
  164    H6     U  15           H6         U  15   3.897  20.697  -6.315
  165   1H5*    U  16          1H5*        U  16   0.282  25.790 -11.513
  166   2H5*    U  16          2H5*        U  16   0.293  26.913 -10.139
  167    H4*    U  16           H4*        U  16  -1.878  26.997 -10.958
  168    H3*    U  16           H3*        U  16  -1.644  26.230  -8.371
  169    H2*    U  16           H2*        U  16  -1.825  23.845  -8.784
  170   2HO*    U  16          2HO*        U  16  -4.476  23.807  -8.863
  171    H1*    U  16           H1*        U  16  -4.020  24.571 -10.825
  172    H3     U  16           H3         U  16  -4.899  20.177 -11.231
  173    H5     U  16           H5         U  16  -0.766  20.435 -11.927
  174    H6     U  16           H6         U  16  -0.888  22.766 -11.352
  175   1H5*    C  17          1H5*        C  17  -5.157  24.913  -7.415
  176   2H5*    C  17          2H5*        C  17  -6.035  26.296  -6.732
  177    H4*    C  17           H4*        C  17  -6.145  24.298  -5.314
  178    H3*    C  17           H3*        C  17  -6.093  26.664  -4.247
  179    H2*    C  17           H2*        C  17  -3.661  27.008  -4.387
  180   2HO*    C  17          2HO*        C  17  -4.006  25.699  -1.873
  181    H1*    C  17           H1*        C  17  -3.275  24.242  -3.140
  182   1H4     C  17          H41         C  17   2.193  25.451  -6.626
  183   2H4     C  17          H42         C  17   2.640  25.760  -4.958
  184    H5     C  17           H5         C  17  -0.085  24.976  -7.303
  185    H6     C  17           H6         C  17  -2.379  24.688  -6.524
  186   1H5*    G  18          1H5*        G  18  -8.132  25.439  -5.010
  187   2H5*    G  18          2H5*        G  18  -9.800  25.582  -4.424
  188    H4*    G  18           H4*        G  18 -10.406  23.665  -5.357
  189    H3*    G  18           H3*        G  18  -7.894  22.367  -4.296
  190    H2*    G  18           H2*        G  18  -8.415  20.538  -5.797
  191   2HO*    G  18          2HO*        G  18 -10.398  20.310  -6.564
  192    H1*    G  18           H1*        G  18  -8.635  22.237  -7.969
  193    H8     G  18           H8         G  18  -6.428  22.489  -9.066
  194    H1     G  18           H1         G  18  -3.286  21.418  -3.586
  195   1H2     G  18          H21         G  18  -6.422  21.577  -2.097
  196   2H2     G  18          H22         G  18  -4.701  21.357  -1.890
  197   1H5*    G  19          1H5*        G  19  -9.912  17.339  -3.418
  198   2H5*    G  19          2H5*        G  19  -8.418  18.086  -2.828
  199    H4*    G  19           H4*        G  19  -9.600  18.735  -5.511
  200    H3*    G  19           H3*        G  19  -7.907  16.357  -4.876
  201    H2*    G  19           H2*        G  19  -6.498  16.813  -6.778
  202   2HO*    G  19          2HO*        G  19  -8.432  17.522  -8.053
  203    H1*    G  19           H1*        G  19  -6.270  19.554  -6.337
  204    H8     G  19           H8         G  19  -6.357  18.521  -2.895
  205    H1     G  19           H1         G  19  -0.833  16.789  -5.660
  206   1H2     G  19          H21         G  19  -2.450  17.422  -8.626
  207   2H2     G  19          H22         G  19  -0.993  16.856  -7.825
  208   1H5*    C  20          1H5*        C  20  -8.914  15.470  -8.815
  209   2H5*    C  20          2H5*        C  20  -9.292  13.745  -8.991
  210    H4*    C  20           H4*        C  20  -7.397  14.332 -10.354
  211    H3*    C  20           H3*        C  20  -6.950  12.419  -8.108
  212    H2*    C  20           H2*        C  20  -4.582  12.408  -8.492
  213   2HO*    C  20          2HO*        C  20  -5.158  13.921 -10.846
  214    H1*    C  20           H1*        C  20  -4.268  15.126  -8.882
  215   1H4     C  20          H41         C  20  -5.011  14.541  -2.368
  216   2H4     C  20          H42         C  20  -3.294  14.722  -2.641
  217    H5     C  20           H5         C  20  -6.618  14.360  -4.127
  218    H6     C  20           H6         C  20  -6.961  14.343  -6.517
  219   1H5*    C  21          1H5*        C  21  -4.232  11.482 -10.936
  220   2H5*    C  21          2H5*        C  21  -4.658   9.892 -11.600
  221    H4*    C  21           H4*        C  21  -2.353   9.814 -11.268
  222    H3*    C  21           H3*        C  21  -3.850   8.317  -9.159
  223    H2*    C  21           H2*        C  21  -1.818   7.867  -7.960
  224   2HO*    C  21          2HO*        C  21  -0.199   7.474  -9.304
  225    H1*    C  21           H1*        C  21  -0.735  10.418  -8.176
  226   1H4     C  21          H41         C  21  -5.544  10.957  -3.667
  227   2H4     C  21          H42         C  21  -4.050  10.732  -2.772
  228    H5     C  21           H5         C  21  -5.649  10.844  -6.094
  229    H6     C  21           H6         C  21  -4.327  10.498  -8.134
  230   1H5*    U  22          1H5*        U  22  -1.326   5.725  -8.648
  231   2H5*    U  22          2H5*        U  22  -2.148   4.157  -8.769
  232    H4*    U  22           H4*        U  22  -1.278   5.100  -6.472
  233    H3*    U  22           H3*        U  22  -3.703   3.438  -7.015
  234    H2*    U  22           H2*        U  22  -4.500   3.710  -4.786
  235   2HO*    U  22          2HO*        U  22  -3.190   4.296  -3.135
  236    H1*    U  22           H1*        U  22  -3.866   6.416  -4.517
  237    H3     U  22           H3         U  22  -8.422   5.819  -4.801
  238    H5     U  22           H5         U  22  -7.038   6.487  -8.710
  239    H6     U  22           H6         U  22  -4.794   6.237  -7.876
  240   1H5*    G  23          1H5*        G  23  -0.498  -0.151  -4.284
  241   2H5*    G  23          2H5*        G  23  -1.860   0.941  -4.595
  242    H4*    G  23           H4*        G  23   0.261   1.632  -2.590
  243    H3*    G  23           H3*        G  23  -1.966  -0.326  -2.157
  244    H2*    G  23           H2*        G  23  -2.439   0.675  -0.019
  245   2HO*    G  23          2HO*        G  23  -0.958   2.610   0.473
  246    H1*    G  23           H1*        G  23  -2.317   3.309  -0.905
  247    H8     G  23           H8         G  23  -3.779   1.759  -3.844
  248    H1     G  23           H1         G  23  -7.954   1.987   1.015
  249   1H2     G  23          H21         G  23  -5.195   2.675   2.980
  250   2H2     G  23          H22         G  23  -6.927   2.427   2.896
  251   1H5*    C  24          1H5*        C  24  -1.558  -3.595   0.907
  252   2H5*    C  24          2H5*        C  24  -3.114  -2.745   0.967
  253    H4*    C  24           H4*        C  24  -0.471  -1.427   1.558
  254    H3*    C  24           H3*        C  24  -2.285  -2.876   3.470
  255    H2*    C  24           H2*        C  24  -1.879  -1.152   5.092
  256   2HO*    C  24          2HO*        C  24  -0.191   0.389   3.551
  257    H1*    C  24           H1*        C  24  -2.039   0.979   3.255
  258   1H4     C  24          H41         C  24  -8.298  -0.467   4.673
  259   2H4     C  24          H42         C  24  -7.777   0.607   5.962
  260    H5     C  24           H5         C  24  -6.785  -1.335   2.998
  261    H6     C  24           H6         C  24  -4.476  -1.350   2.212
  262   1H5*    U  25          1H5*        U  25  -1.392  -3.673   6.109
  263   2H5*    U  25          2H5*        U  25  -1.315  -5.431   6.330
  264    H4*    U  25           H4*        U  25  -3.304  -4.452   7.348
  265    H3*    U  25           H3*        U  25  -3.678  -6.457   5.147
  266    H2*    U  25           H2*        U  25  -6.074  -6.203   5.366
  267   2HO*    U  25          2HO*        U  25  -6.483  -5.936   7.489
  268    H1*    U  25           H1*        U  25  -6.045  -3.442   5.370
  269    H3     U  25           H3         U  25  -7.255  -4.174   1.108
  270    H5     U  25           H5         U  25  -3.200  -5.263   1.184
  271    H6     U  25           H6         U  25  -3.236  -4.929   3.568
  272   1H5*    U  26          1H5*        U  26  -6.293  -7.994   7.902
  273   2H5*    U  26          2H5*        U  26  -6.035  -9.742   8.058
  274    H4*    U  26           H4*        U  26  -8.305  -9.355   7.444
  275    H3*    U  26           H3*        U  26  -6.662 -10.533   5.208
  276    H2*    U  26           H2*        U  26  -8.678 -10.603   3.888
  277   2HO*    U  26          2HO*        U  26 -10.454  -9.497   5.589
  278    H1*    U  26           H1*        U  26  -9.570  -8.050   4.692
  279    H3     U  26           H3         U  26  -8.467  -7.740   0.287
  280    H5     U  26           H5         U  26  -4.838  -7.364   2.369
  281    H6     U  26           H6         U  26  -6.016  -7.969   4.376
  282   1H5*    U  27          1H5*        U  27 -10.196 -12.967   5.657
  283   2H5*    U  27          2H5*        U  27  -9.735 -14.658   5.382
  284    H4*    U  27           H4*        U  27 -11.604 -13.844   3.961
  285    H3*    U  27           H3*        U  27  -9.127 -14.955   2.663
  286    H2*    U  27           H2*        U  27 -10.197 -14.619   0.517
  287   2HO*    U  27          2HO*        U  27 -12.319 -14.759   0.500
  288    H1*    U  27           H1*        U  27 -11.006 -12.022   1.081
  289    H3     U  27           H3         U  27  -7.387 -11.768  -1.690
  290    H5     U  27           H5         U  27  -5.813 -12.032   2.191
  291    H6     U  27           H6         U  27  -8.029 -12.543   2.973
  292   1H5*    U  28          1H5*        U  28 -12.401 -17.726   1.110
  293   2H5*    U  28          2H5*        U  28 -11.566 -19.287   0.986
  294    H4*    U  28           H4*        U  28 -12.639 -18.556  -1.113
  295    H3*    U  28           H3*        U  28  -9.664 -19.022  -1.112
  296    H2*    U  28           H2*        U  28  -9.675 -18.528  -3.480
  297   2HO*    U  28          2HO*        U  28 -11.536 -18.460  -4.637
  298    H1*    U  28           H1*        U  28 -11.248 -16.241  -3.219
  299    H3     U  28           H3         U  28  -7.004 -14.789  -3.965
  300    H5     U  28           H5         U  28  -7.187 -15.584   0.156
  301    H6     U  28           H6         U  28  -9.339 -16.597  -0.214
  302   1H5*    G  29          1H5*        G  29 -10.004 -22.154  -3.708
  303   2H5*    G  29          2H5*        G  29  -9.167 -23.540  -2.984
  304    H4*    G  29           H4*        G  29  -8.025 -22.901  -4.982
  305    H3*    G  29           H3*        G  29  -6.507 -22.297  -2.458
  306    H2*    G  29           H2*        G  29  -4.797 -21.262  -3.727
  307   2HO*    G  29          2HO*        G  29  -5.851 -22.698  -5.961
  308    H1*    G  29           H1*        G  29  -6.524 -20.521  -5.964
  309    H8     G  29           H8         G  29  -7.394 -18.997  -2.633
  310    H1     G  29           H1         G  29  -2.976 -15.752  -5.963
  311   1H2     G  29          H21         G  29  -2.932 -18.515  -8.038
  312   2H2     G  29          H22         G  29  -2.308 -16.917  -7.691
  313   1H5*    C  30          1H5*        C  30  -3.852 -24.106  -5.461
  314   2H5*    C  30          2H5*        C  30  -2.769 -25.182  -4.557
  315    H4*    C  30           H4*        C  30  -1.566 -23.600  -5.994
  316    H3*    C  30           H3*        C  30  -1.083 -23.466  -3.028
  317    H2*    C  30           H2*        C  30   0.497 -21.695  -3.414
  318   2HO*    C  30          2HO*        C  30   0.155 -21.867  -6.210
  319    H1*    C  30           H1*        C  30  -1.060 -20.369  -5.360
  320   1H4     C  30          H41         C  30  -3.461 -18.502   0.495
  321   2H4     C  30          H42         C  30  -2.445 -17.188  -0.067
  322    H5     C  30           H5         C  30  -3.653 -20.606  -0.675
  323    H6     C  30           H6         C  30  -2.923 -21.879  -2.620
  324   1H5*    U  31          1H5*        U  31   2.954 -24.020  -4.710
  325   2H5*    U  31          2H5*        U  31   3.761 -25.167  -3.622
  326    H4*    U  31           H4*        U  31   5.066 -23.142  -3.899
  327    H3*    U  31           H3*        U  31   3.997 -23.716  -1.154
  328    H2*    U  31           H2*        U  31   5.023 -21.695  -0.350
  329   2HO*    U  31          2HO*        U  31   6.143 -21.344  -2.950
  330    H1*    U  31           H1*        U  31   4.231 -20.107  -2.511
  331    H3     U  31           H3         U  31   1.464 -18.629   0.714
  332    H5     U  31           H5         U  31  -0.054 -22.423  -0.255
  333    H6     U  31           H6         U  31   1.870 -22.749  -1.664
  334    H3T    U  31           H3T        U  31   6.605 -23.647  -2.190
  Start of MODEL   16
    1   1H5*    A   1          1H5*        A   1  -2.782 -11.591   9.501
    2   2H5*    A   1          2H5*        A   1  -3.131 -10.954   7.884
    3    H4*    A   1           H4*        A   1  -0.697 -11.149   8.582
    4    H3*    A   1           H3*        A   1  -1.794 -12.041   5.953
    5    H2*    A   1           H2*        A   1   0.327 -13.002   5.330
    6   2HO*    A   1          2HO*        A   1   1.985 -11.879   6.084
    7    H1*    A   1           H1*        A   1   0.764 -14.345   7.693
    8    H8     A   1           H8         A   1  -2.844 -14.603   7.730
    9   1H6     A   1          H61         A   1  -2.536 -18.916   3.300
   10   2H6     A   1          H62         A   1  -3.560 -18.162   4.501
   11    H2     A   1           H2         A   1   1.460 -16.895   3.555
   12    H5T    A   1           H5T        A   1  -3.659 -13.406   8.948
   13   1H5*    G   2          1H5*        G   2   1.542  -9.794   4.675
   14   2H5*    G   2          2H5*        G   2   1.076  -8.720   3.342
   15    H4*    G   2           H4*        G   2   2.929 -10.283   2.813
   16    H3*    G   2           H3*        G   2   0.440 -10.267   1.132
   17    H2*    G   2           H2*        G   2   1.374 -12.025  -0.225
   18   2HO*    G   2          2HO*        G   2   3.566 -12.686   0.138
   19    H1*    G   2           H1*        G   2   2.365 -13.533   1.921
   20    H8     G   2           H8         G   2  -0.750 -12.515   3.412
   21    H1     G   2           H1         G   2  -1.721 -16.684  -1.365
   22   1H2     G   2          H21         G   2   1.543 -15.961  -2.264
   23   2H2     G   2          H22         G   2   0.083 -16.863  -2.601
   24   1H5*    U   3          1H5*        U   3   3.572  -9.084  -1.964
   25   2H5*    U   3          2H5*        U   3   2.733  -7.809  -2.868
   26    H4*    U   3           H4*        U   3   3.527  -9.506  -4.373
   27    H3*    U   3           H3*        U   3   0.528  -9.382  -4.109
   28    H2*    U   3           H2*        U   3   0.424 -11.100  -5.819
   29   2HO*    U   3          2HO*        U   3   2.684 -10.059  -6.604
   30    H1*    U   3           H1*        U   3   2.362 -12.699  -4.617
   31    H3     U   3           H3         U   3  -1.560 -14.776  -3.689
   32    H5     U   3           H5         U   3  -1.329 -11.641  -0.904
   33    H6     U   3           H6         U   3   0.604 -10.833  -2.089
   34   1H5*    A   4          1H5*        A   4   1.006  -8.037  -8.453
   35   2H5*    A   4          2H5*        A   4  -0.344  -6.906  -8.669
   36    H4*    A   4           H4*        A   4  -0.316  -8.824 -10.251
   37    H3*    A   4           H3*        A   4  -2.737  -8.329  -8.541
   38    H2*    A   4           H2*        A   4  -3.792 -10.252  -9.591
   39   2HO*    A   4          2HO*        A   4  -2.003  -9.695 -11.522
   40    H1*    A   4           H1*        A   4  -1.633 -11.926  -9.191
   41    H8     A   4           H8         A   4  -1.205  -9.809  -6.268
   42   1H6     A   4          H61         A   4  -5.937 -12.696  -3.528
   43   2H6     A   4          H62         A   4  -4.569 -11.632  -3.287
   44    H2     A   4           H2         A   4  -6.007 -13.747  -7.890
   45   1H5*    G   5          1H5*        G   5  -4.940  -7.287 -12.179
   46   2H5*    G   5          2H5*        G   5  -5.806  -5.808 -11.723
   47    H4*    G   5           H4*        G   5  -7.267  -7.734 -12.270
   48    H3*    G   5           H3*        G   5  -7.501  -6.432  -9.567
   49    H2*    G   5           H2*        G   5  -9.298  -7.972  -9.063
   50   2HO*    G   5          2HO*        G   5 -10.248  -9.196 -10.635
   51    H1*    G   5           H1*        G   5  -7.945 -10.225  -9.995
   52    H8     G   5           H8         G   5  -5.129  -8.448  -8.580
   53    H1     G   5           H1         G   5  -9.119 -10.551  -4.015
   54   1H2     G   5          H21         G   5 -11.374 -10.973  -6.592
   55   2H2     G   5          H22         G   5 -11.047 -11.078  -4.876
   56   1H5*    A   6          1H5*        A   6 -11.164  -7.272 -10.534
   57   2H5*    A   6          2H5*        A   6 -12.174  -5.815 -10.607
   58    H4*    A   6           H4*        A   6 -13.156  -7.676  -9.304
   59    H3*    A   6           H3*        A   6 -13.440  -5.054  -8.701
   60    H2*    A   6           H2*        A   6 -11.656  -4.900  -7.078
   61   2HO*    A   6          2HO*        A   6 -13.803  -4.596  -6.033
   62    H1*    A   6           H1*        A   6 -12.468  -7.675  -6.036
   63    H8     A   6           H8         A   6  -9.120  -6.432  -7.441
   64   1H6     A   6          H61         A   6  -6.975  -7.022  -1.664
   65   2H6     A   6          H62         A   6  -6.555  -6.674  -3.331
   66    H2     A   6           H2         A   6 -11.383  -7.859  -1.605
   67   1H5*    A   7          1H5*        A   7 -15.758  -6.909  -5.046
   68   2H5*    A   7          2H5*        A   7 -17.169  -5.846  -4.883
   69    H4*    A   7           H4*        A   7 -16.222  -5.912  -2.758
   70    H3*    A   7           H3*        A   7 -15.411  -3.358  -4.127
   71    H2*    A   7           H2*        A   7 -14.006  -2.828  -2.301
   72   2HO*    A   7          2HO*        A   7 -16.106  -3.934  -0.980
   73    H1*    A   7           H1*        A   7 -13.742  -5.632  -1.409
   74    H8     A   7           H8         A   7 -12.166  -4.478  -4.687
   75   1H6     A   7          H61         A   7  -6.945  -3.867  -1.417
   76   2H6     A   7          H62         A   7  -7.647  -3.842  -3.020
   77    H2     A   7           H2         A   7 -10.293  -4.707   1.446
   78   1H5*    A   8          1H5*        A   8 -17.912  -0.141  -0.707
   79   2H5*    A   8          2H5*        A   8 -16.394   0.575  -1.281
   80    H4*    A   8           H4*        A   8 -17.120  -0.494   1.351
   81    H3*    A   8           H3*        A   8 -15.242   1.621   0.352
   82    H2*    A   8           H2*        A   8 -13.879   1.337   2.313
   83   2HO*    A   8          2HO*        A   8 -14.619  -0.057   4.014
   84    H1*    A   8           H1*        A   8 -13.924  -1.447   2.314
   85    H8     A   8           H8         A   8 -13.802   0.129  -1.166
   86   1H6     A   8          H61         A   8  -7.651  -0.409  -0.692
   87   2H6     A   8          H62         A   8  -8.977   0.001  -1.757
   88    H2     A   8           H2         A   8  -9.454  -1.504   3.265
   89   1H5*    C   9          1H5*        C   9 -16.050   3.221   5.147
   90   2H5*    C   9          2H5*        C   9 -15.610   4.811   4.494
   91    H4*    C   9           H4*        C   9 -14.191   3.561   6.370
   92    H3*    C   9           H3*        C   9 -13.315   5.516   4.290
   93    H2*    C   9           H2*        C   9 -11.001   5.089   4.764
   94   2HO*    C   9          2HO*        C   9 -12.091   3.817   7.062
   95    H1*    C   9           H1*        C   9 -11.189   2.321   4.918
   96   1H4     C   9          H41         C   9 -11.596   3.598  -1.545
   97   2H4     C   9          H42         C   9  -9.925   3.157  -1.225
   98    H5     C   9           H5         C   9 -13.247   3.855   0.219
   99    H6     C   9           H6         C   9 -13.625   3.721   2.621
  100   1H5*    A  10          1H5*        A  10  -9.943   8.370   7.187
  101   2H5*    A  10          2H5*        A  10 -10.230   8.435   5.436
  102    H4*    A  10           H4*        A  10  -8.310   6.753   6.995
  103    H3*    A  10           H3*        A  10  -8.044   8.700   4.734
  104    H2*    A  10           H2*        A  10  -6.285   7.383   3.771
  105   2HO*    A  10          2HO*        A  10  -6.298   5.444   5.772
  106    H1*    A  10           H1*        A  10  -7.478   4.889   4.203
  107    H8     A  10           H8         A  10 -10.428   6.725   3.198
  108   1H6     A  10          H61         A  10  -8.416   6.616  -2.656
  109   2H6     A  10          H62         A  10  -9.787   6.928  -1.615
  110    H2     A  10           H2         A  10  -5.010   5.425   0.007
  111   1H5*    A  11          1H5*        A  11  -3.388  11.289   6.025
  112   2H5*    A  11          2H5*        A  11  -3.751  10.537   4.459
  113    H4*    A  11           H4*        A  11  -1.775   9.705   6.554
  114    H3*    A  11           H3*        A  11  -1.552  10.542   3.690
  115    H2*    A  11           H2*        A  11   0.172   8.920   3.302
  116   2HO*    A  11          2HO*        A  11   1.154   7.831   5.037
  117    H1*    A  11           H1*        A  11  -1.015   6.828   4.718
  118    H8     A  11           H8         A  11  -4.007   8.173   3.205
  119   1H6     A  11          H61         A  11  -2.291   5.730  -2.218
  120   2H6     A  11          H62         A  11  -3.609   6.451  -1.322
  121    H2     A  11           H2         A  11   1.245   5.623   0.535
  122   1H5*    G  12          1H5*        G  12   2.478  10.505   4.533
  123   2H5*    G  12          2H5*        G  12   3.013  12.191   4.395
  124    H4*    G  12           H4*        G  12   4.477  10.739   3.151
  125    H3*    G  12           H3*        G  12   2.860  12.701   1.566
  126    H2*    G  12           H2*        G  12   3.793  11.823  -0.477
  127   2HO*    G  12          2HO*        G  12   5.309   9.845   0.103
  128    H1*    G  12           H1*        G  12   3.456   9.155   0.170
  129    H8     G  12           H8         G  12   0.733  11.427   1.574
  130    H1     G  12           H1         G  12  -0.437   9.019  -4.256
  131   1H2     G  12          H21         G  12   2.824   7.872  -4.111
  132   2H2     G  12          H22         G  12   1.336   7.981  -5.024
  133   1H5*    G  13          1H5*        G  13   6.631  12.457  -0.257
  134   2H5*    G  13          2H5*        G  13   7.249  14.113  -0.409
  135    H4*    G  13           H4*        G  13   7.443  13.030  -2.522
  136    H3*    G  13           H3*        G  13   5.319  15.155  -2.432
  137    H2*    G  13           H2*        G  13   4.852  14.714  -4.755
  138   2HO*    G  13          2HO*        G  13   7.141  14.397  -5.287
  139    H1*    G  13           H1*        G  13   4.913  11.927  -4.505
  140    H8     G  13           H8         G  13   3.333  13.505  -1.471
  141    H1     G  13           H1         G  13  -0.675  12.520  -6.387
  142   1H2     G  13          H21         G  13   2.183  11.820  -8.193
  143   2H2     G  13          H22         G  13   0.439  11.964  -8.181
  144   1H5*    C  14          1H5*        C  14   7.634  16.854  -5.964
  145   2H5*    C  14          2H5*        C  14   7.942  18.454  -5.261
  146    H4*    C  14           H4*        C  14   7.012  18.813  -7.394
  147    H3*    C  14           H3*        C  14   4.983  19.332  -5.225
  148    H2*    C  14           H2*        C  14   3.446  20.002  -6.960
  149   2HO*    C  14          2HO*        C  14   4.910  21.128  -8.298
  150    H1*    C  14           H1*        C  14   4.087  17.860  -8.667
  151   1H4     C  14          H41         C  14  -0.003  15.403  -4.118
  152   2H4     C  14          H42         C  14  -1.053  16.181  -5.292
  153    H5     C  14           H5         C  14   2.402  15.527  -4.232
  154    H6     C  14           H6         C  14   4.297  16.466  -5.444
  155   1H5*    U  15          1H5*        U  15   4.195  23.253  -7.047
  156   2H5*    U  15          2H5*        U  15   4.278  24.207  -5.554
  157    H4*    U  15           H4*        U  15   2.104  24.316  -6.764
  158    H3*    U  15           H3*        U  15   2.223  23.502  -3.879
  159    H2*    U  15           H2*        U  15  -0.175  23.212  -3.886
  160   2HO*    U  15          2HO*        U  15  -0.467  25.059  -5.397
  161    H1*    U  15           H1*        U  15  -0.254  21.738  -6.216
  162    H3     U  15           H3         U  15  -0.628  18.737  -2.798
  163    H5     U  15           H5         U  15   3.496  19.315  -3.333
  164    H6     U  15           H6         U  15   2.971  21.122  -4.833
  165   1H5*    U  16          1H5*        U  16  -0.108  28.079  -2.165
  166   2H5*    U  16          2H5*        U  16  -0.593  26.765  -1.076
  167    H4*    U  16           H4*        U  16  -2.545  27.978  -1.619
  168    H3*    U  16           H3*        U  16  -2.692  25.383  -1.861
  169    H2*    U  16           H2*        U  16  -1.753  25.151  -4.078
  170   2HO*    U  16          2HO*        U  16  -3.444  24.489  -5.288
  171    H1*    U  16           H1*        U  16  -3.482  27.416  -5.157
  172    H3     U  16           H3         U  16  -1.049  26.344  -8.865
  173    H5     U  16           H5         U  16   1.685  28.067  -6.181
  174    H6     U  16           H6         U  16  -0.036  27.977  -4.496
  175   1H5*    C  17          1H5*        C  17  -5.798  24.153  -3.744
  176   2H5*    C  17          2H5*        C  17  -6.916  23.543  -2.510
  177    H4*    C  17           H4*        C  17  -5.890  21.883  -4.177
  178    H3*    C  17           H3*        C  17  -6.849  21.314  -1.684
  179    H2*    C  17           H2*        C  17  -4.725  21.595  -0.536
  180   2HO*    C  17          2HO*        C  17  -3.782  19.334  -0.568
  181    H1*    C  17           H1*        C  17  -3.458  20.127  -2.934
  182   1H4     C  17          H41         C  17   1.688  23.275  -0.414
  183   2H4     C  17          H42         C  17   1.869  21.642   0.212
  184    H5     C  17           H5         C  17  -0.286  24.052  -1.539
  185    H6     C  17           H6         C  17  -2.458  23.399  -2.425
  186   1H5*    G  18          1H5*        G  18  -8.237  21.338  -3.419
  187   2H5*    G  18          2H5*        G  18  -9.787  20.957  -2.646
  188    H4*    G  18           H4*        G  18 -10.853  21.216  -4.558
  189    H3*    G  18           H3*        G  18  -9.111  18.992  -5.477
  190    H2*    G  18           H2*        G  18  -8.965  19.767  -7.664
  191   2HO*    G  18          2HO*        G  18 -11.635  19.774  -7.215
  192    H1*    G  18           H1*        G  18 -10.324  22.387  -7.047
  193    H8     G  18           H8         G  18  -9.405  23.395  -9.229
  194    H1     G  18           H1         G  18  -3.411  21.898  -7.484
  195   1H2     G  18          H21         G  18  -4.914  20.116  -4.937
  196   2H2     G  18          H22         G  18  -3.428  20.613  -5.717
  197   1H5*    G  19          1H5*        G  19  -9.035  15.359  -6.141
  198   2H5*    G  19          2H5*        G  19  -8.551  17.035  -5.826
  199    H4*    G  19           H4*        G  19  -9.417  16.565  -8.568
  200    H3*    G  19           H3*        G  19  -7.387  14.706  -7.508
  201    H2*    G  19           H2*        G  19  -5.671  15.354  -9.028
  202   2HO*    G  19          2HO*        G  19  -6.317  16.824 -10.820
  203    H1*    G  19           H1*        G  19  -6.127  18.087  -9.107
  204    H8     G  19           H8         G  19  -6.696  16.537  -5.670
  205    H1     G  19           H1         G  19  -0.732  18.608  -6.767
  206   1H2     G  19          H21         G  19  -1.781  19.055 -10.016
  207   2H2     G  19          H22         G  19  -0.475  19.161  -8.848
  208   1H5*    C  20          1H5*        C  20  -7.644  13.161 -11.713
  209   2H5*    C  20          2H5*        C  20  -7.887  11.419 -11.476
  210    H4*    C  20           H4*        C  20  -5.955  11.963 -12.907
  211    H3*    C  20           H3*        C  20  -5.593  10.345 -10.418
  212    H2*    C  20           H2*        C  20  -3.205  10.297 -10.758
  213   2HO*    C  20          2HO*        C  20  -3.936  11.323 -13.304
  214    H1*    C  20           H1*        C  20  -2.922  12.986 -11.289
  215   1H4     C  20          H41         C  20  -4.279  12.885  -4.849
  216   2H4     C  20          H42         C  20  -2.540  12.728  -4.948
  217    H5     C  20           H5         C  20  -5.713  12.862  -6.764
  218    H6     C  20           H6         C  20  -5.808  12.734  -9.178
  219   1H5*    C  21          1H5*        C  21  -2.756   8.789 -12.520
  220   2H5*    C  21          2H5*        C  21  -3.172   7.104 -12.890
  221    H4*    C  21           H4*        C  21  -0.961   7.117 -12.057
  222    H3*    C  21           H3*        C  21  -2.941   6.028 -10.074
  223    H2*    C  21           H2*        C  21  -1.148   5.683  -8.518
  224   2HO*    C  21          2HO*        C  21   1.063   6.079  -9.296
  225    H1*    C  21           H1*        C  21   0.213   8.091  -9.118
  226   1H4     C  21          H41         C  21  -4.437   9.774  -4.771
  227   2H4     C  21          H42         C  21  -3.100   9.184  -3.797
  228    H5     C  21           H5         C  21  -4.461   9.634  -7.189
  229    H6     C  21           H6         C  21  -3.204   8.919  -9.158
  230   1H5*    U  22          1H5*        U  22  -1.075   0.916  -9.730
  231   2H5*    U  22          2H5*        U  22  -1.984   1.797  -8.487
  232    H4*    U  22           H4*        U  22   0.902   1.141  -8.653
  233    H3*    U  22           H3*        U  22  -1.174   1.120  -6.496
  234    H2*    U  22           H2*        U  22   0.494   1.632  -4.844
  235   2HO*    U  22          2HO*        U  22   2.663   1.805  -6.515
  236    H1*    U  22           H1*        U  22   1.816   3.587  -6.327
  237    H3     U  22           H3         U  22  -0.512   5.792  -3.086
  238    H5     U  22           H5         U  22  -3.253   5.178  -6.209
  239    H6     U  22           H6         U  22  -1.619   3.759  -7.262
  240   1H5*    G  23          1H5*        G  23  -2.169  -0.637  -3.758
  241   2H5*    G  23          2H5*        G  23  -1.751   0.965  -4.394
  242    H4*    G  23           H4*        G  23   0.004   0.578  -2.281
  243    H3*    G  23           H3*        G  23  -2.556  -0.775  -1.595
  244    H2*    G  23           H2*        G  23  -2.809   0.480   0.435
  245   2HO*    G  23          2HO*        G  23  -1.129   1.483   1.380
  246    H1*    G  23           H1*        G  23  -2.219   2.960  -0.602
  247    H8     G  23           H8         G  23  -3.718   1.639  -3.599
  248    H1     G  23           H1         G  23  -8.120   2.486   0.985
  249   1H2     G  23          H21         G  23  -5.424   2.743   3.129
  250   2H2     G  23          H22         G  23  -7.163   2.759   2.929
  251   1H5*    C  24          1H5*        C  24  -2.724  -2.777   2.583
  252   2H5*    C  24          2H5*        C  24  -3.232  -1.186   1.984
  253    H4*    C  24           H4*        C  24  -1.040  -0.973   3.861
  254    H3*    C  24           H3*        C  24  -3.406  -2.560   4.810
  255    H2*    C  24           H2*        C  24  -3.402  -1.296   6.858
  256   2HO*    C  24          2HO*        C  24  -1.608   0.448   6.858
  257    H1*    C  24           H1*        C  24  -3.046   1.191   5.641
  258   1H4     C  24          H41         C  24  -9.393  -0.098   4.539
  259   2H4     C  24          H42         C  24  -9.339   0.325   6.242
  260    H5     C  24           H5         C  24  -7.404  -0.391   3.196
  261    H6     C  24           H6         C  24  -4.967  -0.343   3.204
  262   1H5*    U  25          1H5*        U  25  -3.122  -3.936   7.292
  263   2H5*    U  25          2H5*        U  25  -3.244  -5.706   7.247
  264    H4*    U  25           H4*        U  25  -5.324  -4.544   7.936
  265    H3*    U  25           H3*        U  25  -5.342  -6.415   5.589
  266    H2*    U  25           H2*        U  25  -7.703  -5.961   5.294
  267   2HO*    U  25          2HO*        U  25  -8.313  -4.102   6.991
  268    H1*    U  25           H1*        U  25  -7.449  -3.217   5.442
  269    H3     U  25           H3         U  25  -7.780  -4.043   0.995
  270    H5     U  25           H5         U  25  -3.750  -4.760   1.925
  271    H6     U  25           H6         U  25  -4.326  -4.536   4.251
  272   1H5*    U  26          1H5*        U  26  -8.521  -8.403   7.717
  273   2H5*    U  26          2H5*        U  26  -8.229 -10.127   7.413
  274    H4*    U  26           H4*        U  26 -10.383  -9.263   6.523
  275    H3*    U  26           H3*        U  26  -8.421 -10.534   4.620
  276    H2*    U  26           H2*        U  26 -10.044 -10.221   2.873
  277   2HO*    U  26          2HO*        U  26 -12.175  -9.707   3.338
  278    H1*    U  26           H1*        U  26 -10.833  -7.641   3.740
  279    H3     U  26           H3         U  26  -8.785  -7.437  -0.374
  280    H5     U  26           H5         U  26  -5.754  -7.005   2.502
  281    H6     U  26           H6         U  26  -7.361  -7.638   4.178
  282   1H5*    U  27          1H5*        U  27 -12.213 -12.673   4.153
  283   2H5*    U  27          2H5*        U  27 -11.837 -14.349   3.707
  284    H4*    U  27           H4*        U  27 -13.304 -13.152   2.101
  285    H3*    U  27           H3*        U  27 -10.723 -14.373   1.173
  286    H2*    U  27           H2*        U  27 -11.193 -13.582  -1.064
  287   2HO*    U  27          2HO*        U  27 -13.713 -12.839   0.069
  288    H1*    U  27           H1*        U  27 -11.832 -11.004  -0.289
  289    H3     U  27           H3         U  27  -7.586 -10.731  -1.874
  290    H5     U  27           H5         U  27  -7.173 -12.107   2.070
  291    H6     U  27           H6         U  27  -9.561 -12.388   2.141
  292   1H5*    U  28          1H5*        U  28 -13.871 -16.466  -1.449
  293   2H5*    U  28          2H5*        U  28 -13.221 -18.113  -1.566
  294    H4*    U  28           H4*        U  28 -13.707 -17.112  -3.752
  295    H3*    U  28           H3*        U  28 -10.861 -17.894  -3.167
  296    H2*    U  28           H2*        U  28 -10.287 -17.190  -5.410
  297   2HO*    U  28          2HO*        U  28 -12.468 -17.949  -6.207
  298    H1*    U  28           H1*        U  28 -11.640 -14.768  -5.238
  299    H3     U  28           H3         U  28  -7.230 -13.761  -4.758
  300    H5     U  28           H5         U  28  -8.512 -14.931  -0.934
  301    H6     U  28           H6         U  28 -10.587 -15.635  -1.929
  302   1H5*    G  29          1H5*        G  29 -10.920 -20.982  -6.059
  303   2H5*    G  29          2H5*        G  29 -10.213 -22.368  -5.206
  304    H4*    G  29           H4*        G  29  -8.808 -21.543  -7.048
  305    H3*    G  29           H3*        G  29  -7.652 -21.448  -4.267
  306    H2*    G  29           H2*        G  29  -5.663 -20.504  -5.170
  307   2HO*    G  29          2HO*        G  29  -5.015 -20.930  -7.215
  308    H1*    G  29           H1*        G  29  -7.001 -19.144  -7.359
  309    H8     G  29           H8         G  29  -8.417 -18.096  -4.088
  310    H1     G  29           H1         G  29  -2.919 -15.135  -5.557
  311   1H2     G  29          H21         G  29  -2.640 -17.522  -8.042
  312   2H2     G  29          H22         G  29  -1.946 -16.124  -7.252
  313   1H5*    C  30          1H5*        C  30  -4.522 -23.227  -6.665
  314   2H5*    C  30          2H5*        C  30  -3.900 -24.554  -5.664
  315    H4*    C  30           H4*        C  30  -2.135 -23.024  -6.359
  316    H3*    C  30           H3*        C  30  -2.687 -23.234  -3.409
  317    H2*    C  30           H2*        C  30  -0.903 -21.668  -3.015
  318   2HO*    C  30          2HO*        C  30   0.005 -22.703  -5.313
  319    H1*    C  30           H1*        C  30  -1.592 -19.946  -5.131
  320   1H4     C  30          H41         C  30  -5.706 -18.497  -0.177
  321   2H4     C  30          H42         C  30  -4.424 -17.301  -0.117
  322    H5     C  30           H5         C  30  -5.691 -20.363  -1.711
  323    H6     C  30           H6         C  30  -4.449 -21.471  -3.494
  324   1H5*    U  31          1H5*        U  31   1.550 -23.463  -4.121
  325   2H5*    U  31          2H5*        U  31   2.223 -24.702  -3.045
  326    H4*    U  31           H4*        U  31   3.364 -22.501  -2.928
  327    H3*    U  31           H3*        U  31   2.171 -23.691  -0.436
  328    H2*    U  31           H2*        U  31   2.971 -21.792   0.798
  329   2HO*    U  31          2HO*        U  31   4.532 -20.459  -0.001
  330    H1*    U  31           H1*        U  31   2.277 -19.892  -1.171
  331    H3     U  31           H3         U  31  -0.544 -19.044   2.269
  332    H5     U  31           H5         U  31  -2.176 -22.405   0.352
  333    H6     U  31           H6         U  31  -0.177 -22.518  -0.986
  334    H3T    U  31           H3T        U  31   4.842 -23.240  -0.757
  Start of MODEL   17
    1   1H5*    A   1          1H5*        A   1   1.784 -11.709   6.963
    2   2H5*    A   1          2H5*        A   1   1.362 -13.395   7.313
    3    H4*    A   1           H4*        A   1   4.166 -12.657   6.580
    4    H3*    A   1           H3*        A   1   1.888 -12.856   4.627
    5    H2*    A   1           H2*        A   1   3.363 -14.053   3.128
    6   2HO*    A   1          2HO*        A   1   5.496 -13.900   3.315
    7    H1*    A   1           H1*        A   1   4.344 -15.772   5.080
    8    H8     A   1           H8         A   1   0.712 -14.890   5.730
    9   1H6     A   1          H61         A   1  -0.711 -19.761   2.186
   10   2H6     A   1          H62         A   1  -1.343 -18.538   3.265
   11    H2     A   1           H2         A   1   3.710 -19.068   1.888
   12    H5T    A   1           H5T        A   1   2.977 -11.617   8.716
   13   1H5*    G   2          1H5*        G   2   4.816 -10.713   2.093
   14   2H5*    G   2          2H5*        G   2   3.852  -9.532   1.186
   15    H4*    G   2           H4*        G   2   5.145 -11.133  -0.216
   16    H3*    G   2           H3*        G   2   2.159 -10.944  -0.553
   17    H2*    G   2           H2*        G   2   2.296 -12.609  -2.272
   18   2HO*    G   2          2HO*        G   2   4.763 -11.537  -2.541
   19    H1*    G   2           H1*        G   2   4.277 -14.177  -0.969
   20    H8     G   2           H8         G   2   1.907 -13.488   1.702
   21    H1     G   2           H1         G   2  -0.454 -17.672  -2.546
   22   1H2     G   2          H21         G   2   2.161 -16.662  -4.573
   23   2H2     G   2          H22         G   2   0.756 -17.682  -4.365
   24   1H5*    U   3          1H5*        U   3   3.879 -10.142  -4.704
   25   2H5*    U   3          2H5*        U   3   2.788  -8.890  -5.326
   26    H4*    U   3           H4*        U   3   2.989 -10.737  -6.885
   27    H3*    U   3           H3*        U   3   0.268 -10.356  -5.651
   28    H2*    U   3           H2*        U   3  -0.520 -12.180  -7.011
   29   2HO*    U   3          2HO*        U   3   2.053 -12.271  -8.232
   30    H1*    U   3           H1*        U   3   1.742 -13.800  -6.578
   31    H3     U   3           H3         U   3  -1.425 -16.012  -4.273
   32    H5     U   3           H5         U   3  -0.671 -12.603  -1.939
   33    H6     U   3           H6         U   3   0.729 -11.789  -3.719
   34   1H5*    A   4          1H5*        A   4  -0.317  -9.939 -10.289
   35   2H5*    A   4          2H5*        A   4  -1.263  -8.439 -10.276
   36    H4*    A   4           H4*        A   4  -2.195 -10.108 -11.787
   37    H3*    A   4           H3*        A   4  -3.888  -9.209  -9.481
   38    H2*    A   4           H2*        A   4  -5.645 -10.712 -10.231
   39   2HO*    A   4          2HO*        A   4  -4.529 -12.118 -12.142
   40    H1*    A   4           H1*        A   4  -4.006 -12.904 -10.349
   41    H8     A   4           H8         A   4  -2.173 -11.055  -7.800
   42   1H6     A   4          H61         A   4  -6.463 -12.715  -3.658
   43   2H6     A   4          H62         A   4  -4.860 -12.048  -3.877
   44    H2     A   4           H2         A   4  -8.075 -13.572  -7.756
   45   1H5*    G   5          1H5*        G   5  -6.597  -7.339 -12.387
   46   2H5*    G   5          2H5*        G   5  -6.956  -5.770 -11.641
   47    H4*    G   5           H4*        G   5  -8.916  -7.259 -11.883
   48    H3*    G   5           H3*        G   5  -8.182  -6.330  -9.110
   49    H2*    G   5           H2*        G   5 -10.156  -7.491  -8.322
   50   2HO*    G   5          2HO*        G   5 -10.735  -8.318 -10.970
   51    H1*    G   5           H1*        G   5  -9.632  -9.820  -9.774
   52    H8     G   5           H8         G   5  -6.259  -8.779  -8.791
   53    H1     G   5           H1         G   5  -9.686 -11.001  -3.840
   54   1H2     G   5          H21         G   5 -12.390 -10.691  -5.960
   55   2H2     G   5          H22         G   5 -11.799 -11.142  -4.376
   56   1H5*    A   6          1H5*        A   6 -12.034  -6.467  -9.389
   57   2H5*    A   6          2H5*        A   6 -12.806  -4.902  -9.079
   58    H4*    A   6           H4*        A   6 -13.841  -6.824  -7.900
   59    H3*    A   6           H3*        A   6 -13.670  -4.311  -6.916
   60    H2*    A   6           H2*        A   6 -11.644  -4.634  -5.624
   61   2HO*    A   6          2HO*        A   6 -13.540  -4.186  -4.210
   62    H1*    A   6           H1*        A   6 -12.742  -7.395  -4.823
   63    H8     A   6           H8         A   6  -9.439  -6.382  -6.498
   64   1H6     A   6          H61         A   6  -6.700  -8.199  -1.255
   65   2H6     A   6          H62         A   6  -6.452  -7.631  -2.897
   66    H2     A   6           H2         A   6 -11.145  -8.486  -0.672
   67   1H5*    A   7          1H5*        A   7 -15.314  -6.370  -3.235
   68   2H5*    A   7          2H5*        A   7 -16.766  -5.457  -2.780
   69    H4*    A   7           H4*        A   7 -15.596  -5.563  -0.801
   70    H3*    A   7           H3*        A   7 -14.972  -2.933  -2.115
   71    H2*    A   7           H2*        A   7 -13.337  -2.473  -0.474
   72   2HO*    A   7          2HO*        A   7 -15.163  -3.138   1.132
   73    H1*    A   7           H1*        A   7 -12.921  -5.300   0.254
   74    H8     A   7           H8         A   7 -11.841  -4.060  -3.182
   75   1H6     A   7          H61         A   7  -6.237  -3.323  -0.628
   76   2H6     A   7          H62         A   7  -7.139  -3.300  -2.129
   77    H2     A   7           H2         A   7  -9.143  -4.294   2.636
   78   1H5*    A   8          1H5*        A   8 -16.644   0.311   1.413
   79   2H5*    A   8          2H5*        A   8 -15.138   0.942   0.718
   80    H4*    A   8           H4*        A   8 -15.667  -0.240   3.340
   81    H3*    A   8           H3*        A   8 -13.651   1.694   2.235
   82    H2*    A   8           H2*        A   8 -12.166   1.146   4.039
   83   2HO*    A   8          2HO*        A   8 -12.880   0.230   5.883
   84    H1*    A   8           H1*        A   8 -12.638  -1.619   3.977
   85    H8     A   8           H8         A   8 -12.418   0.034   0.549
   86   1H6     A   8          H61         A   8  -6.387  -1.354   0.744
   87   2H6     A   8          H62         A   8  -7.687  -0.738  -0.251
   88    H2     A   8           H2         A   8  -8.163  -2.299   4.754
   89   1H5*    C   9          1H5*        C   9 -14.019   3.459   7.289
   90   2H5*    C   9          2H5*        C   9 -13.194   4.792   6.457
   91    H4*    C   9           H4*        C   9 -12.118   3.203   8.409
   92    H3*    C   9           H3*        C   9 -10.869   5.040   6.406
   93    H2*    C   9           H2*        C   9  -8.687   4.156   6.909
   94   2HO*    C   9          2HO*        C   9  -8.696   2.400   8.622
   95    H1*    C   9           H1*        C   9  -9.421   1.481   6.880
   96   1H4     C   9          H41         C   9  -9.443   3.257   0.520
   97   2H4     C   9          H42         C   9  -7.880   2.511   0.822
   98    H5     C   9           H5         C   9 -11.070   3.664   2.279
   99    H6     C   9           H6         C   9 -11.519   3.432   4.661
  100   1H5*    A  10          1H5*        A  10  -8.436   8.926   8.890
  101   2H5*    A  10          2H5*        A  10  -8.138   8.129   7.333
  102    H4*    A  10           H4*        A  10  -6.634   7.880   9.914
  103    H3*    A  10           H3*        A  10  -5.941   8.877   7.196
  104    H2*    A  10           H2*        A  10  -3.814   7.772   7.209
  105   2HO*    A  10          2HO*        A  10  -2.822   7.583   9.076
  106    H1*    A  10           H1*        A  10  -4.658   5.353   8.259
  107    H8     A  10           H8         A  10  -7.609   6.036   6.277
  108   1H6     A  10          H61         A  10  -4.438   4.565   1.169
  109   2H6     A  10          H62         A  10  -6.028   4.858   1.837
  110    H2     A  10           H2         A  10  -1.506   5.108   4.516
  111   1H5*    A  11          1H5*        A  11  -2.167  12.297   7.622
  112   2H5*    A  11          2H5*        A  11  -2.606  11.367   6.176
  113    H4*    A  11           H4*        A  11  -0.348  10.943   8.099
  114    H3*    A  11           H3*        A  11  -0.519  11.490   5.166
  115    H2*    A  11           H2*        A  11   1.283   9.976   4.714
  116   2HO*    A  11          2HO*        A  11   2.372  10.763   6.770
  117    H1*    A  11           H1*        A  11   0.484   7.953   6.462
  118    H8     A  11           H8         A  11  -2.784   8.880   5.233
  119   1H6     A  11          H61         A  11  -1.527   6.014  -0.108
  120   2H6     A  11          H62         A  11  -2.786   6.718   0.881
  121    H2     A  11           H2         A  11   2.316   6.493   2.150
  122   1H5*    G  12          1H5*        G  12   3.453  11.853   5.493
  123   2H5*    G  12          2H5*        G  12   3.893  13.552   5.227
  124    H4*    G  12           H4*        G  12   5.311  12.210   3.885
  125    H3*    G  12           H3*        G  12   3.320  13.867   2.424
  126    H2*    G  12           H2*        G  12   3.808  12.826   0.321
  127   2HO*    G  12          2HO*        G  12   6.181  12.358   1.584
  128    H1*    G  12           H1*        G  12   3.905  10.215   1.202
  129    H8     G  12           H8         G  12   1.306  11.859   3.315
  130    H1     G  12           H1         G  12  -0.742  10.188  -2.526
  131   1H2     G  12          H21         G  12   2.602   9.700  -3.232
  132   2H2     G  12          H22         G  12   0.951   9.655  -3.810
  133   1H5*    G  13          1H5*        G  13   6.219  13.292  -0.061
  134   2H5*    G  13          2H5*        G  13   6.868  14.773  -0.787
  135    H4*    G  13           H4*        G  13   6.196  13.167  -2.486
  136    H3*    G  13           H3*        G  13   4.689  15.761  -2.363
  137    H2*    G  13           H2*        G  13   3.330  15.041  -4.186
  138   2HO*    G  13          2HO*        G  13   4.615  12.703  -4.794
  139    H1*    G  13           H1*        G  13   3.381  12.265  -3.490
  140    H8     G  13           H8         G  13   2.240  14.192  -0.545
  141    H1     G  13           H1         G  13  -2.377  13.192  -4.900
  142   1H2     G  13          H21         G  13   0.207  12.194  -6.962
  143   2H2     G  13          H22         G  13  -1.512  12.462  -6.768
  144   1H5*    C  14          1H5*        C  14   5.982  15.786  -6.731
  145   2H5*    C  14          2H5*        C  14   5.882  17.526  -7.064
  146    H4*    C  14           H4*        C  14   4.323  16.122  -8.398
  147    H3*    C  14           H3*        C  14   3.185  18.302  -6.648
  148    H2*    C  14           H2*        C  14   1.022  17.748  -7.572
  149   2HO*    C  14          2HO*        C  14   2.432  15.935  -9.279
  150    H1*    C  14           H1*        C  14   1.396  14.966  -7.325
  151   1H4     C  14          H41         C  14  -0.215  17.439  -1.382
  152   2H4     C  14          H42         C  14  -1.682  16.751  -2.067
  153    H5     C  14           H5         C  14   1.881  17.541  -2.624
  154    H6     C  14           H6         C  14   2.968  16.940  -4.769
  155   1H5*    U  15          1H5*        U  15   2.054  21.005 -10.024
  156   2H5*    U  15          2H5*        U  15   2.671  22.487  -9.268
  157    H4*    U  15           H4*        U  15   0.164  22.298  -9.657
  158    H3*    U  15           H3*        U  15   1.290  23.138  -6.984
  159    H2*    U  15           H2*        U  15  -0.967  23.396  -6.226
  160   2HO*    U  15          2HO*        U  15  -1.972  22.673  -8.767
  161    H1*    U  15           H1*        U  15  -1.897  21.019  -7.380
  162    H3     U  15           H3         U  15  -1.885  20.223  -2.913
  163    H5     U  15           H5         U  15   2.118  19.768  -4.098
  164    H6     U  15           H6         U  15   1.493  20.614  -6.263
  165   1H5*    U  16          1H5*        U  16  -0.717  28.062  -8.458
  166   2H5*    U  16          2H5*        U  16  -1.701  27.933  -6.988
  167    H4*    U  16           H4*        U  16  -3.199  28.532  -8.667
  168    H3*    U  16           H3*        U  16  -3.829  26.346  -7.334
  169    H2*    U  16           H2*        U  16  -2.763  24.663  -8.658
  170   2HO*    U  16          2HO*        U  16  -4.528  23.685  -9.310
  171    H1*    U  16           H1*        U  16  -3.490  25.926 -11.311
  172    H3     U  16           H3         U  16  -0.746  22.533 -12.570
  173    H5     U  16           H5         U  16   1.740  25.378 -10.739
  174    H6     U  16           H6         U  16  -0.247  26.522 -10.003
  175   1H5*    C  17          1H5*        C  17  -6.560  24.198  -8.482
  176   2H5*    C  17          2H5*        C  17  -7.996  25.211  -8.256
  177    H4*    C  17           H4*        C  17  -8.369  23.012  -7.421
  178    H3*    C  17           H3*        C  17  -9.240  25.071  -6.034
  179    H2*    C  17           H2*        C  17  -7.107  25.622  -4.971
  180   2HO*    C  17          2HO*        C  17  -7.466  25.173  -2.817
  181    H1*    C  17           H1*        C  17  -6.850  22.709  -4.094
  182   1H4     C  17          H41         C  17  -0.664  24.976  -4.514
  183   2H4     C  17          H42         C  17  -0.954  24.631  -2.805
  184    H5     C  17           H5         C  17  -2.434  24.908  -6.172
  185    H6     C  17           H6         C  17  -4.776  24.367  -6.572
  186   1H5*    G  18          1H5*        G  18 -10.466  23.845  -7.402
  187   2H5*    G  18          2H5*        G  18 -12.156  23.952  -7.921
  188    H4*    G  18           H4*        G  18 -12.265  21.744  -8.520
  189    H3*    G  18           H3*        G  18  -9.999  21.144  -6.633
  190    H2*    G  18           H2*        G  18  -9.236  19.469  -8.100
  191   2HO*    G  18          2HO*        G  18 -11.692  19.355  -9.483
  192    H1*    G  18           H1*        G  18 -10.600  20.631 -10.456
  193    H8     G  18           H8         G  18  -8.850  21.002 -12.257
  194    H1     G  18           H1         G  18  -4.112  20.903  -7.931
  195   1H2     G  18          H21         G  18  -6.641  20.733  -5.591
  196   2H2     G  18          H22         G  18  -4.923  20.785  -5.906
  197   1H5*    G  19          1H5*        G  19 -11.068  15.794  -5.949
  198   2H5*    G  19          2H5*        G  19 -10.048  16.887  -5.002
  199    H4*    G  19           H4*        G  19 -10.389  17.165  -7.971
  200    H3*    G  19           H3*        G  19  -8.664  15.186  -6.587
  201    H2*    G  19           H2*        G  19  -6.681  15.890  -7.718
  202   2HO*    G  19          2HO*        G  19  -7.808  16.040  -9.792
  203    H1*    G  19           H1*        G  19  -7.151  18.641  -7.692
  204    H8     G  19           H8         G  19  -8.351  17.845  -4.373
  205    H1     G  19           H1         G  19  -1.972  17.431  -4.791
  206   1H2     G  19          H21         G  19  -2.496  17.427  -8.197
  207   2H2     G  19          H22         G  19  -1.353  17.365  -6.864
  208   1H5*    C  20          1H5*        C  20  -8.138  13.879 -10.821
  209   2H5*    C  20          2H5*        C  20  -8.193  12.106 -10.766
  210    H4*    C  20           H4*        C  20  -6.112  12.951 -11.729
  211    H3*    C  20           H3*        C  20  -6.051  11.220  -9.310
  212    H2*    C  20           H2*        C  20  -3.705  11.569  -8.976
  213   2HO*    C  20          2HO*        C  20  -2.739  11.499 -10.902
  214    H1*    C  20           H1*        C  20  -3.636  14.294  -9.526
  215   1H4     C  20          H41         C  20  -6.230  13.894  -3.453
  216   2H4     C  20          H42         C  20  -4.564  14.426  -3.273
  217    H5     C  20           H5         C  20  -7.194  13.295  -5.622
  218    H6     C  20           H6         C  20  -6.681  13.039  -8.031
  219   1H5*    C  21          1H5*        C  21  -3.151   9.704 -11.333
  220   2H5*    C  21          2H5*        C  21  -3.153   7.949 -11.592
  221    H4*    C  21           H4*        C  21  -1.154   8.824 -10.414
  222    H3*    C  21           H3*        C  21  -2.765   6.578  -9.391
  223    H2*    C  21           H2*        C  21  -2.323   7.050  -7.142
  224   2HO*    C  21          2HO*        C  21   0.045   6.435  -8.226
  225    H1*    C  21           H1*        C  21  -0.466   9.344  -7.933
  226   1H4     C  21          H41         C  21  -3.965  11.386  -2.710
  227   2H4     C  21          H42         C  21  -2.472  10.770  -2.021
  228    H5     C  21           H5         C  21  -4.506  11.150  -5.048
  229    H6     C  21           H6         C  21  -3.747  10.337  -7.192
  230   1H5*    U  22          1H5*        U  22  -1.460   3.178  -7.446
  231   2H5*    U  22          2H5*        U  22  -2.191   4.794  -7.425
  232    H4*    U  22           H4*        U  22   0.339   4.565  -5.955
  233    H3*    U  22           H3*        U  22  -1.953   2.811  -5.147
  234    H2*    U  22           H2*        U  22  -1.689   3.493  -2.858
  235   2HO*    U  22          2HO*        U  22   0.218   5.196  -2.715
  236    H1*    U  22           H1*        U  22  -1.327   6.208  -3.380
  237    H3     U  22           H3         U  22  -5.483   6.092  -1.651
  238    H5     U  22           H5         U  22  -5.959   4.642  -5.563
  239    H6     U  22           H6         U  22  -3.562   4.642  -5.771
  240   1H5*    G  23          1H5*        G  23   1.856   0.222  -2.189
  241   2H5*    G  23          2H5*        G  23   0.302  -0.516  -1.754
  242    H4*    G  23           H4*        G  23   2.040   1.154  -0.196
  243    H3*    G  23           H3*        G  23  -0.318  -0.585   0.386
  244    H2*    G  23           H2*        G  23  -0.798   0.644   2.401
  245   2HO*    G  23          2HO*        G  23   1.807   1.631   1.924
  246    H1*    G  23           H1*        G  23  -0.603   3.153   1.289
  247    H8     G  23           H8         G  23  -1.792   1.481  -1.683
  248    H1     G  23           H1         G  23  -6.365   1.762   2.806
  249   1H2     G  23          H21         G  23  -3.776   2.555   4.962
  250   2H2     G  23          H22         G  23  -5.492   2.275   4.756
  251   1H5*    C  24          1H5*        C  24  -0.667  -2.682   4.199
  252   2H5*    C  24          2H5*        C  24  -1.389  -1.116   3.783
  253    H4*    C  24           H4*        C  24   0.568  -0.968   5.945
  254    H3*    C  24           H3*        C  24  -1.769  -2.821   6.310
  255    H2*    C  24           H2*        C  24  -2.125  -1.882   8.500
  256   2HO*    C  24          2HO*        C  24   0.212  -1.708   8.912
  257    H1*    C  24           H1*        C  24  -1.798   0.779   7.708
  258   1H4     C  24          H41         C  24  -7.854  -0.687   5.622
  259   2H4     C  24          H42         C  24  -8.034  -0.572   7.364
  260    H5     C  24           H5         C  24  -5.708  -0.615   4.517
  261    H6     C  24           H6         C  24  -3.301  -0.416   4.846
  262   1H5*    U  25          1H5*        U  25  -2.199  -4.149   8.181
  263   2H5*    U  25          2H5*        U  25  -1.700  -5.844   8.339
  264    H4*    U  25           H4*        U  25  -4.065  -5.787   8.393
  265    H3*    U  25           H3*        U  25  -2.999  -6.849   5.784
  266    H2*    U  25           H2*        U  25  -5.262  -7.203   5.081
  267   2HO*    U  25          2HO*        U  25  -6.324  -8.004   6.816
  268    H1*    U  25           H1*        U  25  -6.250  -4.784   6.143
  269    H3     U  25           H3         U  25  -6.650  -4.449   1.660
  270    H5     U  25           H5         U  25  -2.628  -3.535   2.457
  271    H6     U  25           H6         U  25  -3.002  -4.239   4.730
  272   1H5*    U  26          1H5*        U  26  -5.909  -9.498   7.922
  273   2H5*    U  26          2H5*        U  26  -5.570 -11.188   7.503
  274    H4*    U  26           H4*        U  26  -7.933 -10.643   7.272
  275    H3*    U  26           H3*        U  26  -6.494 -11.385   4.728
  276    H2*    U  26           H2*        U  26  -8.630 -11.235   3.612
  277   2HO*    U  26          2HO*        U  26  -9.536 -11.435   6.249
  278    H1*    U  26           H1*        U  26  -9.374  -8.847   4.881
  279    H3     U  26           H3         U  26  -8.538  -7.608   0.611
  280    H5     U  26           H5         U  26  -4.738  -8.077   2.348
  281    H6     U  26           H6         U  26  -5.827  -8.998   4.285
  282   1H5*    U  27          1H5*        U  27 -10.054 -13.442   5.285
  283   2H5*    U  27          2H5*        U  27 -10.051 -15.102   4.658
  284    H4*    U  27           H4*        U  27 -11.901 -13.694   3.808
  285    H3*    U  27           H3*        U  27  -9.986 -14.948   1.858
  286    H2*    U  27           H2*        U  27 -11.307 -13.993   0.063
  287   2HO*    U  27          2HO*        U  27 -13.396 -14.012   0.685
  288    H1*    U  27           H1*        U  27 -11.365 -11.454   1.167
  289    H3     U  27           H3         U  27  -8.222 -11.501  -2.149
  290    H5     U  27           H5         U  27  -6.216 -12.666   1.348
  291    H6     U  27           H6         U  27  -8.358 -12.883   2.410
  292   1H5*    U  28          1H5*        U  28 -13.682 -16.665   0.207
  293   2H5*    U  28          2H5*        U  28 -13.257 -18.378   0.032
  294    H4*    U  28           H4*        U  28 -14.037 -17.500  -2.065
  295    H3*    U  28           H3*        U  28 -11.095 -18.166  -2.043
  296    H2*    U  28           H2*        U  28 -11.101 -17.639  -4.413
  297   2HO*    U  28          2HO*        U  28 -13.923 -17.412  -4.009
  298    H1*    U  28           H1*        U  28 -12.429 -15.222  -4.042
  299    H3     U  28           H3         U  28  -8.016 -14.268  -4.730
  300    H5     U  28           H5         U  28  -8.368 -15.054  -0.619
  301    H6     U  28           H6         U  28 -10.612 -15.819  -1.037
  302   1H5*    G  29          1H5*        G  29 -11.719 -21.528  -4.605
  303   2H5*    G  29          2H5*        G  29 -10.700 -22.786  -3.879
  304    H4*    G  29           H4*        G  29  -9.960 -22.015  -6.123
  305    H3*    G  29           H3*        G  29  -8.025 -21.745  -3.823
  306    H2*    G  29           H2*        G  29  -6.434 -20.866  -5.371
  307   2HO*    G  29          2HO*        G  29  -8.018 -22.319  -7.165
  308    H1*    G  29           H1*        G  29  -8.416 -19.546  -7.015
  309    H8     G  29           H8         G  29  -8.921 -18.416  -3.557
  310    H1     G  29           H1         G  29  -3.855 -15.642  -6.346
  311   1H2     G  29          H21         G  29  -4.214 -18.087  -8.765
  312   2H2     G  29          H22         G  29  -3.328 -16.691  -8.194
  313   1H5*    C  30          1H5*        C  30  -5.877 -22.863  -7.035
  314   2H5*    C  30          2H5*        C  30  -5.118 -24.424  -6.664
  315    H4*    C  30           H4*        C  30  -3.450 -23.041  -7.602
  316    H3*    C  30           H3*        C  30  -3.113 -23.371  -4.629
  317    H2*    C  30           H2*        C  30  -1.147 -21.995  -4.752
  318   2HO*    C  30          2HO*        C  30  -1.158 -21.495  -7.444
  319    H1*    C  30           H1*        C  30  -2.236 -20.143  -6.593
  320   1H4     C  30          H41         C  30  -4.360 -18.290  -0.626
  321   2H4     C  30          H42         C  30  -2.985 -17.266  -1.002
  322    H5     C  30           H5         C  30  -5.064 -20.116  -2.050
  323    H6     C  30           H6         C  30  -4.590 -21.338  -4.107
  324   1H5*    U  31          1H5*        U  31   0.516 -23.468  -5.982
  325   2H5*    U  31          2H5*        U  31   1.109 -25.140  -5.943
  326    H4*    U  31           H4*        U  31   2.933 -23.919  -5.236
  327    H3*    U  31           H3*        U  31   1.492 -24.986  -2.826
  328    H2*    U  31           H2*        U  31   3.100 -23.890  -1.415
  329   2HO*    U  31          2HO*        U  31   4.916 -24.405  -2.825
  330    H1*    U  31           H1*        U  31   3.149 -21.492  -2.873
  331    H3     U  31           H3         U  31   0.989 -20.380   0.941
  332    H5     U  31           H5         U  31  -1.887 -22.416  -1.344
  333    H6     U  31           H6         U  31  -0.140 -22.978  -2.902
  334    H3T    U  31           H3T        U  31   4.014 -25.713  -3.195
  Start of MODEL   18
    1   1H5*    A   1          1H5*        A   1   4.165 -16.813   7.490
    2   2H5*    A   1          2H5*        A   1   3.100 -15.961   6.356
    3    H4*    A   1           H4*        A   1   5.190 -17.209   5.479
    4    H3*    A   1           H3*        A   1   2.484 -17.164   4.194
    5    H2*    A   1           H2*        A   1   3.263 -18.706   2.506
    6   2HO*    A   1          2HO*        A   1   5.539 -17.577   2.845
    7    H1*    A   1           H1*        A   1   4.495 -20.454   4.265
    8    H8     A   1           H8         A   1   1.728 -19.511   6.402
    9   1H6     A   1          H61         A   1  -2.045 -23.013   2.962
   10   2H6     A   1          H62         A   1  -1.871 -22.141   4.467
   11    H2     A   1           H2         A   1   1.796 -22.478   0.709
   12    H5T    A   1           H5T        A   1   2.728 -18.473   7.604
   13   1H5*    G   2          1H5*        G   2   4.995 -15.606   0.775
   14   2H5*    G   2          2H5*        G   2   3.998 -14.298   0.108
   15    H4*    G   2           H4*        G   2   4.642 -16.063  -1.523
   16    H3*    G   2           H3*        G   2   1.771 -15.330  -1.086
   17    H2*    G   2           H2*        G   2   1.050 -17.090  -2.527
   18   2HO*    G   2          2HO*        G   2   3.791 -17.370  -3.285
   19    H1*    G   2           H1*        G   2   2.988 -18.995  -1.761
   20    H8     G   2           H8         G   2   1.833 -17.597   1.425
   21    H1     G   2           H1         G   2  -2.460 -21.554  -1.219
   22   1H2     G   2          H21         G   2  -0.535 -21.237  -4.081
   23   2H2     G   2          H22         G   2  -1.942 -21.951  -3.322
   24   1H5*    U   3          1H5*        U   3   3.001 -15.151  -5.594
   25   2H5*    U   3          2H5*        U   3   1.848 -14.028  -6.341
   26    H4*    U   3           H4*        U   3   2.071 -16.218  -7.496
   27    H3*    U   3           H3*        U   3  -0.608 -15.247  -6.557
   28    H2*    U   3           H2*        U   3  -1.617 -17.283  -7.357
   29   2HO*    U   3          2HO*        U   3  -0.538 -17.596  -9.282
   30    H1*    U   3           H1*        U   3   0.351 -18.996  -6.365
   31    H3     U   3           H3         U   3  -3.042 -19.776  -3.511
   32    H5     U   3           H5         U   3  -1.596 -16.002  -2.364
   33    H6     U   3           H6         U   3  -0.164 -16.049  -4.296
   34   1H5*    A   4          1H5*        A   4  -1.697 -15.990 -10.835
   35   2H5*    A   4          2H5*        A   4  -2.046 -14.323 -11.330
   36    H4*    A   4           H4*        A   4  -3.814 -15.683 -12.098
   37    H3*    A   4           H3*        A   4  -4.542 -13.861  -9.855
   38    H2*    A   4           H2*        A   4  -6.764 -14.805  -9.730
   39   2HO*    A   4          2HO*        A   4  -6.933 -16.781 -11.302
   40    H1*    A   4           H1*        A   4  -5.962 -17.389  -9.576
   41    H8     A   4           H8         A   4  -2.929 -15.823  -8.220
   42   1H6     A   4          H61         A   4  -5.879 -15.146  -2.821
   43   2H6     A   4          H62         A   4  -4.331 -15.087  -3.633
   44    H2     A   4           H2         A   4  -8.921 -16.206  -5.956
   45   1H5*    G   5          1H5*        G   5  -7.336 -11.962 -12.734
   46   2H5*    G   5          2H5*        G   5  -7.193 -10.240 -12.334
   47    H4*    G   5           H4*        G   5  -9.435 -11.229 -11.934
   48    H3*    G   5           H3*        G   5  -8.029  -9.891  -9.635
   49    H2*    G   5           H2*        G   5  -9.959 -10.444  -8.257
   50   2HO*    G   5          2HO*        G   5 -11.223 -11.853 -10.315
   51    H1*    G   5           H1*        G   5 -10.066 -13.090  -9.053
   52    H8     G   5           H8         G   5  -6.448 -12.388  -9.205
   53    H1     G   5           H1         G   5  -8.623 -13.028  -3.205
   54   1H2     G   5          H21         G   5 -11.753 -12.771  -4.623
   55   2H2     G   5          H22         G   5 -10.801 -12.965  -3.168
   56   1H5*    A   6          1H5*        A   6 -11.747  -9.408  -9.737
   57   2H5*    A   6          2H5*        A   6 -12.558  -7.895  -9.302
   58    H4*    A   6           H4*        A   6 -13.217  -9.953  -7.995
   59    H3*    A   6           H3*        A   6 -13.246  -7.391  -7.055
   60    H2*    A   6           H2*        A   6 -11.128  -7.396  -5.927
   61   2HO*    A   6          2HO*        A   6 -11.511  -8.056  -3.739
   62    H1*    A   6           H1*        A   6 -11.547 -10.343  -5.134
   63    H8     A   6           H8         A   6  -8.739  -9.153  -7.368
   64   1H6     A   6          H61         A   6  -5.114  -9.552  -2.370
   65   2H6     A   6          H62         A   6  -5.155  -9.328  -4.111
   66    H2     A   6           H2         A   6  -9.371 -10.031  -1.040
   67   1H5*    A   7          1H5*        A   7 -14.819  -8.891  -3.093
   68   2H5*    A   7          2H5*        A   7 -16.293  -7.929  -2.871
   69    H4*    A   7           H4*        A   7 -14.956  -7.507  -0.993
   70    H3*    A   7           H3*        A   7 -14.909  -5.214  -2.924
   71    H2*    A   7           H2*        A   7 -13.193  -4.145  -1.710
   72   2HO*    A   7          2HO*        A   7 -12.948  -4.699   0.584
   73    H1*    A   7           H1*        A   7 -12.230  -6.591  -0.377
   74    H8     A   7           H8         A   7 -11.814  -6.144  -4.136
   75   1H6     A   7          H61         A   7  -6.135  -4.052  -2.837
   76   2H6     A   7          H62         A   7  -7.237  -4.527  -4.111
   77    H2     A   7           H2         A   7  -8.351  -4.569   1.032
   78   1H5*    A   8          1H5*        A   8 -15.962  -0.989  -0.559
   79   2H5*    A   8          2H5*        A   8 -14.543  -1.788  -1.263
   80    H4*    A   8           H4*        A   8 -14.949  -1.487   1.703
   81    H3*    A   8           H3*        A   8 -13.788   0.540  -0.179
   82    H2*    A   8           H2*        A   8 -11.993   0.949   1.355
   83   2HO*    A   8          2HO*        A   8 -13.775  -0.316   3.141
   84    H1*    A   8           H1*        A   8 -11.584  -1.734   2.083
   85    H8     A   8           H8         A   8 -12.245  -1.077  -1.627
   86   1H6     A   8          H61         A   8  -6.084  -0.803  -2.191
   87   2H6     A   8          H62         A   8  -7.608  -0.812  -3.049
   88    H2     A   8           H2         A   8  -7.083  -1.096   2.184
   89   1H5*    C   9          1H5*        C   9 -14.151   3.948   4.288
   90   2H5*    C   9          2H5*        C   9 -13.203   4.571   2.925
   91    H4*    C   9           H4*        C   9 -12.336   3.489   5.480
   92    H3*    C   9           H3*        C   9 -11.168   5.313   3.418
   93    H2*    C   9           H2*        C   9  -8.941   4.736   4.095
   94   2HO*    C   9          2HO*        C   9  -9.989   3.112   6.177
   95    H1*    C   9           H1*        C   9  -9.365   1.993   4.330
   96   1H4     C   9          H41         C   9  -9.030   2.928  -2.183
   97   2H4     C   9          H42         C   9  -7.385   2.607  -1.646
   98    H5     C   9           H5         C   9 -10.880   3.199  -0.619
   99    H6     C   9           H6         C   9 -11.505   3.203   1.736
  100   1H5*    A  10          1H5*        A  10  -9.172   9.002   6.760
  101   2H5*    A  10          2H5*        A  10  -9.079   9.319   5.018
  102    H4*    A  10           H4*        A  10  -7.021   8.465   6.898
  103    H3*    A  10           H3*        A  10  -7.112  10.064   4.410
  104    H2*    A  10           H2*        A  10  -5.033   9.240   3.574
  105   2HO*    A  10          2HO*        A  10  -4.682   8.624   6.280
  106    H1*    A  10           H1*        A  10  -5.350   6.576   4.190
  107    H8     A  10           H8         A  10  -8.827   7.215   3.455
  108   1H6     A  10          H61         A  10  -7.462   7.402  -2.581
  109   2H6     A  10          H62         A  10  -8.751   7.292  -1.404
  110    H2     A  10           H2         A  10  -3.622   7.652  -0.277
  111   1H5*    A  11          1H5*        A  11  -3.518  12.647   7.353
  112   2H5*    A  11          2H5*        A  11  -2.913  13.486   5.911
  113    H4*    A  11           H4*        A  11  -1.433  11.950   7.635
  114    H3*    A  11           H3*        A  11  -0.888  13.113   4.964
  115    H2*    A  11           H2*        A  11   0.857  11.563   4.449
  116   2HO*    A  11          2HO*        A  11   0.892  11.356   7.220
  117    H1*    A  11           H1*        A  11  -0.338   9.258   5.392
  118    H8     A  11           H8         A  11  -3.338  10.906   4.172
  119   1H6     A  11          H61         A  11  -1.688   9.437  -1.610
  120   2H6     A  11          H62         A  11  -2.986  10.018  -0.592
  121    H2     A  11           H2         A  11   1.847   8.748   1.058
  122   1H5*    G  12          1H5*        G  12   3.202  13.445   6.334
  123   2H5*    G  12          2H5*        G  12   3.479  15.196   6.260
  124    H4*    G  12           H4*        G  12   5.183  14.019   5.027
  125    H3*    G  12           H3*        G  12   3.330  15.774   3.459
  126    H2*    G  12           H2*        G  12   4.408  15.111   1.407
  127   2HO*    G  12          2HO*        G  12   6.228  13.533   1.667
  128    H1*    G  12           H1*        G  12   4.431  12.399   1.957
  129    H8     G  12           H8         G  12   1.323  13.666   3.568
  130    H1     G  12           H1         G  12   0.818  12.850  -2.772
  131   1H2     G  12          H21         G  12   4.257  12.557  -2.704
  132   2H2     G  12          H22         G  12   2.796  12.561  -3.667
  133   1H5*    G  13          1H5*        G  13   6.548  16.122   1.550
  134   2H5*    G  13          2H5*        G  13   7.031  17.789   1.188
  135    H4*    G  13           H4*        G  13   6.782  16.444  -0.836
  136    H3*    G  13           H3*        G  13   4.798  18.702  -0.536
  137    H2*    G  13           H2*        G  13   4.076  18.153  -2.771
  138   2HO*    G  13          2HO*        G  13   5.341  16.967  -4.143
  139    H1*    G  13           H1*        G  13   4.402  15.323  -2.346
  140    H8     G  13           H8         G  13   2.433  16.317   0.504
  141    H1     G  13           H1         G  13  -1.027  16.360  -4.915
  142   1H2     G  13          H21         G  13   2.037  16.260  -6.503
  143   2H2     G  13          H22         G  13   0.293  16.305  -6.656
  144   1H5*    C  14          1H5*        C  14   6.655  20.679  -4.251
  145   2H5*    C  14          2H5*        C  14   6.948  22.222  -3.428
  146    H4*    C  14           H4*        C  14   5.678  22.701  -5.352
  147    H3*    C  14           H3*        C  14   3.945  22.822  -2.884
  148    H2*    C  14           H2*        C  14   2.168  23.589  -4.337
  149   2HO*    C  14          2HO*        C  14   2.577  24.110  -6.485
  150    H1*    C  14           H1*        C  14   2.657  21.635  -6.281
  151   1H4     C  14          H41         C  14  -0.463  18.527  -1.364
  152   2H4     C  14          H42         C  14  -1.728  19.497  -2.095
  153    H5     C  14           H5         C  14   1.850  18.703  -1.997
  154    H6     C  14           H6         C  14   3.439  19.776  -3.556
  155   1H5*    U  15          1H5*        U  15   2.739  25.851  -5.456
  156   2H5*    U  15          2H5*        U  15   2.272  27.238  -4.454
  157    H4*    U  15           H4*        U  15   0.479  26.205  -5.909
  158    H3*    U  15           H3*        U  15   0.022  26.654  -2.964
  159    H2*    U  15           H2*        U  15  -2.228  25.872  -3.299
  160   2HO*    U  15          2HO*        U  15  -1.749  25.542  -6.070
  161    H1*    U  15           H1*        U  15  -1.464  23.728  -4.957
  162    H3     U  15           H3         U  15  -2.942  21.951  -1.021
  163    H5     U  15           H5         U  15   1.091  22.938  -0.390
  164    H6     U  15           H6         U  15   1.059  24.097  -2.490
  165   1H5*    U  16          1H5*        U  16  -2.837  30.748  -5.345
  166   2H5*    U  16          2H5*        U  16  -4.096  30.416  -4.141
  167    H4*    U  16           H4*        U  16  -5.260  30.524  -6.131
  168    H3*    U  16           H3*        U  16  -5.558  28.221  -4.879
  169    H2*    U  16           H2*        U  16  -3.721  26.991  -5.836
  170   2HO*    U  16          2HO*        U  16  -5.990  26.739  -7.531
  171    H1*    U  16           H1*        U  16  -4.285  28.042  -8.635
  172    H3     U  16           H3         U  16  -0.549  25.630  -9.485
  173    H5     U  16           H5         U  16   0.720  28.768  -6.999
  174    H6     U  16           H6         U  16  -1.596  29.333  -6.662
  175   1H5*    C  17          1H5*        C  17  -7.201  25.446  -6.693
  176   2H5*    C  17          2H5*        C  17  -8.842  26.059  -6.965
  177    H4*    C  17           H4*        C  17  -8.971  23.805  -6.268
  178    H3*    C  17           H3*        C  17 -10.623  25.488  -5.140
  179    H2*    C  17           H2*        C  17  -8.977  26.458  -3.594
  180   2HO*    C  17          2HO*        C  17  -9.589  25.493  -1.504
  181    H1*    C  17           H1*        C  17  -8.354  23.637  -2.617
  182   1H4     C  17          H41         C  17  -3.006  27.315  -1.373
  183   2H4     C  17          H42         C  17  -3.541  26.648   0.161
  184    H5     C  17           H5         C  17  -4.243  27.020  -3.431
  185    H6     C  17           H6         C  17  -6.203  25.988  -4.453
  186   1H5*    G  18          1H5*        G  18 -11.098  24.468  -6.978
  187   2H5*    G  18          2H5*        G  18 -12.763  24.368  -7.580
  188    H4*    G  18           H4*        G  18 -12.246  22.866  -9.140
  189    H3*    G  18           H3*        G  18 -10.510  21.471  -7.123
  190    H2*    G  18           H2*        G  18  -9.146  20.635  -8.859
  191   2HO*    G  18          2HO*        G  18 -10.897  21.143 -10.953
  192    H1*    G  18           H1*        G  18  -9.909  22.729 -10.797
  193    H8     G  18           H8         G  18  -7.674  23.433 -11.716
  194    H1     G  18           H1         G  18  -4.797  22.561  -6.044
  195   1H2     G  18          H21         G  18  -7.924  21.631  -4.927
  196   2H2     G  18          H22         G  18  -6.232  21.878  -4.557
  197   1H5*    G  19          1H5*        G  19 -10.057  17.018  -7.143
  198   2H5*    G  19          2H5*        G  19  -8.999  17.933  -6.065
  199    H4*    G  19           H4*        G  19  -9.308  18.320  -9.034
  200    H3*    G  19           H3*        G  19  -7.317  16.761  -7.503
  201    H2*    G  19           H2*        G  19  -5.434  17.833  -8.533
  202   2HO*    G  19          2HO*        G  19  -7.389  18.484 -10.428
  203    H1*    G  19           H1*        G  19  -6.324  20.425  -8.424
  204    H8     G  19           H8         G  19  -7.879  19.031  -5.382
  205    H1     G  19           H1         G  19  -1.609  20.116  -4.713
  206   1H2     G  19          H21         G  19  -1.603  20.510  -8.134
  207   2H2     G  19          H22         G  19  -0.717  20.526  -6.613
  208   1H5*    C  20          1H5*        C  20  -6.105  16.602 -11.273
  209   2H5*    C  20          2H5*        C  20  -5.656  15.018 -11.938
  210    H4*    C  20           H4*        C  20  -3.794  16.459 -12.179
  211    H3*    C  20           H3*        C  20  -3.483  14.264 -10.198
  212    H2*    C  20           H2*        C  20  -1.413  15.141  -9.364
  213   2HO*    C  20          2HO*        C  20  -0.462  16.987 -10.521
  214    H1*    C  20           H1*        C  20  -2.103  17.843  -9.358
  215   1H4     C  20          H41         C  20  -5.178  15.441  -4.027
  216   2H4     C  20          H42         C  20  -3.807  16.378  -3.457
  217    H5     C  20           H5         C  20  -5.621  15.057  -6.396
  218    H6     C  20           H6         C  20  -4.752  15.447  -8.674
  219   1H5*    C  21          1H5*        C  21   0.128  13.901 -11.592
  220   2H5*    C  21          2H5*        C  21   0.345  12.321 -12.371
  221    H4*    C  21           H4*        C  21   2.034  12.428 -10.773
  222    H3*    C  21           H3*        C  21  -0.253  10.820  -9.630
  223    H2*    C  21           H2*        C  21   1.030  10.551  -7.648
  224   2HO*    C  21          2HO*        C  21   2.936  10.044  -9.172
  225    H1*    C  21           H1*        C  21   2.467  13.080  -8.022
  226   1H4     C  21          H41         C  21  -2.338  13.998  -3.555
  227   2H4     C  21          H42         C  21  -0.952  13.448  -2.624
  228    H5     C  21           H5         C  21  -2.322  14.064  -5.979
  229    H6     C  21           H6         C  21  -1.001  13.627  -7.974
  230   1H5*    U  22          1H5*        U  22   2.192   8.463  -8.067
  231   2H5*    U  22          2H5*        U  22   1.394   6.880  -8.049
  232    H4*    U  22           H4*        U  22   1.555   8.302  -5.877
  233    H3*    U  22           H3*        U  22  -0.784   6.655  -6.763
  234    H2*    U  22           H2*        U  22  -2.109   7.489  -4.953
  235   2HO*    U  22          2HO*        U  22  -0.716   7.411  -3.241
  236    H1*    U  22           H1*        U  22  -1.200  10.152  -5.061
  237    H3     U  22           H3         U  22  -5.615   9.982  -6.278
  238    H5     U  22           H5         U  22  -3.397   9.426  -9.800
  239    H6     U  22           H6         U  22  -1.430   9.189  -8.433
  240   1H5*    G  23          1H5*        G  23   1.424   2.379  -4.707
  241   2H5*    G  23          2H5*        G  23   0.184   3.647  -4.743
  242    H4*    G  23           H4*        G  23   2.224   3.458  -2.546
  243    H3*    G  23           H3*        G  23  -0.292   1.850  -2.803
  244    H2*    G  23           H2*        G  23  -0.792   2.259  -0.481
  245   2HO*    G  23          2HO*        G  23   1.258   3.919   0.156
  246    H1*    G  23           H1*        G  23  -0.252   4.985  -0.555
  247    H8     G  23           H8         G  23  -1.614   4.708  -3.872
  248    H1     G  23           H1         G  23  -6.172   3.774   0.541
  249   1H2     G  23          H21         G  23  -3.548   3.382   2.758
  250   2H2     G  23          H22         G  23  -5.281   3.396   2.504
  251   1H5*    C  24          1H5*        C  24  -0.399  -2.063  -0.529
  252   2H5*    C  24          2H5*        C  24  -1.844  -1.056  -0.324
  253    H4*    C  24           H4*        C  24   0.931  -0.089   0.319
  254    H3*    C  24           H3*        C  24  -0.876  -1.706   2.084
  255    H2*    C  24           H2*        C  24  -0.317  -0.276   3.941
  256   2HO*    C  24          2HO*        C  24   1.285   1.404   3.604
  257    H1*    C  24           H1*        C  24  -0.605   2.113   2.546
  258   1H4     C  24          H41         C  24  -6.835   0.240   3.494
  259   2H4     C  24          H42         C  24  -6.303   0.716   5.094
  260    H5     C  24           H5         C  24  -5.331   0.093   1.602
  261    H6     C  24           H6         C  24  -3.025   0.347   0.864
  262   1H5*    U  25          1H5*        U  25  -0.184  -2.535   4.509
  263   2H5*    U  25          2H5*        U  25   0.125  -4.269   4.725
  264    H4*    U  25           H4*        U  25  -1.962  -3.575   5.771
  265    H3*    U  25           H3*        U  25  -2.124  -5.567   3.530
  266    H2*    U  25           H2*        U  25  -4.524  -5.606   3.778
  267   2HO*    U  25          2HO*        U  25  -5.519  -4.796   5.560
  268    H1*    U  25           H1*        U  25  -4.828  -2.854   3.923
  269    H3     U  25           H3         U  25  -6.199  -3.812  -0.276
  270    H5     U  25           H5         U  25  -2.010  -3.937  -0.493
  271    H6     U  25           H6         U  25  -1.953  -3.718   1.903
  272   1H5*    U  26          1H5*        U  26  -4.802  -6.500   6.307
  273   2H5*    U  26          2H5*        U  26  -4.625  -8.157   6.915
  274    H4*    U  26           H4*        U  26  -6.919  -7.776   6.414
  275    H3*    U  26           H3*        U  26  -5.554  -9.651   4.501
  276    H2*    U  26           H2*        U  26  -7.646  -9.897   3.327
  277   2HO*    U  26          2HO*        U  26  -9.372  -9.827   4.572
  278    H1*    U  26           H1*        U  26  -8.283  -7.173   3.353
  279    H3     U  26           H3         U  26  -7.147  -8.218  -0.934
  280    H5     U  26           H5         U  26  -3.515  -7.461   1.034
  281    H6     U  26           H6         U  26  -4.739  -7.404   3.105
  282   1H5*    U  27          1H5*        U  27  -8.963 -11.723   6.018
  283   2H5*    U  27          2H5*        U  27  -8.661 -13.464   6.173
  284    H4*    U  27           H4*        U  27 -10.591 -12.861   4.725
  285    H3*    U  27           H3*        U  27  -8.349 -14.514   3.570
  286    H2*    U  27           H2*        U  27  -9.644 -14.653   1.530
  287   2HO*    U  27          2HO*        U  27 -11.763 -14.522   1.677
  288    H1*    U  27           H1*        U  27 -10.239 -11.928   1.470
  289    H3     U  27           H3         U  27  -7.062 -12.970  -1.692
  290    H5     U  27           H5         U  27  -4.969 -11.987   1.797
  291    H6     U  27           H6         U  27  -7.039 -12.015   2.981
  292   1H5*    U  28          1H5*        U  28 -12.332 -16.527   3.205
  293   2H5*    U  28          2H5*        U  28 -12.092 -18.285   3.249
  294    H4*    U  28           H4*        U  28 -13.466 -17.461   1.345
  295    H3*    U  28           H3*        U  28 -11.007 -19.110   0.831
  296    H2*    U  28           H2*        U  28 -11.420 -18.925  -1.542
  297   2HO*    U  28          2HO*        U  28 -13.517 -17.287  -1.647
  298    H1*    U  28           H1*        U  28 -11.907 -16.191  -1.509
  299    H3     U  28           H3         U  28  -7.722 -16.694  -3.215
  300    H5     U  28           H5         U  28  -7.227 -16.811   0.954
  301    H6     U  28           H6         U  28  -9.624 -16.898   1.160
  302   1H5*    G  29          1H5*        G  29 -13.088 -21.732  -1.108
  303   2H5*    G  29          2H5*        G  29 -13.065 -23.342  -0.361
  304    H4*    G  29           H4*        G  29 -12.094 -23.647  -2.454
  305    H3*    G  29           H3*        G  29 -10.029 -23.544  -0.290
  306    H2*    G  29           H2*        G  29  -8.266 -23.472  -1.850
  307   2HO*    G  29          2HO*        G  29  -9.753 -24.214  -4.076
  308    H1*    G  29           H1*        G  29  -9.789 -22.335  -4.050
  309    H8     G  29           H8         G  29  -9.452 -20.240  -0.913
  310    H1     G  29           H1         G  29  -4.736 -19.525  -5.202
  311   1H2     G  29          H21         G  29  -6.155 -22.257  -6.771
  312   2H2     G  29          H22         G  29  -4.889 -21.049  -6.768
  313   1H5*    C  30          1H5*        C  30  -9.109 -26.851  -3.191
  314   2H5*    C  30          2H5*        C  30  -8.262 -28.094  -2.251
  315    H4*    C  30           H4*        C  30  -7.028 -27.275  -4.247
  316    H3*    C  30           H3*        C  30  -5.764 -27.119  -1.526
  317    H2*    C  30           H2*        C  30  -3.819 -26.106  -2.511
  318   2HO*    C  30          2HO*        C  30  -4.579 -27.562  -4.604
  319    H1*    C  30           H1*        C  30  -5.233 -24.440  -4.296
  320   1H4     C  30          H41         C  30  -5.271 -21.358   1.542
  321   2H4     C  30          H42         C  30  -4.092 -20.529   0.541
  322    H5     C  30           H5         C  30  -6.435 -23.348   0.824
  323    H6     C  30           H6         C  30  -6.720 -24.944  -0.995
  324   1H5*    U  31          1H5*        U  31  -2.857 -28.753  -4.067
  325   2H5*    U  31          2H5*        U  31  -2.118 -30.174  -3.302
  326    H4*    U  31           H4*        U  31  -0.500 -28.472  -4.107
  327    H3*    U  31           H3*        U  31  -0.499 -29.300  -1.218
  328    H2*    U  31           H2*        U  31   1.330 -27.792  -0.820
  329   2HO*    U  31          2HO*        U  31   1.660 -28.153  -3.527
  330    H1*    U  31           H1*        U  31   0.283 -25.688  -2.361
  331    H3     U  31           H3         U  31   0.140 -24.550   2.078
  332    H5     U  31           H5         U  31  -3.475 -26.523   1.252
  333    H6     U  31           H6         U  31  -2.554 -27.154  -0.881
  334    H3T    U  31           H3T        U  31   1.682 -29.756  -2.659
  Start of MODEL   19
    1   1H5*    A   1          1H5*        A   1   5.525 -15.886   8.250
    2   2H5*    A   1          2H5*        A   1   5.304 -14.405   7.302
    3    H4*    A   1           H4*        A   1   6.630 -15.827   5.995
    4    H3*    A   1           H3*        A   1   3.794 -15.732   5.005
    5    H2*    A   1           H2*        A   1   4.398 -17.265   3.248
    6   2HO*    A   1          2HO*        A   1   6.990 -16.472   4.021
    7    H1*    A   1           H1*        A   1   5.893 -18.972   4.886
    8    H8     A   1           H8         A   1   3.182 -18.240   7.171
    9   1H6     A   1          H61         A   1  -0.512 -21.954   3.867
   10   2H6     A   1          H62         A   1  -0.325 -21.092   5.379
   11    H2     A   1           H2         A   1   3.166 -21.133   1.440
   12    H5T    A   1           H5T        A   1   3.293 -14.856   7.909
   13   1H5*    G   2          1H5*        G   2   5.976 -15.746   1.650
   14   2H5*    G   2          2H5*        G   2   5.818 -14.151   0.887
   15    H4*    G   2           H4*        G   2   5.663 -15.751  -0.836
   16    H3*    G   2           H3*        G   2   2.969 -14.586  -0.160
   17    H2*    G   2           H2*        G   2   1.997 -15.970  -1.851
   18   2HO*    G   2          2HO*        G   2   3.427 -17.125  -3.316
   19    H1*    G   2           H1*        G   2   3.689 -18.216  -1.371
   20    H8     G   2           H8         G   2   2.533 -17.323   1.957
   21    H1     G   2           H1         G   2  -2.149 -19.943  -1.557
   22   1H2     G   2          H21         G   2  -0.044 -19.389  -4.247
   23   2H2     G   2          H22         G   2  -1.578 -19.998  -3.676
   24   1H5*    U   3          1H5*        U   3   4.080 -14.001  -4.587
   25   2H5*    U   3          2H5*        U   3   3.167 -12.586  -5.146
   26    H4*    U   3           H4*        U   3   2.928 -14.609  -6.568
   27    H3*    U   3           H3*        U   3   0.492 -13.292  -5.401
   28    H2*    U   3           H2*        U   3  -0.878 -14.965  -6.460
   29   2HO*    U   3          2HO*        U   3   0.774 -16.619  -7.623
   30    H1*    U   3           H1*        U   3   0.725 -17.130  -5.742
   31    H3     U   3           H3         U   3  -2.843 -17.513  -3.001
   32    H5     U   3           H5         U   3  -0.563 -14.416  -1.314
   33    H6     U   3           H6         U   3   0.843 -14.493  -3.264
   34   1H5*    A   4          1H5*        A   4  -0.113 -13.687  -9.930
   35   2H5*    A   4          2H5*        A   4  -0.275 -11.968 -10.337
   36    H4*    A   4           H4*        A   4  -1.846 -13.071 -11.654
   37    H3*    A   4           H3*        A   4  -3.121 -11.655  -9.359
   38    H2*    A   4           H2*        A   4  -5.292 -12.533  -9.972
   39   2HO*    A   4          2HO*        A   4  -5.427 -12.760 -12.116
   40    H1*    A   4           H1*        A   4  -4.512 -15.123 -10.056
   41    H8     A   4           H8         A   4  -1.940 -13.801  -7.771
   42   1H6     A   4          H61         A   4  -6.111 -14.119  -3.213
   43   2H6     A   4          H62         A   4  -4.418 -13.916  -3.599
   44    H2     A   4           H2         A   4  -8.269 -14.607  -7.124
   45   1H5*    G   5          1H5*        G   5  -5.170  -9.190 -12.431
   46   2H5*    G   5          2H5*        G   5  -5.165  -7.575 -11.699
   47    H4*    G   5           H4*        G   5  -7.417  -8.557 -12.053
   48    H3*    G   5           H3*        G   5  -6.636  -7.684  -9.283
   49    H2*    G   5           H2*        G   5  -8.818  -8.434  -8.515
   50   2HO*    G   5          2HO*        G   5  -9.332  -8.299 -11.243
   51    H1*    G   5           H1*        G   5  -8.687 -10.897  -9.761
   52    H8     G   5           H8         G   5  -5.146 -10.149  -8.949
   53    H1     G   5           H1         G   5  -8.574 -12.024  -3.864
   54   1H2     G   5          H21         G   5 -11.313 -11.550  -5.905
   55   2H2     G   5          H22         G   5 -10.705 -12.013  -4.331
   56   1H5*    A   6          1H5*        A   6 -10.262  -7.035 -10.189
   57   2H5*    A   6          2H5*        A   6 -11.131  -5.563  -9.718
   58    H4*    A   6           H4*        A   6 -12.134  -7.749  -8.967
   59    H3*    A   6           H3*        A   6 -12.326  -5.379  -7.641
   60    H2*    A   6           H2*        A   6 -10.564  -5.666  -6.056
   61   2HO*    A   6          2HO*        A   6 -12.962  -6.753  -5.177
   62    H1*    A   6           H1*        A   6 -11.118  -8.681  -5.861
   63    H8     A   6           H8         A   6  -7.962  -7.070  -7.261
   64   1H6     A   6          H61         A   6  -5.348  -8.564  -1.850
   65   2H6     A   6          H62         A   6  -5.059  -7.956  -3.471
   66    H2     A   6           H2         A   6  -9.751  -9.342  -1.528
   67   1H5*    A   7          1H5*        A   7 -14.599  -7.556  -4.343
   68   2H5*    A   7          2H5*        A   7 -16.069  -6.574  -4.187
   69    H4*    A   7           H4*        A   7 -15.174  -6.609  -2.045
   70    H3*    A   7           H3*        A   7 -14.462  -4.017  -3.382
   71    H2*    A   7           H2*        A   7 -13.054  -3.432  -1.576
   72   2HO*    A   7          2HO*        A   7 -14.566  -5.311  -0.043
   73    H1*    A   7           H1*        A   7 -12.599  -6.195  -0.680
   74    H8     A   7           H8         A   7 -11.298  -5.039  -4.065
   75   1H6     A   7          H61         A   7  -5.933  -3.982  -1.177
   76   2H6     A   7          H62         A   7  -6.741  -4.052  -2.727
   77    H2     A   7           H2         A   7  -9.010  -4.983   1.929
   78   1H5*    A   8          1H5*        A   8 -16.106  -0.218  -0.322
   79   2H5*    A   8          2H5*        A   8 -14.541  -0.707  -0.999
   80    H4*    A   8           H4*        A   8 -15.474  -0.973   1.854
   81    H3*    A   8           H3*        A   8 -13.498   0.873   0.554
   82    H2*    A   8           H2*        A   8 -12.067   0.674   2.481
   83   2HO*    A   8          2HO*        A   8 -14.008  -0.978   3.733
   84    H1*    A   8           H1*        A   8 -12.322  -2.088   2.745
   85    H8     A   8           H8         A   8 -12.288  -1.326  -0.920
   86   1H6     A   8          H61         A   8  -6.106  -1.315  -0.557
   87   2H6     A   8          H62         A   8  -7.481  -1.293  -1.635
   88    H2     A   8           H2         A   8  -7.749  -1.405   3.621
   89   1H5*    C   9          1H5*        C   9 -14.028   2.802   5.349
   90   2H5*    C   9          2H5*        C   9 -13.853   4.357   4.512
   91    H4*    C   9           H4*        C   9 -12.204   3.669   6.411
   92    H3*    C   9           H3*        C   9 -11.541   5.142   3.890
   93    H2*    C   9           H2*        C   9  -9.198   5.035   4.407
   94   2HO*    C   9          2HO*        C   9  -9.929   3.878   6.915
   95    H1*    C   9           H1*        C   9  -9.172   2.376   5.245
   96   1H4     C   9          H41         C   9  -9.476   2.060  -1.339
   97   2H4     C   9          H42         C   9  -7.785   1.845  -0.909
   98    H5     C   9           H5         C   9 -11.197   2.577   0.295
   99    H6     C   9           H6         C   9 -11.636   2.989   2.656
  100   1H5*    A  10          1H5*        A  10  -9.432   8.356   7.368
  101   2H5*    A  10          2H5*        A  10  -8.845   9.261   5.959
  102    H4*    A  10           H4*        A  10  -7.379   7.665   7.783
  103    H3*    A  10           H3*        A  10  -6.643   9.361   5.427
  104    H2*    A  10           H2*        A  10  -4.521   8.246   5.251
  105   2HO*    A  10          2HO*        A  10  -5.229   7.317   7.838
  106    H1*    A  10           H1*        A  10  -5.481   5.663   5.613
  107    H8     A  10           H8         A  10  -8.235   6.911   3.628
  108   1H6     A  10          H61         A  10  -4.621   6.681  -1.394
  109   2H6     A  10          H62         A  10  -6.265   6.837  -0.815
  110    H2     A  10           H2         A  10  -2.002   6.299   2.225
  111   1H5*    A  11          1H5*        A  11  -3.181  12.551   7.545
  112   2H5*    A  11          2H5*        A  11  -3.305  12.764   5.787
  113    H4*    A  11           H4*        A  11  -1.172  11.646   7.374
  114    H3*    A  11           H3*        A  11  -1.417  12.841   4.687
  115    H2*    A  11           H2*        A  11   0.160  11.383   3.645
  116   2HO*    A  11          2HO*        A  11   0.920  10.957   6.331
  117    H1*    A  11           H1*        A  11  -0.603   9.004   4.791
  118    H8     A  11           H8         A  11  -3.912  10.522   4.655
  119   1H6     A  11          H61         A  11  -4.063   9.401  -1.429
  120   2H6     A  11          H62         A  11  -5.009   9.854  -0.029
  121    H2     A  11           H2         A  11   0.153   8.827  -0.016
  122   1H5*    G  12          1H5*        G  12   2.612  12.281   4.862
  123   2H5*    G  12          2H5*        G  12   3.326  13.887   5.108
  124    H4*    G  12           H4*        G  12   4.667  12.937   3.486
  125    H3*    G  12           H3*        G  12   2.718  14.849   2.294
  126    H2*    G  12           H2*        G  12   3.315  14.213   0.062
  127   2HO*    G  12          2HO*        G  12   5.095  12.405   0.111
  128    H1*    G  12           H1*        G  12   3.363  11.497   0.443
  129    H8     G  12           H8         G  12   0.758  13.345   2.552
  130    H1     G  12           H1         G  12  -1.276  11.297  -3.177
  131   1H2     G  12          H21         G  12   2.038  10.453  -3.717
  132   2H2     G  12          H22         G  12   0.405  10.501  -4.342
  133   1H5*    G  13          1H5*        G  13   6.211  14.752  -0.081
  134   2H5*    G  13          2H5*        G  13   6.888  16.391  -0.019
  135    H4*    G  13           H4*        G  13   7.011  15.746  -2.261
  136    H3*    G  13           H3*        G  13   4.769  17.665  -1.765
  137    H2*    G  13           H2*        G  13   4.106  17.499  -4.082
  138   2HO*    G  13          2HO*        G  13   6.096  17.383  -5.107
  139    H1*    G  13           H1*        G  13   4.182  14.752  -4.201
  140    H8     G  13           H8         G  13   3.267  16.042  -0.741
  141    H1     G  13           H1         G  13  -1.699  15.063  -4.681
  142   1H2     G  13          H21         G  13   0.708  14.559  -7.113
  143   2H2     G  13          H22         G  13  -0.994  14.632  -6.709
  144   1H5*    C  14          1H5*        C  14   6.974  19.310  -5.179
  145   2H5*    C  14          2H5*        C  14   6.802  21.076  -5.157
  146    H4*    C  14           H4*        C  14   5.966  19.962  -7.221
  147    H3*    C  14           H3*        C  14   4.076  21.678  -5.614
  148    H2*    C  14           H2*        C  14   2.436  21.289  -7.363
  149   2HO*    C  14          2HO*        C  14   4.435  19.711  -8.659
  150    H1*    C  14           H1*        C  14   2.775  18.548  -7.312
  151   1H4     C  14          H41         C  14  -0.187  20.109  -1.621
  152   2H4     C  14          H42         C  14  -1.474  20.151  -2.810
  153    H5     C  14           H5         C  14   2.129  19.788  -2.205
  154    H6     C  14           H6         C  14   3.694  19.426  -4.044
  155   1H5*    U  15          1H5*        U  15   2.602  22.851  -9.031
  156   2H5*    U  15          2H5*        U  15   2.426  24.611  -8.898
  157    H4*    U  15           H4*        U  15   0.301  23.307  -9.157
  158    H3*    U  15           H3*        U  15   0.650  25.216  -6.855
  159    H2*    U  15           H2*        U  15  -1.661  24.735  -6.259
  160   2HO*    U  15          2HO*        U  15  -2.841  23.235  -7.609
  161    H1*    U  15           H1*        U  15  -1.311  21.993  -6.399
  162    H3     U  15           H3         U  15  -1.240  23.397  -2.005
  163    H5     U  15           H5         U  15   2.747  23.317  -3.323
  164    H6     U  15           H6         U  15   1.923  22.997  -5.558
  165   1H5*    U  16          1H5*        U  16  -2.327  26.455 -10.519
  166   2H5*    U  16          2H5*        U  16  -2.394  28.213 -10.293
  167    H4*    U  16           H4*        U  16  -4.593  28.200 -10.247
  168    H3*    U  16           H3*        U  16  -4.373  27.165  -7.786
  169    H2*    U  16           H2*        U  16  -4.200  24.840  -8.475
  170   2HO*    U  16          2HO*        U  16  -5.921  24.305  -7.352
  171    H1*    U  16           H1*        U  16  -6.463  25.432 -10.483
  172    H3     U  16           H3         U  16  -6.502  21.043 -11.488
  173    H5     U  16           H5         U  16  -2.479  22.140 -11.958
  174    H6     U  16           H6         U  16  -3.039  24.303 -11.074
  175   1H5*    C  17          1H5*        C  17  -7.548  25.071  -6.945
  176   2H5*    C  17          2H5*        C  17  -8.682  26.323  -6.408
  177    H4*    C  17           H4*        C  17  -8.511  24.325  -4.910
  178    H3*    C  17           H3*        C  17  -9.199  26.675  -4.055
  179    H2*    C  17           H2*        C  17  -6.946  27.616  -3.810
  180   2HO*    C  17          2HO*        C  17  -7.486  26.273  -1.342
  181    H1*    C  17           H1*        C  17  -6.073  25.053  -2.395
  182   1H4     C  17          H41         C  17  -0.730  27.834  -5.141
  183   2H4     C  17          H42         C  17  -0.470  27.848  -3.408
  184    H5     C  17           H5         C  17  -2.813  27.080  -6.148
  185    H6     C  17           H6         C  17  -5.032  26.178  -5.689
  186   1H5*    G  18          1H5*        G  18 -10.439  24.543  -5.146
  187   2H5*    G  18          2H5*        G  18 -12.134  24.973  -4.874
  188    H4*    G  18           H4*        G  18 -12.888  22.830  -5.190
  189    H3*    G  18           H3*        G  18 -10.215  21.799  -4.378
  190    H2*    G  18           H2*        G  18 -10.344  19.991  -5.944
  191   2HO*    G  18          2HO*        G  18 -12.357  19.301  -6.245
  192    H1*    G  18           H1*        G  18 -10.893  21.541  -8.100
  193    H8     G  18           H8         G  18  -8.971  22.662  -9.133
  194    H1     G  18           H1         G  18  -5.544  22.396  -3.739
  195   1H2     G  18          H21         G  18  -8.542  21.380  -2.230
  196   2H2     G  18          H22         G  18  -6.841  21.744  -2.032
  197   1H5*    G  19          1H5*        G  19 -10.438  17.251  -3.601
  198   2H5*    G  19          2H5*        G  19  -8.751  17.754  -3.434
  199    H4*    G  19           H4*        G  19 -10.588  18.008  -5.785
  200    H3*    G  19           H3*        G  19  -8.143  16.446  -5.306
  201    H2*    G  19           H2*        G  19  -6.989  17.210  -7.264
  202   2HO*    G  19          2HO*        G  19  -9.046  17.114  -8.524
  203    H1*    G  19           H1*        G  19  -7.576  19.897  -7.058
  204    H8     G  19           H8         G  19  -7.722  19.335  -3.540
  205    H1     G  19           H1         G  19  -1.679  18.714  -5.563
  206   1H2     G  19          H21         G  19  -3.031  18.605  -8.730
  207   2H2     G  19          H22         G  19  -1.588  18.564  -7.729
  208   1H5*    C  20          1H5*        C  20  -8.854  15.180  -9.090
  209   2H5*    C  20          2H5*        C  20  -8.803  13.411  -9.224
  210    H4*    C  20           H4*        C  20  -7.114  14.388 -10.624
  211    H3*    C  20           H3*        C  20  -6.206  12.721  -8.328
  212    H2*    C  20           H2*        C  20  -3.908  13.305  -8.685
  213   2HO*    C  20          2HO*        C  20  -4.848  13.721 -11.214
  214    H1*    C  20           H1*        C  20  -4.270  15.998  -9.155
  215   1H4     C  20          H41         C  20  -5.073  15.435  -2.638
  216   2H4     C  20          H42         C  20  -3.453  16.049  -2.872
  217    H5     C  20           H5         C  20  -6.517  14.787  -4.438
  218    H6     C  20           H6         C  20  -6.745  14.617  -6.847
  219   1H5*    C  21          1H5*        C  21  -3.266  12.489 -11.121
  220   2H5*    C  21          2H5*        C  21  -3.193  10.809 -11.689
  221    H4*    C  21           H4*        C  21  -0.981  11.485 -11.277
  222    H3*    C  21           H3*        C  21  -2.076   9.515  -9.349
  223    H2*    C  21           H2*        C  21  -0.245   9.735  -7.839
  224   2HO*    C  21          2HO*        C  21   1.023  10.989 -10.064
  225    H1*    C  21           H1*        C  21   0.184  12.487  -8.087
  226   1H4     C  21          H41         C  21  -4.953  11.824  -3.966
  227   2H4     C  21          H42         C  21  -3.553  12.160  -2.961
  228    H5     C  21           H5         C  21  -4.805  11.507  -6.366
  229    H6     C  21           H6         C  21  -3.268  11.450  -8.281
  230   1H5*    U  22          1H5*        U  22  -1.032   5.312  -9.187
  231   2H5*    U  22          2H5*        U  22  -2.206   5.887  -7.989
  232    H4*    U  22           H4*        U  22   0.752   5.691  -7.843
  233    H3*    U  22           H3*        U  22  -1.519   4.983  -6.036
  234    H2*    U  22           H2*        U  22  -0.230   5.540  -4.091
  235   2HO*    U  22          2HO*        U  22   2.067   6.261  -4.594
  236    H1*    U  22           H1*        U  22   0.880   7.893  -5.075
  237    H3     U  22           H3         U  22  -2.262   9.197  -2.076
  238    H5     U  22           H5         U  22  -4.370   8.522  -5.643
  239    H6     U  22           H6         U  22  -2.355   7.580  -6.561
  240   1H5*    G  23          1H5*        G  23   1.711   1.523  -3.899
  241   2H5*    G  23          2H5*        G  23   0.134   0.867  -3.419
  242    H4*    G  23           H4*        G  23   2.098   2.212  -1.840
  243    H3*    G  23           H3*        G  23  -0.368   0.649  -1.286
  244    H2*    G  23           H2*        G  23  -0.784   1.783   0.786
  245   2HO*    G  23          2HO*        G  23   0.889   3.471   1.370
  246    H1*    G  23           H1*        G  23  -0.358   4.347  -0.104
  247    H8     G  23           H8         G  23  -1.607   3.071  -3.230
  248    H1     G  23           H1         G  23  -6.268   3.326   1.167
  249   1H2     G  23          H21         G  23  -3.696   3.683   3.451
  250   2H2     G  23          H22         G  23  -5.420   3.569   3.169
  251   1H5*    C  24          1H5*        C  24   2.103   0.671   2.902
  252   2H5*    C  24          2H5*        C  24   2.122  -1.103   2.930
  253    H4*    C  24           H4*        C  24   1.430  -0.125   5.066
  254    H3*    C  24           H3*        C  24  -0.475  -1.923   3.607
  255    H2*    C  24           H2*        C  24  -2.113  -1.590   5.340
  256   2HO*    C  24          2HO*        C  24  -1.325  -0.057   7.120
  257    H1*    C  24           H1*        C  24  -1.771   1.169   5.533
  258   1H4     C  24          H41         C  24  -5.219   0.171  -0.018
  259   2H4     C  24          H42         C  24  -6.367   0.692   1.202
  260    H5     C  24           H5         C  24  -2.881  -0.228   0.466
  261    H6     C  24           H6         C  24  -1.174  -0.213   2.208
  262   1H5*    U  25          1H5*        U  25  -1.301  -3.135   6.911
  263   2H5*    U  25          2H5*        U  25  -1.010  -4.863   7.194
  264    H4*    U  25           H4*        U  25  -3.296  -4.316   7.695
  265    H3*    U  25           H3*        U  25  -2.910  -6.078   5.286
  266    H2*    U  25           H2*        U  25  -5.315  -6.178   5.073
  267   2HO*    U  25          2HO*        U  25  -6.641  -5.594   6.705
  268    H1*    U  25           H1*        U  25  -5.703  -3.443   5.455
  269    H3     U  25           H3         U  25  -6.413  -3.814   1.030
  270    H5     U  25           H5         U  25  -2.257  -4.264   1.421
  271    H6     U  25           H6         U  25  -2.557  -4.270   3.810
  272   1H5*    U  26          1H5*        U  26  -5.859  -8.195   7.578
  273   2H5*    U  26          2H5*        U  26  -5.507  -9.922   7.378
  274    H4*    U  26           H4*        U  26  -7.786  -9.229   6.658
  275    H3*    U  26           H3*        U  26  -5.966 -10.572   4.665
  276    H2*    U  26           H2*        U  26  -7.747 -10.450   3.066
  277   2HO*    U  26          2HO*        U  26  -9.744 -10.643   3.759
  278    H1*    U  26           H1*        U  26  -8.665  -7.884   3.907
  279    H3     U  26           H3         U  26  -7.313  -7.664  -0.464
  280    H5     U  26           H5         U  26  -3.868  -7.057   1.860
  281    H6     U  26           H6         U  26  -5.149  -7.709   3.790
  282   1H5*    U  27          1H5*        U  27  -9.802 -12.553   5.225
  283   2H5*    U  27          2H5*        U  27  -9.702 -14.310   4.999
  284    H4*    U  27           H4*        U  27 -11.508 -13.198   3.707
  285    H3*    U  27           H3*        U  27  -9.439 -14.864   2.315
  286    H2*    U  27           H2*        U  27 -10.472 -14.354   0.193
  287   2HO*    U  27          2HO*        U  27 -12.575 -13.643   1.876
  288    H1*    U  27           H1*        U  27 -10.672 -11.632   0.642
  289    H3     U  27           H3         U  27  -7.110 -12.350  -2.130
  290    H5     U  27           H5         U  27  -5.594 -12.616   1.774
  291    H6     U  27           H6         U  27  -7.859 -12.627   2.573
  292   1H5*    U  28          1H5*        U  28 -13.515 -16.460   0.923
  293   2H5*    U  28          2H5*        U  28 -13.221 -18.207   0.824
  294    H4*    U  28           H4*        U  28 -14.201 -17.220  -1.223
  295    H3*    U  28           H3*        U  28 -11.593 -18.699  -1.371
  296    H2*    U  28           H2*        U  28 -11.503 -18.255  -3.743
  297   2HO*    U  28          2HO*        U  28 -14.206 -17.646  -3.293
  298    H1*    U  28           H1*        U  28 -12.134 -15.561  -3.529
  299    H3     U  28           H3         U  28  -7.654 -15.665  -4.241
  300    H5     U  28           H5         U  28  -8.116 -16.328  -0.119
  301    H6     U  28           H6         U  28 -10.483 -16.546  -0.499
  302   1H5*    G  29          1H5*        G  29 -12.913 -21.062  -3.970
  303   2H5*    G  29          2H5*        G  29 -12.977 -22.762  -3.466
  304    H4*    G  29           H4*        G  29 -11.471 -22.784  -5.218
  305    H3*    G  29           H3*        G  29  -9.940 -22.693  -2.633
  306    H2*    G  29           H2*        G  29  -7.907 -22.469  -3.826
  307   2HO*    G  29          2HO*        G  29  -8.443 -22.949  -6.348
  308    H1*    G  29           H1*        G  29  -9.084 -21.209  -6.172
  309    H8     G  29           H8         G  29  -9.455 -19.349  -2.905
  310    H1     G  29           H1         G  29  -4.010 -18.167  -6.082
  311   1H2     G  29          H21         G  29  -4.961 -20.792  -8.110
  312   2H2     G  29          H22         G  29  -3.786 -19.544  -7.760
  313   1H5*    C  30          1H5*        C  30  -7.966 -25.300  -5.399
  314   2H5*    C  30          2H5*        C  30  -7.502 -26.754  -4.494
  315    H4*    C  30           H4*        C  30  -5.626 -25.790  -5.723
  316    H3*    C  30           H3*        C  30  -5.391 -25.812  -2.718
  317    H2*    C  30           H2*        C  30  -3.183 -24.895  -2.971
  318   2HO*    C  30          2HO*        C  30  -3.538 -25.858  -5.598
  319    H1*    C  30           H1*        C  30  -3.901 -23.129  -5.080
  320   1H4     C  30          H41         C  30  -5.418 -20.028   0.533
  321   2H4     C  30          H42         C  30  -3.810 -19.472   0.093
  322    H5     C  30           H5         C  30  -6.585 -21.764  -0.682
  323    H6     C  30           H6         C  30  -6.433 -23.349  -2.527
  324   1H5*    U  31          1H5*        U  31  -1.807 -27.132  -3.897
  325   2H5*    U  31          2H5*        U  31  -1.746 -28.871  -3.548
  326    H4*    U  31           H4*        U  31   0.352 -28.121  -2.931
  327    H3*    U  31           H3*        U  31  -1.357 -28.260  -0.453
  328    H2*    U  31           H2*        U  31   0.525 -27.499   0.814
  329   2HO*    U  31          2HO*        U  31   2.234 -28.631   0.062
  330    H1*    U  31           H1*        U  31   1.463 -25.693  -1.194
  331    H3     U  31           H3         U  31   0.504 -22.911   2.216
  332    H5     U  31           H5         U  31  -3.257 -24.154   0.821
  333    H6     U  31           H6         U  31  -2.122 -25.711  -0.623
  334    H3T    U  31           H3T        U  31   0.865 -29.791  -1.160
  Start of MODEL   20
    1   1H5*    A   1          1H5*        A   1   3.093 -16.273   6.572
    2   2H5*    A   1          2H5*        A   1   2.347 -14.858   5.808
    3    H4*    A   1           H4*        A   1   4.421 -15.525   4.711
    4    H3*    A   1           H3*        A   1   1.881 -15.572   3.119
    5    H2*    A   1           H2*        A   1   3.108 -16.383   1.203
    6   2HO*    A   1          2HO*        A   1   5.082 -15.067   2.230
    7    H1*    A   1           H1*        A   1   4.476 -18.357   2.572
    8    H8     A   1           H8         A   1   1.116 -17.925   4.217
    9   1H6     A   1          H61         A   1  -1.091 -21.910   0.023
   10   2H6     A   1          H62         A   1  -1.442 -21.033   1.494
   11    H2     A   1           H2         A   1   3.094 -20.809  -1.167
   12    H5T    A   1           H5T        A   1   0.773 -16.411   6.192
   13   1H5*    G   2          1H5*        G   2   4.607 -14.173   0.597
   14   2H5*    G   2          2H5*        G   2   4.183 -12.559  -0.009
   15    H4*    G   2           H4*        G   2   4.835 -14.062  -1.807
   16    H3*    G   2           H3*        G   2   2.019 -13.018  -1.830
   17    H2*    G   2           H2*        G   2   1.602 -14.268  -3.846
   18   2HO*    G   2          2HO*        G   2   3.684 -13.864  -4.803
   19    H1*    G   2           H1*        G   2   2.838 -16.611  -2.982
   20    H8     G   2           H8         G   2   1.313 -15.676   0.154
   21    H1     G   2           H1         G   2  -3.105 -17.411  -4.154
   22   1H2     G   2          H21         G   2  -0.555 -17.063  -6.470
   23   2H2     G   2          H22         G   2  -2.232 -17.459  -6.173
   24   1H5*    U   3          1H5*        U   3   3.666 -11.190  -5.711
   25   2H5*    U   3          2H5*        U   3   2.733  -9.690  -5.871
   26    H4*    U   3           H4*        U   3   2.502 -11.189  -7.802
   27    H3*    U   3           H3*        U   3   0.011 -10.520  -6.247
   28    H2*    U   3           H2*        U   3  -1.230 -11.804  -7.889
   29   2HO*    U   3          2HO*        U   3   0.229 -11.134  -9.666
   30    H1*    U   3           H1*        U   3   0.471 -13.989  -7.761
   31    H3     U   3           H3         U   3  -3.121 -15.206  -5.280
   32    H5     U   3           H5         U   3  -0.843 -12.772  -2.726
   33    H6     U   3           H6         U   3   0.567 -12.254  -4.605
   34   1H5*    A   4          1H5*        A   4  -0.876  -8.487 -10.271
   35   2H5*    A   4          2H5*        A   4  -1.951  -7.151  -9.819
   36    H4*    A   4           H4*        A   4  -2.892  -8.736 -11.483
   37    H3*    A   4           H3*        A   4  -4.374  -8.237  -8.917
   38    H2*    A   4           H2*        A   4  -6.113  -9.738  -9.720
   39   2HO*    A   4          2HO*        A   4  -5.666 -10.789 -11.826
   40    H1*    A   4           H1*        A   4  -4.357 -11.759 -10.341
   41    H8     A   4           H8         A   4  -2.570 -10.078  -7.598
   42   1H6     A   4          H61         A   4  -6.294 -12.909  -3.558
   43   2H6     A   4          H62         A   4  -4.829 -11.973  -3.755
   44    H2     A   4           H2         A   4  -8.032 -13.454  -7.664
   45   1H5*    G   5          1H5*        G   5  -7.461  -6.290 -11.306
   46   2H5*    G   5          2H5*        G   5  -7.923  -4.886 -10.324
   47    H4*    G   5           H4*        G   5  -9.711  -6.586 -10.637
   48    H3*    G   5           H3*        G   5  -8.889  -5.790  -7.857
   49    H2*    G   5           H2*        G   5 -10.511  -7.359  -6.984
   50   2HO*    G   5          2HO*        G   5 -12.017  -8.337  -8.332
   51    H1*    G   5           H1*        G   5  -9.823  -9.442  -8.698
   52    H8     G   5           H8         G   5  -6.543  -7.956  -8.076
   53    H1     G   5           H1         G   5  -8.836 -11.046  -2.940
   54   1H2     G   5          H21         G   5 -11.852 -10.978  -4.609
   55   2H2     G   5          H22         G   5 -10.960 -11.439  -3.176
   56   1H5*    A   6          1H5*        A   6 -12.519  -6.546  -8.038
   57   2H5*    A   6          2H5*        A   6 -13.723  -5.385  -7.453
   58    H4*    A   6           H4*        A   6 -13.969  -7.710  -6.573
   59    H3*    A   6           H3*        A   6 -14.560  -5.417  -5.247
   60    H2*    A   6           H2*        A   6 -12.528  -5.183  -4.015
   61   2HO*    A   6          2HO*        A   6 -13.916  -7.177  -2.507
   62    H1*    A   6           H1*        A   6 -12.410  -8.238  -3.640
   63    H8     A   6           H8         A   6  -9.804  -6.107  -5.421
   64   1H6     A   6          H61         A   6  -6.418  -6.664  -0.265
   65   2H6     A   6          H62         A   6  -6.437  -6.124  -1.931
   66    H2     A   6           H2         A   6 -10.495  -8.400   0.541
   67   1H5*    A   7          1H5*        A   7 -15.739  -7.436  -1.470
   68   2H5*    A   7          2H5*        A   7 -17.266  -6.622  -1.084
   69    H4*    A   7           H4*        A   7 -15.985  -5.979   0.676
   70    H3*    A   7           H3*        A   7 -15.760  -3.818  -1.371
   71    H2*    A   7           H2*        A   7 -13.881  -2.904  -0.318
   72   2HO*    A   7          2HO*        A   7 -14.354  -2.207   1.620
   73    H1*    A   7           H1*        A   7 -13.571  -5.262   1.534
   74    H8     A   7           H8         A   7 -12.115  -5.339  -1.936
   75   1H6     A   7          H61         A   7  -6.764  -3.562   0.590
   76   2H6     A   7          H62         A   7  -7.542  -4.138  -0.867
   77    H2     A   7           H2         A   7  -9.951  -3.287   3.732
   78   1H5*    A   8          1H5*        A   8 -15.862   0.434   0.412
   79   2H5*    A   8          2H5*        A   8 -14.725  -0.906   0.170
   80    H4*    A   8           H4*        A   8 -15.248  -0.238   2.975
   81    H3*    A   8           H3*        A   8 -14.376   1.963   1.223
   82    H2*    A   8           H2*        A   8 -12.161   1.934   1.974
   83   2HO*    A   8          2HO*        A   8 -13.152   3.068   3.818
   84    H1*    A   8           H1*        A   8 -12.780  -0.250   4.007
   85    H8     A   8           H8         A   8 -11.122  -0.424   0.562
   86   1H6     A   8          H61         A   8  -5.804  -1.482   3.531
   87   2H6     A   8          H62         A   8  -6.578  -1.351   1.967
   88    H2     A   8           H2         A   8  -8.962  -0.715   6.610
   89   1H5*    C   9          1H5*        C   9 -14.958   5.822   5.521
   90   2H5*    C   9          2H5*        C   9 -13.892   5.940   4.108
   91    H4*    C   9           H4*        C   9 -13.278   5.333   6.924
   92    H3*    C   9           H3*        C   9 -11.911   6.805   4.707
   93    H2*    C   9           H2*        C   9  -9.755   6.255   5.617
   94   2HO*    C   9          2HO*        C   9 -10.098   4.788   7.694
   95    H1*    C   9           H1*        C   9 -10.298   3.585   6.147
   96   1H4     C   9          H41         C   9  -9.630   3.765  -0.411
   97   2H4     C   9          H42         C   9  -8.037   3.392   0.234
   98    H5     C   9           H5         C   9 -11.523   4.317   1.012
   99    H6     C   9           H6         C   9 -12.255   4.612   3.316
  100   1H5*    A  10          1H5*        A  10  -9.647   9.377   8.400
  101   2H5*    A  10          2H5*        A  10  -9.128  10.445   7.083
  102    H4*    A  10           H4*        A  10  -7.555   8.685   8.553
  103    H3*    A  10           H3*        A  10  -7.058  10.460   6.232
  104    H2*    A  10           H2*        A  10  -5.206   9.185   5.426
  105   2HO*    A  10          2HO*        A  10  -4.028   8.629   7.165
  106    H1*    A  10           H1*        A  10  -6.252   6.655   5.781
  107    H8     A  10           H8         A  10  -9.346   8.348   4.864
  108   1H6     A  10          H61         A  10  -7.440   8.407  -1.027
  109   2H6     A  10          H62         A  10  -8.801   8.644   0.044
  110    H2     A  10           H2         A  10  -3.937   7.328   1.563
  111   1H5*    A  11          1H5*        A  11  -2.737  13.211   8.528
  112   2H5*    A  11          2H5*        A  11  -2.664  12.715   6.826
  113    H4*    A  11           H4*        A  11  -1.016  11.901   9.134
  114    H3*    A  11           H3*        A  11  -0.510  12.584   6.292
  115    H2*    A  11           H2*        A  11   1.135  10.871   6.002
  116   2HO*    A  11          2HO*        A  11   1.782  11.369   8.402
  117    H1*    A  11           H1*        A  11  -0.177   8.823   7.300
  118    H8     A  11           H8         A  11  -3.123  10.453   5.917
  119   1H6     A  11          H61         A  11  -1.677   8.121   0.366
  120   2H6     A  11          H62         A  11  -2.917   8.918   1.308
  121    H2     A  11           H2         A  11   1.860   7.586   3.058
  122   1H5*    G  12          1H5*        G  12   3.479  12.487   6.924
  123   2H5*    G  12          2H5*        G  12   3.958  14.196   6.899
  124    H4*    G  12           H4*        G  12   5.362  13.024   5.393
  125    H3*    G  12           H3*        G  12   3.354  14.807   4.058
  126    H2*    G  12           H2*        G  12   4.169  14.101   1.902
  127   2HO*    G  12          2HO*        G  12   6.048  12.849   1.728
  128    H1*    G  12           H1*        G  12   4.254  11.390   2.504
  129    H8     G  12           H8         G  12   1.358  13.123   4.244
  130    H1     G  12           H1         G  12   0.129  11.064  -1.704
  131   1H2     G  12          H21         G  12   3.527  10.461  -1.881
  132   2H2     G  12          H22         G  12   1.977  10.404  -2.687
  133   1H5*    G  13          1H5*        G  13   6.621  15.122   1.910
  134   2H5*    G  13          2H5*        G  13   6.920  16.754   1.281
  135    H4*    G  13           H4*        G  13   6.579  15.046  -0.478
  136    H3*    G  13           H3*        G  13   4.659  17.369  -0.371
  137    H2*    G  13           H2*        G  13   3.586  16.471  -2.300
  138   2HO*    G  13          2HO*        G  13   6.023  15.028  -2.581
  139    H1*    G  13           H1*        G  13   4.099  13.721  -1.581
  140    H8     G  13           H8         G  13   2.382  15.341   1.232
  141    H1     G  13           H1         G  13  -1.617  13.864  -3.567
  142   1H2     G  13          H21         G  13   1.270  13.366  -5.416
  143   2H2     G  13          H22         G  13  -0.477  13.350  -5.376
  144   1H5*    C  14          1H5*        C  14   6.869  17.552  -4.564
  145   2H5*    C  14          2H5*        C  14   6.639  19.264  -4.972
  146    H4*    C  14           H4*        C  14   5.872  17.666  -6.713
  147    H3*    C  14           H3*        C  14   3.931  19.662  -5.572
  148    H2*    C  14           H2*        C  14   2.255  18.793  -7.077
  149   2HO*    C  14          2HO*        C  14   4.376  17.211  -8.168
  150    H1*    C  14           H1*        C  14   2.852  16.103  -6.587
  151   1H4     C  14          H41         C  14  -0.581  18.142  -1.341
  152   2H4     C  14          H42         C  14  -1.769  17.502  -2.459
  153    H5     C  14           H5         C  14   1.751  18.365  -1.886
  154    H6     C  14           H6         C  14   3.450  17.972  -3.592
  155   1H5*    U  15          1H5*        U  15   2.432  19.349  -9.344
  156   2H5*    U  15          2H5*        U  15   2.691  20.972 -10.012
  157    H4*    U  15           H4*        U  15   0.375  20.171 -10.244
  158    H3*    U  15           H3*        U  15   0.865  22.692  -8.674
  159    H2*    U  15           H2*        U  15  -1.500  22.871  -8.321
  160   2HO*    U  15          2HO*        U  15  -1.590  20.912 -10.378
  161    H1*    U  15           H1*        U  15  -1.914  20.134  -7.810
  162    H3     U  15           H3         U  15  -2.627  22.090  -3.797
  163    H5     U  15           H5         U  15   1.549  22.101  -4.244
  164    H6     U  15           H6         U  15   1.234  21.323  -6.499
  165   1H5*    U  16          1H5*        U  16  -1.504  25.198 -13.040
  166   2H5*    U  16          2H5*        U  16  -2.413  25.935 -11.706
  167    H4*    U  16           H4*        U  16  -4.044  25.330 -13.241
  168    H3*    U  16           H3*        U  16  -4.406  24.302 -10.853
  169    H2*    U  16           H2*        U  16  -3.037  22.319 -11.109
  170   2HO*    U  16          2HO*        U  16  -5.688  21.700 -11.969
  171    H1*    U  16           H1*        U  16  -4.303  21.753 -13.833
  172    H3     U  16           H3         U  16  -1.511  18.246 -14.041
  173    H5     U  16           H5         U  16   1.045  21.506 -13.351
  174    H6     U  16           H6         U  16  -0.910  22.881 -13.070
  175   1H5*    C  17          1H5*        C  17  -7.381  21.770 -10.116
  176   2H5*    C  17          2H5*        C  17  -8.710  22.936  -9.974
  177    H4*    C  17           H4*        C  17  -8.251  21.506  -7.947
  178    H3*    C  17           H3*        C  17  -9.293  23.984  -7.863
  179    H2*    C  17           H2*        C  17  -7.116  25.123  -7.816
  180   2HO*    C  17          2HO*        C  17  -7.380  26.129  -5.948
  181    H1*    C  17           H1*        C  17  -6.385  23.041  -5.670
  182   1H4     C  17          H41         C  17  -0.664  25.660  -7.734
  183   2H4     C  17          H42         C  17  -0.678  25.802  -5.984
  184    H5     C  17           H5         C  17  -2.548  24.833  -9.001
  185    H6     C  17           H6         C  17  -4.803  23.915  -8.850
  186   1H5*    G  18          1H5*        G  18 -11.019  22.572  -8.332
  187   2H5*    G  18          2H5*        G  18 -12.726  22.368  -7.903
  188    H4*    G  18           H4*        G  18 -12.705  20.236  -8.510
  189    H3*    G  18           H3*        G  18 -10.261  19.914  -6.789
  190    H2*    G  18           H2*        G  18  -9.699  17.961  -8.025
  191   2HO*    G  18          2HO*        G  18 -11.235  16.540  -8.510
  192    H1*    G  18           H1*        G  18 -11.374  18.823 -10.358
  193    H8     G  18           H8         G  18  -9.878  18.372 -12.352
  194    H1     G  18           H1         G  18  -4.574  19.574  -8.934
  195   1H2     G  18          H21         G  18  -6.748  20.198  -6.339
  196   2H2     G  18          H22         G  18  -5.090  20.117  -6.892
  197   1H5*    G  19          1H5*        G  19 -10.604  15.241  -4.401
  198   2H5*    G  19          2H5*        G  19  -9.664  16.733  -4.254
  199    H4*    G  19           H4*        G  19 -10.586  15.746  -6.924
  200    H3*    G  19           H3*        G  19  -8.488  14.451  -5.306
  201    H2*    G  19           H2*        G  19  -6.752  14.741  -6.912
  202   2HO*    G  19          2HO*        G  19  -8.955  15.137  -8.654
  203    H1*    G  19           H1*        G  19  -7.369  17.281  -7.807
  204    H8     G  19           H8         G  19  -8.180  17.796  -4.319
  205    H1     G  19           H1         G  19  -1.860  17.264  -5.228
  206   1H2     G  19          H21         G  19  -2.717  15.984  -8.316
  207   2H2     G  19          H22         G  19  -1.434  16.421  -7.203
  208   1H5*    C  20          1H5*        C  20  -8.350  12.000  -8.891
  209   2H5*    C  20          2H5*        C  20  -8.075  10.321  -8.385
  210    H4*    C  20           H4*        C  20  -6.289  11.218  -9.820
  211    H3*    C  20           H3*        C  20  -5.637  10.200  -7.084
  212    H2*    C  20           H2*        C  20  -3.333  10.857  -7.365
  213   2HO*    C  20          2HO*        C  20  -2.508  10.974  -9.327
  214    H1*    C  20           H1*        C  20  -3.853  13.379  -8.345
  215   1H4     C  20          H41         C  20  -5.554  13.833  -1.991
  216   2H4     C  20          H42         C  20  -3.899  14.401  -2.077
  217    H5     C  20           H5         C  20  -6.732  12.904  -3.867
  218    H6     C  20           H6         C  20  -6.589  12.343  -6.232
  219   1H5*    C  21          1H5*        C  21  -2.891   9.197  -9.840
  220   2H5*    C  21          2H5*        C  21  -2.094   7.616  -9.716
  221    H4*    C  21           H4*        C  21  -0.555   9.572  -9.726
  222    H3*    C  21           H3*        C  21  -0.479   7.575  -7.493
  223    H2*    C  21           H2*        C  21   1.185   8.867  -6.359
  224   2HO*    C  21          2HO*        C  21   1.868   9.475  -8.859
  225    H1*    C  21           H1*        C  21   0.125  11.411  -7.036
  226   1H4     C  21          H41         C  21  -3.171   9.680  -1.626
  227   2H4     C  21          H42         C  21  -1.657  10.346  -1.034
  228    H5     C  21           H5         C  21  -3.602   9.293  -3.975
  229    H6     C  21           H6         C  21  -2.686   9.481  -6.226
  230   1H5*    U  22          1H5*        U  22  -0.123   5.091  -5.911
  231   2H5*    U  22          2H5*        U  22   0.692   6.665  -5.980
  232    H4*    U  22           H4*        U  22   2.567   4.518  -6.392
  233    H3*    U  22           H3*        U  22   0.749   4.133  -4.062
  234    H2*    U  22           H2*        U  22   2.586   3.894  -2.543
  235   2HO*    U  22          2HO*        U  22   4.155   3.772  -4.924
  236    H1*    U  22           H1*        U  22   4.131   5.974  -3.506
  237    H3     U  22           H3         U  22   2.509   7.876   0.224
  238    H5     U  22           H5         U  22  -0.774   7.841  -2.389
  239    H6     U  22           H6         U  22   0.552   6.556  -3.919
  240   1H5*    G  23          1H5*        G  23   0.085   1.194  -1.764
  241   2H5*    G  23          2H5*        G  23  -0.176   2.735  -2.599
  242    H4*    G  23           H4*        G  23   1.678   3.297  -0.595
  243    H3*    G  23           H3*        G  23  -0.174   1.209   0.413
  244    H2*    G  23           H2*        G  23  -0.873   2.531   2.285
  245   2HO*    G  23          2HO*        G  23   1.565   3.553   2.012
  246    H1*    G  23           H1*        G  23  -1.231   4.918   0.956
  247    H8     G  23           H8         G  23  -2.039   2.375  -1.617
  248    H1     G  23           H1         G  23  -6.791   3.215   2.600
  249   1H2     G  23          H21         G  23  -4.464   4.980   4.450
  250   2H2     G  23          H22         G  23  -6.104   4.383   4.313
  251   1H5*    C  24          1H5*        C  24  -0.081  -1.249   3.502
  252   2H5*    C  24          2H5*        C  24  -0.796   0.296   3.003
  253    H4*    C  24           H4*        C  24   0.664   0.283   5.572
  254    H3*    C  24           H3*        C  24  -1.838  -1.347   5.227
  255    H2*    C  24           H2*        C  24  -2.641  -0.484   7.327
  256   2HO*    C  24          2HO*        C  24  -0.001  -0.226   7.782
  257    H1*    C  24           H1*        C  24  -1.879   2.166   6.834
  258   1H4     C  24          H41         C  24  -7.405   1.250   3.352
  259   2H4     C  24          H42         C  24  -7.922   1.877   4.908
  260    H5     C  24           H5         C  24  -5.110   0.683   2.859
  261    H6     C  24           H6         C  24  -2.843   0.597   3.751
  262   1H5*    U  25          1H5*        U  25  -2.253  -2.511   8.412
  263   2H5*    U  25          2H5*        U  25  -1.649  -4.172   8.577
  264    H4*    U  25           H4*        U  25  -3.870  -4.087   9.421
  265    H3*    U  25           H3*        U  25  -3.596  -5.579   6.831
  266    H2*    U  25           H2*        U  25  -5.976  -6.021   6.885
  267   2HO*    U  25          2HO*        U  25  -5.946  -4.688   9.416
  268    H1*    U  25           H1*        U  25  -6.701  -3.412   7.401
  269    H3     U  25           H3         U  25  -7.376  -3.807   2.944
  270    H5     U  25           H5         U  25  -3.218  -3.355   3.320
  271    H6     U  25           H6         U  25  -3.501  -3.497   5.704
  272   1H5*    U  26          1H5*        U  26  -5.452  -8.828   9.049
  273   2H5*    U  26          2H5*        U  26  -4.631 -10.279   8.442
  274    H4*    U  26           H4*        U  26  -7.082 -10.211   8.023
  275    H3*    U  26           H3*        U  26  -5.198 -10.499   5.689
  276    H2*    U  26           H2*        U  26  -7.110 -10.632   4.247
  277   2HO*    U  26          2HO*        U  26  -9.149 -11.059   5.046
  278    H1*    U  26           H1*        U  26  -8.619  -8.670   5.647
  279    H3     U  26           H3         U  26  -7.798  -7.214   1.390
  280    H5     U  26           H5         U  26  -4.456  -6.083   3.675
  281    H6     U  26           H6         U  26  -5.335  -7.413   5.475
  282   1H5*    U  27          1H5*        U  27  -8.376 -13.008   5.941
  283   2H5*    U  27          2H5*        U  27  -8.156 -14.715   5.509
  284    H4*    U  27           H4*        U  27 -10.136 -13.807   4.460
  285    H3*    U  27           H3*        U  27  -7.910 -14.591   2.592
  286    H2*    U  27           H2*        U  27  -9.315 -13.951   0.746
  287   2HO*    U  27          2HO*        U  27 -11.385 -14.359   1.022
  288    H1*    U  27           H1*        U  27 -10.298 -11.604   1.971
  289    H3     U  27           H3         U  27  -7.709  -9.965  -1.335
  290    H5     U  27           H5         U  27  -4.978 -11.303   1.548
  291    H6     U  27           H6         U  27  -6.793 -12.375   2.676
  292   1H5*    U  28          1H5*        U  28 -11.773 -16.929   1.670
  293   2H5*    U  28          2H5*        U  28 -11.214 -18.522   1.123
  294    H4*    U  28           H4*        U  28 -12.931 -17.470  -0.329
  295    H3*    U  28           H3*        U  28 -10.280 -18.295  -1.476
  296    H2*    U  28           H2*        U  28 -11.024 -17.502  -3.644
  297   2HO*    U  28          2HO*        U  28 -13.202 -18.041  -3.603
  298    H1*    U  28           H1*        U  28 -11.865 -15.049  -2.713
  299    H3     U  28           H3         U  28  -7.718 -14.376  -4.510
  300    H5     U  28           H5         U  28  -7.033 -15.619  -0.557
  301    H6     U  28           H6         U  28  -9.380 -16.117  -0.387
  302   1H5*    G  29          1H5*        G  29 -12.176 -21.335  -3.857
  303   2H5*    G  29          2H5*        G  29 -11.178 -22.772  -3.564
  304    H4*    G  29           H4*        G  29 -11.075 -21.991  -5.888
  305    H3*    G  29           H3*        G  29  -8.514 -22.008  -4.306
  306    H2*    G  29           H2*        G  29  -7.371 -21.105  -6.188
  307   2HO*    G  29          2HO*        G  29  -7.870 -22.014  -8.026
  308    H1*    G  29           H1*        G  29  -9.633 -19.619  -7.206
  309    H8     G  29           H8         G  29  -8.912 -18.696  -3.678
  310    H1     G  29           H1         G  29  -5.067 -15.780  -7.897
  311   1H2     G  29          H21         G  29  -6.349 -18.026 -10.186
  312   2H2     G  29          H22         G  29  -5.274 -16.678  -9.870
  313   1H5*    C  30          1H5*        C  30  -7.411 -24.037  -8.008
  314   2H5*    C  30          2H5*        C  30  -6.312 -25.332  -7.493
  315    H4*    C  30           H4*        C  30  -5.298 -23.845  -9.144
  316    H3*    C  30           H3*        C  30  -4.039 -24.069  -6.437
  317    H2*    C  30           H2*        C  30  -2.401 -22.420  -7.030
  318   2HO*    C  30          2HO*        C  30  -3.220 -21.902  -9.588
  319    H1*    C  30           H1*        C  30  -4.155 -20.692  -8.374
  320   1H4     C  30          H41         C  30  -5.050 -19.499  -1.945
  321   2H4     C  30          H42         C  30  -4.058 -18.196  -2.581
  322    H5     C  30           H5         C  30  -5.704 -21.401  -3.284
  323    H6     C  30           H6         C  30  -5.566 -22.428  -5.490
  324   1H5*    U  31          1H5*        U  31  -1.070 -24.280  -9.011
  325   2H5*    U  31          2H5*        U  31   0.066 -25.632  -8.833
  326    H4*    U  31           H4*        U  31   1.240 -23.521  -8.893
  327    H3*    U  31           H3*        U  31   1.375 -25.084  -6.339
  328    H2*    U  31           H2*        U  31   2.703 -23.346  -5.339
  329   2HO*    U  31          2HO*        U  31   3.234 -21.478  -6.757
  330    H1*    U  31           H1*        U  31   1.145 -21.229  -6.259
  331    H3     U  31           H3         U  31   0.264 -21.712  -1.808
  332    H5     U  31           H5         U  31  -2.322 -24.379  -3.767
  333    H6     U  31           H6         U  31  -1.115 -23.934  -5.802
  334    H3T    U  31           H3T        U  31   3.558 -24.392  -7.837
  Start of MODEL   21
    1   1H5*    A   1          1H5*        A   1  -0.540 -11.938   6.757
    2   2H5*    A   1          2H5*        A   1  -1.263 -13.521   6.420
    3    H4*    A   1           H4*        A   1   1.618 -12.951   7.100
    4    H3*    A   1           H3*        A   1   0.280 -13.566   4.484
    5    H2*    A   1           H2*        A   1   2.189 -14.920   3.868
    6   2HO*    A   1          2HO*        A   1   3.955 -13.917   4.679
    7    H1*    A   1           H1*        A   1   2.295 -16.309   6.257
    8    H8     A   1           H8         A   1  -1.313 -15.793   6.028
    9   1H6     A   1          H61         A   1  -1.580 -20.320   1.815
   10   2H6     A   1          H62         A   1  -2.514 -19.297   2.883
   11    H2     A   1           H2         A   1   2.723 -19.186   2.367
   12    H5T    A   1           H5T        A   1  -1.352 -12.544   8.668
   13   1H5*    G   2          1H5*        G   2   3.944 -12.203   2.661
   14   2H5*    G   2          2H5*        G   2   3.367 -10.949   1.546
   15    H4*    G   2           H4*        G   2   4.672 -12.641   0.392
   16    H3*    G   2           H3*        G   2   1.774 -12.406  -0.368
   17    H2*    G   2           H2*        G   2   2.068 -14.190  -1.944
   18   2HO*    G   2          2HO*        G   2   4.451 -14.990  -1.998
   19    H1*    G   2           H1*        G   2   3.744 -15.760  -0.297
   20    H8     G   2           H8         G   2   1.183 -14.723   2.055
   21    H1     G   2           H1         G   2  -1.055 -19.034  -2.128
   22   1H2     G   2          H21         G   2   1.800 -18.322  -3.947
   23   2H2     G   2          H22         G   2   0.314 -19.241  -3.826
   24   1H5*    U   3          1H5*        U   3   3.955 -11.917  -4.170
   25   2H5*    U   3          2H5*        U   3   3.190 -10.537  -4.983
   26    H4*    U   3           H4*        U   3   3.297 -12.383  -6.496
   27    H3*    U   3           H3*        U   3   0.518 -11.709  -5.565
   28    H2*    U   3           H2*        U   3  -0.315 -13.471  -6.991
   29   2HO*    U   3          2HO*        U   3   2.389 -13.751  -7.880
   30    H1*    U   3           H1*        U   3   1.588 -15.345  -6.195
   31    H3     U   3           H3         U   3  -2.179 -16.692  -4.082
   32    H5     U   3           H5         U   3  -0.809 -13.440  -1.806
   33    H6     U   3           H6         U   3   0.839 -13.038  -3.512
   34   1H5*    A   4          1H5*        A   4   0.418 -11.336 -10.242
   35   2H5*    A   4          2H5*        A   4  -0.306  -9.718 -10.324
   36    H4*    A   4           H4*        A   4  -1.335 -11.237 -11.908
   37    H3*    A   4           H3*        A   4  -3.072 -10.137  -9.731
   38    H2*    A   4           H2*        A   4  -4.942 -11.425 -10.586
   39   2HO*    A   4          2HO*        A   4  -4.575 -12.760 -12.477
   40    H1*    A   4           H1*        A   4  -3.568 -13.800 -10.688
   41    H8     A   4           H8         A   4  -1.681 -12.326  -7.990
   42   1H6     A   4          H61         A   4  -6.380 -13.294  -4.095
   43   2H6     A   4          H62         A   4  -4.685 -12.885  -4.230
   44    H2     A   4           H2         A   4  -7.906 -13.855  -8.282
   45   1H5*    G   5          1H5*        G   5  -5.284  -7.991 -12.868
   46   2H5*    G   5          2H5*        G   5  -5.499  -6.374 -12.172
   47    H4*    G   5           H4*        G   5  -7.610  -7.584 -12.576
   48    H3*    G   5           H3*        G   5  -6.991  -6.722  -9.756
   49    H2*    G   5           H2*        G   5  -9.159  -7.595  -9.124
   50   2HO*    G   5          2HO*        G   5 -10.703  -7.985 -10.597
   51    H1*    G   5           H1*        G   5  -8.856  -9.993 -10.529
   52    H8     G   5           H8         G   5  -5.462  -9.381  -9.277
   53    H1     G   5           H1         G   5  -9.515 -11.188  -4.638
   54   1H2     G   5          H21         G   5 -11.987 -10.536  -6.948
   55   2H2     G   5          H22         G   5 -11.574 -11.064  -5.333
   56   1H5*    A   6          1H5*        A   6 -10.614  -6.013 -10.570
   57   2H5*    A   6          2H5*        A   6 -11.308  -4.417 -10.228
   58    H4*    A   6           H4*        A   6 -12.606  -6.335  -9.329
   59    H3*    A   6           H3*        A   6 -12.365  -3.913  -8.125
   60    H2*    A   6           H2*        A   6 -10.576  -4.490  -6.609
   61   2HO*    A   6          2HO*        A   6 -12.867  -4.257  -5.523
   62    H1*    A   6           H1*        A   6 -11.898  -7.244  -6.228
   63    H8     A   6           H8         A   6  -8.376  -6.340  -7.440
   64   1H6     A   6          H61         A   6  -6.380  -8.692  -2.075
   65   2H6     A   6          H62         A   6  -5.908  -8.048  -3.637
   66    H2     A   6           H2         A   6 -10.871  -8.642  -1.987
   67   1H5*    A   7          1H5*        A   7 -14.790  -5.770  -4.689
   68   2H5*    A   7          2H5*        A   7 -16.062  -4.563  -4.419
   69    H4*    A   7           H4*        A   7 -15.101  -4.820  -2.329
   70    H3*    A   7           H3*        A   7 -13.915  -2.378  -3.626
   71    H2*    A   7           H2*        A   7 -12.403  -2.148  -1.823
   72   2HO*    A   7          2HO*        A   7 -14.369  -3.623  -0.369
   73    H1*    A   7           H1*        A   7 -12.535  -4.993  -1.040
   74    H8     A   7           H8         A   7 -10.957  -3.969  -4.357
   75   1H6     A   7          H61         A   7  -5.554  -4.215  -1.355
   76   2H6     A   7          H62         A   7  -6.329  -4.029  -2.913
   77    H2     A   7           H2         A   7  -8.843  -4.705   1.660
   78   1H5*    A   8          1H5*        A   8 -15.483   1.182  -0.629
   79   2H5*    A   8          2H5*        A   8 -13.857   1.761  -1.039
   80    H4*    A   8           H4*        A   8 -14.777   0.102   1.199
   81    H3*    A   8           H3*        A   8 -12.515   2.035   0.766
   82    H2*    A   8           H2*        A   8 -11.251   0.938   2.460
   83   2HO*    A   8          2HO*        A   8 -12.818   0.823   4.062
   84    H1*    A   8           H1*        A   8 -12.276  -1.694   1.945
   85    H8     A   8           H8         A   8 -11.040  -0.283  -1.246
   86   1H6     A   8          H61         A   8  -5.361  -2.106   0.417
   87   2H6     A   8          H62         A   8  -6.347  -1.504  -0.897
   88    H2     A   8           H2         A   8  -8.038  -2.464   3.995
   89   1H5*    C   9          1H5*        C   9 -13.323   3.847   5.840
   90   2H5*    C   9          2H5*        C   9 -12.363   5.017   4.912
   91    H4*    C   9           H4*        C   9 -11.511   3.536   7.078
   92    H3*    C   9           H3*        C   9 -10.059   5.185   5.051
   93    H2*    C   9           H2*        C   9  -7.952   4.235   5.730
   94   2HO*    C   9          2HO*        C   9  -8.637   2.431   7.549
   95    H1*    C   9           H1*        C   9  -8.797   1.603   5.783
   96   1H4     C   9          H41         C   9  -8.547   2.989  -0.660
   97   2H4     C   9          H42         C   9  -6.957   2.368  -0.240
   98    H5     C   9           H5         C   9 -10.272   3.414   0.997
   99    H6     C   9           H6         C   9 -10.810   3.326   3.371
  100   1H5*    A  10          1H5*        A  10  -8.264   8.449   8.872
  101   2H5*    A  10          2H5*        A  10  -7.783   9.175   7.326
  102    H4*    A  10           H4*        A  10  -6.113   8.298   9.358
  103    H3*    A  10           H3*        A  10  -5.652   9.305   6.603
  104    H2*    A  10           H2*        A  10  -3.497   8.277   6.430
  105   2HO*    A  10          2HO*        A  10  -3.232   7.031   8.781
  106    H1*    A  10           H1*        A  10  -4.140   5.824   7.510
  107    H8     A  10           H8         A  10  -7.321   6.407   5.894
  108   1H6     A  10          H61         A  10  -4.703   5.176   0.422
  109   2H6     A  10          H62         A  10  -6.216   5.383   1.276
  110    H2     A  10           H2         A  10  -1.428   5.793   3.423
  111   1H5*    A  11          1H5*        A  11  -1.954  13.121   8.201
  112   2H5*    A  11          2H5*        A  11  -2.045  12.719   6.476
  113    H4*    A  11           H4*        A  11   0.047  12.172   8.451
  114    H3*    A  11           H3*        A  11  -0.043  12.828   5.570
  115    H2*    A  11           H2*        A  11   1.697  11.315   4.954
  116   2HO*    A  11          2HO*        A  11   2.410  10.223   7.292
  117    H1*    A  11           H1*        A  11   0.958   9.149   6.486
  118    H8     A  11           H8         A  11  -2.391  10.358   5.794
  119   1H6     A  11          H61         A  11  -1.943   8.093   0.054
  120   2H6     A  11          H62         A  11  -3.031   8.735   1.264
  121    H2     A  11           H2         A  11   2.161   8.113   1.862
  122   1H5*    G  12          1H5*        G  12   4.052  12.825   5.682
  123   2H5*    G  12          2H5*        G  12   4.506  14.484   5.247
  124    H4*    G  12           H4*        G  12   5.591  12.905   3.789
  125    H3*    G  12           H3*        G  12   3.610  14.775   2.564
  126    H2*    G  12           H2*        G  12   3.826  13.685   0.427
  127   2HO*    G  12          2HO*        G  12   5.695  12.788  -0.040
  128    H1*    G  12           H1*        G  12   3.631  11.109   1.350
  129    H8     G  12           H8         G  12   1.633  13.581   3.462
  130    H1     G  12           H1         G  12  -1.553  10.957  -1.446
  131   1H2     G  12          H21         G  12   1.526   9.661  -2.354
  132   2H2     G  12          H22         G  12  -0.181   9.794  -2.712
  133   1H5*    G  13          1H5*        G  13   6.764  14.309  -0.399
  134   2H5*    G  13          2H5*        G  13   7.160  15.974  -0.870
  135    H4*    G  13           H4*        G  13   6.704  14.627  -2.819
  136    H3*    G  13           H3*        G  13   4.754  16.832  -2.242
  137    H2*    G  13           H2*        G  13   3.484  16.185  -4.183
  138   2HO*    G  13          2HO*        G  13   4.305  14.735  -5.685
  139    H1*    G  13           H1*        G  13   3.576  13.452  -3.686
  140    H8     G  13           H8         G  13   3.295  15.382  -0.459
  141    H1     G  13           H1         G  13  -2.299  14.239  -3.382
  142   1H2     G  13          H21         G  13  -0.360  13.196  -6.048
  143   2H2     G  13          H22         G  13  -1.965  13.465  -5.404
  144   1H5*    C  14          1H5*        C  14   6.414  17.281  -6.414
  145   2H5*    C  14          2H5*        C  14   6.259  18.975  -6.920
  146    H4*    C  14           H4*        C  14   5.196  17.316  -8.446
  147    H3*    C  14           H3*        C  14   3.534  19.543  -7.284
  148    H2*    C  14           H2*        C  14   1.653  18.686  -8.559
  149   2HO*    C  14          2HO*        C  14   3.678  17.466  -9.942
  150    H1*    C  14           H1*        C  14   1.929  16.127  -7.611
  151   1H4     C  14          H41         C  14   0.168  19.735  -2.376
  152   2H4     C  14          H42         C  14  -1.323  19.506  -3.275
  153    H5     C  14           H5         C  14   2.321  19.031  -3.205
  154    H6     C  14           H6         C  14   3.493  17.958  -5.063
  155   1H5*    U  15          1H5*        U  15   1.441  19.570 -10.603
  156   2H5*    U  15          2H5*        U  15   1.436  21.267 -11.117
  157    H4*    U  15           H4*        U  15  -0.798  20.203 -10.552
  158    H3*    U  15           H3*        U  15   0.066  22.855  -9.448
  159    H2*    U  15           H2*        U  15  -2.048  23.000  -8.268
  160   2HO*    U  15          2HO*        U  15  -3.170  20.673  -8.597
  161    H1*    U  15           H1*        U  15  -1.833  20.499  -7.151
  162    H3     U  15           H3         U  15  -0.441  23.780  -4.193
  163    H5     U  15           H5         U  15   2.994  22.218  -6.042
  164    H6     U  15           H6         U  15   1.550  21.083  -7.591
  165   1H5*    U  16          1H5*        U  16  -3.570  23.817 -13.204
  166   2H5*    U  16          2H5*        U  16  -3.473  25.546 -12.819
  167    H4*    U  16           H4*        U  16  -5.671  25.497 -12.635
  168    H3*    U  16           H3*        U  16  -4.896  25.094 -10.084
  169    H2*    U  16           H2*        U  16  -4.992  22.674 -10.126
  170   2HO*    U  16          2HO*        U  16  -6.424  22.809  -8.545
  171    H1*    U  16           H1*        U  16  -7.585  22.949 -11.769
  172    H3     U  16           H3         U  16  -8.020  18.473 -11.518
  173    H5     U  16           H5         U  16  -4.167  19.025 -13.091
  174    H6     U  16           H6         U  16  -4.426  21.386 -12.700
  175   1H5*    C  17          1H5*        C  17  -7.710  24.003  -8.211
  176   2H5*    C  17          2H5*        C  17  -8.776  25.361  -7.799
  177    H4*    C  17           H4*        C  17  -8.407  23.835  -5.911
  178    H3*    C  17           H3*        C  17  -8.722  26.372  -5.507
  179    H2*    C  17           H2*        C  17  -6.428  27.079  -6.021
  180   2HO*    C  17          2HO*        C  17  -6.026  27.970  -4.126
  181    H1*    C  17           H1*        C  17  -5.367  24.864  -4.207
  182   1H4     C  17          H41         C  17  -0.709  26.088  -8.729
  183   2H4     C  17          H42         C  17  -0.100  26.739  -7.219
  184    H5     C  17           H5         C  17  -2.955  25.182  -8.953
  185    H6     C  17           H6         C  17  -5.039  24.713  -7.774
  186   1H5*    G  18          1H5*        G  18 -10.591  24.543  -5.629
  187   2H5*    G  18          2H5*        G  18 -12.173  24.669  -4.839
  188    H4*    G  18           H4*        G  18 -12.565  22.486  -5.003
  189    H3*    G  18           H3*        G  18  -9.721  21.930  -4.165
  190    H2*    G  18           H2*        G  18 -10.088  19.676  -4.983
  191   2HO*    G  18          2HO*        G  18 -12.665  20.476  -5.861
  192    H1*    G  18           H1*        G  18 -10.943  20.576  -7.446
  193    H8     G  18           H8         G  18  -9.019  20.738  -8.965
  194    H1     G  18           H1         G  18  -4.981  22.147  -4.197
  195   1H2     G  18          H21         G  18  -7.837  22.305  -2.217
  196   2H2     G  18          H22         G  18  -6.096  22.448  -2.309
  197   1H5*    G  19          1H5*        G  19 -10.634  17.180  -1.562
  198   2H5*    G  19          2H5*        G  19  -9.214  18.236  -1.487
  199    H4*    G  19           H4*        G  19 -10.909  17.968  -3.949
  200    H3*    G  19           H3*        G  19  -8.735  16.101  -3.105
  201    H2*    G  19           H2*        G  19  -7.731  16.217  -5.294
  202   2HO*    G  19          2HO*        G  19 -10.141  17.587  -5.990
  203    H1*    G  19           H1*        G  19  -7.946  18.982  -5.587
  204    H8     G  19           H8         G  19  -7.336  18.863  -2.032
  205    H1     G  19           H1         G  19  -2.045  17.391  -5.339
  206   1H2     G  19          H21         G  19  -4.175  16.985  -8.007
  207   2H2     G  19          H22         G  19  -2.532  16.886  -7.397
  208   1H5*    C  20          1H5*        C  20 -10.239  14.150  -6.485
  209   2H5*    C  20          2H5*        C  20 -10.333  12.397  -6.229
  210    H4*    C  20           H4*        C  20  -8.871  12.897  -8.073
  211    H3*    C  20           H3*        C  20  -7.678  11.610  -5.666
  212    H2*    C  20           H2*        C  20  -5.453  11.855  -6.523
  213   2HO*    C  20          2HO*        C  20  -6.746  12.615  -8.954
  214    H1*    C  20           H1*        C  20  -5.703  14.427  -7.501
  215   1H4     C  20          H41         C  20  -5.210  15.261  -0.989
  216   2H4     C  20          H42         C  20  -3.636  15.656  -1.643
  217    H5     C  20           H5         C  20  -7.020  14.418  -2.302
  218    H6     C  20           H6         C  20  -7.742  13.782  -4.519
  219   1H5*    C  21          1H5*        C  21  -5.332  10.555  -8.804
  220   2H5*    C  21          2H5*        C  21  -5.470   8.799  -9.019
  221    H4*    C  21           H4*        C  21  -3.184   9.250  -9.112
  222    H3*    C  21           H3*        C  21  -3.999   8.067  -6.491
  223    H2*    C  21           H2*        C  21  -1.767   8.309  -5.639
  224   2HO*    C  21          2HO*        C  21  -0.290   7.932  -7.137
  225    H1*    C  21           H1*        C  21  -1.325  10.877  -6.603
  226   1H4     C  21          H41         C  21  -5.417  11.512  -1.423
  227   2H4     C  21          H42         C  21  -3.819  11.931  -0.835
  228    H5     C  21           H5         C  21  -5.831  10.705  -3.672
  229    H6     C  21           H6         C  21  -4.768  10.131  -5.817
  230   1H5*    U  22          1H5*        U  22  -0.929   4.273  -8.206
  231   2H5*    U  22          2H5*        U  22  -1.547   3.292  -6.863
  232    H4*    U  22           H4*        U  22   1.033   3.778  -7.200
  233    H3*    U  22           H3*        U  22  -0.486   3.366  -4.658
  234    H2*    U  22           H2*        U  22   1.425   4.012  -3.353
  235   2HO*    U  22          2HO*        U  22   2.867   4.106  -5.821
  236    H1*    U  22           H1*        U  22   2.121   6.227  -4.868
  237    H3     U  22           H3         U  22   0.136   7.880  -1.115
  238    H5     U  22           H5         U  22  -3.029   6.898  -3.695
  239    H6     U  22           H6         U  22  -1.425   5.831  -5.132
  240   1H5*    G  23          1H5*        G  23   3.207   2.623  -2.801
  241   2H5*    G  23          2H5*        G  23   2.925   0.945  -2.301
  242    H4*    G  23           H4*        G  23   3.313   2.745  -0.504
  243    H3*    G  23           H3*        G  23   1.271   0.565  -0.405
  244    H2*    G  23           H2*        G  23   0.334   1.470   1.617
  245   2HO*    G  23          2HO*        G  23   1.705   2.416   2.937
  246    H1*    G  23           H1*        G  23   0.312   4.124   0.801
  247    H8     G  23           H8         G  23  -0.425   2.525  -2.377
  248    H1     G  23           H1         G  23  -5.391   2.155   1.667
  249   1H2     G  23          H21         G  23  -3.109   3.069   4.095
  250   2H2     G  23          H22         G  23  -4.761   2.640   3.706
  251   1H5*    C  24          1H5*        C  24   2.547  -3.064   2.477
  252   2H5*    C  24          2H5*        C  24   0.854  -3.036   1.947
  253    H4*    C  24           H4*        C  24   2.041  -2.500   4.585
  254    H3*    C  24           H3*        C  24  -0.502  -3.722   3.586
  255    H2*    C  24           H2*        C  24  -1.658  -3.028   5.577
  256   2HO*    C  24          2HO*        C  24   0.502  -3.423   6.798
  257    H1*    C  24           H1*        C  24  -0.651  -0.445   5.639
  258   1H4     C  24          H41         C  24  -4.981  -0.298   0.678
  259   2H4     C  24          H42         C  24  -5.932  -0.020   2.127
  260    H5     C  24           H5         C  24  -2.631  -0.868   0.739
  261    H6     C  24           H6         C  24  -0.719  -1.288   2.194
  262   1H5*    U  25          1H5*        U  25  -1.242  -4.929   6.831
  263   2H5*    U  25          2H5*        U  25  -1.205  -6.697   6.971
  264    H4*    U  25           H4*        U  25  -3.331  -5.898   7.706
  265    H3*    U  25           H3*        U  25  -3.373  -7.434   5.128
  266    H2*    U  25           H2*        U  25  -5.768  -7.109   5.014
  267   2HO*    U  25          2HO*        U  25  -6.908  -6.606   6.767
  268    H1*    U  25           H1*        U  25  -5.682  -4.398   5.532
  269    H3     U  25           H3         U  25  -6.238  -4.635   1.040
  270    H5     U  25           H5         U  25  -2.124  -5.232   1.641
  271    H6     U  25           H6         U  25  -2.564  -5.344   4.005
  272   1H5*    U  26          1H5*        U  26  -6.521  -8.474   7.004
  273   2H5*    U  26          2H5*        U  26  -6.651 -10.202   7.383
  274    H4*    U  26           H4*        U  26  -8.708  -9.673   6.457
  275    H3*    U  26           H3*        U  26  -7.001 -10.903   4.294
  276    H2*    U  26           H2*        U  26  -8.918 -10.718   2.840
  277   2HO*    U  26          2HO*        U  26 -10.794  -9.559   4.188
  278    H1*    U  26           H1*        U  26  -9.593  -8.122   3.700
  279    H3     U  26           H3         U  26  -8.138  -7.640  -0.570
  280    H5     U  26           H5         U  26  -4.638  -7.999   1.727
  281    H6     U  26           H6         U  26  -6.025  -8.550   3.614
  282   1H5*    U  27          1H5*        U  27 -10.774 -12.539   4.582
  283   2H5*    U  27          2H5*        U  27 -10.859 -14.291   4.315
  284    H4*    U  27           H4*        U  27 -12.460 -13.044   2.947
  285    H3*    U  27           H3*        U  27 -10.345 -14.610   1.478
  286    H2*    U  27           H2*        U  27 -11.471 -13.973  -0.574
  287   2HO*    U  27          2HO*        U  27 -13.615 -13.923  -0.127
  288    H1*    U  27           H1*        U  27 -11.616 -11.284   0.122
  289    H3     U  27           H3         U  27  -8.252 -11.824  -2.915
  290    H5     U  27           H5         U  27  -6.501 -12.465   0.848
  291    H6     U  27           H6         U  27  -8.717 -12.503   1.779
  292   1H5*    U  28          1H5*        U  28 -13.906 -16.394  -0.330
  293   2H5*    U  28          2H5*        U  28 -13.540 -18.129  -0.292
  294    H4*    U  28           H4*        U  28 -14.093 -17.389  -2.533
  295    H3*    U  28           H3*        U  28 -11.241 -18.302  -2.160
  296    H2*    U  28           H2*        U  28 -10.991 -18.033  -4.558
  297   2HO*    U  28          2HO*        U  28 -13.407 -16.927  -5.118
  298    H1*    U  28           H1*        U  28 -12.158 -15.497  -4.568
  299    H3     U  28           H3         U  28  -7.669 -14.892  -5.040
  300    H5     U  28           H5         U  28  -8.303 -15.296  -0.904
  301    H6     U  28           H6         U  28 -10.576 -15.921  -1.393
  302   1H5*    G  29          1H5*        G  29 -12.009 -21.890  -4.393
  303   2H5*    G  29          2H5*        G  29 -11.217 -23.151  -3.429
  304    H4*    G  29           H4*        G  29 -10.185 -22.809  -5.640
  305    H3*    G  29           H3*        G  29  -8.451 -22.318  -3.221
  306    H2*    G  29           H2*        G  29  -6.659 -21.780  -4.691
  307   2HO*    G  29          2HO*        G  29  -6.437 -22.815  -6.553
  308    H1*    G  29           H1*        G  29  -8.387 -20.748  -6.797
  309    H8     G  29           H8         G  29  -8.890 -18.922  -3.599
  310    H1     G  29           H1         G  29  -3.739 -16.955  -6.877
  311   1H2     G  29          H21         G  29  -4.243 -19.774  -8.803
  312   2H2     G  29          H22         G  29  -3.294 -18.333  -8.507
  313   1H5*    C  30          1H5*        C  30  -6.225 -24.720  -6.127
  314   2H5*    C  30          2H5*        C  30  -5.495 -26.005  -5.145
  315    H4*    C  30           H4*        C  30  -3.855 -24.913  -6.570
  316    H3*    C  30           H3*        C  30  -3.486 -24.680  -3.600
  317    H2*    C  30           H2*        C  30  -1.515 -23.353  -3.962
  318   2HO*    C  30          2HO*        C  30  -0.457 -23.356  -5.878
  319    H1*    C  30           H1*        C  30  -2.593 -21.793  -6.033
  320   1H4     C  30          H41         C  30  -4.989 -19.237  -0.438
  321   2H4     C  30          H42         C  30  -3.652 -18.209  -0.923
  322    H5     C  30           H5         C  30  -5.571 -21.273  -1.606
  323    H6     C  30           H6         C  30  -4.996 -22.737  -3.470
  324   1H5*    U  31          1H5*        U  31   0.280 -25.891  -4.942
  325   2H5*    U  31          2H5*        U  31   0.724 -27.397  -4.115
  326    H4*    U  31           H4*        U  31   2.562 -25.904  -3.967
  327    H3*    U  31           H3*        U  31   1.113 -26.309  -1.369
  328    H2*    U  31           H2*        U  31   2.642 -24.792  -0.299
  329   2HO*    U  31          2HO*        U  31   4.373 -23.888  -1.729
  330    H1*    U  31           H1*        U  31   2.599 -22.877  -2.338
  331    H3     U  31           H3         U  31   0.220 -20.994   1.028
  332    H5     U  31           H5         U  31  -2.455 -23.660  -0.811
  333    H6     U  31           H6         U  31  -0.611 -24.490  -2.116
  334    H3T    U  31           H3T        U  31   3.736 -26.971  -2.054
  Start of MODEL   22
    1   1H5*    A   1          1H5*        A   1  -2.790 -12.019  10.226
    2   2H5*    A   1          2H5*        A   1  -3.185 -11.300   8.654
    3    H4*    A   1           H4*        A   1  -0.738 -11.558   9.215
    4    H3*    A   1           H3*        A   1  -1.953 -12.434   6.628
    5    H2*    A   1           H2*        A   1   0.149 -13.374   5.916
    6   2HO*    A   1          2HO*        A   1   1.102 -11.883   8.127
    7    H1*    A   1           H1*        A   1   0.680 -14.726   8.261
    8    H8     A   1           H8         A   1  -2.982 -14.896   8.248
    9   1H6     A   1          H61         A   1  -2.620 -19.415   4.033
   10   2H6     A   1          H62         A   1  -3.671 -18.578   5.153
   11    H2     A   1           H2         A   1   1.421 -17.500   4.369
   12    H5T    A   1           H5T        A   1  -4.128 -13.084   8.109
   13   1H5*    G   2          1H5*        G   2   1.371 -10.219   5.238
   14   2H5*    G   2          2H5*        G   2   0.846  -9.116   3.951
   15    H4*    G   2           H4*        G   2   2.689 -10.655   3.315
   16    H3*    G   2           H3*        G   2   0.137 -10.647   1.722
   17    H2*    G   2           H2*        G   2   1.089 -12.328   0.283
   18   2HO*    G   2          2HO*        G   2   3.315 -12.926   0.568
   19    H1*    G   2           H1*        G   2   2.211 -13.848   2.370
   20    H8     G   2           H8         G   2  -0.938 -13.048   3.919
   21    H1     G   2           H1         G   2  -1.736 -17.109  -0.981
   22   1H2     G   2          H21         G   2   1.483 -16.195  -1.875
   23   2H2     G   2          H22         G   2   0.069 -17.160  -2.235
   24   1H5*    U   3          1H5*        U   3   3.285  -9.313  -1.358
   25   2H5*    U   3          2H5*        U   3   2.388  -8.112  -2.306
   26    H4*    U   3           H4*        U   3   3.387  -9.805  -3.728
   27    H3*    U   3           H3*        U   3   0.376  -9.743  -3.676
   28    H2*    U   3           H2*        U   3   0.411 -11.493  -5.347
   29   2HO*    U   3          2HO*        U   3   2.888 -12.144  -5.702
   30    H1*    U   3           H1*        U   3   2.353 -13.013  -4.030
   31    H3     U   3           H3         U   3  -1.485 -15.308  -3.321
   32    H5     U   3           H5         U   3  -1.637 -12.123  -0.589
   33    H6     U   3           H6         U   3   0.320 -11.214  -1.656
   34   1H5*    A   4          1H5*        A   4   1.187  -8.456  -8.006
   35   2H5*    A   4          2H5*        A   4  -0.106  -7.278  -8.300
   36    H4*    A   4           H4*        A   4  -0.009  -9.149  -9.928
   37    H3*    A   4           H3*        A   4  -2.536  -8.603  -8.408
   38    H2*    A   4           H2*        A   4  -3.578 -10.493  -9.521
   39   2HO*    A   4          2HO*        A   4  -2.355 -11.662 -11.105
   40    H1*    A   4           H1*        A   4  -1.514 -12.245  -9.004
   41    H8     A   4           H8         A   4  -1.125 -10.176  -6.061
   42   1H6     A   4          H61         A   4  -6.126 -12.795  -3.545
   43   2H6     A   4          H62         A   4  -4.713 -11.807  -3.246
   44    H2     A   4           H2         A   4  -6.057 -13.844  -7.912
   45   1H5*    G   5          1H5*        G   5  -4.391  -7.458 -12.227
   46   2H5*    G   5          2H5*        G   5  -5.239  -5.952 -11.829
   47    H4*    G   5           H4*        G   5  -6.742  -7.770 -12.521
   48    H3*    G   5           H3*        G   5  -7.097  -6.600  -9.773
   49    H2*    G   5           H2*        G   5  -8.971  -8.101  -9.454
   50   2HO*    G   5          2HO*        G   5  -9.413  -9.592 -11.300
   51    H1*    G   5           H1*        G   5  -7.619 -10.352 -10.350
   52    H8     G   5           H8         G   5  -4.866  -8.535  -8.791
   53    H1     G   5           H1         G   5  -8.962 -10.890  -4.450
   54   1H2     G   5          H21         G   5 -11.087 -11.336  -7.129
   55   2H2     G   5          H22         G   5 -10.828 -11.473  -5.403
   56   1H5*    A   6          1H5*        A   6 -10.738  -7.328 -10.922
   57   2H5*    A   6          2H5*        A   6 -11.681  -5.828 -11.007
   58    H4*    A   6           H4*        A   6 -12.806  -7.676  -9.808
   59    H3*    A   6           H3*        A   6 -13.020  -5.066  -9.155
   60    H2*    A   6           H2*        A   6 -11.322  -4.997  -7.444
   61   2HO*    A   6          2HO*        A   6 -13.456  -4.616  -6.471
   62    H1*    A   6           H1*        A   6 -12.233  -7.759  -6.471
   63    H8     A   6           H8         A   6  -8.839  -6.573  -7.817
   64   1H6     A   6          H61         A   6  -6.781  -7.253  -2.019
   65   2H6     A   6          H62         A   6  -6.338  -6.893  -3.678
   66    H2     A   6           H2         A   6 -11.200  -8.058  -2.032
   67   1H5*    A   7          1H5*        A   7 -15.601  -6.901  -5.669
   68   2H5*    A   7          2H5*        A   7 -16.996  -5.808  -5.595
   69    H4*    A   7           H4*        A   7 -16.169  -5.970  -3.406
   70    H3*    A   7           H3*        A   7 -15.375  -3.351  -4.653
   71    H2*    A   7           H2*        A   7 -14.090  -2.827  -2.741
   72   2HO*    A   7          2HO*        A   7 -15.261  -4.801  -1.130
   73    H1*    A   7           H1*        A   7 -13.747  -5.638  -1.917
   74    H8     A   7           H8         A   7 -12.096  -4.390  -5.112
   75   1H6     A   7          H61         A   7  -7.047  -3.538  -1.630
   76   2H6     A   7          H62         A   7  -7.681  -3.541  -3.262
   77    H2     A   7           H2         A   7 -10.462  -4.545   1.092
   78   1H5*    A   8          1H5*        A   8 -17.320   0.329  -1.531
   79   2H5*    A   8          2H5*        A   8 -15.704  -0.075  -2.142
   80    H4*    A   8           H4*        A   8 -16.784  -0.595   0.625
   81    H3*    A   8           H3*        A   8 -14.869   1.483  -0.393
   82    H2*    A   8           H2*        A   8 -13.562   1.221   1.615
   83   2HO*    A   8          2HO*        A   8 -15.825   0.699   2.726
   84    H1*    A   8           H1*        A   8 -13.638  -1.571   1.632
   85    H8     A   8           H8         A   8 -13.402  -0.184  -1.895
   86   1H6     A   8          H61         A   8  -7.262  -0.453  -1.143
   87   2H6     A   8          H62         A   8  -8.557  -0.174  -2.286
   88    H2     A   8           H2         A   8  -9.188  -1.312   2.815
   89   1H5*    C   9          1H5*        C   9 -15.746   3.655   4.190
   90   2H5*    C   9          2H5*        C   9 -15.234   5.099   3.295
   91    H4*    C   9           H4*        C   9 -13.882   4.081   5.368
   92    H3*    C   9           H3*        C   9 -12.905   5.690   3.042
   93    H2*    C   9           H2*        C   9 -10.623   5.298   3.692
   94   2HO*    C   9          2HO*        C   9 -11.590   5.245   6.089
   95    H1*    C   9           H1*        C   9 -10.902   2.582   4.190
   96   1H4     C   9          H41         C   9 -11.021   3.053  -2.394
   97   2H4     C   9          H42         C   9  -9.358   2.687  -1.959
   98    H5     C   9           H5         C   9 -12.751   3.489  -0.744
   99    H6     C   9           H6         C   9 -13.227   3.654   1.639
  100   1H5*    A  10          1H5*        A  10 -10.008   7.715   6.419
  101   2H5*    A  10          2H5*        A  10  -9.668   8.983   5.225
  102    H4*    A  10           H4*        A  10  -8.004   6.884   5.988
  103    H3*    A  10           H3*        A  10  -7.835   8.941   3.811
  104    H2*    A  10           H2*        A  10  -6.074   7.701   2.759
  105   2HO*    A  10          2HO*        A  10  -6.071   5.942   5.004
  106    H1*    A  10           H1*        A  10  -7.184   5.152   3.176
  107    H8     A  10           H8         A  10 -10.161   6.970   2.178
  108   1H6     A  10          H61         A  10  -8.165   6.838  -3.681
  109   2H6     A  10          H62         A  10  -9.534   7.151  -2.638
  110    H2     A  10           H2         A  10  -4.749   5.672  -1.021
  111   1H5*    A  11          1H5*        A  11  -3.245  11.585   5.619
  112   2H5*    A  11          2H5*        A  11  -3.366  11.005   3.947
  113    H4*    A  11           H4*        A  11  -1.539  10.184   6.138
  114    H3*    A  11           H3*        A  11  -1.218  10.957   3.288
  115    H2*    A  11           H2*        A  11   0.434   9.277   2.868
  116   2HO*    A  11          2HO*        A  11   0.383   8.690   5.664
  117    H1*    A  11           H1*        A  11  -0.793   7.185   4.185
  118    H8     A  11           H8         A  11  -3.829   8.743   3.002
  119   1H6     A  11          H61         A  11  -2.610   6.670  -2.702
  120   2H6     A  11          H62         A  11  -3.827   7.371  -1.659
  121    H2     A  11           H2         A  11   1.105   6.212  -0.234
  122   1H5*    G  12          1H5*        G  12   3.041  11.100   4.324
  123   2H5*    G  12          2H5*        G  12   3.401  12.810   4.014
  124    H4*    G  12           H4*        G  12   4.980  11.322   2.906
  125    H3*    G  12           H3*        G  12   3.302  13.148   1.236
  126    H2*    G  12           H2*        G  12   4.218  12.197  -0.783
  127   2HO*    G  12          2HO*        G  12   5.862  10.501  -0.524
  128    H1*    G  12           H1*        G  12   3.915   9.565  -0.043
  129    H8     G  12           H8         G  12   1.235  11.785   1.493
  130    H1     G  12           H1         G  12  -0.183   9.428  -4.302
  131   1H2     G  12          H21         G  12   3.101   8.337  -4.333
  132   2H2     G  12          H22         G  12   1.567   8.430  -5.171
  133   1H5*    G  13          1H5*        G  13   6.916  12.813  -0.835
  134   2H5*    G  13          2H5*        G  13   7.508  14.473  -1.041
  135    H4*    G  13           H4*        G  13   7.540  13.381  -3.158
  136    H3*    G  13           H3*        G  13   5.433  15.507  -2.905
  137    H2*    G  13           H2*        G  13   4.766  15.052  -5.179
  138   2HO*    G  13          2HO*        G  13   6.845  14.728  -6.071
  139    H1*    G  13           H1*        G  13   4.797  12.277  -4.908
  140    H8     G  13           H8         G  13   3.599  13.875  -1.715
  141    H1     G  13           H1         G  13  -0.960  13.004  -6.148
  142   1H2     G  13          H21         G  13   1.657  12.256  -8.271
  143   2H2     G  13          H22         G  13  -0.070  12.437  -8.060
  144   1H5*    C  14          1H5*        C  14   7.170  16.905  -6.642
  145   2H5*    C  14          2H5*        C  14   7.769  18.500  -6.147
  146    H4*    C  14           H4*        C  14   6.560  18.931  -8.074
  147    H3*    C  14           H3*        C  14   4.795  19.539  -5.705
  148    H2*    C  14           H2*        C  14   3.110  20.258  -7.281
  149   2HO*    C  14          2HO*        C  14   5.339  20.385  -8.942
  150    H1*    C  14           H1*        C  14   3.459  18.057  -8.987
  151   1H4     C  14          H41         C  14  -0.106  15.866  -3.886
  152   2H4     C  14          H42         C  14  -1.265  16.601  -4.984
  153    H5     C  14           H5         C  14   2.278  15.959  -4.264
  154    H6     C  14           H6         C  14   4.034  16.808  -5.723
  155   1H5*    U  15          1H5*        U  15   3.765  23.332  -7.398
  156   2H5*    U  15          2H5*        U  15   4.007  24.329  -5.950
  157    H4*    U  15           H4*        U  15   1.690  24.339  -6.811
  158    H3*    U  15           H3*        U  15   2.206  23.435  -3.992
  159    H2*    U  15           H2*        U  15  -0.175  23.110  -3.721
  160   2HO*    U  15          2HO*        U  15  -0.727  24.971  -5.092
  161    H1*    U  15           H1*        U  15  -0.490  21.699  -6.075
  162    H3     U  15           H3         U  15  -0.451  18.642  -2.672
  163    H5     U  15           H5         U  15   3.568  19.207  -3.741
  164    H6     U  15           H6         U  15   2.866  21.051  -5.118
  165   1H5*    U  16          1H5*        U  16   0.118  27.864  -1.714
  166   2H5*    U  16          2H5*        U  16  -0.308  26.461  -0.715
  167    H4*    U  16           H4*        U  16  -2.246  27.820  -0.973
  168    H3*    U  16           H3*        U  16  -2.521  25.242  -1.313
  169    H2*    U  16           H2*        U  16  -1.851  25.083  -3.631
  170   2HO*    U  16          2HO*        U  16  -4.657  25.521  -3.465
  171    H1*    U  16           H1*        U  16  -3.574  27.469  -4.410
  172    H3     U  16           H3         U  16  -1.619  26.480  -8.404
  173    H5     U  16           H5         U  16   1.485  27.915  -5.964
  174    H6     U  16           H6         U  16  -0.045  27.832  -4.105
  175   1H5*    C  17          1H5*        C  17  -5.775  24.062  -3.010
  176   2H5*    C  17          2H5*        C  17  -6.763  23.465  -1.663
  177    H4*    C  17           H4*        C  17  -5.936  21.792  -3.427
  178    H3*    C  17           H3*        C  17  -6.635  21.235  -0.846
  179    H2*    C  17           H2*        C  17  -4.396  21.484   0.071
  180   2HO*    C  17          2HO*        C  17  -5.300  19.151   0.094
  181    H1*    C  17           H1*        C  17  -3.420  20.005  -2.453
  182   1H4     C  17          H41         C  17   2.032  23.042  -0.501
  183   2H4     C  17          H42         C  17   2.255  21.393   0.070
  184    H5     C  17           H5         C  17  -0.048  23.871  -1.370
  185    H6     C  17           H6         C  17  -2.317  23.265  -2.013
  186   1H5*    G  18          1H5*        G  18  -8.160  21.421  -2.488
  187   2H5*    G  18          2H5*        G  18  -9.627  21.054  -1.561
  188    H4*    G  18           H4*        G  18 -10.892  21.431  -3.328
  189    H3*    G  18           H3*        G  18  -9.339  19.205  -4.537
  190    H2*    G  18           H2*        G  18  -9.409  20.079  -6.689
  191   2HO*    G  18          2HO*        G  18 -11.679  21.484  -6.760
  192    H1*    G  18           H1*        G  18 -10.596  22.708  -5.813
  193    H8     G  18           H8         G  18  -9.880  23.784  -8.036
  194    H1     G  18           H1         G  18  -3.793  22.014  -7.024
  195   1H2     G  18          H21         G  18  -5.077  20.169  -4.402
  196   2H2     G  18          H22         G  18  -3.668  20.652  -5.320
  197   1H5*    G  19          1H5*        G  19  -9.404  15.570  -5.118
  198   2H5*    G  19          2H5*        G  19  -8.849  17.233  -4.861
  199    H4*    G  19           H4*        G  19  -9.958  16.713  -7.519
  200    H3*    G  19           H3*        G  19  -7.798  14.935  -6.578
  201    H2*    G  19           H2*        G  19  -6.250  15.565  -8.276
  202   2HO*    G  19          2HO*        G  19  -7.899  15.465  -9.950
  203    H1*    G  19           H1*        G  19  -6.777  18.281  -8.396
  204    H8     G  19           H8         G  19  -6.988  16.910  -4.855
  205    H1     G  19           H1         G  19  -1.152  18.851  -6.651
  206   1H2     G  19          H21         G  19  -2.512  19.119  -9.804
  207   2H2     G  19          H22         G  19  -1.096  19.278  -8.776
  208   1H5*    C  20          1H5*        C  20  -8.475  13.479 -10.609
  209   2H5*    C  20          2H5*        C  20  -8.611  11.710 -10.565
  210    H4*    C  20           H4*        C  20  -6.873  12.440 -12.098
  211    H3*    C  20           H3*        C  20  -6.092  10.770  -9.744
  212    H2*    C  20           H2*        C  20  -3.762  10.958 -10.340
  213   2HO*    C  20          2HO*        C  20  -4.598  12.431 -12.638
  214    H1*    C  20           H1*        C  20  -3.776  13.680 -10.756
  215   1H4     C  20          H41         C  20  -4.457  13.258  -4.229
  216   2H4     C  20          H42         C  20  -2.731  13.188  -4.499
  217    H5     C  20           H5         C  20  -6.068  13.225  -5.996
  218    H6     C  20           H6         C  20  -6.392  13.182  -8.394
  219   1H5*    C  21          1H5*        C  21  -3.424   9.510 -12.149
  220   2H5*    C  21          2H5*        C  21  -3.828   7.860 -12.662
  221    H4*    C  21           H4*        C  21  -1.576   7.759 -12.100
  222    H3*    C  21           H3*        C  21  -3.246   6.672  -9.848
  223    H2*    C  21           H2*        C  21  -1.227   6.261  -8.604
  224   2HO*    C  21          2HO*        C  21   0.190   7.054 -10.957
  225    H1*    C  21           H1*        C  21  -0.006   8.702  -9.258
  226   1H4     C  21          H41         C  21  -4.306  10.149  -4.469
  227   2H4     C  21          H42         C  21  -2.878   9.554  -3.636
  228    H5     C  21           H5         C  21  -4.529  10.096  -6.884
  229    H6     C  21           H6         C  21  -3.432   9.456  -8.974
  230   1H5*    U  22          1H5*        U  22  -1.447   1.952 -10.345
  231   2H5*    U  22          2H5*        U  22  -2.568   1.777  -8.980
  232    H4*    U  22           H4*        U  22   0.187   1.585  -8.896
  233    H3*    U  22           H3*        U  22  -1.890   1.823  -6.747
  234    H2*    U  22           H2*        U  22  -0.160   2.228  -5.122
  235   2HO*    U  22          2HO*        U  22   1.287   0.779  -6.801
  236    H1*    U  22           H1*        U  22   1.269   4.049  -6.669
  237    H3     U  22           H3         U  22  -0.814   6.675  -3.632
  238    H5     U  22           H5         U  22  -3.808   5.720  -6.419
  239    H6     U  22           H6         U  22  -2.259   4.191  -7.444
  240   1H5*    G  23          1H5*        G  23   0.801   0.230  -4.404
  241   2H5*    G  23          2H5*        G  23   0.097  -1.288  -3.813
  242    H4*    G  23           H4*        G  23   0.843   0.482  -2.110
  243    H3*    G  23           H3*        G  23  -1.735  -1.044  -1.996
  244    H2*    G  23           H2*        G  23  -2.386   0.200  -0.041
  245   2HO*    G  23          2HO*        G  23   0.286   1.219  -0.139
  246    H1*    G  23           H1*        G  23  -1.621   2.695  -1.017
  247    H8     G  23           H8         G  23  -2.858   1.304  -4.104
  248    H1     G  23           H1         G  23  -7.639   2.346   0.047
  249   1H2     G  23          H21         G  23  -5.136   2.632   2.410
  250   2H2     G  23          H22         G  23  -6.850   2.667   2.060
  251   1H5*    C  24          1H5*        C  24  -2.399  -2.907   2.434
  252   2H5*    C  24          2H5*        C  24  -2.755  -1.382   1.602
  253    H4*    C  24           H4*        C  24  -0.722  -1.017   3.614
  254    H3*    C  24           H3*        C  24  -3.212  -2.405   4.567
  255    H2*    C  24           H2*        C  24  -3.285  -0.904   6.448
  256   2HO*    C  24          2HO*        C  24  -0.628  -0.406   5.626
  257    H1*    C  24           H1*        C  24  -2.712   1.403   4.969
  258   1H4     C  24          H41         C  24  -9.063   0.292   3.689
  259   2H4     C  24          H42         C  24  -9.058   1.025   5.282
  260    H5     C  24           H5         C  24  -7.032  -0.368   2.545
  261    H6     C  24           H6         C  24  -4.599  -0.446   2.687
  262   1H5*    U  25          1H5*        U  25  -3.262  -3.679   7.154
  263   2H5*    U  25          2H5*        U  25  -3.285  -5.453   7.157
  264    H4*    U  25           H4*        U  25  -5.479  -4.388   7.617
  265    H3*    U  25           H3*        U  25  -5.217  -6.289   5.298
  266    H2*    U  25           H2*        U  25  -7.589  -5.993   4.901
  267   2HO*    U  25          2HO*        U  25  -7.525  -5.271   7.515
  268    H1*    U  25           H1*        U  25  -7.505  -3.222   5.098
  269    H3     U  25           H3         U  25  -7.861  -4.101   0.653
  270    H5     U  25           H5         U  25  -3.772  -4.482   1.518
  271    H6     U  25           H6         U  25  -4.325  -4.293   3.854
  272   1H5*    U  26          1H5*        U  26  -8.518  -8.234   7.331
  273   2H5*    U  26          2H5*        U  26  -8.203  -9.965   7.106
  274    H4*    U  26           H4*        U  26 -10.353  -9.186   6.153
  275    H3*    U  26           H3*        U  26  -8.341 -10.467   4.309
  276    H2*    U  26           H2*        U  26  -9.955 -10.246   2.538
  277   2HO*    U  26          2HO*        U  26 -11.784  -9.407   4.570
  278    H1*    U  26           H1*        U  26 -10.795  -7.654   3.305
  279    H3     U  26           H3         U  26  -8.680  -7.507  -0.768
  280    H5     U  26           H5         U  26  -5.686  -7.038   2.141
  281    H6     U  26           H6         U  26  -7.318  -7.638   3.805
  282   1H5*    U  27          1H5*        U  27 -12.141 -12.637   3.954
  283   2H5*    U  27          2H5*        U  27 -11.786 -14.326   3.546
  284    H4*    U  27           H4*        U  27 -13.304 -13.170   1.957
  285    H3*    U  27           H3*        U  27 -10.756 -14.414   0.962
  286    H2*    U  27           H2*        U  27 -11.336 -13.698  -1.274
  287   2HO*    U  27          2HO*        U  27 -13.592 -14.041  -1.166
  288    H1*    U  27           H1*        U  27 -11.969 -11.100  -0.541
  289    H3     U  27           H3         U  27  -7.844 -10.832  -2.396
  290    H5     U  27           H5         U  27  -7.159 -12.099   1.548
  291    H6     U  27           H6         U  27  -9.532 -12.412   1.775
  292   1H5*    U  28          1H5*        U  28 -13.819 -16.896  -1.343
  293   2H5*    U  28          2H5*        U  28 -13.046 -18.491  -1.429
  294    H4*    U  28           H4*        U  28 -13.619 -17.518  -3.629
  295    H3*    U  28           H3*        U  28 -10.749 -18.218  -3.054
  296    H2*    U  28           H2*        U  28 -10.219 -17.541  -5.318
  297   2HO*    U  28          2HO*        U  28 -12.104 -18.299  -6.361
  298    H1*    U  28           H1*        U  28 -11.616 -15.145  -5.156
  299    H3     U  28           H3         U  28  -7.157 -14.207  -4.752
  300    H5     U  28           H5         U  28  -8.509 -15.042  -0.863
  301    H6     U  28           H6         U  28 -10.580 -15.799  -1.829
  302   1H5*    G  29          1H5*        G  29 -10.844 -21.413  -5.902
  303   2H5*    G  29          2H5*        G  29 -10.076 -22.757  -5.036
  304    H4*    G  29           H4*        G  29  -8.787 -21.946  -6.985
  305    H3*    G  29           H3*        G  29  -7.475 -21.829  -4.272
  306    H2*    G  29           H2*        G  29  -5.527 -20.933  -5.320
  307   2HO*    G  29          2HO*        G  29  -6.669 -21.643  -7.837
  308    H1*    G  29           H1*        G  29  -6.989 -19.517  -7.379
  309    H8     G  29           H8         G  29  -8.300 -18.480  -4.091
  310    H1     G  29           H1         G  29  -2.711 -15.688  -5.549
  311   1H2     G  29          H21         G  29  -2.515 -18.063  -8.054
  312   2H2     G  29          H22         G  29  -1.774 -16.696  -7.254
  313   1H5*    C  30          1H5*        C  30  -4.330 -23.321  -6.560
  314   2H5*    C  30          2H5*        C  30  -3.850 -24.809  -5.721
  315    H4*    C  30           H4*        C  30  -1.923 -23.437  -6.009
  316    H3*    C  30           H3*        C  30  -2.871 -23.624  -3.161
  317    H2*    C  30           H2*        C  30  -1.043 -22.206  -2.504
  318   2HO*    C  30          2HO*        C  30   0.730 -22.006  -3.725
  319    H1*    C  30           H1*        C  30  -1.303 -20.417  -4.661
  320   1H4     C  30          H41         C  30  -5.912 -18.701  -0.258
  321   2H4     C  30          H42         C  30  -4.569 -17.598  -0.021
  322    H5     C  30           H5         C  30  -5.834 -20.556  -1.803
  323    H6     C  30           H6         C  30  -4.459 -21.735  -3.437
  324   1H5*    U  31          1H5*        U  31   1.182 -23.770  -3.208
  325   2H5*    U  31          2H5*        U  31   1.693 -25.377  -2.656
  326    H4*    U  31           H4*        U  31   3.169 -23.880  -1.643
  327    H3*    U  31           H3*        U  31   1.074 -24.781   0.317
  328    H2*    U  31           H2*        U  31   2.114 -23.409   1.992
  329   2HO*    U  31          2HO*        U  31   4.273 -23.774   0.348
  330    H1*    U  31           H1*        U  31   2.575 -21.214   0.284
  331    H3     U  31           H3         U  31  -0.626 -19.611   3.015
  332    H5     U  31           H5         U  31  -2.664 -22.324   0.540
  333    H6     U  31           H6         U  31  -0.532 -22.986  -0.361
  334    H3T    U  31           H3T        U  31   2.460 -26.316  -0.186
  Start of MODEL   23
    1   1H5*    A   1          1H5*        A   1   0.076 -12.366   7.460
    2   2H5*    A   1          2H5*        A   1   0.650 -13.717   8.455
    3    H4*    A   1           H4*        A   1   2.895 -12.487   7.209
    4    H3*    A   1           H3*        A   1   0.622 -12.938   5.293
    5    H2*    A   1           H2*        A   1   2.193 -13.906   3.740
    6   2HO*    A   1          2HO*        A   1   4.259 -13.297   5.605
    7    H1*    A   1           H1*        A   1   3.480 -15.491   5.635
    8    H8     A   1           H8         A   1   0.111 -15.810   6.911
    9   1H6     A   1          H61         A   1  -1.247 -19.605   2.207
   10   2H6     A   1          H62         A   1  -1.772 -19.009   3.766
   11    H2     A   1           H2         A   1   2.623 -17.547   1.264
   12    H5T    A   1           H5T        A   1   2.109 -11.335   8.528
   13   1H5*    G   2          1H5*        G   2   3.689 -11.522   3.236
   14   2H5*    G   2          2H5*        G   2   3.350 -10.057   2.294
   15    H4*    G   2           H4*        G   2   4.527 -11.696   0.961
   16    H3*    G   2           H3*        G   2   1.727 -11.023   0.111
   17    H2*    G   2           H2*        G   2   1.913 -12.598  -1.693
   18   2HO*    G   2          2HO*        G   2   3.859 -12.580  -2.572
   19    H1*    G   2           H1*        G   2   3.211 -14.595  -0.221
   20    H8     G   2           H8         G   2   0.759 -13.508   2.224
   21    H1     G   2           H1         G   2  -1.994 -16.639  -2.647
   22   1H2     G   2          H21         G   2   1.034 -16.177  -4.262
   23   2H2     G   2          H22         G   2  -0.592 -16.825  -4.328
   24   1H5*    U   3          1H5*        U   3   4.172 -10.444  -3.625
   25   2H5*    U   3          2H5*        U   3   3.443  -9.000  -4.354
   26    H4*    U   3           H4*        U   3   3.518 -10.855  -5.921
   27    H3*    U   3           H3*        U   3   0.767  -9.932  -5.107
   28    H2*    U   3           H2*        U   3  -0.124 -11.549  -6.671
   29   2HO*    U   3          2HO*        U   3   1.855 -11.112  -8.112
   30    H1*    U   3           H1*        U   3   1.571 -13.612  -5.838
   31    H3     U   3           H3         U   3  -2.407 -14.817  -4.079
   32    H5     U   3           H5         U   3  -1.078 -11.708  -1.589
   33    H6     U   3           H6         U   3   0.730 -11.346  -3.132
   34   1H5*    A   4          1H5*        A   4   0.661  -8.874  -9.477
   35   2H5*    A   4          2H5*        A   4  -0.353  -7.420  -9.542
   36    H4*    A   4           H4*        A   4  -1.172  -9.335 -10.899
   37    H3*    A   4           H3*        A   4  -2.978  -8.165  -8.791
   38    H2*    A   4           H2*        A   4  -4.689  -9.714  -9.552
   39   2HO*    A   4          2HO*        A   4  -3.012 -11.009 -11.359
   40    H1*    A   4           H1*        A   4  -2.994 -11.910  -9.481
   41    H8     A   4           H8         A   4  -1.602 -10.067  -6.675
   42   1H6     A   4          H61         A   4  -6.486 -11.752  -3.264
   43   2H6     A   4          H62         A   4  -4.868 -11.089  -3.224
   44    H2     A   4           H2         A   4  -7.446 -12.564  -7.571
   45   1H5*    G   5          1H5*        G   5  -5.389  -6.507 -12.083
   46   2H5*    G   5          2H5*        G   5  -5.796  -4.882 -11.502
   47    H4*    G   5           H4*        G   5  -7.756  -6.322 -11.828
   48    H3*    G   5           H3*        G   5  -7.262  -5.319  -9.026
   49    H2*    G   5           H2*        G   5  -9.363  -6.374  -8.424
   50   2HO*    G   5          2HO*        G   5 -10.411  -7.581 -10.280
   51    H1*    G   5           H1*        G   5  -8.764  -8.772  -9.729
   52    H8     G   5           H8         G   5  -5.508  -7.671  -8.380
   53    H1     G   5           H1         G   5  -9.454  -9.961  -3.867
   54   1H2     G   5          H21         G   5 -11.889  -9.727  -6.297
   55   2H2     G   5          H22         G   5 -11.481 -10.155  -4.651
   56   1H5*    A   6          1H5*        A   6 -11.007  -5.056  -9.864
   57   2H5*    A   6          2H5*        A   6 -11.783  -3.489  -9.571
   58    H4*    A   6           H4*        A   6 -12.988  -5.435  -8.615
   59    H3*    A   6           H3*        A   6 -12.855  -2.973  -7.479
   60    H2*    A   6           H2*        A   6 -11.018  -3.451  -5.974
   61   2HO*    A   6          2HO*        A   6 -13.534  -3.821  -4.886
   62    H1*    A   6           H1*        A   6 -12.301  -6.216  -5.509
   63    H8     A   6           H8         A   6  -8.768  -5.198  -6.623
   64   1H6     A   6          H61         A   6  -6.851  -7.489  -1.204
   65   2H6     A   6          H62         A   6  -6.357  -6.810  -2.743
   66    H2     A   6           H2         A   6 -11.339  -7.673  -1.280
   67   1H5*    A   7          1H5*        A   7 -15.180  -4.890  -3.997
   68   2H5*    A   7          2H5*        A   7 -16.478  -3.719  -3.695
   69    H4*    A   7           H4*        A   7 -15.465  -3.941  -1.630
   70    H3*    A   7           H3*        A   7 -14.316  -1.488  -2.947
   71    H2*    A   7           H2*        A   7 -12.826  -1.237  -1.120
   72   2HO*    A   7          2HO*        A   7 -14.394  -3.016   0.446
   73    H1*    A   7           H1*        A   7 -12.892  -4.093  -0.389
   74    H8     A   7           H8         A   7 -11.335  -3.013  -3.703
   75   1H6     A   7          H61         A   7  -5.947  -3.142  -0.645
   76   2H6     A   7          H62         A   7  -6.697  -2.970  -2.218
   77    H2     A   7           H2         A   7  -9.251  -3.692   2.328
   78   1H5*    A   8          1H5*        A   8 -15.851   2.075   0.069
   79   2H5*    A   8          2H5*        A   8 -14.180   2.582  -0.239
   80    H4*    A   8           H4*        A   8 -15.289   0.825   1.849
   81    H3*    A   8           H3*        A   8 -12.962   2.731   1.687
   82    H2*    A   8           H2*        A   8 -11.906   1.530   3.460
   83   2HO*    A   8          2HO*        A   8 -13.371   1.131   4.988
   84    H1*    A   8           H1*        A   8 -12.882  -1.044   2.663
   85    H8     A   8           H8         A   8 -11.365   0.542  -0.308
   86   1H6     A   8          H61         A   8  -5.838  -1.338   1.754
   87   2H6     A   8          H62         A   8  -6.712  -0.669   0.396
   88    H2     A   8           H2         A   8  -8.822  -1.912   5.055
   89   1H5*    C   9          1H5*        C   9 -13.464   5.463   6.206
   90   2H5*    C   9          2H5*        C   9 -12.373   6.011   4.918
   91    H4*    C   9           H4*        C   9 -11.752   4.765   7.410
   92    H3*    C   9           H3*        C   9 -10.157   6.059   5.237
   93    H2*    C   9           H2*        C   9  -8.167   4.917   5.964
   94   2HO*    C   9          2HO*        C   9  -8.144   3.750   7.907
   95    H1*    C   9           H1*        C   9  -9.320   2.419   6.236
   96   1H4     C   9          H41         C   9  -9.082   3.158  -0.299
   97   2H4     C   9          H42         C   9  -7.457   2.667   0.157
   98    H5     C   9           H5         C   9 -10.805   3.687   1.334
   99    H6     C   9           H6         C   9 -11.307   3.842   3.713
  100   1H5*    A  10          1H5*        A  10  -7.279   9.207   8.785
  101   2H5*    A  10          2H5*        A  10  -6.679   9.057   7.122
  102    H4*    A  10           H4*        A  10  -5.621   7.986   9.626
  103    H3*    A  10           H3*        A  10  -4.485   8.917   7.052
  104    H2*    A  10           H2*        A  10  -2.747   7.272   7.028
  105   2HO*    A  10          2HO*        A  10  -2.065   6.311   8.849
  106    H1*    A  10           H1*        A  10  -4.243   5.092   7.788
  107    H8     A  10           H8         A  10  -6.880   6.746   5.945
  108   1H6     A  10          H61         A  10  -4.139   5.093   0.647
  109   2H6     A  10          H62         A  10  -5.605   5.710   1.374
  110    H2     A  10           H2         A  10  -1.209   4.462   3.984
  111   1H5*    A  11          1H5*        A  11  -0.504  12.086   8.765
  112   2H5*    A  11          2H5*        A  11  -0.943  11.920   7.055
  113    H4*    A  11           H4*        A  11   1.406  10.995   8.492
  114    H3*    A  11           H3*        A  11   0.761  11.717   5.684
  115    H2*    A  11           H2*        A  11   2.286  10.118   4.767
  116   2HO*    A  11          2HO*        A  11   3.173   9.669   7.448
  117    H1*    A  11           H1*        A  11   1.676   7.995   6.425
  118    H8     A  11           H8         A  11  -1.668   9.358   6.261
  119   1H6     A  11          H61         A  11  -2.224   7.152   0.505
  120   2H6     A  11          H62         A  11  -3.081   7.816   1.877
  121    H2     A  11           H2         A  11   2.112   6.997   1.639
  122   1H5*    G  12          1H5*        G  12   5.031  12.316   5.268
  123   2H5*    G  12          2H5*        G  12   5.132  13.986   4.677
  124    H4*    G  12           H4*        G  12   6.263  12.358   3.220
  125    H3*    G  12           H3*        G  12   4.091  14.106   2.155
  126    H2*    G  12           H2*        G  12   4.137  12.979   0.032
  127   2HO*    G  12          2HO*        G  12   5.926  11.054   0.360
  128    H1*    G  12           H1*        G  12   4.204  10.409   1.008
  129    H8     G  12           H8         G  12   2.243  12.840   3.209
  130    H1     G  12           H1         G  12  -1.188   9.794  -1.272
  131   1H2     G  12          H21         G  12   1.873   8.633  -2.397
  132   2H2     G  12          H22         G  12   0.134   8.656  -2.603
  133   1H5*    G  13          1H5*        G  13   6.944  13.458  -1.018
  134   2H5*    G  13          2H5*        G  13   7.386  15.090  -1.557
  135    H4*    G  13           H4*        G  13   6.817  13.735  -3.454
  136    H3*    G  13           H3*        G  13   4.955  15.995  -2.829
  137    H2*    G  13           H2*        G  13   3.497  15.330  -4.608
  138   2HO*    G  13          2HO*        G  13   4.197  13.671  -6.093
  139    H1*    G  13           H1*        G  13   3.659  12.577  -4.163
  140    H8     G  13           H8         G  13   3.490  14.597  -0.964
  141    H1     G  13           H1         G  13  -2.196  13.074  -3.515
  142   1H2     G  13          H21         G  13  -0.350  11.985  -6.231
  143   2H2     G  13          H22         G  13  -1.931  12.201  -5.508
  144   1H5*    C  14          1H5*        C  14   6.513  16.217  -7.131
  145   2H5*    C  14          2H5*        C  14   6.341  17.884  -7.714
  146    H4*    C  14           H4*        C  14   5.272  16.150  -9.151
  147    H3*    C  14           H3*        C  14   3.641  18.433  -8.069
  148    H2*    C  14           H2*        C  14   1.716  17.534  -9.234
  149   2HO*    C  14          2HO*        C  14   3.622  15.671 -10.274
  150    H1*    C  14           H1*        C  14   2.013  15.003  -8.208
  151   1H4     C  14          H41         C  14   0.359  18.808  -3.075
  152   2H4     C  14          H42         C  14  -1.156  18.474  -3.897
  153    H5     C  14           H5         C  14   2.505  18.130  -3.956
  154    H6     C  14           H6         C  14   3.638  16.997  -5.804
  155   1H5*    U  15          1H5*        U  15   1.569  18.325 -11.358
  156   2H5*    U  15          2H5*        U  15   1.321  20.017 -11.829
  157    H4*    U  15           H4*        U  15  -0.708  18.652 -11.088
  158    H3*    U  15           H3*        U  15  -0.099  21.424 -10.132
  159    H2*    U  15           H2*        U  15  -2.087  21.358  -8.746
  160   2HO*    U  15          2HO*        U  15  -3.492  19.581  -8.850
  161    H1*    U  15           H1*        U  15  -1.482  18.930  -7.606
  162    H3     U  15           H3         U  15  -0.190  22.351  -4.785
  163    H5     U  15           H5         U  15   3.185  21.265  -7.039
  164    H6     U  15           H6         U  15   1.736  19.955  -8.436
  165   1H5*    U  16          1H5*        U  16  -3.956  22.280 -13.715
  166   2H5*    U  16          2H5*        U  16  -4.073  23.931 -13.079
  167    H4*    U  16           H4*        U  16  -6.263  23.347 -13.092
  168    H3*    U  16           H3*        U  16  -5.367  23.565 -10.548
  169    H2*    U  16           H2*        U  16  -5.003  21.199 -10.170
  170   2HO*    U  16          2HO*        U  16  -6.424  21.236  -8.569
  171    H1*    U  16           H1*        U  16  -7.623  20.717 -11.726
  172    H3     U  16           H3         U  16  -7.251  16.356 -10.642
  173    H5     U  16           H5         U  16  -3.582  17.264 -12.468
  174    H6     U  16           H6         U  16  -4.260  19.570 -12.514
  175   1H5*    C  17          1H5*        C  17  -8.199  22.388  -8.726
  176   2H5*    C  17          2H5*        C  17  -9.423  23.573  -8.224
  177    H4*    C  17           H4*        C  17  -8.790  22.187  -6.357
  178    H3*    C  17           H3*        C  17  -9.137  24.740  -5.958
  179    H2*    C  17           H2*        C  17  -6.910  25.457  -6.696
  180   2HO*    C  17          2HO*        C  17  -6.640  26.494  -4.848
  181    H1*    C  17           H1*        C  17  -5.721  23.291  -4.884
  182   1H4     C  17          H41         C  17  -1.160  24.488  -9.484
  183   2H4     C  17          H42         C  17  -0.607  25.342  -8.057
  184    H5     C  17           H5         C  17  -3.328  23.399  -9.603
  185    H6     C  17           H6         C  17  -5.381  22.912  -8.371
  186   1H5*    G  18          1H5*        G  18 -11.672  23.113  -5.339
  187   2H5*    G  18          2H5*        G  18 -12.697  22.443  -4.057
  188    H4*    G  18           H4*        G  18 -12.518  20.717  -5.583
  189    H3*    G  18           H3*        G  18 -10.609  20.236  -3.322
  190    H2*    G  18           H2*        G  18  -9.550  18.512  -4.500
  191   2HO*    G  18          2HO*        G  18 -12.081  17.868  -4.918
  192    H1*    G  18           H1*        G  18 -10.532  19.315  -7.174
  193    H8     G  18           H8         G  18  -8.571  18.804  -8.529
  194    H1     G  18           H1         G  18  -4.489  21.134  -4.188
  195   1H2     G  18          H21         G  18  -7.341  21.700  -2.244
  196   2H2     G  18          H22         G  18  -5.598  21.821  -2.374
  197   1H5*    G  19          1H5*        G  19 -10.633  15.905  -1.805
  198   2H5*    G  19          2H5*        G  19  -9.114  16.800  -1.629
  199    H4*    G  19           H4*        G  19 -10.600  16.489  -4.225
  200    H3*    G  19           H3*        G  19  -8.459  14.704  -3.128
  201    H2*    G  19           H2*        G  19  -7.404  14.690  -5.300
  202   2HO*    G  19          2HO*        G  19  -8.488  15.321  -7.119
  203    H1*    G  19           H1*        G  19  -7.778  17.449  -5.800
  204    H8     G  19           H8         G  19  -6.985  17.640  -2.325
  205    H1     G  19           H1         G  19  -1.778  16.058  -5.717
  206   1H2     G  19          H21         G  19  -3.997  15.328  -8.242
  207   2H2     G  19          H22         G  19  -2.330  15.347  -7.700
  208   1H5*    C  20          1H5*        C  20 -10.121  12.287  -6.314
  209   2H5*    C  20          2H5*        C  20 -10.055  10.584  -5.817
  210    H4*    C  20           H4*        C  20  -8.738  10.990  -7.818
  211    H3*    C  20           H3*        C  20  -7.386   9.972  -5.372
  212    H2*    C  20           H2*        C  20  -5.205  10.280  -6.303
  213   2HO*    C  20          2HO*        C  20  -6.643  10.067  -8.632
  214    H1*    C  20           H1*        C  20  -5.623  12.739  -7.490
  215   1H4     C  20          H41         C  20  -5.037  14.126  -1.073
  216   2H4     C  20          H42         C  20  -3.524  14.599  -1.812
  217    H5     C  20           H5         C  20  -6.800  13.043  -2.256
  218    H6     C  20           H6         C  20  -7.537  12.191  -4.395
  219   1H5*    C  21          1H5*        C  21  -5.085   8.837  -8.490
  220   2H5*    C  21          2H5*        C  21  -5.105   7.065  -8.573
  221    H4*    C  21           H4*        C  21  -2.860   7.655  -8.771
  222    H3*    C  21           H3*        C  21  -3.512   6.654  -6.027
  223    H2*    C  21           H2*        C  21  -1.254   7.080  -5.314
  224   2HO*    C  21          2HO*        C  21   0.293   6.941  -6.761
  225    H1*    C  21           H1*        C  21  -1.043   9.595  -6.468
  226   1H4     C  21          H41         C  21  -4.962  10.304  -1.165
  227   2H4     C  21          H42         C  21  -3.373  10.875  -0.684
  228    H5     C  21           H5         C  21  -5.404   9.317  -3.332
  229    H6     C  21           H6         C  21  -4.405   8.687  -5.483
  230   1H5*    U  22          1H5*        U  22  -0.130   4.148  -7.640
  231   2H5*    U  22          2H5*        U  22  -0.602   2.467  -7.323
  232    H4*    U  22           H4*        U  22   1.654   2.722  -6.653
  233    H3*    U  22           H3*        U  22  -0.269   2.447  -4.369
  234    H2*    U  22           H2*        U  22   1.533   2.720  -2.803
  235   2HO*    U  22          2HO*        U  22   2.977   1.429  -4.292
  236    H1*    U  22           H1*        U  22   2.790   4.826  -4.144
  237    H3     U  22           H3         U  22   0.945   6.922  -0.604
  238    H5     U  22           H5         U  22  -2.305   6.153  -3.149
  239    H6     U  22           H6         U  22  -0.819   4.862  -4.532
  240   1H5*    G  23          1H5*        G  23   2.517   0.652  -2.525
  241   2H5*    G  23          2H5*        G  23   1.857  -0.832  -1.812
  242    H4*    G  23           H4*        G  23   2.651   1.155  -0.308
  243    H3*    G  23           H3*        G  23   0.307  -0.652   0.146
  244    H2*    G  23           H2*        G  23  -0.347   0.659   2.060
  245   2HO*    G  23          2HO*        G  23   2.058   1.021   2.532
  246    H1*    G  23           H1*        G  23  -0.017   3.136   0.848
  247    H8     G  23           H8         G  23  -1.227   1.349  -2.038
  248    H1     G  23           H1         G  23  -5.852   2.059   2.350
  249   1H2     G  23          H21         G  23  -3.274   2.868   4.509
  250   2H2     G  23          H22         G  23  -4.994   2.644   4.279
  251   1H5*    C  24          1H5*        C  24  -0.418  -2.956   3.503
  252   2H5*    C  24          2H5*        C  24  -0.721  -1.226   3.247
  253    H4*    C  24           H4*        C  24   0.853  -1.786   5.639
  254    H3*    C  24           H3*        C  24  -1.837  -3.108   5.411
  255    H2*    C  24           H2*        C  24  -2.327  -2.410   7.663
  256   2HO*    C  24          2HO*        C  24   0.313  -2.511   7.903
  257    H1*    C  24           H1*        C  24  -1.382   0.198   7.333
  258   1H4     C  24          H41         C  24  -7.211   0.211   4.276
  259   2H4     C  24          H42         C  24  -7.606   0.379   5.978
  260    H5     C  24           H5         C  24  -4.967  -0.212   3.483
  261    H6     C  24           H6         C  24  -2.649  -0.564   4.153
  262   1H5*    U  25          1H5*        U  25  -2.321  -4.717   7.866
  263   2H5*    U  25          2H5*        U  25  -2.169  -6.483   7.778
  264    H4*    U  25           H4*        U  25  -4.419  -5.867   8.370
  265    H3*    U  25           H3*        U  25  -4.058  -7.163   5.684
  266    H2*    U  25           H2*        U  25  -6.443  -7.003   5.335
  267   2HO*    U  25          2HO*        U  25  -7.481  -7.295   7.199
  268    H1*    U  25           H1*        U  25  -6.640  -4.360   6.095
  269    H3     U  25           H3         U  25  -6.797  -4.405   1.549
  270    H5     U  25           H5         U  25  -2.714  -4.325   2.518
  271    H6     U  25           H6         U  25  -3.328  -4.722   4.813
  272   1H5*    U  26          1H5*        U  26  -7.360  -9.218   7.874
  273   2H5*    U  26          2H5*        U  26  -7.157 -10.941   7.504
  274    H4*    U  26           H4*        U  26  -9.438 -10.201   7.114
  275    H3*    U  26           H3*        U  26  -7.897 -11.115   4.695
  276    H2*    U  26           H2*        U  26  -9.899 -10.746   3.386
  277   2HO*    U  26          2HO*        U  26 -11.847 -10.572   4.317
  278    H1*    U  26           H1*        U  26 -10.418  -8.237   4.469
  279    H3     U  26           H3         U  26  -8.725  -7.443   0.324
  280    H5     U  26           H5         U  26  -5.373  -8.085   2.771
  281    H6     U  26           H6         U  26  -6.878  -8.753   4.524
  282   1H5*    U  27          1H5*        U  27 -11.623 -12.806   4.551
  283   2H5*    U  27          2H5*        U  27 -11.585 -14.475   3.948
  284    H4*    U  27           H4*        U  27 -13.065 -12.993   2.652
  285    H3*    U  27           H3*        U  27 -10.760 -14.299   1.218
  286    H2*    U  27           H2*        U  27 -11.609 -13.301  -0.826
  287   2HO*    U  27          2HO*        U  27 -13.628 -12.551  -0.950
  288    H1*    U  27           H1*        U  27 -11.855 -10.769   0.283
  289    H3     U  27           H3         U  27  -8.068 -10.851  -2.264
  290    H5     U  27           H5         U  27  -6.900 -12.186   1.542
  291    H6     U  27           H6         U  27  -9.228 -12.333   2.117
  292   1H5*    U  28          1H5*        U  28 -14.038 -16.122  -1.158
  293   2H5*    U  28          2H5*        U  28 -13.472 -17.785  -1.403
  294    H4*    U  28           H4*        U  28 -13.907 -16.607  -3.506
  295    H3*    U  28           H3*        U  28 -11.057 -17.473  -3.021
  296    H2*    U  28           H2*        U  28 -10.597 -16.713  -5.281
  297   2HO*    U  28          2HO*        U  28 -12.577 -15.630  -6.306
  298    H1*    U  28           H1*        U  28 -11.890 -14.270  -4.902
  299    H3     U  28           H3         U  28  -7.371 -13.568  -4.788
  300    H5     U  28           H5         U  28  -8.482 -14.528  -0.852
  301    H6     U  28           H6         U  28 -10.651 -15.140  -1.696
  302   1H5*    G  29          1H5*        G  29 -11.424 -20.583  -5.991
  303   2H5*    G  29          2H5*        G  29 -10.651 -21.978  -5.214
  304    H4*    G  29           H4*        G  29  -9.450 -21.173  -7.209
  305    H3*    G  29           H3*        G  29  -7.972 -21.119  -4.582
  306    H2*    G  29           H2*        G  29  -6.088 -20.209  -5.715
  307   2HO*    G  29          2HO*        G  29  -5.691 -20.642  -7.827
  308    H1*    G  29           H1*        G  29  -7.664 -18.844  -7.747
  309    H8     G  29           H8         G  29  -8.583 -17.733  -4.321
  310    H1     G  29           H1         G  29  -3.299 -14.896  -6.591
  311   1H2     G  29          H21         G  29  -3.422 -17.308  -9.067
  312   2H2     G  29          H22         G  29  -2.599 -15.917  -8.397
  313   1H5*    C  30          1H5*        C  30  -5.445 -23.055  -7.704
  314   2H5*    C  30          2H5*        C  30  -4.533 -24.306  -6.837
  315    H4*    C  30           H4*        C  30  -3.129 -22.734  -8.139
  316    H3*    C  30           H3*        C  30  -2.683 -23.073  -5.193
  317    H2*    C  30           H2*        C  30  -0.940 -21.421  -5.264
  318   2HO*    C  30          2HO*        C  30  -0.233 -20.610  -7.324
  319    H1*    C  30           H1*        C  30  -2.286 -19.634  -6.956
  320   1H4     C  30          H41         C  30  -4.862 -18.709  -0.948
  321   2H4     C  30          H42         C  30  -3.708 -17.413  -1.207
  322    H5     C  30           H5         C  30  -5.172 -20.517  -2.525
  323    H6     C  30           H6         C  30  -4.445 -21.449  -4.656
  324   1H5*    U  31          1H5*        U  31   0.835 -22.517  -6.957
  325   2H5*    U  31          2H5*        U  31   2.035 -23.743  -6.504
  326    H4*    U  31           H4*        U  31   2.851 -21.447  -6.213
  327    H3*    U  31           H3*        U  31   2.672 -23.193  -3.768
  328    H2*    U  31           H2*        U  31   3.581 -21.388  -2.477
  329   2HO*    U  31          2HO*        U  31   5.129 -20.840  -4.221
  330    H1*    U  31           H1*        U  31   2.111 -19.358  -3.808
  331    H3     U  31           H3         U  31   0.507 -19.344   0.428
  332    H5     U  31           H5         U  31  -1.323 -22.653  -1.399
  333    H6     U  31           H6         U  31   0.124 -22.311  -3.293
  334    H3T    U  31           H3T        U  31   4.997 -22.213  -4.870
  Start of MODEL   24
    1   1H5*    A   1          1H5*        A   1  -1.287  -9.874   9.009
    2   2H5*    A   1          2H5*        A   1  -2.011  -9.552   7.423
    3    H4*    A   1           H4*        A   1   0.498  -9.406   7.576
    4    H3*    A   1           H3*        A   1  -0.949 -10.952   5.471
    5    H2*    A   1           H2*        A   1   1.125 -11.819   4.605
    6   2HO*    A   1          2HO*        A   1   3.128 -11.072   5.612
    7    H1*    A   1           H1*        A   1   2.206 -12.536   7.041
    8    H8     A   1           H8         A   1  -1.255 -13.185   7.882
    9   1H6     A   1          H61         A   1  -1.076 -18.317   4.423
   10   2H6     A   1          H62         A   1  -1.977 -17.436   5.637
   11    H2     A   1           H2         A   1   2.540 -15.854   3.445
   12    H5T    A   1           H5T        A   1  -2.309 -11.728   7.120
   13   1H5*    G   2          1H5*        G   2   1.822  -8.663   3.361
   14   2H5*    G   2          2H5*        G   2   1.161  -7.885   1.910
   15    H4*    G   2           H4*        G   2   3.137  -9.331   1.505
   16    H3*    G   2           H3*        G   2   0.568  -9.799   0.033
   17    H2*    G   2           H2*        G   2   1.536 -11.720  -1.059
   18   2HO*    G   2          2HO*        G   2   3.609 -11.267  -1.506
   19    H1*    G   2           H1*        G   2   2.682 -12.807   1.234
   20    H8     G   2           H8         G   2  -0.283 -11.535   2.820
   21    H1     G   2           H1         G   2  -1.650 -16.439  -1.081
   22   1H2     G   2          H21         G   2   1.499 -15.886  -2.401
   23   2H2     G   2          H22         G   2   0.027 -16.830  -2.439
   24   1H5*    U   3          1H5*        U   3   3.384  -9.097  -3.471
   25   2H5*    U   3          2H5*        U   3   2.429  -7.996  -4.483
   26    H4*    U   3           H4*        U   3   3.140  -9.878  -5.785
   27    H3*    U   3           H3*        U   3   0.178  -9.812  -5.236
   28    H2*    U   3           H2*        U   3  -0.011 -11.788  -6.635
   29   2HO*    U   3          2HO*        U   3   1.957 -10.894  -7.930
   30    H1*    U   3           H1*        U   3   2.058 -13.129  -5.362
   31    H3     U   3           H3         U   3  -1.745 -14.963  -3.685
   32    H5     U   3           H5         U   3  -1.213 -11.411  -1.509
   33    H6     U   3           H6         U   3   0.578 -10.847  -3.014
   34   1H5*    A   4          1H5*        A   4   0.162  -9.173  -9.765
   35   2H5*    A   4          2H5*        A   4  -1.278  -8.169 -10.023
   36    H4*    A   4           H4*        A   4  -1.262 -10.328 -11.260
   37    H3*    A   4           H3*        A   4  -3.546  -9.703  -9.401
   38    H2*    A   4           H2*        A   4  -4.550 -11.816 -10.075
   39   2HO*    A   4          2HO*        A   4  -4.016 -12.631 -11.968
   40    H1*    A   4           H1*        A   4  -2.245 -13.274  -9.625
   41    H8     A   4           H8         A   4  -1.784 -10.706  -7.084
   42   1H6     A   4          H61         A   4  -6.062 -13.480  -3.584
   43   2H6     A   4          H62         A   4  -4.775 -12.296  -3.611
   44    H2     A   4           H2         A   4  -6.335 -15.187  -7.726
   45   1H5*    G   5          1H5*        G   5  -6.149  -9.324 -12.900
   46   2H5*    G   5          2H5*        G   5  -7.081  -7.854 -12.556
   47    H4*    G   5           H4*        G   5  -8.441  -9.915 -12.686
   48    H3*    G   5           H3*        G   5  -8.492  -8.312 -10.136
   49    H2*    G   5           H2*        G   5 -10.127  -9.883  -9.289
   50   2HO*    G   5          2HO*        G   5 -10.026 -11.035 -11.907
   51    H1*    G   5           H1*        G   5  -8.714 -12.146 -10.110
   52    H8     G   5           H8         G   5  -5.941 -10.008  -9.143
   53    H1     G   5           H1         G   5  -9.329 -11.964  -4.056
   54   1H2     G   5          H21         G   5 -11.731 -12.856  -6.367
   55   2H2     G   5          H22         G   5 -11.256 -12.763  -4.686
   56   1H5*    A   6          1H5*        A   6 -12.135  -9.506 -10.585
   57   2H5*    A   6          2H5*        A   6 -13.256  -8.141 -10.745
   58    H4*    A   6           H4*        A   6 -13.973  -9.874  -9.129
   59    H3*    A   6           H3*        A   6 -14.411  -7.220  -8.844
   60    H2*    A   6           H2*        A   6 -12.526  -6.714  -7.426
   61   2HO*    A   6          2HO*        A   6 -14.711  -7.620  -5.864
   62    H1*    A   6           H1*        A   6 -12.973  -9.372  -5.957
   63    H8     A   6           H8         A   6  -9.918  -8.100  -7.899
   64   1H6     A   6          H61         A   6  -7.148  -7.627  -2.381
   65   2H6     A   6          H62         A   6  -6.936  -7.506  -4.118
   66    H2     A   6           H2         A   6 -11.425  -8.814  -1.699
   67   1H5*    A   7          1H5*        A   7 -16.271  -8.726  -4.792
   68   2H5*    A   7          2H5*        A   7 -17.739  -7.742  -4.631
   69    H4*    A   7           H4*        A   7 -16.605  -7.483  -2.611
   70    H3*    A   7           H3*        A   7 -16.117  -5.065  -4.339
   71    H2*    A   7           H2*        A   7 -14.637  -4.217  -2.702
   72   2HO*    A   7          2HO*        A   7 -15.488  -5.957  -0.678
   73    H1*    A   7           H1*        A   7 -14.076  -6.876  -1.537
   74    H8     A   7           H8         A   7 -12.821  -6.014  -5.034
   75   1H6     A   7          H61         A   7  -7.497  -4.539  -2.222
   76   2H6     A   7          H62         A   7  -8.279  -4.780  -3.770
   77    H2     A   7           H2         A   7 -10.585  -5.278   0.935
   78   1H5*    A   8          1H5*        A   8 -18.896  -2.292  -0.710
   79   2H5*    A   8          2H5*        A   8 -17.875  -1.025  -1.418
   80    H4*    A   8           H4*        A   8 -17.841  -2.062   1.215
   81    H3*    A   8           H3*        A   8 -16.257   0.061  -0.199
   82    H2*    A   8           H2*        A   8 -14.652   0.028   1.599
   83   2HO*    A   8          2HO*        A   8 -15.728  -0.242   3.463
   84    H1*    A   8           H1*        A   8 -14.483  -2.748   1.767
   85    H8     A   8           H8         A   8 -14.936  -1.963  -1.853
   86   1H6     A   8          H61         A   8  -8.834  -0.948  -2.107
   87   2H6     A   8          H62         A   8 -10.294  -1.153  -3.047
   88    H2     A   8           H2         A   8 -10.007  -1.303   2.207
   89   1H5*    C   9          1H5*        C   9 -16.920   2.547   4.215
   90   2H5*    C   9          2H5*        C   9 -16.797   3.991   3.191
   91    H4*    C   9           H4*        C   9 -15.111   3.529   5.164
   92    H3*    C   9           H3*        C   9 -14.579   4.871   2.543
   93    H2*    C   9           H2*        C   9 -12.223   4.941   3.021
   94   2HO*    C   9          2HO*        C   9 -11.840   3.770   5.285
   95    H1*    C   9           H1*        C   9 -12.015   2.333   3.956
   96   1H4     C   9          H41         C   9 -12.608   1.639  -2.576
   97   2H4     C   9          H42         C   9 -10.883   1.740  -2.258
   98    H5     C   9           H5         C   9 -14.289   1.970  -0.850
   99    H6     C   9           H6         C   9 -14.644   2.450   1.513
  100   1H5*    A  10          1H5*        A  10 -11.535   8.719   4.822
  101   2H5*    A  10          2H5*        A  10 -11.684   8.457   3.073
  102    H4*    A  10           H4*        A  10  -9.774   7.231   5.026
  103    H3*    A  10           H3*        A  10  -9.471   8.951   2.618
  104    H2*    A  10           H2*        A  10  -7.633   7.669   1.777
  105   2HO*    A  10          2HO*        A  10  -6.599   6.121   3.081
  106    H1*    A  10           H1*        A  10  -8.658   5.149   2.288
  107    H8     A  10           H8         A  10 -11.789   6.705   1.377
  108   1H6     A  10          H61         A  10 -10.017   6.652  -4.556
  109   2H6     A  10          H62         A  10 -11.366   6.863  -3.462
  110    H2     A  10           H2         A  10  -6.412   5.825  -2.018
  111   1H5*    A  11          1H5*        A  11  -5.328  10.615   5.772
  112   2H5*    A  11          2H5*        A  11  -4.806  11.420   4.280
  113    H4*    A  11           H4*        A  11  -3.286   9.754   5.851
  114    H3*    A  11           H3*        A  11  -2.916  10.853   3.104
  115    H2*    A  11           H2*        A  11  -1.224   9.237   2.582
  116   2HO*    A  11          2HO*        A  11   0.018   8.542   4.159
  117    H1*    A  11           H1*        A  11  -2.491   7.022   3.664
  118    H8     A  11           H8         A  11  -5.459   8.650   2.408
  119   1H6     A  11          H61         A  11  -3.855   7.011  -3.340
  120   2H6     A  11          H62         A  11  -5.145   7.622  -2.328
  121    H2     A  11           H2         A  11  -0.292   6.421  -0.683
  122   1H5*    G  12          1H5*        G  12   1.079  10.100   4.285
  123   2H5*    G  12          2H5*        G  12   1.834  11.705   4.267
  124    H4*    G  12           H4*        G  12   3.201  10.095   3.096
  125    H3*    G  12           H3*        G  12   2.071  12.373   1.534
  126    H2*    G  12           H2*        G  12   2.941  11.474  -0.521
  127   2HO*    G  12          2HO*        G  12   4.306   9.613  -0.463
  128    H1*    G  12           H1*        G  12   2.121   8.883  -0.126
  129    H8     G  12           H8         G  12  -0.250  11.384   1.485
  130    H1     G  12           H1         G  12  -1.546   9.965  -4.634
  131   1H2     G  12          H21         G  12   1.486   8.302  -4.582
  132   2H2     G  12          H22         G  12   0.071   8.765  -5.500
  133   1H5*    G  13          1H5*        G  13   5.820  11.343  -0.147
  134   2H5*    G  13          2H5*        G  13   6.800  12.822  -0.090
  135    H4*    G  13           H4*        G  13   6.982  11.869  -2.266
  136    H3*    G  13           H3*        G  13   5.430  14.430  -2.145
  137    H2*    G  13           H2*        G  13   5.024  14.287  -4.516
  138   2HO*    G  13          2HO*        G  13   6.507  13.355  -5.715
  139    H1*    G  13           H1*        G  13   4.391  11.573  -4.539
  140    H8     G  13           H8         G  13   3.111  13.249  -1.408
  141    H1     G  13           H1         G  13  -0.845  13.592  -6.449
  142   1H2     G  13          H21         G  13   1.823  12.360  -8.258
  143   2H2     G  13          H22         G  13   0.165  12.918  -8.265
  144   1H5*    C  14          1H5*        C  14   7.824  15.723  -5.427
  145   2H5*    C  14          2H5*        C  14   8.750  17.039  -4.681
  146    H4*    C  14           H4*        C  14   7.873  18.044  -6.552
  147    H3*    C  14           H3*        C  14   6.007  18.660  -4.267
  148    H2*    C  14           H2*        C  14   4.687  19.955  -5.819
  149   2HO*    C  14          2HO*        C  14   5.642  19.876  -8.126
  150    H1*    C  14           H1*        C  14   4.811  18.041  -7.875
  151   1H4     C  14          H41         C  14   0.243  15.849  -3.658
  152   2H4     C  14          H42         C  14  -0.604  16.959  -4.725
  153    H5     C  14           H5         C  14   2.629  15.533  -3.746
  154    H6     C  14           H6         C  14   4.695  16.208  -4.849
  155   1H5*    U  15          1H5*        U  15   5.803  22.614  -5.804
  156   2H5*    U  15          2H5*        U  15   6.111  23.517  -4.309
  157    H4*    U  15           H4*        U  15   3.933  24.030  -5.318
  158    H3*    U  15           H3*        U  15   4.011  22.901  -2.538
  159    H2*    U  15           H2*        U  15   1.607  22.977  -2.461
  160   2HO*    U  15          2HO*        U  15   0.587  23.784  -4.547
  161    H1*    U  15           H1*        U  15   1.218  21.842  -4.955
  162    H3     U  15           H3         U  15   0.332  18.488  -2.030
  163    H5     U  15           H5         U  15   4.518  18.558  -2.351
  164    H6     U  15           H6         U  15   4.310  20.598  -3.612
  165   1H5*    U  16          1H5*        U  16   2.211  27.632  -0.519
  166   2H5*    U  16          2H5*        U  16   1.556  26.340   0.506
  167    H4*    U  16           H4*        U  16  -0.227  27.800  -0.019
  168    H3*    U  16           H3*        U  16  -0.673  25.244  -0.361
  169    H2*    U  16           H2*        U  16   0.236  24.999  -2.591
  170   2HO*    U  16          2HO*        U  16  -2.449  25.853  -3.080
  171    H1*    U  16           H1*        U  16  -1.210  27.504  -3.550
  172    H3     U  16           H3         U  16   1.007  26.378  -7.363
  173    H5     U  16           H5         U  16   4.003  27.434  -4.615
  174    H6     U  16           H6         U  16   2.302  27.505  -2.909
  175   1H5*    C  17          1H5*        C  17  -3.960  24.478  -2.313
  176   2H5*    C  17          2H5*        C  17  -5.097  23.910  -1.075
  177    H4*    C  17           H4*        C  17  -4.271  22.262  -2.874
  178    H3*    C  17           H3*        C  17  -5.267  21.636  -0.412
  179    H2*    C  17           H2*        C  17  -3.109  21.629   0.716
  180   2HO*    C  17          2HO*        C  17  -3.253  19.014  -0.436
  181    H1*    C  17           H1*        C  17  -2.059  20.178  -1.795
  182   1H4     C  17          H41         C  17   3.451  22.494   0.899
  183   2H4     C  17          H42         C  17   3.465  20.786   1.316
  184    H5     C  17           H5         C  17   1.551  23.604  -0.072
  185    H6     C  17           H6         C  17  -0.683  23.286  -0.990
  186   1H5*    G  18          1H5*        G  18  -6.712  22.468  -1.948
  187   2H5*    G  18          2H5*        G  18  -8.311  21.864  -1.472
  188    H4*    G  18           H4*        G  18  -9.116  23.083  -3.137
  189    H3*    G  18           H3*        G  18  -7.985  20.777  -4.647
  190    H2*    G  18           H2*        G  18  -7.677  21.990  -6.600
  191   2HO*    G  18          2HO*        G  18  -9.428  23.837  -6.793
  192    H1*    G  18           H1*        G  18  -8.305  24.636  -5.298
  193    H8     G  18           H8         G  18  -7.186  25.823  -7.310
  194    H1     G  18           H1         G  18  -1.728  22.629  -6.197
  195   1H2     G  18          H21         G  18  -3.610  20.764  -3.995
  196   2H2     G  18          H22         G  18  -2.051  21.053  -4.733
  197   1H5*    G  19          1H5*        G  19  -8.850  17.346  -5.800
  198   2H5*    G  19          2H5*        G  19  -7.932  18.741  -5.209
  199    H4*    G  19           H4*        G  19  -8.816  18.865  -8.014
  200    H3*    G  19           H3*        G  19  -7.194  16.572  -7.136
  201    H2*    G  19           H2*        G  19  -5.304  17.066  -8.483
  202   2HO*    G  19          2HO*        G  19  -6.058  17.512 -10.458
  203    H1*    G  19           H1*        G  19  -5.305  19.836  -8.339
  204    H8     G  19           H8         G  19  -6.208  18.123  -5.055
  205    H1     G  19           H1         G  19   0.043  19.240  -5.919
  206   1H2     G  19          H21         G  19  -0.837  20.095  -9.137
  207   2H2     G  19          H22         G  19   0.444  19.884  -7.953
  208   1H5*    C  20          1H5*        C  20  -7.603  15.699 -11.496
  209   2H5*    C  20          2H5*        C  20  -8.128  14.005 -11.575
  210    H4*    C  20           H4*        C  20  -6.125  14.397 -12.900
  211    H3*    C  20           H3*        C  20  -5.976  12.485 -10.606
  212    H2*    C  20           H2*        C  20  -3.615  12.163 -10.988
  213   2HO*    C  20          2HO*        C  20  -2.714  12.632 -12.886
  214    H1*    C  20           H1*        C  20  -2.983  14.833 -11.210
  215   1H4     C  20          H41         C  20  -4.418  14.195  -4.815
  216   2H4     C  20          H42         C  20  -2.705  13.860  -4.933
  217    H5     C  20           H5         C  20  -5.824  14.535  -6.719
  218    H6     C  20           H6         C  20  -5.908  14.672  -9.135
  219   1H5*    C  21          1H5*        C  21  -3.356  10.827 -12.891
  220   2H5*    C  21          2H5*        C  21  -4.001   9.279 -13.470
  221    H4*    C  21           H4*        C  21  -1.840   8.825 -12.688
  222    H3*    C  21           H3*        C  21  -3.927   7.908 -10.728
  223    H2*    C  21           H2*        C  21  -2.166   7.112  -9.291
  224   2HO*    C  21          2HO*        C  21   0.088   7.467 -10.196
  225    H1*    C  21           H1*        C  21  -0.522   9.364  -9.615
  226   1H4     C  21          H41         C  21  -5.160  11.182  -5.290
  227   2H4     C  21          H42         C  21  -3.928  10.378  -4.331
  228    H5     C  21           H5         C  21  -5.094  11.261  -7.710
  229    H6     C  21           H6         C  21  -3.847  10.573  -9.694
  230   1H5*    U  22          1H5*        U  22  -2.719   2.947 -11.009
  231   2H5*    U  22          2H5*        U  22  -3.899   3.100  -9.693
  232    H4*    U  22           H4*        U  22  -1.129   2.560  -9.530
  233    H3*    U  22           H3*        U  22  -3.317   2.846  -7.499
  234    H2*    U  22           H2*        U  22  -1.670   3.074  -5.759
  235   2HO*    U  22          2HO*        U  22   0.094   2.212  -7.821
  236    H1*    U  22           H1*        U  22  -0.035   4.856  -7.135
  237    H3     U  22           H3         U  22  -2.177   7.434  -4.078
  238    H5     U  22           H5         U  22  -4.977   6.891  -7.162
  239    H6     U  22           H6         U  22  -3.457   5.314  -8.159
  240   1H5*    G  23          1H5*        G  23  -0.463   1.081  -5.073
  241   2H5*    G  23          2H5*        G  23  -1.351  -0.282  -4.363
  242    H4*    G  23           H4*        G  23  -0.441   1.832  -2.965
  243    H3*    G  23           H3*        G  23  -2.669  -0.077  -2.397
  244    H2*    G  23           H2*        G  23  -3.441   1.293  -0.577
  245   2HO*    G  23          2HO*        G  23  -2.123   3.297  -0.176
  246    H1*    G  23           H1*        G  23  -3.272   3.717  -1.909
  247    H8     G  23           H8         G  23  -4.257   1.701  -4.733
  248    H1     G  23           H1         G  23  -9.051   2.263  -0.506
  249   1H2     G  23          H21         G  23  -6.607   3.381   1.672
  250   2H2     G  23          H22         G  23  -8.296   3.011   1.410
  251   1H5*    C  24          1H5*        C  24  -0.222   0.229   1.759
  252   2H5*    C  24          2H5*        C  24  -0.174  -1.528   2.004
  253    H4*    C  24           H4*        C  24  -0.858  -0.345   4.018
  254    H3*    C  24           H3*        C  24  -2.782  -2.264   2.763
  255    H2*    C  24           H2*        C  24  -4.442  -1.719   4.419
  256   2HO*    C  24          2HO*        C  24  -2.184  -0.817   5.762
  257    H1*    C  24           H1*        C  24  -4.099   1.034   4.293
  258   1H4     C  24          H41         C  24  -7.299  -0.529  -1.266
  259   2H4     C  24          H42         C  24  -8.529  -0.037  -0.114
  260    H5     C  24           H5         C  24  -4.962  -0.739  -0.682
  261    H6     C  24           H6         C  24  -3.329  -0.523   1.116
  262   1H5*    U  25          1H5*        U  25  -3.619  -2.930   6.363
  263   2H5*    U  25          2H5*        U  25  -3.649  -4.654   6.781
  264    H4*    U  25           H4*        U  25  -5.803  -3.580   7.157
  265    H3*    U  25           H3*        U  25  -5.676  -5.781   5.118
  266    H2*    U  25           H2*        U  25  -8.051  -5.499   4.735
  267   2HO*    U  25          2HO*        U  25  -8.168  -3.373   6.587
  268    H1*    U  25           H1*        U  25  -7.936  -2.743   4.502
  269    H3     U  25           H3         U  25  -8.258  -4.307   0.244
  270    H5     U  25           H5         U  25  -4.164  -4.425   1.164
  271    H6     U  25           H6         U  25  -4.740  -3.923   3.447
  272   1H5*    U  26          1H5*        U  26  -8.806  -7.600   7.409
  273   2H5*    U  26          2H5*        U  26  -8.367  -9.319   7.444
  274    H4*    U  26           H4*        U  26 -10.528  -8.865   6.342
  275    H3*    U  26           H3*        U  26  -8.358 -10.180   4.714
  276    H2*    U  26           H2*        U  26  -9.926 -10.323   2.898
  277   2HO*    U  26          2HO*        U  26 -12.098  -9.170   4.043
  278    H1*    U  26           H1*        U  26 -11.042  -7.752   3.345
  279    H3     U  26           H3         U  26  -8.896  -7.921  -0.720
  280    H5     U  26           H5         U  26  -6.020  -6.743   2.105
  281    H6     U  26           H6         U  26  -7.605  -7.286   3.831
  282   1H5*    U  27          1H5*        U  27 -11.924 -12.769   4.583
  283   2H5*    U  27          2H5*        U  27 -11.371 -14.446   4.409
  284    H4*    U  27           H4*        U  27 -12.953 -13.688   2.653
  285    H3*    U  27           H3*        U  27 -10.249 -14.748   1.882
  286    H2*    U  27           H2*        U  27 -10.839 -14.416  -0.439
  287   2HO*    U  27          2HO*        U  27 -12.966 -13.665  -0.961
  288    H1*    U  27           H1*        U  27 -11.799 -11.837  -0.077
  289    H3     U  27           H3         U  27  -7.689 -11.313  -1.925
  290    H5     U  27           H5         U  27  -6.949 -11.973   2.155
  291    H6     U  27           H6         U  27  -9.277 -12.520   2.409
  292   1H5*    U  28          1H5*        U  28 -13.285 -17.554  -0.235
  293   2H5*    U  28          2H5*        U  28 -12.487 -19.127  -0.042
  294    H4*    U  28           H4*        U  28 -13.169 -18.707  -2.347
  295    H3*    U  28           H3*        U  28 -10.220 -19.007  -1.824
  296    H2*    U  28           H2*        U  28  -9.856 -18.774  -4.207
  297   2HO*    U  28          2HO*        U  28 -11.447 -19.537  -5.408
  298    H1*    U  28           H1*        U  28 -11.469 -16.527  -4.451
  299    H3     U  28           H3         U  28  -7.165 -15.036  -4.487
  300    H5     U  28           H5         U  28  -8.181 -15.396  -0.426
  301    H6     U  28           H6         U  28 -10.202 -16.510  -1.111
  302   1H5*    G  29          1H5*        G  29 -10.049 -22.682  -3.948
  303   2H5*    G  29          2H5*        G  29  -9.108 -23.736  -2.876
  304    H4*    G  29           H4*        G  29  -7.959 -23.197  -4.989
  305    H3*    G  29           H3*        G  29  -6.625 -22.366  -2.418
  306    H2*    G  29           H2*        G  29  -4.846 -21.428  -3.692
  307   2HO*    G  29          2HO*        G  29  -5.574 -23.471  -5.373
  308    H1*    G  29           H1*        G  29  -6.505 -20.742  -5.976
  309    H8     G  29           H8         G  29  -7.809 -19.165  -2.878
  310    H1     G  29           H1         G  29  -2.869 -15.994  -5.461
  311   1H2     G  29          H21         G  29  -2.452 -18.821  -7.409
  312   2H2     G  29          H22         G  29  -1.896 -17.214  -7.001
  313   1H5*    C  30          1H5*        C  30  -3.492 -24.319  -4.720
  314   2H5*    C  30          2H5*        C  30  -2.611 -25.293  -3.527
  315    H4*    C  30           H4*        C  30  -1.150 -23.770  -4.765
  316    H3*    C  30           H3*        C  30  -1.360 -23.404  -1.788
  317    H2*    C  30           H2*        C  30   0.211 -21.587  -1.943
  318   2HO*    C  30          2HO*        C  30   1.600 -21.460  -3.578
  319    H1*    C  30           H1*        C  30  -0.930 -20.440  -4.240
  320   1H4     C  30          H41         C  30  -4.731 -18.535   0.807
  321   2H4     C  30          H42         C  30  -3.629 -17.206   0.491
  322    H5     C  30           H5         C  30  -4.589 -20.660  -0.338
  323    H6     C  30           H6         C  30  -3.370 -21.944  -2.017
  324   1H5*    U  31          1H5*        U  31   2.929 -23.258  -2.838
  325   2H5*    U  31          2H5*        U  31   3.687 -24.305  -1.623
  326    H4*    U  31           H4*        U  31   4.735 -22.069  -1.857
  327    H3*    U  31           H3*        U  31   3.680 -22.958   0.813
  328    H2*    U  31           H2*        U  31   4.405 -20.870   1.757
  329   2HO*    U  31          2HO*        U  31   5.783 -19.502   0.644
  330    H1*    U  31           H1*        U  31   3.516 -19.283  -0.384
  331    H3     U  31           H3         U  31   0.718 -18.312   3.055
  332    H5     U  31           H5         U  31  -0.727 -21.921   1.467
  333    H6     U  31           H6         U  31   1.249 -22.022   0.097
  334    H3T    U  31           H3T        U  31   5.975 -23.098  -0.631
  Start of MODEL   25
    1   1H5*    A   1          1H5*        A   1  -3.961 -12.700   8.781
    2   2H5*    A   1          2H5*        A   1  -3.865 -11.841   7.233
    3    H4*    A   1           H4*        A   1  -1.698 -12.693   8.165
    4    H3*    A   1           H3*        A   1  -2.593 -13.245   5.365
    5    H2*    A   1           H2*        A   1  -0.662 -14.643   4.992
    6   2HO*    A   1          2HO*        A   1   0.463 -14.649   7.435
    7    H1*    A   1           H1*        A   1  -0.895 -16.095   7.324
    8    H8     A   1           H8         A   1  -4.436 -15.558   6.795
    9   1H6     A   1          H61         A   1  -4.333 -19.736   2.226
   10   2H6     A   1          H62         A   1  -5.356 -18.804   3.296
   11    H2     A   1           H2         A   1  -0.095 -18.646   3.212
   12    H5T    A   1           H5T        A   1  -4.677 -13.605   6.195
   13   1H5*    G   2          1H5*        G   2   1.422 -11.671   4.350
   14   2H5*    G   2          2H5*        G   2   1.028 -10.414   3.161
   15    H4*    G   2           H4*        G   2   2.685 -12.076   2.375
   16    H3*    G   2           H3*        G   2   0.139 -11.671   0.833
   17    H2*    G   2           H2*        G   2   0.846 -13.356  -0.730
   18   2HO*    G   2          2HO*        G   2   3.303 -12.611   0.231
   19    H1*    G   2           H1*        G   2   1.842 -15.137   1.201
   20    H8     G   2           H8         G   2  -1.158 -14.074   2.896
   21    H1     G   2           H1         G   2  -2.540 -17.706  -2.206
   22   1H2     G   2          H21         G   2   0.740 -17.116  -3.146
   23   2H2     G   2          H22         G   2  -0.787 -17.885  -3.515
   24   1H5*    U   3          1H5*        U   3   3.551 -10.690  -2.149
   25   2H5*    U   3          2H5*        U   3   2.836  -9.382  -3.111
   26    H4*    U   3           H4*        U   3   3.727 -11.173  -4.507
   27    H3*    U   3           H3*        U   3   0.757 -10.695  -4.639
   28    H2*    U   3           H2*        U   3   0.646 -12.413  -6.338
   29   2HO*    U   3          2HO*        U   3   2.444 -12.192  -7.560
   30    H1*    U   3           H1*        U   3   2.273 -14.210  -4.948
   31    H3     U   3           H3         U   3  -1.878 -15.952  -4.496
   32    H5     U   3           H5         U   3  -1.762 -12.786  -1.740
   33    H6     U   3           H6         U   3   0.367 -12.156  -2.669
   34   1H5*    A   4          1H5*        A   4   1.892  -9.668  -8.931
   35   2H5*    A   4          2H5*        A   4   0.970  -8.173  -9.183
   36    H4*    A   4           H4*        A   4   0.542  -9.823 -10.924
   37    H3*    A   4           H3*        A   4  -1.756  -8.963  -9.202
   38    H2*    A   4           H2*        A   4  -3.208 -10.475 -10.430
   39   2HO*    A   4          2HO*        A   4  -1.633 -11.841 -11.990
   40    H1*    A   4           H1*        A   4  -1.558 -12.651 -10.153
   41    H8     A   4           H8         A   4  -0.608 -10.863  -7.116
   42   1H6     A   4          H61         A   4  -5.879 -12.729  -4.467
   43   2H6     A   4          H62         A   4  -4.302 -12.025  -4.188
   44    H2     A   4           H2         A   4  -6.193 -13.489  -8.879
   45   1H5*    G   5          1H5*        G   5  -3.592  -7.116 -12.693
   46   2H5*    G   5          2H5*        G   5  -4.110  -5.531 -12.088
   47    H4*    G   5           H4*        G   5  -5.960  -7.024 -12.790
   48    H3*    G   5           H3*        G   5  -5.922  -5.981  -9.964
   49    H2*    G   5           H2*        G   5  -8.032  -7.115  -9.614
   50   2HO*    G   5          2HO*        G   5  -8.058  -6.998 -12.369
   51    H1*    G   5           H1*        G   5  -7.205  -9.506 -10.795
   52    H8     G   5           H8         G   5  -4.108  -8.553  -9.166
   53    H1     G   5           H1         G   5  -8.617 -10.201  -4.908
   54   1H2     G   5          H21         G   5 -10.810  -9.894  -7.554
   55   2H2     G   5          H22         G   5 -10.581 -10.259  -5.858
   56   1H5*    A   6          1H5*        A   6  -9.567  -5.891 -11.087
   57   2H5*    A   6          2H5*        A   6 -10.307  -4.280 -11.060
   58    H4*    A   6           H4*        A   6 -11.679  -6.062 -10.023
   59    H3*    A   6           H3*        A   6 -11.583  -3.499  -9.176
   60    H2*    A   6           H2*        A   6  -9.931  -3.771  -7.437
   61   2HO*    A   6          2HO*        A   6 -12.041  -4.857  -5.931
   62    H1*    A   6           H1*        A   6 -11.198  -6.465  -6.703
   63    H8     A   6           H8         A   6  -7.641  -5.675  -7.898
   64   1H6     A   6          H61         A   6  -5.877  -6.978  -2.108
   65   2H6     A   6          H62         A   6  -5.333  -6.595  -3.730
   66    H2     A   6           H2         A   6 -10.362  -7.096  -2.260
   67   1H5*    A   7          1H5*        A   7 -14.295  -5.228  -5.842
   68   2H5*    A   7          2H5*        A   7 -15.619  -4.054  -5.711
   69    H4*    A   7           H4*        A   7 -14.887  -4.241  -3.537
   70    H3*    A   7           H3*        A   7 -13.530  -1.836  -4.733
   71    H2*    A   7           H2*        A   7 -12.243  -1.590  -2.768
   72   2HO*    A   7          2HO*        A   7 -14.592  -2.125  -1.678
   73    H1*    A   7           H1*        A   7 -12.557  -4.415  -1.956
   74    H8     A   7           H8         A   7 -10.460  -3.505  -5.009
   75   1H6     A   7          H61         A   7  -5.607  -3.763  -1.166
   76   2H6     A   7          H62         A   7  -6.108  -3.612  -2.837
   77    H2     A   7           H2         A   7  -9.347  -4.095   1.284
   78   1H5*    A   8          1H5*        A   8 -16.030   1.431  -1.320
   79   2H5*    A   8          2H5*        A   8 -14.465   2.178  -1.698
   80    H4*    A   8           H4*        A   8 -15.422   1.096   0.778
   81    H3*    A   8           H3*        A   8 -12.986   2.669  -0.022
   82    H2*    A   8           H2*        A   8 -11.954   2.050   2.058
   83   2HO*    A   8          2HO*        A   8 -13.130   1.265   3.753
   84    H1*    A   8           H1*        A   8 -12.823  -0.624   2.015
   85    H8     A   8           H8         A   8 -11.764   0.402  -1.439
   86   1H6     A   8          H61         A   8  -6.002  -1.132   0.231
   87   2H6     A   8          H62         A   8  -7.038  -0.685  -1.106
   88    H2     A   8           H2         A   8  -8.575  -1.180   3.904
   89   1H5*    C   9          1H5*        C   9 -14.136   4.461   4.506
   90   2H5*    C   9          2H5*        C   9 -13.465   6.033   4.027
   91    H4*    C   9           H4*        C   9 -12.546   4.846   6.123
   92    H3*    C   9           H3*        C   9 -10.923   6.264   4.048
   93    H2*    C   9           H2*        C   9  -8.882   5.555   5.112
   94   2HO*    C   9          2HO*        C   9  -8.924   5.306   7.221
   95    H1*    C   9           H1*        C   9  -9.638   2.914   5.507
   96   1H4     C   9          H41         C   9  -8.489   3.255  -0.980
   97   2H4     C   9          H42         C   9  -7.007   2.659  -0.248
   98    H5     C   9           H5         C   9 -10.402   3.985   0.328
   99    H6     C   9           H6         C   9 -11.273   4.273   2.585
  100   1H5*    A  10          1H5*        A  10  -9.247   8.306   7.936
  101   2H5*    A  10          2H5*        A  10  -8.788   9.853   7.199
  102    H4*    A  10           H4*        A  10  -7.019   8.228   8.306
  103    H3*    A  10           H3*        A  10  -6.676  10.106   6.010
  104    H2*    A  10           H2*        A  10  -4.510   9.200   5.508
  105   2HO*    A  10          2HO*        A  10  -4.818   7.790   7.978
  106    H1*    A  10           H1*        A  10  -5.189   6.521   5.789
  107    H8     A  10           H8         A  10  -8.284   7.615   4.279
  108   1H6     A  10          H61         A  10  -5.398   8.052  -1.180
  109   2H6     A  10          H62         A  10  -6.951   8.016  -0.375
  110    H2     A  10           H2         A  10  -2.275   7.683   2.018
  111   1H5*    A  11          1H5*        A  11  -3.616  13.028   5.814
  112   2H5*    A  11          2H5*        A  11  -3.225  11.316   5.553
  113    H4*    A  11           H4*        A  11  -1.669  13.288   7.222
  114    H3*    A  11           H3*        A  11  -1.419  13.315   4.595
  115    H2*    A  11           H2*        A  11  -1.160  10.945   4.209
  116   2HO*    A  11          2HO*        A  11   1.358  10.692   4.482
  117    H1*    A  11           H1*        A  11   0.766  10.697   6.563
  118    H8     A  11           H8         A  11  -2.438   9.099   7.196
  119   1H6     A  11          H61         A  11  -0.250   3.907   4.629
  120   2H6     A  11          H62         A  11  -1.532   4.598   5.598
  121    H2     A  11           H2         A  11   2.562   7.248   3.620
  122   1H5*    G  12          1H5*        G  12   2.973  12.606   4.998
  123   2H5*    G  12          2H5*        G  12   3.596  14.244   4.716
  124    H4*    G  12           H4*        G  12   4.993  12.848   3.484
  125    H3*    G  12           H3*        G  12   3.001  14.227   1.718
  126    H2*    G  12           H2*        G  12   3.876  13.036  -0.189
  127   2HO*    G  12          2HO*        G  12   5.881  12.304  -0.171
  128    H1*    G  12           H1*        G  12   3.930  10.555   1.023
  129    H8     G  12           H8         G  12   1.053  12.681   2.297
  130    H1     G  12           H1         G  12  -0.239   9.233  -2.956
  131   1H2     G  12          H21         G  12   3.154   8.558  -2.984
  132   2H2     G  12          H22         G  12   1.595   8.325  -3.744
  133   1H5*    G  13          1H5*        G  13   6.739  13.993  -0.475
  134   2H5*    G  13          2H5*        G  13   7.014  15.660  -1.018
  135    H4*    G  13           H4*        G  13   7.228  14.129  -2.866
  136    H3*    G  13           H3*        G  13   4.887  16.008  -2.994
  137    H2*    G  13           H2*        G  13   4.294  15.040  -5.126
  138   2HO*    G  13          2HO*        G  13   5.761  14.036  -6.325
  139    H1*    G  13           H1*        G  13   4.638  12.398  -4.308
  140    H8     G  13           H8         G  13   3.249  14.428  -1.463
  141    H1     G  13           H1         G  13  -1.163  12.264  -5.589
  142   1H2     G  13          H21         G  13   1.531  11.412  -7.572
  143   2H2     G  13          H22         G  13  -0.208  11.445  -7.373
  144   1H5*    C  14          1H5*        C  14   6.701  17.441  -7.033
  145   2H5*    C  14          2H5*        C  14   6.589  19.162  -6.616
  146    H4*    C  14           H4*        C  14   5.467  18.664  -8.717
  147    H3*    C  14           H3*        C  14   3.679  19.598  -6.472
  148    H2*    C  14           H2*        C  14   1.862  19.565  -8.058
  149   2HO*    C  14          2HO*        C  14   3.830  20.034  -9.785
  150    H1*    C  14           H1*        C  14   2.637  17.108  -9.220
  151   1H4     C  14          H41         C  14  -0.680  15.515  -3.760
  152   2H4     C  14          H42         C  14  -1.923  15.914  -4.936
  153    H5     C  14           H5         C  14   1.672  15.823  -4.205
  154    H6     C  14           H6         C  14   3.311  16.607  -5.828
  155   1H5*    U  15          1H5*        U  15   2.375  23.031  -8.986
  156   2H5*    U  15          2H5*        U  15   2.342  24.236  -7.684
  157    H4*    U  15           H4*        U  15   0.147  23.766  -8.789
  158    H3*    U  15           H3*        U  15   0.468  23.577  -5.812
  159    H2*    U  15           H2*        U  15  -1.853  22.940  -5.627
  160   2HO*    U  15          2HO*        U  15  -3.105  22.818  -7.627
  161    H1*    U  15           H1*        U  15  -1.748  21.028  -7.613
  162    H3     U  15           H3         U  15  -1.583  18.880  -3.570
  163    H5     U  15           H5         U  15   2.397  19.790  -4.542
  164    H6     U  15           H6         U  15   1.568  21.134  -6.359
  165   1H5*    U  16          1H5*        U  16  -2.580  27.978  -4.852
  166   2H5*    U  16          2H5*        U  16  -2.749  26.807  -3.531
  167    H4*    U  16           H4*        U  16  -4.913  27.618  -4.171
  168    H3*    U  16           H3*        U  16  -4.606  25.052  -3.728
  169    H2*    U  16           H2*        U  16  -3.813  24.386  -5.914
  170   2HO*    U  16          2HO*        U  16  -5.430  22.989  -6.028
  171    H1*    U  16           H1*        U  16  -5.986  26.023  -7.291
  172    H3     U  16           H3         U  16  -3.836  24.420 -10.963
  173    H5     U  16           H5         U  16  -1.040  26.911  -9.061
  174    H6     U  16           H6         U  16  -2.565  27.073  -7.203
  175   1H5*    C  17          1H5*        C  17  -7.665  22.925  -4.810
  176   2H5*    C  17          2H5*        C  17  -8.504  22.509  -3.303
  177    H4*    C  17           H4*        C  17  -7.375  20.640  -4.665
  178    H3*    C  17           H3*        C  17  -7.958  20.602  -1.997
  179    H2*    C  17           H2*        C  17  -5.812  21.487  -1.271
  180   2HO*    C  17          2HO*        C  17  -6.254  19.065  -0.693
  181    H1*    C  17           H1*        C  17  -4.561  19.643  -3.401
  182   1H4     C  17          H41         C  17   0.166  24.073  -2.397
  183   2H4     C  17          H42         C  17   0.686  22.692  -1.443
  184    H5     C  17           H5         C  17  -2.006  24.222  -3.429
  185    H6     C  17           H6         C  17  -4.100  23.045  -3.838
  186   1H5*    G  18          1H5*        G  18  -9.571  20.213  -3.461
  187   2H5*    G  18          2H5*        G  18 -10.916  19.676  -2.436
  188    H4*    G  18           H4*        G  18 -12.222  19.613  -4.211
  189    H3*    G  18           H3*        G  18 -10.410  17.388  -4.982
  190    H2*    G  18           H2*        G  18 -10.615  17.759  -7.262
  191   2HO*    G  18          2HO*        G  18 -12.766  18.376  -8.063
  192    H1*    G  18           H1*        G  18 -12.138  20.340  -6.919
  193    H8     G  18           H8         G  18 -11.617  20.979  -9.353
  194    H1     G  18           H1         G  18  -5.323  20.349  -8.256
  195   1H2     G  18          H21         G  18  -6.287  18.946  -5.252
  196   2H2     G  18          H22         G  18  -4.977  19.413  -6.311
  197   1H5*    G  19          1H5*        G  19 -10.005  13.729  -4.720
  198   2H5*    G  19          2H5*        G  19  -9.655  15.465  -4.804
  199    H4*    G  19           H4*        G  19 -10.647  14.299  -7.298
  200    H3*    G  19           H3*        G  19  -8.309  13.010  -6.037
  201    H2*    G  19           H2*        G  19  -6.814  13.476  -7.835
  202   2HO*    G  19          2HO*        G  19  -7.586  14.076  -9.871
  203    H1*    G  19           H1*        G  19  -7.641  16.043  -8.459
  204    H8     G  19           H8         G  19  -7.796  15.316  -4.726
  205    H1     G  19           H1         G  19  -2.185  17.613  -6.795
  206   1H2     G  19          H21         G  19  -3.469  17.150  -9.956
  207   2H2     G  19          H22         G  19  -2.118  17.661  -8.956
  208   1H5*    C  20          1H5*        C  20  -8.748  10.651  -9.708
  209   2H5*    C  20          2H5*        C  20  -8.661   8.937  -9.257
  210    H4*    C  20           H4*        C  20  -7.008   9.515 -10.947
  211    H3*    C  20           H3*        C  20  -6.058   8.522  -8.291
  212    H2*    C  20           H2*        C  20  -3.762   8.855  -8.952
  213   2HO*    C  20          2HO*        C  20  -4.567   8.311 -11.305
  214    H1*    C  20           H1*        C  20  -4.106  11.387  -9.980
  215   1H4     C  20          H41         C  20  -4.757  12.357  -3.504
  216   2H4     C  20          H42         C  20  -3.043  12.513  -3.811
  217    H5     C  20           H5         C  20  -6.335  11.664  -5.162
  218    H6     C  20           H6         C  20  -6.644  11.042  -7.480
  219   1H5*    C  21          1H5*        C  21  -3.269   7.137 -10.561
  220   2H5*    C  21          2H5*        C  21  -3.469   5.382 -10.724
  221    H4*    C  21           H4*        C  21  -1.203   5.652 -10.338
  222    H3*    C  21           H3*        C  21  -2.587   4.864  -7.793
  223    H2*    C  21           H2*        C  21  -0.484   4.991  -6.629
  224   2HO*    C  21          2HO*        C  21   0.585   4.146  -8.722
  225    H1*    C  21           H1*        C  21   0.342   7.391  -7.801
  226   1H4     C  21          H41         C  21  -4.128   9.153  -3.277
  227   2H4     C  21          H42         C  21  -2.602   9.057  -2.412
  228    H5     C  21           H5         C  21  -4.364   8.481  -5.595
  229    H6     C  21           H6         C  21  -3.187   7.578  -7.539
  230   1H5*    U  22          1H5*        U  22  -0.404   0.771  -5.825
  231   2H5*    U  22          2H5*        U  22  -1.253   2.229  -5.276
  232    H4*    U  22           H4*        U  22   1.724   1.835  -5.548
  233    H3*    U  22           H3*        U  22  -0.076   1.921  -3.149
  234    H2*    U  22           H2*        U  22   1.581   3.180  -1.947
  235   2HO*    U  22          2HO*        U  22   3.377   1.928  -2.793
  236    H1*    U  22           H1*        U  22   2.263   4.883  -4.068
  237    H3     U  22           H3         U  22  -0.029   7.240  -0.858
  238    H5     U  22           H5         U  22  -2.922   5.711  -3.489
  239    H6     U  22           H6         U  22  -1.190   4.379  -4.498
  240   1H5*    G  23          1H5*        G  23   2.853   1.490  -0.980
  241   2H5*    G  23          2H5*        G  23   2.901  -0.173  -0.363
  242    H4*    G  23           H4*        G  23   3.203   1.349   1.452
  243    H3*    G  23           H3*        G  23   0.703  -0.265   1.436
  244    H2*    G  23           H2*        G  23  -0.204   0.926   3.316
  245   2HO*    G  23          2HO*        G  23   1.854   2.717   3.657
  246    H1*    G  23           H1*        G  23   0.393   3.467   2.436
  247    H8     G  23           H8         G  23  -0.140   2.006  -0.821
  248    H1     G  23           H1         G  23  -5.647   2.457   2.438
  249   1H2     G  23          H21         G  23  -3.626   2.966   5.201
  250   2H2     G  23          H22         G  23  -5.249   2.825   4.562
  251   1H5*    C  24          1H5*        C  24  -0.649  -2.881   4.367
  252   2H5*    C  24          2H5*        C  24  -0.841  -1.134   4.122
  253    H4*    C  24           H4*        C  24   0.243  -1.800   6.739
  254    H3*    C  24           H3*        C  24  -2.381  -3.067   5.995
  255    H2*    C  24           H2*        C  24  -3.238  -2.429   8.156
  256   2HO*    C  24          2HO*        C  24  -1.708  -2.609   9.658
  257    H1*    C  24           H1*        C  24  -2.180   0.164   8.088
  258   1H4     C  24          H41         C  24  -7.486   0.416   4.189
  259   2H4     C  24          H42         C  24  -8.081   0.742   5.808
  260    H5     C  24           H5         C  24  -5.198  -0.230   3.737
  261    H6     C  24           H6         C  24  -3.023  -0.697   4.738
  262   1H5*    U  25          1H5*        U  25  -3.194  -4.778   8.299
  263   2H5*    U  25          2H5*        U  25  -3.381  -6.526   8.056
  264    H4*    U  25           H4*        U  25  -5.515  -5.317   8.343
  265    H3*    U  25           H3*        U  25  -5.051  -6.879   5.814
  266    H2*    U  25           H2*        U  25  -7.288  -6.269   5.121
  267   2HO*    U  25          2HO*        U  25  -8.715  -5.970   6.668
  268    H1*    U  25           H1*        U  25  -7.019  -3.584   5.791
  269    H3     U  25           H3         U  25  -6.780  -3.916   1.234
  270    H5     U  25           H5         U  25  -2.858  -4.451   2.630
  271    H6     U  25           H6         U  25  -3.751  -4.582   4.862
  272   1H5*    U  26          1H5*        U  26  -8.815  -8.454   7.119
  273   2H5*    U  26          2H5*        U  26  -8.815 -10.180   6.708
  274    H4*    U  26           H4*        U  26 -10.641  -8.865   5.658
  275    H3*    U  26           H3*        U  26  -8.720 -10.366   3.884
  276    H2*    U  26           H2*        U  26 -10.024  -9.640   2.001
  277   2HO*    U  26          2HO*        U  26 -11.898  -8.475   3.798
  278    H1*    U  26           H1*        U  26 -10.448  -7.018   2.999
  279    H3     U  26           H3         U  26  -7.919  -6.887  -0.836
  280    H5     U  26           H5         U  26  -5.223  -7.294   2.359
  281    H6     U  26           H6         U  26  -7.106  -7.730   3.791
  282   1H5*    U  27          1H5*        U  27 -12.831 -11.793   2.926
  283   2H5*    U  27          2H5*        U  27 -12.668 -13.487   2.421
  284    H4*    U  27           H4*        U  27 -13.818 -12.026   0.779
  285    H3*    U  27           H3*        U  27 -11.358 -13.550  -0.029
  286    H2*    U  27           H2*        U  27 -11.581 -12.629  -2.254
  287   2HO*    U  27          2HO*        U  27 -13.758 -11.015  -1.620
  288    H1*    U  27           H1*        U  27 -11.936 -10.018  -1.395
  289    H3     U  27           H3         U  27  -7.619 -10.243  -2.777
  290    H5     U  27           H5         U  27  -7.584 -11.812   1.119
  291    H6     U  27           H6         U  27  -9.989 -11.770   1.072
  292   1H5*    U  28          1H5*        U  28 -14.519 -15.256  -2.873
  293   2H5*    U  28          2H5*        U  28 -14.054 -16.966  -2.973
  294    H4*    U  28           H4*        U  28 -14.246 -15.863  -5.166
  295    H3*    U  28           H3*        U  28 -11.579 -17.029  -4.390
  296    H2*    U  28           H2*        U  28 -10.775 -16.400  -6.588
  297   2HO*    U  28          2HO*        U  28 -12.455 -15.164  -7.899
  298    H1*    U  28           H1*        U  28 -11.785 -13.813  -6.444
  299    H3     U  28           H3         U  28  -7.271 -13.642  -5.704
  300    H5     U  28           H5         U  28  -9.029 -14.285  -1.945
  301    H6     U  28           H6         U  28 -11.117 -14.683  -3.075
  302   1H5*    G  29          1H5*        G  29 -12.041 -20.149  -7.332
  303   2H5*    G  29          2H5*        G  29 -11.575 -21.617  -6.452
  304    H4*    G  29           H4*        G  29 -10.052 -21.045  -8.309
  305    H3*    G  29           H3*        G  29  -8.900 -21.158  -5.526
  306    H2*    G  29           H2*        G  29  -6.772 -20.593  -6.438
  307   2HO*    G  29          2HO*        G  29  -6.231 -21.487  -8.283
  308    H1*    G  29           H1*        G  29  -7.844 -18.979  -8.593
  309    H8     G  29           H8         G  29  -9.107 -17.726  -5.345
  310    H1     G  29           H1         G  29  -3.108 -15.850  -6.617
  311   1H2     G  29          H21         G  29  -3.215 -18.220  -9.135
  312   2H2     G  29          H22         G  29  -2.291 -16.987  -8.307
  313   1H5*    C  30          1H5*        C  30  -6.115 -23.545  -7.807
  314   2H5*    C  30          2H5*        C  30  -5.795 -24.948  -6.769
  315    H4*    C  30           H4*        C  30  -3.745 -23.800  -7.408
  316    H3*    C  30           H3*        C  30  -4.442 -23.860  -4.486
  317    H2*    C  30           H2*        C  30  -2.432 -22.623  -4.013
  318   2HO*    C  30          2HO*        C  30  -1.747 -23.627  -6.509
  319    H1*    C  30           H1*        C  30  -2.717 -20.812  -6.133
  320   1H4     C  30          H41         C  30  -6.873 -18.731  -1.451
  321   2H4     C  30          H42         C  30  -5.415 -17.771  -1.272
  322    H5     C  30           H5         C  30  -7.059 -20.563  -3.014
  323    H6     C  30           H6         C  30  -5.895 -21.848  -4.728
  324   1H5*    U  31          1H5*        U  31  -0.151 -24.864  -4.713
  325   2H5*    U  31          2H5*        U  31  -0.044 -26.317  -3.701
  326    H4*    U  31           H4*        U  31   1.617 -24.609  -3.111
  327    H3*    U  31           H3*        U  31  -0.391 -25.419  -1.025
  328    H2*    U  31           H2*        U  31   0.658 -23.900   0.514
  329   2HO*    U  31          2HO*        U  31   2.652 -23.504  -1.498
  330    H1*    U  31           H1*        U  31   0.983 -21.819  -1.353
  331    H3     U  31           H3         U  31  -2.198 -20.283   1.478
  332    H5     U  31           H5         U  31  -4.220 -22.970  -1.038
  333    H6     U  31           H6         U  31  -2.083 -23.617  -1.937
  334    H3T    U  31           H3T        U  31   2.039 -26.204  -1.929
  Start of MODEL   26
    1   1H5*    A   1          1H5*        A   1  -1.841 -11.941  10.312
    2   2H5*    A   1          2H5*        A   1  -2.290 -11.034   8.856
    3    H4*    A   1           H4*        A   1   0.181 -11.504   9.273
    4    H3*    A   1           H3*        A   1  -1.216 -11.846   6.654
    5    H2*    A   1           H2*        A   1   0.772 -12.794   5.669
    6   2HO*    A   1          2HO*        A   1   2.124 -11.290   7.078
    7    H1*    A   1           H1*        A   1   1.299 -14.568   7.709
    8    H8     A   1           H8         A   1  -2.370 -14.408   7.897
    9   1H6     A   1          H61         A   1  -2.629 -18.232   3.035
   10   2H6     A   1          H62         A   1  -3.547 -17.489   4.325
   11    H2     A   1           H2         A   1   1.588 -16.763   3.425
   12    H5T    A   1           H5T        A   1  -2.831 -13.635   9.563
   13   1H5*    G   2          1H5*        G   2   2.176  -9.856   5.399
   14   2H5*    G   2          2H5*        G   2   1.771  -8.605   4.208
   15    H4*    G   2           H4*        G   2   3.320 -10.364   3.382
   16    H3*    G   2           H3*        G   2   0.717  -9.904   1.935
   17    H2*    G   2           H2*        G   2   1.395 -11.585   0.352
   18   2HO*    G   2          2HO*        G   2   3.735 -12.429   1.189
   19    H1*    G   2           H1*        G   2   2.478 -13.332   2.300
   20    H8     G   2           H8         G   2  -0.601 -12.390   3.928
   21    H1     G   2           H1         G   2  -1.713 -16.125  -1.168
   22   1H2     G   2          H21         G   2   1.555 -15.392  -2.046
   23   2H2     G   2          H22         G   2   0.073 -16.235  -2.438
   24   1H5*    U   3          1H5*        U   3   3.644  -8.548  -1.285
   25   2H5*    U   3          2H5*        U   3   2.716  -7.336  -2.189
   26    H4*    U   3           H4*        U   3   3.466  -9.234  -3.568
   27    H3*    U   3           H3*        U   3   0.512  -8.715  -3.332
   28    H2*    U   3           H2*        U   3   0.131 -10.562  -4.828
   29   2HO*    U   3          2HO*        U   3   2.537 -11.538  -5.298
   30    H1*    U   3           H1*        U   3   1.984 -12.269  -3.605
   31    H3     U   3           H3         U   3  -1.983 -14.063  -2.413
   32    H5     U   3           H5         U   3  -1.631 -10.644   0.001
   33    H6     U   3           H6         U   3   0.336 -10.054  -1.254
   34   1H5*    A   4          1H5*        A   4   1.854  -8.524  -7.921
   35   2H5*    A   4          2H5*        A   4   0.981  -7.034  -8.323
   36    H4*    A   4           H4*        A   4   0.749  -8.654 -10.090
   37    H3*    A   4           H3*        A   4  -1.755  -7.925  -8.620
   38    H2*    A   4           H2*        A   4  -3.002  -9.500  -9.984
   39   2HO*    A   4          2HO*        A   4  -0.510  -9.966 -11.315
   40    H1*    A   4           H1*        A   4  -1.305 -11.601  -9.527
   41    H8     A   4           H8         A   4  -0.693  -9.672  -6.490
   42   1H6     A   4          H61         A   4  -6.015 -11.770  -4.145
   43   2H6     A   4          H62         A   4  -4.508 -10.955  -3.790
   44    H2     A   4           H2         A   4  -5.957 -12.716  -8.536
   45   1H5*    G   5          1H5*        G   5  -3.328  -6.213 -12.297
   46   2H5*    G   5          2H5*        G   5  -4.012  -4.664 -11.764
   47    H4*    G   5           H4*        G   5  -5.676  -6.282 -12.635
   48    H3*    G   5           H3*        G   5  -5.991  -5.218  -9.837
   49    H2*    G   5           H2*        G   5  -8.035  -6.504  -9.662
   50   2HO*    G   5          2HO*        G   5  -7.944  -6.295 -12.352
   51    H1*    G   5           H1*        G   5  -6.926  -8.842 -10.688
   52    H8     G   5           H8         G   5  -4.056  -7.556  -8.862
   53    H1     G   5           H1         G   5  -8.689  -9.573  -4.906
   54   1H2     G   5          H21         G   5 -10.695  -9.542  -7.714
   55   2H2     G   5          H22         G   5 -10.559  -9.843  -5.996
   56   1H5*    A   6          1H5*        A   6  -9.647  -5.522 -11.160
   57   2H5*    A   6          2H5*        A   6 -10.405  -3.920 -11.225
   58    H4*    A   6           H4*        A   6 -11.799  -5.673 -10.170
   59    H3*    A   6           H3*        A   6 -11.755  -3.080  -9.416
   60    H2*    A   6           H2*        A   6 -10.147  -3.284  -7.625
   61   2HO*    A   6          2HO*        A   6 -12.338  -2.720  -6.779
   62    H1*    A   6           H1*        A   6 -11.456  -5.944  -6.830
   63    H8     A   6           H8         A   6  -7.847  -5.145  -7.879
   64   1H6     A   6          H61         A   6  -6.337  -6.319  -1.991
   65   2H6     A   6          H62         A   6  -5.729  -5.950  -3.594
   66    H2     A   6           H2         A   6 -10.809  -6.549  -2.357
   67   1H5*    A   7          1H5*        A   7 -14.469  -4.838  -6.149
   68   2H5*    A   7          2H5*        A   7 -15.854  -3.736  -6.024
   69    H4*    A   7           H4*        A   7 -15.153  -3.924  -3.839
   70    H3*    A   7           H3*        A   7 -13.894  -1.434  -4.970
   71    H2*    A   7           H2*        A   7 -12.672  -1.155  -2.967
   72   2HO*    A   7          2HO*        A   7 -14.294  -2.952  -1.527
   73    H1*    A   7           H1*        A   7 -12.835  -4.011  -2.220
   74    H8     A   7           H8         A   7 -10.749  -2.921  -5.223
   75   1H6     A   7          H61         A   7  -5.948  -3.009  -1.306
   76   2H6     A   7          H62         A   7  -6.429  -2.845  -2.980
   77    H2     A   7           H2         A   7  -9.703  -3.585   1.074
   78   1H5*    A   8          1H5*        A   8 -17.168   0.639  -1.385
   79   2H5*    A   8          2H5*        A   8 -16.270   2.157  -1.586
   80    H4*    A   8           H4*        A   8 -16.534   0.897   0.757
   81    H3*    A   8           H3*        A   8 -14.271   2.633  -0.197
   82    H2*    A   8           H2*        A   8 -13.099   2.144   1.850
   83   2HO*    A   8          2HO*        A   8 -14.485   0.537   3.255
   84    H1*    A   8           H1*        A   8 -13.694  -0.594   1.850
   85    H8     A   8           H8         A   8 -12.969   0.782  -1.621
   86   1H6     A   8          H61         A   8  -7.052  -0.672  -0.509
   87   2H6     A   8          H62         A   8  -8.192  -0.124  -1.717
   88    H2     A   8           H2         A   8  -9.368  -1.250   3.290
   89   1H5*    C   9          1H5*        C   9 -14.739   5.256   4.085
   90   2H5*    C   9          2H5*        C   9 -13.870   6.464   3.119
   91    H4*    C   9           H4*        C   9 -12.845   5.246   5.283
   92    H3*    C   9           H3*        C   9 -11.458   6.447   2.912
   93    H2*    C   9           H2*        C   9  -9.357   5.565   3.687
   94   2HO*    C   9          2HO*        C   9 -10.836   4.917   6.047
   95    H1*    C   9           H1*        C   9 -10.320   3.033   4.342
   96   1H4     C   9          H41         C   9  -9.929   2.956  -2.239
   97   2H4     C   9          H42         C   9  -8.380   2.362  -1.658
   98    H5     C   9           H5         C   9 -11.646   3.829  -0.754
   99    H6     C   9           H6         C   9 -12.216   4.295   1.569
  100   1H5*    A  10          1H5*        A  10  -9.556   7.519   6.773
  101   2H5*    A  10          2H5*        A  10  -8.652   9.040   6.626
  102    H4*    A  10           H4*        A  10  -7.474   6.821   7.370
  103    H3*    A  10           H3*        A  10  -6.351   9.009   5.666
  104    H2*    A  10           H2*        A  10  -4.387   7.705   5.219
  105   2HO*    A  10          2HO*        A  10  -3.935   5.837   6.405
  106    H1*    A  10           H1*        A  10  -5.697   5.280   4.790
  107    H8     A  10           H8         A  10  -8.085   7.430   3.135
  108   1H6     A  10          H61         A  10  -4.134   8.071  -1.590
  109   2H6     A  10          H62         A  10  -5.784   8.311  -1.056
  110    H2     A  10           H2         A  10  -1.899   6.282   1.859
  111   1H5*    A  11          1H5*        A  11  -3.466  11.438   6.036
  112   2H5*    A  11          2H5*        A  11  -3.338   9.794   5.381
  113    H4*    A  11           H4*        A  11  -1.352  11.243   7.122
  114    H3*    A  11           H3*        A  11  -1.405  11.573   4.488
  115    H2*    A  11           H2*        A  11  -1.436   9.250   3.826
  116   2HO*    A  11          2HO*        A  11   0.961  10.479   3.699
  117    H1*    A  11           H1*        A  11   0.685   8.592   5.929
  118    H8     A  11           H8         A  11  -2.500   7.086   6.732
  119   1H6     A  11          H61         A  11  -0.987   2.169   3.291
  120   2H6     A  11          H62         A  11  -2.091   2.795   4.496
  121    H2     A  11           H2         A  11   1.885   5.476   2.328
  122   1H5*    G  12          1H5*        G  12   2.850  10.323   4.359
  123   2H5*    G  12          2H5*        G  12   3.669  11.889   4.200
  124    H4*    G  12           H4*        G  12   4.783  10.499   2.711
  125    H3*    G  12           H3*        G  12   2.838  12.265   1.267
  126    H2*    G  12           H2*        G  12   3.404  11.190  -0.811
  127   2HO*    G  12          2HO*        G  12   5.676  10.605   0.586
  128    H1*    G  12           H1*        G  12   3.309   8.600   0.157
  129    H8     G  12           H8         G  12   0.751  10.869   1.816
  130    H1     G  12           H1         G  12  -1.228   8.030  -3.586
  131   1H2     G  12          H21         G  12   2.069   7.032  -3.917
  132   2H2     G  12          H22         G  12   0.448   7.020  -4.576
  133   1H5*    G  13          1H5*        G  13   6.326  11.677  -1.091
  134   2H5*    G  13          2H5*        G  13   6.964  13.298  -1.428
  135    H4*    G  13           H4*        G  13   6.997  12.074  -3.453
  136    H3*    G  13           H3*        G  13   4.867  14.188  -3.374
  137    H2*    G  13           H2*        G  13   4.197  13.544  -5.604
  138   2HO*    G  13          2HO*        G  13   6.481  13.120  -6.230
  139    H1*    G  13           H1*        G  13   4.218  10.809  -5.101
  140    H8     G  13           H8         G  13   3.112  12.717  -2.036
  141    H1     G  13           H1         G  13  -1.576  11.347  -6.198
  142   1H2     G  13          H21         G  13   0.980  10.378  -8.308
  143   2H2     G  13          H22         G  13  -0.742  10.572  -8.063
  144   1H5*    C  14          1H5*        C  14   6.709  15.901  -7.206
  145   2H5*    C  14          2H5*        C  14   6.851  17.551  -6.567
  146    H4*    C  14           H4*        C  14   5.580  17.530  -8.622
  147    H3*    C  14           H3*        C  14   3.973  18.251  -6.171
  148    H2*    C  14           H2*        C  14   2.123  18.672  -7.661
  149   2HO*    C  14          2HO*        C  14   3.263  17.996 -10.028
  150    H1*    C  14           H1*        C  14   2.607  16.376  -9.243
  151   1H4     C  14          H41         C  14  -0.769  14.286  -3.986
  152   2H4     C  14          H42         C  14  -1.983  14.940  -5.074
  153    H5     C  14           H5         C  14   1.599  14.477  -4.419
  154    H6     C  14           H6         C  14   3.285  15.322  -5.961
  155   1H5*    U  15          1H5*        U  15   2.664  21.854  -8.300
  156   2H5*    U  15          2H5*        U  15   2.901  23.003  -6.970
  157    H4*    U  15           H4*        U  15   0.569  22.846  -7.808
  158    H3*    U  15           H3*        U  15   1.168  22.363  -4.906
  159    H2*    U  15           H2*        U  15  -1.181  21.965  -4.521
  160   2HO*    U  15          2HO*        U  15  -2.466  22.054  -6.677
  161    H1*    U  15           H1*        U  15  -1.512  20.259  -6.672
  162    H3     U  15           H3         U  15  -1.292  17.622  -2.955
  163    H5     U  15           H5         U  15   2.693  18.270  -4.105
  164    H6     U  15           H6         U  15   1.893  19.896  -5.689
  165   1H5*    U  16          1H5*        U  16  -1.297  26.971  -3.470
  166   2H5*    U  16          2H5*        U  16  -1.561  25.819  -2.147
  167    H4*    U  16           H4*        U  16  -3.647  26.809  -2.636
  168    H3*    U  16           H3*        U  16  -3.610  24.197  -2.475
  169    H2*    U  16           H2*        U  16  -2.933  23.690  -4.743
  170   2HO*    U  16          2HO*        U  16  -5.041  22.710  -4.286
  171    H1*    U  16           H1*        U  16  -4.951  25.672  -5.880
  172    H3     U  16           H3         U  16  -3.020  24.251  -9.746
  173    H5     U  16           H5         U  16   0.018  26.293  -7.685
  174    H6     U  16           H6         U  16  -1.453  26.395  -5.779
  175   1H5*    C  17          1H5*        C  17  -6.846  22.484  -3.755
  176   2H5*    C  17          2H5*        C  17  -7.711  21.992  -2.286
  177    H4*    C  17           H4*        C  17  -6.774  20.179  -3.853
  178    H3*    C  17           H3*        C  17  -7.345  19.915  -1.198
  179    H2*    C  17           H2*        C  17  -5.122  20.513  -0.413
  180   2HO*    C  17          2HO*        C  17  -4.013  18.395  -0.161
  181    H1*    C  17           H1*        C  17  -4.064  18.792  -2.742
  182   1H4     C  17          H41         C  17   1.093  22.593  -1.410
  183   2H4     C  17          H42         C  17   1.495  21.070  -0.630
  184    H5     C  17           H5         C  17  -1.075  23.082  -2.324
  185    H6     C  17           H6         C  17  -3.283  22.173  -2.801
  186   1H5*    G  18          1H5*        G  18  -8.948  19.846  -2.740
  187   2H5*    G  18          2H5*        G  18 -10.339  19.381  -1.742
  188    H4*    G  18           H4*        G  18 -11.665  19.589  -3.489
  189    H3*    G  18           H3*        G  18 -10.065  17.308  -4.520
  190    H2*    G  18           H2*        G  18 -10.267  17.934  -6.748
  191   2HO*    G  18          2HO*        G  18 -12.532  17.424  -6.595
  192    H1*    G  18           H1*        G  18 -11.535  20.594  -6.106
  193    H8     G  18           H8         G  18 -10.967  21.417  -8.483
  194    H1     G  18           H1         G  18  -4.757  20.097  -7.526
  195   1H2     G  18          H21         G  18  -5.841  18.517  -4.655
  196   2H2     G  18          H22         G  18  -4.495  18.956  -5.682
  197   1H5*    G  19          1H5*        G  19 -10.029  13.615  -4.787
  198   2H5*    G  19          2H5*        G  19  -9.515  15.309  -4.695
  199    H4*    G  19           H4*        G  19 -10.726  14.544  -7.244
  200    H3*    G  19           H3*        G  19  -8.506  12.875  -6.265
  201    H2*    G  19           H2*        G  19  -7.002  13.414  -8.026
  202   2HO*    G  19          2HO*        G  19  -8.382  14.939  -9.687
  203    H1*    G  19           H1*        G  19  -7.603  16.099  -8.368
  204    H8     G  19           H8         G  19  -7.659  14.945  -4.730
  205    H1     G  19           H1         G  19  -2.002  17.118  -6.814
  206   1H2     G  19          H21         G  19  -3.466  17.130  -9.931
  207   2H2     G  19          H22         G  19  -2.033  17.428  -8.961
  208   1H5*    C  20          1H5*        C  20  -9.356  10.934 -10.219
  209   2H5*    C  20          2H5*        C  20  -9.410   9.196  -9.864
  210    H4*    C  20           H4*        C  20  -7.796   9.766 -11.621
  211    H3*    C  20           H3*        C  20  -6.864   8.407  -9.126
  212    H2*    C  20           H2*        C  20  -4.572   8.540  -9.866
  213   2HO*    C  20          2HO*        C  20  -4.098   8.748 -11.946
  214    H1*    C  20           H1*        C  20  -4.648  11.188 -10.620
  215   1H4     C  20          H41         C  20  -4.965  11.526  -4.055
  216   2H4     C  20          H42         C  20  -3.255  11.471  -4.417
  217    H5     C  20           H5         C  20  -6.670  11.248  -5.711
  218    H6     C  20           H6         C  20  -7.123  10.914  -8.068
  219   1H5*    C  21          1H5*        C  21  -4.257   6.915 -11.507
  220   2H5*    C  21          2H5*        C  21  -4.596   5.186 -11.716
  221    H4*    C  21           H4*        C  21  -2.304   5.355 -11.236
  222    H3*    C  21           H3*        C  21  -3.875   4.381  -8.866
  223    H2*    C  21           H2*        C  21  -1.837   4.262  -7.601
  224   2HO*    C  21          2HO*        C  21  -0.519   3.374  -9.250
  225    H1*    C  21           H1*        C  21  -0.759   6.676  -8.582
  226   1H4     C  21          H41         C  21  -4.947   8.427  -3.795
  227   2H4     C  21          H42         C  21  -3.458   8.017  -2.959
  228    H5     C  21           H5         C  21  -5.258   8.086  -6.172
  229    H6     C  21           H6         C  21  -4.205   7.282  -8.227
  230   1H5*    U  22          1H5*        U  22  -1.694  -0.409  -7.963
  231   2H5*    U  22          2H5*        U  22  -2.479   0.733  -6.855
  232    H4*    U  22           H4*        U  22   0.422   0.218  -7.335
  233    H3*    U  22           H3*        U  22  -1.329   0.324  -4.903
  234    H2*    U  22           H2*        U  22   0.519   1.167  -3.613
  235   2HO*    U  22          2HO*        U  22   2.102  -0.218  -4.643
  236    H1*    U  22           H1*        U  22   1.398   3.003  -5.526
  237    H3     U  22           H3         U  22  -0.541   5.442  -2.208
  238    H5     U  22           H5         U  22  -3.713   4.188  -4.658
  239    H6     U  22           H6         U  22  -2.154   2.774  -5.823
  240   1H5*    G  23          1H5*        G  23   1.787  -0.531  -2.667
  241   2H5*    G  23          2H5*        G  23   1.304  -2.016  -1.823
  242    H4*    G  23           H4*        G  23   1.808  -0.092  -0.337
  243    H3*    G  23           H3*        G  23  -0.840  -1.490  -0.201
  244    H2*    G  23           H2*        G  23  -1.566   0.044   1.505
  245   2HO*    G  23          2HO*        G  23  -0.082   0.822   2.813
  246    H1*    G  23           H1*        G  23  -0.613   2.344   0.254
  247    H8     G  23           H8         G  23  -1.699   0.579  -2.691
  248    H1     G  23           H1         G  23  -6.704   2.396   0.884
  249   1H2     G  23          H21         G  23  -4.361   2.909   3.376
  250   2H2     G  23          H22         G  23  -6.042   2.966   2.894
  251   1H5*    C  24          1H5*        C  24  -2.139  -2.876   3.965
  252   2H5*    C  24          2H5*        C  24  -2.404  -1.304   3.187
  253    H4*    C  24           H4*        C  24  -0.722  -1.054   5.521
  254    H3*    C  24           H3*        C  24  -3.307  -2.523   5.958
  255    H2*    C  24           H2*        C  24  -3.723  -1.150   7.890
  256   2HO*    C  24          2HO*        C  24  -1.030  -0.990   7.866
  257    H1*    C  24           H1*        C  24  -2.936   1.257   6.690
  258   1H4     C  24          H41         C  24  -8.986   0.257   4.320
  259   2H4     C  24          H42         C  24  -9.247   0.869   5.944
  260    H5     C  24           H5         C  24  -6.789  -0.316   3.473
  261    H6     C  24           H6         C  24  -4.409  -0.413   4.005
  262   1H5*    U  25          1H5*        U  25  -3.807  -3.713   8.169
  263   2H5*    U  25          2H5*        U  25  -3.870  -5.482   8.282
  264    H4*    U  25           H4*        U  25  -6.094  -4.539   8.175
  265    H3*    U  25           H3*        U  25  -5.281  -6.201   5.797
  266    H2*    U  25           H2*        U  25  -7.516  -5.871   4.935
  267   2HO*    U  25          2HO*        U  25  -9.135  -5.040   6.198
  268    H1*    U  25           H1*        U  25  -7.567  -3.134   5.490
  269    H3     U  25           H3         U  25  -7.116  -3.255   0.996
  270    H5     U  25           H5         U  25  -3.285  -4.155   2.448
  271    H6     U  25           H6         U  25  -4.227  -4.250   4.662
  272   1H5*    U  26          1H5*        U  26  -9.172  -7.808   7.088
  273   2H5*    U  26          2H5*        U  26  -9.085  -9.544   6.733
  274    H4*    U  26           H4*        U  26 -10.977  -8.355   5.647
  275    H3*    U  26           H3*        U  26  -8.993  -9.811   3.903
  276    H2*    U  26           H2*        U  26 -10.374  -9.225   2.020
  277   2HO*    U  26          2HO*        U  26 -12.248  -8.293   3.971
  278    H1*    U  26           H1*        U  26 -10.886  -6.590   2.926
  279    H3     U  26           H3         U  26  -8.406  -6.287  -0.889
  280    H5     U  26           H5         U  26  -5.640  -6.925   2.206
  281    H6     U  26           H6         U  26  -7.497  -7.370   3.669
  282   1H5*    U  27          1H5*        U  27 -12.984 -11.431   2.947
  283   2H5*    U  27          2H5*        U  27 -12.749 -13.118   2.449
  284    H4*    U  27           H4*        U  27 -13.908 -11.692   0.778
  285    H3*    U  27           H3*        U  27 -11.373 -13.118   0.011
  286    H2*    U  27           H2*        U  27 -11.638 -12.218  -2.223
  287   2HO*    U  27          2HO*        U  27 -13.629 -11.827  -2.860
  288    H1*    U  27           H1*        U  27 -12.083  -9.622  -1.359
  289    H3     U  27           H3         U  27  -7.764  -9.706  -2.750
  290    H5     U  27           H5         U  27  -7.666 -11.268   1.146
  291    H6     U  27           H6         U  27 -10.071 -11.317   1.102
  292   1H5*    U  28          1H5*        U  28 -14.337 -15.203  -2.783
  293   2H5*    U  28          2H5*        U  28 -13.689 -16.852  -2.869
  294    H4*    U  28           H4*        U  28 -13.925 -15.746  -5.064
  295    H3*    U  28           H3*        U  28 -11.182 -16.662  -4.220
  296    H2*    U  28           H2*        U  28 -10.390 -15.951  -6.397
  297   2HO*    U  28          2HO*        U  28 -12.777 -14.840  -7.229
  298    H1*    U  28           H1*        U  28 -11.628 -13.467  -6.252
  299    H3     U  28           H3         U  28  -7.151 -12.973  -5.396
  300    H5     U  28           H5         U  28  -8.976 -13.691  -1.682
  301    H6     U  28           H6         U  28 -10.987 -14.270  -2.871
  302   1H5*    G  29          1H5*        G  29 -11.114 -19.712  -7.179
  303   2H5*    G  29          2H5*        G  29 -10.490 -21.121  -6.301
  304    H4*    G  29           H4*        G  29  -8.968 -20.259  -8.055
  305    H3*    G  29           H3*        G  29  -7.956 -20.340  -5.215
  306    H2*    G  29           H2*        G  29  -5.879 -19.463  -5.996
  307   2HO*    G  29          2HO*        G  29  -5.227 -19.709  -8.098
  308    H1*    G  29           H1*        G  29  -7.061 -17.878  -8.109
  309    H8     G  29           H8         G  29  -8.689 -16.987  -4.919
  310    H1     G  29           H1         G  29  -2.902 -14.309  -5.616
  311   1H2     G  29          H21         G  29  -2.516 -16.531  -8.238
  312   2H2     G  29          H22         G  29  -1.824 -15.241  -7.281
  313   1H5*    C  30          1H5*        C  30  -4.796 -21.440  -7.453
  314   2H5*    C  30          2H5*        C  30  -4.317 -23.067  -6.933
  315    H4*    C  30           H4*        C  30  -2.360 -21.752  -6.978
  316    H3*    C  30           H3*        C  30  -3.309 -22.248  -4.164
  317    H2*    C  30           H2*        C  30  -1.407 -21.009  -3.371
  318   2HO*    C  30          2HO*        C  30   0.204 -20.320  -4.923
  319    H1*    C  30           H1*        C  30  -1.585 -18.983  -5.330
  320   1H4     C  30          H41         C  30  -5.942 -17.455  -0.607
  321   2H4     C  30          H42         C  30  -4.527 -16.457  -0.320
  322    H5     C  30           H5         C  30  -6.025 -19.151  -2.329
  323    H6     C  30           H6         C  30  -4.776 -20.237  -4.121
  324   1H5*    U  31          1H5*        U  31   1.051 -22.907  -4.520
  325   2H5*    U  31          2H5*        U  31   1.336 -24.421  -3.638
  326    H4*    U  31           H4*        U  31   2.884 -22.635  -2.989
  327    H3*    U  31           H3*        U  31   1.044 -23.722  -0.868
  328    H2*    U  31           H2*        U  31   2.089 -22.249   0.712
  329   2HO*    U  31          2HO*        U  31   3.996 -21.097   0.116
  330    H1*    U  31           H1*        U  31   2.272 -20.054  -1.076
  331    H3     U  31           H3         U  31  -0.671 -18.563   1.993
  332    H5     U  31           H5         U  31  -2.849 -21.376  -0.237
  333    H6     U  31           H6         U  31  -0.800 -21.965  -1.354
  334    H3T    U  31           H3T        U  31   2.544 -25.107  -1.587
  Start of MODEL   27
    1   1H5*    A   1          1H5*        A   1   0.039 -14.127   8.947
    2   2H5*    A   1          2H5*        A   1  -0.092 -12.840   7.734
    3    H4*    A   1           H4*        A   1   2.035 -14.131   7.686
    4    H3*    A   1           H3*        A   1   0.329 -13.817   5.247
    5    H2*    A   1           H2*        A   1   1.840 -15.222   3.991
    6   2HO*    A   1          2HO*        A   1   3.556 -14.429   5.930
    7    H1*    A   1           H1*        A   1   1.975 -17.234   5.869
    8    H8     A   1           H8         A   1  -1.403 -15.543   6.099
    9   1H6     A   1          H61         A   1  -3.312 -19.563   1.796
   10   2H6     A   1          H62         A   1  -3.813 -18.325   2.926
   11    H2     A   1           H2         A   1   1.137 -19.963   2.198
   12    H5T    A   1           H5T        A   1  -1.722 -13.836   6.879
   13   1H5*    G   2          1H5*        G   2   4.034 -12.616   3.482
   14   2H5*    G   2          2H5*        G   2   3.654 -11.194   2.494
   15    H4*    G   2           H4*        G   2   4.622 -13.108   1.233
   16    H3*    G   2           H3*        G   2   1.932 -12.015   0.432
   17    H2*    G   2           H2*        G   2   1.850 -13.635  -1.327
   18   2HO*    G   2          2HO*        G   2   4.054 -14.946  -1.371
   19    H1*    G   2           H1*        G   2   3.163 -15.705   0.157
   20    H8     G   2           H8         G   2   0.507 -14.488   2.358
   21    H1     G   2           H1         G   2  -1.776 -18.094  -2.429
   22   1H2     G   2          H21         G   2   1.356 -17.683  -3.844
   23   2H2     G   2          H22         G   2  -0.246 -18.380  -3.972
   24   1H5*    U   3          1H5*        U   3   4.171 -11.420  -3.329
   25   2H5*    U   3          2H5*        U   3   3.669  -9.810  -3.878
   26    H4*    U   3           H4*        U   3   3.267 -11.454  -5.597
   27    H3*    U   3           H3*        U   3   0.805 -10.222  -4.382
   28    H2*    U   3           H2*        U   3  -0.533 -11.545  -5.855
   29   2HO*    U   3          2HO*        U   3   0.215 -11.935  -7.801
   30    H1*    U   3           H1*        U   3   1.073 -13.874  -5.681
   31    H3     U   3           H3         U   3  -2.847 -15.123  -3.826
   32    H5     U   3           H5         U   3  -1.061 -12.663  -0.927
   33    H6     U   3           H6         U   3   0.637 -12.123  -2.545
   34   1H5*    A   4          1H5*        A   4   1.193  -9.758  -9.083
   35   2H5*    A   4          2H5*        A   4   0.825  -8.026  -9.190
   36    H4*    A   4           H4*        A   4  -0.180  -9.103 -11.043
   37    H3*    A   4           H3*        A   4  -2.131  -8.143  -8.986
   38    H2*    A   4           H2*        A   4  -3.959  -9.051 -10.303
   39   2HO*    A   4          2HO*        A   4  -3.676  -9.631 -12.368
   40    H1*    A   4           H1*        A   4  -2.862 -11.546 -10.511
   41    H8     A   4           H8         A   4  -1.198 -10.488  -7.458
   42   1H6     A   4          H61         A   4  -6.382 -11.626  -4.288
   43   2H6     A   4          H62         A   4  -4.668 -11.308  -4.172
   44    H2     A   4           H2         A   4  -7.399 -11.614  -8.663
   45   1H5*    G   5          1H5*        G   5  -3.671  -5.337 -11.973
   46   2H5*    G   5          2H5*        G   5  -3.877  -3.839 -11.045
   47    H4*    G   5           H4*        G   5  -5.983  -4.815 -11.919
   48    H3*    G   5           H3*        G   5  -5.709  -4.373  -8.953
   49    H2*    G   5           H2*        G   5  -7.973  -5.190  -8.708
   50   2HO*    G   5          2HO*        G   5  -9.302  -5.466 -10.460
   51    H1*    G   5           H1*        G   5  -7.615  -7.394 -10.387
   52    H8     G   5           H8         G   5  -4.375  -7.196  -8.684
   53    H1     G   5           H1         G   5  -9.067  -9.266  -4.821
   54   1H2     G   5          H21         G   5 -11.188  -8.156  -7.302
   55   2H2     G   5          H22         G   5 -11.016  -8.907  -5.731
   56   1H5*    A   6          1H5*        A   6  -9.296  -3.612  -9.951
   57   2H5*    A   6          2H5*        A   6  -9.874  -1.985  -9.550
   58    H4*    A   6           H4*        A   6 -11.405  -3.825  -8.891
   59    H3*    A   6           H3*        A   6 -11.065  -1.517  -7.523
   60    H2*    A   6           H2*        A   6  -9.411  -2.346  -5.958
   61   2HO*    A   6          2HO*        A   6 -11.936  -3.124  -4.862
   62    H1*    A   6           H1*        A   6 -11.061  -4.940  -5.794
   63    H8     A   6           H8         A   6  -7.365  -4.389  -6.664
   64   1H6     A   6          H61         A   6  -6.117  -7.192  -1.285
   65   2H6     A   6          H62         A   6  -5.440  -6.520  -2.756
   66    H2     A   6           H2         A   6 -10.571  -6.688  -1.592
   67   1H5*    A   7          1H5*        A   7 -13.809  -3.587  -4.428
   68   2H5*    A   7          2H5*        A   7 -15.025  -2.342  -4.087
   69    H4*    A   7           H4*        A   7 -14.269  -2.891  -1.986
   70    H3*    A   7           H3*        A   7 -12.754  -0.462  -2.900
   71    H2*    A   7           H2*        A   7 -11.362  -0.593  -0.994
   72   2HO*    A   7          2HO*        A   7 -13.140  -2.307   0.373
   73    H1*    A   7           H1*        A   7 -11.864  -3.468  -0.534
   74    H8     A   7           H8         A   7  -9.896  -2.305  -3.583
   75   1H6     A   7          H61         A   7  -4.834  -3.469  -0.214
   76   2H6     A   7          H62         A   7  -5.441  -3.041  -1.799
   77    H2     A   7           H2         A   7  -8.414  -3.877   2.462
   78   1H5*    A   8          1H5*        A   8 -14.733   2.999   0.180
   79   2H5*    A   8          2H5*        A   8 -13.033   3.503   0.233
   80    H4*    A   8           H4*        A   8 -14.588   2.129   2.205
   81    H3*    A   8           H3*        A   8 -11.857   3.372   2.158
   82    H2*    A   8           H2*        A   8 -11.273   2.139   4.138
   83   2HO*    A   8          2HO*        A   8 -12.810   1.670   5.528
   84    H1*    A   8           H1*        A   8 -12.423  -0.276   3.331
   85    H8     A   8           H8         A   8 -10.874   1.272   0.307
   86   1H6     A   8          H61         A   8  -5.500  -1.239   2.089
   87   2H6     A   8          H62         A   8  -6.346  -0.424   0.795
   88    H2     A   8           H2         A   8  -8.432  -1.678   5.463
   89   1H5*    C   9          1H5*        C   9 -12.416   3.792   6.268
   90   2H5*    C   9          2H5*        C   9 -12.303   5.548   6.500
   91    H4*    C   9           H4*        C   9 -10.750   4.533   7.964
   92    H3*    C   9           H3*        C   9  -9.509   5.966   5.651
   93    H2*    C   9           H2*        C   9  -7.316   5.243   6.324
   94   2HO*    C   9          2HO*        C   9  -6.924   4.441   8.339
   95    H1*    C   9           H1*        C   9  -7.998   2.601   6.851
   96   1H4     C   9          H41         C   9  -7.961   2.977   0.262
   97   2H4     C   9          H42         C   9  -6.403   2.314   0.729
   98    H5     C   9           H5         C   9  -9.600   3.753   1.874
   99    H6     C   9           H6         C   9 -10.076   4.038   4.245
  100   1H5*    A  10          1H5*        A  10  -6.819   7.012   8.508
  101   2H5*    A  10          2H5*        A  10  -6.403   8.720   8.261
  102    H4*    A  10           H4*        A  10  -4.526   7.076   7.986
  103    H3*    A  10           H3*        A  10  -5.190   9.036   5.799
  104    H2*    A  10           H2*        A  10  -3.352   8.148   4.532
  105   2HO*    A  10          2HO*        A  10  -2.124   7.951   6.687
  106    H1*    A  10           H1*        A  10  -3.828   5.445   5.261
  107    H8     A  10           H8         A  10  -7.181   6.525   4.416
  108   1H6     A  10          H61         A  10  -5.671   6.238  -1.583
  109   2H6     A  10          H62         A  10  -6.990   6.361  -0.441
  110    H2     A  10           H2         A  10  -1.887   6.067   0.815
  111   1H5*    A  11          1H5*        A  11  -2.078  12.725   5.353
  112   2H5*    A  11          2H5*        A  11  -1.706  11.244   4.450
  113    H4*    A  11           H4*        A  11   0.061  12.747   6.368
  114    H3*    A  11           H3*        A  11  -0.033  13.369   3.824
  115    H2*    A  11           H2*        A  11   0.083  11.191   2.823
  116   2HO*    A  11          2HO*        A  11   2.392  12.543   2.860
  117    H1*    A  11           H1*        A  11   2.243  10.187   4.690
  118    H8     A  11           H8         A  11  -1.181   9.008   5.427
  119   1H6     A  11          H61         A  11  -0.100   4.195   1.686
  120   2H6     A  11          H62         A  11  -1.176   4.856   2.897
  121    H2     A  11           H2         A  11   3.190   7.179   1.097
  122   1H5*    G  12          1H5*        G  12   4.547  13.004   3.513
  123   2H5*    G  12          2H5*        G  12   4.976  14.676   3.100
  124    H4*    G  12           H4*        G  12   6.070  13.283   1.548
  125    H3*    G  12           H3*        G  12   3.709  14.701   0.345
  126    H2*    G  12           H2*        G  12   4.195  13.623  -1.760
  127   2HO*    G  12          2HO*        G  12   6.547  12.663  -0.444
  128    H1*    G  12           H1*        G  12   4.606  11.094  -0.668
  129    H8     G  12           H8         G  12   1.878  13.094   1.080
  130    H1     G  12           H1         G  12  -0.083   9.527  -3.880
  131   1H2     G  12          H21         G  12   3.290   9.010  -4.457
  132   2H2     G  12          H22         G  12   1.641   8.698  -4.951
  133   1H5*    G  13          1H5*        G  13   6.678  14.541  -2.374
  134   2H5*    G  13          2H5*        G  13   7.132  16.176  -2.894
  135    H4*    G  13           H4*        G  13   6.940  14.909  -4.854
  136    H3*    G  13           H3*        G  13   4.525  16.667  -4.479
  137    H2*    G  13           H2*        G  13   3.687  15.816  -6.588
  138   2HO*    G  13          2HO*        G  13   5.372  15.498  -7.925
  139    H1*    G  13           H1*        G  13   4.190  13.154  -5.961
  140    H8     G  13           H8         G  13   3.247  15.006  -2.821
  141    H1     G  13           H1         G  13  -1.719  12.925  -6.313
  142   1H2     G  13          H21         G  13   0.649  12.240  -8.728
  143   2H2     G  13          H22         G  13  -1.037  12.215  -8.264
  144   1H5*    C  14          1H5*        C  14   5.637  18.561  -8.438
  145   2H5*    C  14          2H5*        C  14   5.228  20.238  -8.024
  146    H4*    C  14           H4*        C  14   3.957  19.291  -9.942
  147    H3*    C  14           H3*        C  14   2.391  20.295  -7.559
  148    H2*    C  14           H2*        C  14   0.410  19.880  -8.873
  149   2HO*    C  14          2HO*        C  14   0.936  20.515 -10.912
  150    H1*    C  14           H1*        C  14   1.356  17.397  -9.858
  151   1H4     C  14          H41         C  14  -1.190  16.197  -3.898
  152   2H4     C  14          H42         C  14  -2.580  16.295  -4.965
  153    H5     C  14           H5         C  14   1.052  16.720  -4.632
  154    H6     C  14           H6         C  14   2.420  17.441  -6.510
  155   1H5*    U  15          1H5*        U  15   0.142  22.987 -10.012
  156   2H5*    U  15          2H5*        U  15  -0.151  24.237  -8.788
  157    H4*    U  15           H4*        U  15  -2.093  22.722  -9.618
  158    H3*    U  15           H3*        U  15  -1.636  23.561  -6.768
  159    H2*    U  15           H2*        U  15  -3.616  22.291  -6.163
  160   2HO*    U  15          2HO*        U  15  -3.899  22.200  -8.976
  161    H1*    U  15           H1*        U  15  -2.786  20.012  -7.452
  162    H3     U  15           H3         U  15  -1.784  19.649  -2.976
  163    H5     U  15           H5         U  15   1.643  21.192  -4.851
  164    H6     U  15           H6         U  15   0.320  21.508  -6.837
  165   1H5*    U  16          1H5*        U  16  -5.128  27.549  -6.533
  166   2H5*    U  16          2H5*        U  16  -5.168  26.732  -4.959
  167    H4*    U  16           H4*        U  16  -7.402  27.136  -5.469
  168    H3*    U  16           H3*        U  16  -6.855  24.623  -4.966
  169    H2*    U  16           H2*        U  16  -6.173  23.949  -7.194
  170   2HO*    U  16          2HO*        U  16  -7.826  22.495  -6.697
  171    H1*    U  16           H1*        U  16  -8.607  25.347  -8.402
  172    H3     U  16           H3         U  16  -6.806  23.978 -12.334
  173    H5     U  16           H5         U  16  -3.838  26.394 -10.600
  174    H6     U  16           H6         U  16  -5.202  26.490  -8.608
  175   1H5*    C  17          1H5*        C  17  -9.671  22.210  -5.552
  176   2H5*    C  17          2H5*        C  17 -10.342  21.807  -3.960
  177    H4*    C  17           H4*        C  17  -9.024  20.025  -5.312
  178    H3*    C  17           H3*        C  17  -9.538  20.030  -2.628
  179    H2*    C  17           H2*        C  17  -7.511  21.208  -1.991
  180   2HO*    C  17          2HO*        C  17  -6.696  18.477  -2.259
  181    H1*    C  17           H1*        C  17  -6.065  19.485  -4.099
  182   1H4     C  17          H41         C  17  -1.965  24.528  -3.402
  183   2H4     C  17          H42         C  17  -1.278  23.314  -2.339
  184    H5     C  17           H5         C  17  -4.127  24.315  -4.437
  185    H6     C  17           H6         C  17  -6.055  22.855  -4.733
  186   1H5*    G  18          1H5*        G  18 -11.156  19.219  -3.780
  187   2H5*    G  18          2H5*        G  18 -12.377  18.475  -2.731
  188    H4*    G  18           H4*        G  18 -13.641  18.057  -4.483
  189    H3*    G  18           H3*        G  18 -11.364  16.322  -5.304
  190    H2*    G  18           H2*        G  18 -11.849  16.557  -7.585
  191   2HO*    G  18          2HO*        G  18 -13.751  15.690  -7.963
  192    H1*    G  18           H1*        G  18 -13.811  18.790  -7.131
  193    H8     G  18           H8         G  18 -13.556  19.639  -9.544
  194    H1     G  18           H1         G  18  -7.169  19.879  -8.911
  195   1H2     G  18          H21         G  18  -7.708  18.289  -5.896
  196   2H2     G  18          H22         G  18  -6.557  18.963  -7.026
  197   1H5*    G  19          1H5*        G  19 -10.050  13.130  -4.335
  198   2H5*    G  19          2H5*        G  19 -10.517  14.812  -4.624
  199    H4*    G  19           H4*        G  19 -11.218  13.231  -6.895
  200    H3*    G  19           H3*        G  19  -8.556  12.514  -5.831
  201    H2*    G  19           H2*        G  19  -7.420  13.055  -7.865
  202   2HO*    G  19          2HO*        G  19  -8.917  12.101  -9.289
  203    H1*    G  19           H1*        G  19  -8.751  15.396  -8.481
  204    H8     G  19           H8         G  19  -8.507  15.185  -4.744
  205    H1     G  19           H1         G  19  -3.268  17.577  -7.555
  206   1H2     G  19          H21         G  19  -4.691  16.481 -10.498
  207   2H2     G  19          H22         G  19  -3.333  17.271  -9.724
  208   1H5*    C  20          1H5*        C  20  -9.130  10.101  -9.267
  209   2H5*    C  20          2H5*        C  20  -8.789   8.387  -8.955
  210    H4*    C  20           H4*        C  20  -7.532   9.168 -10.856
  211    H3*    C  20           H3*        C  20  -6.003   8.313  -8.437
  212    H2*    C  20           H2*        C  20  -3.921   8.972  -9.460
  213   2HO*    C  20          2HO*        C  20  -3.756   9.334 -11.606
  214    H1*    C  20           H1*        C  20  -4.778  11.433 -10.345
  215   1H4     C  20          H41         C  20  -4.511  12.331  -3.846
  216   2H4     C  20          H42         C  20  -2.865  12.577  -4.375
  217    H5     C  20           H5         C  20  -6.261  11.570  -5.271
  218    H6     C  20           H6         C  20  -6.850  10.893  -7.511
  219   1H5*    C  21          1H5*        C  21  -3.513   7.128 -10.824
  220   2H5*    C  21          2H5*        C  21  -3.576   5.371 -11.069
  221    H4*    C  21           H4*        C  21  -1.324   5.762 -10.825
  222    H3*    C  21           H3*        C  21  -2.441   4.893  -8.180
  223    H2*    C  21           H2*        C  21  -0.280   5.198  -7.170
  224   2HO*    C  21          2HO*        C  21   1.162   4.458  -8.642
  225    H1*    C  21           H1*        C  21   0.282   7.637  -8.418
  226   1H4     C  21          H41         C  21  -3.893   9.350  -3.642
  227   2H4     C  21          H42         C  21  -2.345   9.168  -2.829
  228    H5     C  21           H5         C  21  -4.239   8.740  -5.967
  229    H6     C  21           H6         C  21  -3.168   7.838  -7.972
  230   1H5*    U  22          1H5*        U  22  -0.205   0.588  -6.710
  231   2H5*    U  22          2H5*        U  22  -1.081   1.793  -5.747
  232    H4*    U  22           H4*        U  22   1.852   1.352  -6.060
  233    H3*    U  22           H3*        U  22  -0.003   1.640  -3.725
  234    H2*    U  22           H2*        U  22   1.735   2.732  -2.463
  235   2HO*    U  22          2HO*        U  22   3.433   2.131  -4.685
  236    H1*    U  22           H1*        U  22   2.542   4.444  -4.490
  237    H3     U  22           H3         U  22   0.022   6.773  -1.433
  238    H5     U  22           H5         U  22  -2.645   5.398  -4.371
  239    H6     U  22           H6         U  22  -0.861   4.036  -5.242
  240   1H5*    G  23          1H5*        G  23   3.483   1.498  -1.576
  241   2H5*    G  23          2H5*        G  23   3.444  -0.206  -1.082
  242    H4*    G  23           H4*        G  23   4.016   1.280   0.764
  243    H3*    G  23           H3*        G  23   1.578  -0.430   0.949
  244    H2*    G  23           H2*        G  23   0.940   0.581   3.037
  245   2HO*    G  23          2HO*        G  23   2.597   2.421   3.631
  246    H1*    G  23           H1*        G  23   1.348   3.201   2.267
  247    H8     G  23           H8         G  23   0.319   1.773  -0.930
  248    H1     G  23           H1         G  23  -4.605   2.293   3.145
  249   1H2     G  23          H21         G  23  -2.176   2.797   5.557
  250   2H2     G  23          H22         G  23  -3.880   2.668   5.178
  251   1H5*    C  24          1H5*        C  24   1.369  -3.659   4.234
  252   2H5*    C  24          2H5*        C  24  -0.014  -2.597   3.907
  253    H4*    C  24           H4*        C  24   1.826  -2.485   6.294
  254    H3*    C  24           H3*        C  24  -0.951  -3.582   5.986
  255    H2*    C  24           H2*        C  24  -1.501  -2.717   8.170
  256   2HO*    C  24          2HO*        C  24   0.040  -2.378   9.613
  257    H1*    C  24           H1*        C  24  -0.368  -0.211   7.752
  258   1H4     C  24          H41         C  24  -5.897   0.044   4.205
  259   2H4     C  24          H42         C  24  -6.462   0.126   5.867
  260    H5     C  24           H5         C  24  -3.591  -0.384   3.624
  261    H6     C  24           H6         C  24  -1.361  -0.826   4.506
  262   1H5*    U  25          1H5*        U  25  -1.979  -4.866   8.811
  263   2H5*    U  25          2H5*        U  25  -2.077  -6.630   8.655
  264    H4*    U  25           H4*        U  25  -4.265  -5.693   9.032
  265    H3*    U  25           H3*        U  25  -3.821  -6.953   6.340
  266    H2*    U  25           H2*        U  25  -6.118  -6.441   5.787
  267   2HO*    U  25          2HO*        U  25  -7.581  -5.970   7.318
  268    H1*    U  25           H1*        U  25  -6.013  -3.819   6.688
  269    H3     U  25           H3         U  25  -5.784  -3.294   2.213
  270    H5     U  25           H5         U  25  -1.939  -4.594   3.291
  271    H6     U  25           H6         U  25  -2.770  -4.964   5.518
  272   1H5*    U  26          1H5*        U  26  -7.408  -7.835   7.532
  273   2H5*    U  26          2H5*        U  26  -7.682  -9.574   7.747
  274    H4*    U  26           H4*        U  26  -9.564  -8.903   6.607
  275    H3*    U  26           H3*        U  26  -7.615  -9.908   4.533
  276    H2*    U  26           H2*        U  26  -9.332  -9.483   2.891
  277   2HO*    U  26          2HO*        U  26 -11.426  -9.241   3.454
  278    H1*    U  26           H1*        U  26 -10.052  -6.988   3.978
  279    H3     U  26           H3         U  26  -8.044  -5.907   0.080
  280    H5     U  26           H5         U  26  -4.872  -6.950   2.629
  281    H6     U  26           H6         U  26  -6.507  -7.674   4.240
  282   1H5*    U  27          1H5*        U  27 -11.455 -11.480   4.130
  283   2H5*    U  27          2H5*        U  27 -11.488 -13.176   3.609
  284    H4*    U  27           H4*        U  27 -12.913 -11.697   2.252
  285    H3*    U  27           H3*        U  27 -10.675 -13.155   0.854
  286    H2*    U  27           H2*        U  27 -11.533 -12.236  -1.217
  287   2HO*    U  27          2HO*        U  27 -13.625 -11.847  -1.279
  288    H1*    U  27           H1*        U  27 -11.731  -9.645  -0.209
  289    H3     U  27           H3         U  27  -8.077  -9.927  -2.943
  290    H5     U  27           H5         U  27  -6.734 -10.987   0.894
  291    H6     U  27           H6         U  27  -9.034 -11.091   1.579
  292   1H5*    U  28          1H5*        U  28 -14.316 -14.514  -1.378
  293   2H5*    U  28          2H5*        U  28 -14.003 -16.246  -1.608
  294    H4*    U  28           H4*        U  28 -14.544 -15.112  -3.701
  295    H3*    U  28           H3*        U  28 -11.791 -16.317  -3.483
  296    H2*    U  28           H2*        U  28 -11.431 -15.655  -5.787
  297   2HO*    U  28          2HO*        U  28 -14.133 -15.693  -5.813
  298    H1*    U  28           H1*        U  28 -12.342 -13.059  -5.394
  299    H3     U  28           H3         U  28  -7.800 -12.765  -5.482
  300    H5     U  28           H5         U  28  -8.748 -13.917  -1.554
  301    H6     U  28           H6         U  28 -11.023 -14.225  -2.273
  302   1H5*    G  29          1H5*        G  29 -12.721 -19.357  -6.313
  303   2H5*    G  29          2H5*        G  29 -12.131 -20.843  -5.543
  304    H4*    G  29           H4*        G  29 -10.884 -20.253  -7.576
  305    H3*    G  29           H3*        G  29  -9.344 -20.329  -4.985
  306    H2*    G  29           H2*        G  29  -7.378 -19.742  -6.195
  307   2HO*    G  29          2HO*        G  29  -8.524 -21.284  -8.033
  308    H1*    G  29           H1*        G  29  -8.781 -18.178  -8.198
  309    H8     G  29           H8         G  29  -9.543 -16.889  -4.810
  310    H1     G  29           H1         G  29  -3.832 -14.978  -7.016
  311   1H2     G  29          H21         G  29  -4.307 -17.373  -9.465
  312   2H2     G  29          H22         G  29  -3.278 -16.124  -8.794
  313   1H5*    C  30          1H5*        C  30  -6.988 -22.397  -8.032
  314   2H5*    C  30          2H5*        C  30  -6.501 -23.898  -7.221
  315    H4*    C  30           H4*        C  30  -4.612 -22.745  -8.243
  316    H3*    C  30           H3*        C  30  -4.587 -23.102  -5.260
  317    H2*    C  30           H2*        C  30  -2.457 -21.983  -5.177
  318   2HO*    C  30          2HO*        C  30  -2.459 -21.766  -8.007
  319    H1*    C  30           H1*        C  30  -3.150 -19.937  -6.960
  320   1H4     C  30          H41         C  30  -5.986 -18.303  -1.231
  321   2H4     C  30          H42         C  30  -4.478 -17.410  -1.295
  322    H5     C  30           H5         C  30  -6.625 -19.932  -2.891
  323    H6     C  30           H6         C  30  -5.959 -21.042  -4.958
  324   1H5*    U  31          1H5*        U  31  -0.815 -23.537  -6.184
  325   2H5*    U  31          2H5*        U  31  -0.356 -25.230  -5.914
  326    H4*    U  31           H4*        U  31   1.365 -24.051  -4.929
  327    H3*    U  31           H3*        U  31  -0.600 -24.853  -2.800
  328    H2*    U  31           H2*        U  31   0.771 -23.746  -1.166
  329   2HO*    U  31          2HO*        U  31   2.868 -23.338  -1.528
  330    H1*    U  31           H1*        U  31   1.289 -21.478  -2.746
  331    H3     U  31           H3         U  31  -1.472 -19.710   0.319
  332    H5     U  31           H5         U  31  -3.982 -22.181  -1.970
  333    H6     U  31           H6         U  31  -2.022 -22.973  -3.122
  334    H3T    U  31           H3T        U  31   1.081 -26.146  -4.091
  Start of MODEL   28
    1   1H5*    A   1          1H5*        A   1   2.486 -16.057   7.931
    2   2H5*    A   1          2H5*        A   1   1.818 -14.732   6.960
    3    H4*    A   1           H4*        A   1   4.131 -15.603   6.360
    4    H3*    A   1           H3*        A   1   1.948 -15.072   4.386
    5    H2*    A   1           H2*        A   1   3.320 -15.944   2.598
    6   2HO*    A   1          2HO*        A   1   5.425 -15.748   2.815
    7    H1*    A   1           H1*        A   1   4.054 -18.253   3.903
    8    H8     A   1           H8         A   1   0.680 -17.412   5.271
    9   1H6     A   1          H61         A   1  -1.742 -20.235   0.325
   10   2H6     A   1          H62         A   1  -2.085 -19.537   1.892
   11    H2     A   1           H2         A   1   2.669 -19.782  -0.353
   12    H5T    A   1           H5T        A   1   0.198 -16.023   6.668
   13   1H5*    G   2          1H5*        G   2   5.120 -13.912   2.432
   14   2H5*    G   2          2H5*        G   2   4.914 -12.385   1.551
   15    H4*    G   2           H4*        G   2   5.460 -14.298   0.097
   16    H3*    G   2           H3*        G   2   2.875 -12.828  -0.361
   17    H2*    G   2           H2*        G   2   2.419 -14.304  -2.202
   18   2HO*    G   2          2HO*        G   2   4.845 -15.683  -1.908
   19    H1*    G   2           H1*        G   2   3.330 -16.637  -0.914
   20    H8     G   2           H8         G   2   1.448 -15.107   1.779
   21    H1     G   2           H1         G   2  -2.415 -17.252  -2.868
   22   1H2     G   2          H21         G   2   0.469 -17.440  -4.771
   23   2H2     G   2          H22         G   2  -1.262 -17.680  -4.686
   24   1H5*    U   3          1H5*        U   3   4.945 -12.010  -4.305
   25   2H5*    U   3          2H5*        U   3   4.368 -10.387  -4.731
   26    H4*    U   3           H4*        U   3   3.840 -12.045  -6.445
   27    H3*    U   3           H3*        U   3   1.529 -10.690  -5.076
   28    H2*    U   3           H2*        U   3   0.039 -11.941  -6.512
   29   2HO*    U   3          2HO*        U   3   1.466 -11.806  -8.387
   30    H1*    U   3           H1*        U   3   1.324 -14.377  -6.124
   31    H3     U   3           H3         U   3  -2.401 -14.733  -3.578
   32    H5     U   3           H5         U   3   0.198 -12.343  -1.306
   33    H6     U   3           H6         U   3   1.676 -12.278  -3.203
   34   1H5*    A   4          1H5*        A   4   1.241  -9.494  -9.537
   35   2H5*    A   4          2H5*        A   4   0.497  -7.885  -9.491
   36    H4*    A   4           H4*        A   4  -0.640  -9.534 -10.967
   37    H3*    A   4           H3*        A   4  -2.181  -8.144  -8.795
   38    H2*    A   4           H2*        A   4  -4.164  -9.364  -9.496
   39   2HO*    A   4          2HO*        A   4  -4.247 -10.364 -11.410
   40    H1*    A   4           H1*        A   4  -2.930 -11.817  -9.431
   41    H8     A   4           H8         A   4  -0.953 -10.115  -6.859
   42   1H6     A   4          H61         A   4  -5.703 -10.789  -2.941
   43   2H6     A   4          H62         A   4  -4.005 -10.389  -3.079
   44    H2     A   4           H2         A   4  -7.178 -11.656  -7.084
   45   1H5*    G   5          1H5*        G   5  -4.468  -6.141 -11.927
   46   2H5*    G   5          2H5*        G   5  -4.563  -4.462 -11.365
   47    H4*    G   5           H4*        G   5  -6.744  -5.628 -11.528
   48    H3*    G   5           H3*        G   5  -5.920  -4.482  -8.863
   49    H2*    G   5           H2*        G   5  -8.075  -5.183  -8.016
   50   2HO*    G   5          2HO*        G   5  -9.242  -6.447  -9.971
   51    H1*    G   5           H1*        G   5  -7.985  -7.718  -9.223
   52    H8     G   5           H8         G   5  -4.530  -7.322  -8.123
   53    H1     G   5           H1         G   5  -8.557  -8.227  -3.207
   54   1H2     G   5          H21         G   5 -11.039  -7.531  -5.502
   55   2H2     G   5          H22         G   5 -10.625  -7.944  -3.853
   56   1H5*    A   6          1H5*        A   6  -9.584  -3.848  -9.824
   57   2H5*    A   6          2H5*        A   6 -10.281  -2.224  -9.677
   58    H4*    A   6           H4*        A   6 -11.639  -4.059  -8.674
   59    H3*    A   6           H3*        A   6 -11.478  -1.519  -7.716
   60    H2*    A   6           H2*        A   6  -9.784  -1.939  -6.040
   61   2HO*    A   6          2HO*        A   6 -11.575  -3.000  -4.304
   62    H1*    A   6           H1*        A   6 -11.178  -4.630  -5.483
   63    H8     A   6           H8         A   6  -7.544  -3.788  -6.417
   64   1H6     A   6          H61         A   6  -6.089  -5.680  -0.709
   65   2H6     A   6          H62         A   6  -5.463  -5.142  -2.255
   66    H2     A   6           H2         A   6 -10.561  -5.752  -1.097
   67   1H5*    A   7          1H5*        A   7 -14.267  -3.397  -4.431
   68   2H5*    A   7          2H5*        A   7 -15.453  -2.116  -4.116
   69    H4*    A   7           H4*        A   7 -14.618  -2.641  -2.017
   70    H3*    A   7           H3*        A   7 -13.187  -0.184  -3.016
   71    H2*    A   7           H2*        A   7 -11.825  -0.224  -1.077
   72   2HO*    A   7          2HO*        A   7 -14.103  -1.513   0.000
   73    H1*    A   7           H1*        A   7 -12.199  -3.116  -0.621
   74    H8     A   7           H8         A   7 -10.241  -1.818  -3.653
   75   1H6     A   7          H61         A   7  -5.200  -2.856  -0.209
   76   2H6     A   7          H62         A   7  -5.785  -2.416  -1.798
   77    H2     A   7           H2         A   7  -8.807  -3.484   2.377
   78   1H5*    A   8          1H5*        A   8 -14.667   3.412  -0.117
   79   2H5*    A   8          2H5*        A   8 -12.939   3.763  -0.309
   80    H4*    A   8           H4*        A   8 -14.342   2.095   1.679
   81    H3*    A   8           H3*        A   8 -11.886   3.837   1.714
   82    H2*    A   8           H2*        A   8 -11.068   2.566   3.573
   83   2HO*    A   8          2HO*        A   8 -12.506   1.884   4.977
   84    H1*    A   8           H1*        A   8 -12.021   0.060   2.628
   85    H8     A   8           H8         A   8 -10.407   1.408  -0.329
   86   1H6     A   8          H61         A   8  -4.893   0.041   2.130
   87   2H6     A   8          H62         A   8  -5.740   0.502   0.671
   88    H2     A   8           H2         A   8  -7.978  -0.270   5.373
   89   1H5*    C   9          1H5*        C   9 -12.437   4.446   5.370
   90   2H5*    C   9          2H5*        C   9 -12.816   6.134   5.765
   91    H4*    C   9           H4*        C   9 -10.952   5.794   7.035
   92    H3*    C   9           H3*        C   9 -10.046   6.970   4.427
   93    H2*    C   9           H2*        C   9  -7.756   6.752   5.127
   94   2HO*    C   9          2HO*        C   9  -8.630   7.242   7.460
   95    H1*    C   9           H1*        C   9  -8.023   4.186   6.216
   96   1H4     C   9          H41         C   9  -7.716   3.223  -0.304
   97   2H4     C   9          H42         C   9  -6.079   3.017   0.303
   98    H5     C   9           H5         C   9  -9.561   3.956   1.107
   99    H6     C   9           H6         C   9 -10.191   4.631   3.364
  100   1H5*    A  10          1H5*        A  10  -7.835  10.113   7.194
  101   2H5*    A  10          2H5*        A  10  -7.591  11.265   5.866
  102    H4*    A  10           H4*        A  10  -5.659   9.706   7.067
  103    H3*    A  10           H3*        A  10  -5.674  11.295   4.523
  104    H2*    A  10           H2*        A  10  -3.599  10.278   3.873
  105   2HO*    A  10          2HO*        A  10  -2.555   8.833   5.449
  106    H1*    A  10           H1*        A  10  -4.264   7.680   4.702
  107    H8     A  10           H8         A  10  -7.421   8.606   3.205
  108   1H6     A  10          H61         A  10  -4.869   7.950  -2.400
  109   2H6     A  10          H62         A  10  -6.371   8.116  -1.519
  110    H2     A  10           H2         A  10  -1.568   8.043   0.631
  111   1H5*    A  11          1H5*        A  11  -2.441  14.323   3.874
  112   2H5*    A  11          2H5*        A  11  -1.899  12.633   3.884
  113    H4*    A  11           H4*        A  11  -0.633  14.867   5.468
  114    H3*    A  11           H3*        A  11  -0.281  14.919   2.871
  115    H2*    A  11           H2*        A  11   0.183  12.615   2.410
  116   2HO*    A  11          2HO*        A  11   2.649  12.422   2.799
  117    H1*    A  11           H1*        A  11   1.968  12.207   4.810
  118    H8     A  11           H8         A  11  -1.303  10.835   5.502
  119   1H6     A  11          H61         A  11   0.288   5.670   2.491
  120   2H6     A  11          H62         A  11  -0.869   6.400   3.577
  121    H2     A  11           H2         A  11   3.315   8.842   1.512
  122   1H5*    G  12          1H5*        G  12   4.248  14.622   3.143
  123   2H5*    G  12          2H5*        G  12   4.643  16.296   2.708
  124    H4*    G  12           H4*        G  12   6.022  15.113   1.319
  125    H3*    G  12           H3*        G  12   3.525  15.793  -0.195
  126    H2*    G  12           H2*        G  12   4.354  14.566  -2.093
  127   2HO*    G  12          2HO*        G  12   6.772  14.470  -0.582
  128    H1*    G  12           H1*        G  12   5.223  12.362  -0.676
  129    H8     G  12           H8         G  12   2.051  13.980   0.706
  130    H1     G  12           H1         G  12   1.126   9.334  -3.620
  131   1H2     G  12          H21         G  12   4.557   9.448  -4.037
  132   2H2     G  12          H22         G  12   3.036   8.721  -4.502
  133   1H5*    G  13          1H5*        G  13   6.839  15.995  -2.919
  134   2H5*    G  13          2H5*        G  13   6.686  17.576  -3.710
  135    H4*    G  13           H4*        G  13   6.961  15.900  -5.384
  136    H3*    G  13           H3*        G  13   4.235  17.144  -5.284
  137    H2*    G  13           H2*        G  13   3.536  15.710  -7.104
  138   2HO*    G  13          2HO*        G  13   6.322  15.280  -7.275
  139    H1*    G  13           H1*        G  13   4.551  13.386  -6.002
  140    H8     G  13           H8         G  13   3.417  15.817  -3.318
  141    H1     G  13           H1         G  13  -1.120  11.838  -5.485
  142   1H2     G  13          H21         G  13   1.214  10.957  -7.876
  143   2H2     G  13          H22         G  13  -0.395  10.725  -7.228
  144   1H5*    C  14          1H5*        C  14   4.581  18.123  -9.677
  145   2H5*    C  14          2H5*        C  14   4.222  19.850  -9.485
  146    H4*    C  14           H4*        C  14   2.670  18.812 -11.020
  147    H3*    C  14           H3*        C  14   1.413  19.714  -8.426
  148    H2*    C  14           H2*        C  14  -0.706  19.096  -9.405
  149   2HO*    C  14          2HO*        C  14  -0.915  18.715 -11.574
  150    H1*    C  14           H1*        C  14   0.289  16.686 -10.507
  151   1H4     C  14          H41         C  14  -1.090  15.414  -4.188
  152   2H4     C  14          H42         C  14  -2.625  15.275  -5.031
  153    H5     C  14           H5         C  14   0.919  16.207  -5.277
  154    H6     C  14           H6         C  14   1.879  16.977  -7.380
  155   1H5*    U  15          1H5*        U  15  -1.490  21.835 -10.975
  156   2H5*    U  15          2H5*        U  15  -1.634  23.310 -10.001
  157    H4*    U  15           H4*        U  15  -3.746  22.035 -10.272
  158    H3*    U  15           H3*        U  15  -2.702  22.636  -7.520
  159    H2*    U  15           H2*        U  15  -4.638  21.510  -6.600
  160   2HO*    U  15          2HO*        U  15  -5.473  21.582  -9.315
  161    H1*    U  15           H1*        U  15  -4.357  19.263  -8.164
  162    H3     U  15           H3         U  15  -2.522  18.060  -4.183
  163    H5     U  15           H5         U  15   0.505  20.183  -6.163
  164    H6     U  15           H6         U  15  -1.111  20.775  -7.844
  165   1H5*    U  16          1H5*        U  16  -6.597  26.276  -6.504
  166   2H5*    U  16          2H5*        U  16  -6.183  25.449  -4.990
  167    H4*    U  16           H4*        U  16  -8.530  25.496  -5.112
  168    H3*    U  16           H3*        U  16  -7.454  23.152  -4.623
  169    H2*    U  16           H2*        U  16  -7.062  22.454  -6.912
  170   2HO*    U  16          2HO*        U  16  -8.261  20.748  -6.184
  171    H1*    U  16           H1*        U  16  -9.880  23.340  -7.699
  172    H3     U  16           H3         U  16  -8.592  21.879 -11.777
  173    H5     U  16           H5         U  16  -5.934  25.007 -10.888
  174    H6     U  16           H6         U  16  -6.856  25.060  -8.667
  175   1H5*    C  17          1H5*        C  17  -9.850  20.226  -4.752
  176   2H5*    C  17          2H5*        C  17 -10.307  19.869  -3.074
  177    H4*    C  17           H4*        C  17  -8.975  18.112  -4.366
  178    H3*    C  17           H3*        C  17  -9.040  18.416  -1.665
  179    H2*    C  17           H2*        C  17  -7.126  19.912  -1.540
  180   2HO*    C  17          2HO*        C  17  -6.438  18.293  -0.210
  181    H1*    C  17           H1*        C  17  -5.803  18.058  -3.614
  182   1H4     C  17          H41         C  17  -2.401  23.645  -4.181
  183   2H4     C  17          H42         C  17  -1.331  22.591  -3.266
  184    H5     C  17           H5         C  17  -4.683  23.096  -4.690
  185    H6     C  17           H6         C  17  -6.405  21.383  -4.513
  186   1H5*    G  18          1H5*        G  18 -10.749  17.339  -2.484
  187   2H5*    G  18          2H5*        G  18 -11.656  16.567  -1.171
  188    H4*    G  18           H4*        G  18 -13.149  15.843  -2.619
  189    H3*    G  18           H3*        G  18 -10.858  14.282  -3.711
  190    H2*    G  18           H2*        G  18 -11.726  14.257  -5.876
  191   2HO*    G  18          2HO*        G  18 -13.526  13.121  -5.819
  192    H1*    G  18           H1*        G  18 -13.860  16.287  -5.258
  193    H8     G  18           H8         G  18 -14.123  16.940  -7.719
  194    H1     G  18           H1         G  18  -7.800  17.932  -8.254
  195   1H2     G  18          H21         G  18  -7.618  16.566  -5.097
  196   2H2     G  18          H22         G  18  -6.769  17.262  -6.459
  197   1H5*    G  19          1H5*        G  19  -9.144  11.208  -2.526
  198   2H5*    G  19          2H5*        G  19  -9.742  12.809  -3.000
  199    H4*    G  19           H4*        G  19 -10.587  10.780  -4.865
  200    H3*    G  19           H3*        G  19  -7.736  10.601  -4.126
  201    H2*    G  19           H2*        G  19  -6.943  10.974  -6.349
  202   2HO*    G  19          2HO*        G  19  -8.270  10.717  -8.121
  203    H1*    G  19           H1*        G  19  -8.675  12.979  -7.104
  204    H8     G  19           H8         G  19  -7.836  13.193  -3.405
  205    H1     G  19           H1         G  19  -3.796  16.332  -7.263
  206   1H2     G  19          H21         G  19  -5.449  14.738  -9.830
  207   2H2     G  19          H22         G  19  -4.170  15.840  -9.343
  208   1H5*    C  20          1H5*        C  20  -8.358   7.549  -7.074
  209   2H5*    C  20          2H5*        C  20  -7.578   6.021  -6.621
  210    H4*    C  20           H4*        C  20  -6.835   6.799  -8.799
  211    H3*    C  20           H3*        C  20  -4.819   6.541  -6.608
  212    H2*    C  20           H2*        C  20  -3.097   7.459  -8.026
  213   2HO*    C  20          2HO*        C  20  -3.402   6.735 -10.043
  214    H1*    C  20           H1*        C  20  -4.573   9.580  -8.976
  215   1H4     C  20          H41         C  20  -3.469  11.312  -2.734
  216   2H4     C  20          H42         C  20  -2.055  11.866  -3.596
  217    H5     C  20           H5         C  20  -5.189  10.000  -3.726
  218    H6     C  20           H6         C  20  -5.976   8.953  -5.750
  219   1H5*    C  21          1H5*        C  21  -2.462   5.062  -9.629
  220   2H5*    C  21          2H5*        C  21  -2.216   3.349  -9.234
  221    H4*    C  21           H4*        C  21  -0.099   4.286  -9.722
  222    H3*    C  21           H3*        C  21  -0.540   3.626  -6.841
  223    H2*    C  21           H2*        C  21   1.573   4.584  -6.237
  224   2HO*    C  21          2HO*        C  21   2.267   5.237  -8.869
  225    H1*    C  21           H1*        C  21   1.412   6.833  -7.885
  226   1H4     C  21          H41         C  21  -2.462   8.346  -2.771
  227   2H4     C  21          H42         C  21  -0.830   8.618  -2.179
  228    H5     C  21           H5         C  21  -2.922   7.343  -4.929
  229    H6     C  21           H6         C  21  -1.910   6.394  -6.945
  230   1H5*    U  22          1H5*        U  22   1.454   1.312  -4.267
  231   2H5*    U  22          2H5*        U  22   1.014   2.972  -4.709
  232    H4*    U  22           H4*        U  22   3.898   2.262  -4.665
  233    H3*    U  22           H3*        U  22   2.247   2.364  -2.160
  234    H2*    U  22           H2*        U  22   3.979   3.657  -1.095
  235   2HO*    U  22          2HO*        U  22   5.820   2.653  -1.906
  236    H1*    U  22           H1*        U  22   4.365   5.402  -3.229
  237    H3     U  22           H3         U  22   2.092   7.939  -0.291
  238    H5     U  22           H5         U  22  -0.838   5.466  -1.998
  239    H6     U  22           H6         U  22   0.929   4.254  -3.088
  240   1H5*    G  23          1H5*        G  23   4.692   1.701  -0.029
  241   2H5*    G  23          2H5*        G  23   4.361   0.426   1.159
  242    H4*    G  23           H4*        G  23   4.368   2.799   2.014
  243    H3*    G  23           H3*        G  23   2.094   0.909   2.541
  244    H2*    G  23           H2*        G  23   0.956   2.650   3.748
  245   2HO*    G  23          2HO*        G  23   3.369   3.417   4.341
  246    H1*    G  23           H1*        G  23   1.543   4.691   1.913
  247    H8     G  23           H8         G  23   0.846   2.031  -0.413
  248    H1     G  23           H1         G  23  -4.486   3.877   2.636
  249   1H2     G  23          H21         G  23  -2.337   5.438   4.846
  250   2H2     G  23          H22         G  23  -3.989   5.067   4.400
  251   1H5*    C  24          1H5*        C  24   1.702  -2.425   4.681
  252   2H5*    C  24          2H5*        C  24   0.169  -1.697   4.162
  253    H4*    C  24           H4*        C  24   1.623  -1.454   6.757
  254    H3*    C  24           H3*        C  24  -1.167  -2.194   5.958
  255    H2*    C  24           H2*        C  24  -2.032  -1.165   7.955
  256   2HO*    C  24          2HO*        C  24   0.721  -0.876   8.681
  257    H1*    C  24           H1*        C  24  -0.543   1.165   7.759
  258   1H4     C  24          H41         C  24  -5.023   1.925   3.007
  259   2H4     C  24          H42         C  24  -5.914   2.226   4.489
  260    H5     C  24           H5         C  24  -2.745   1.109   2.990
  261    H6     C  24           H6         C  24  -0.861   0.427   4.379
  262   1H5*    U  25          1H5*        U  25  -2.522  -3.383   8.455
  263   2H5*    U  25          2H5*        U  25  -2.306  -5.118   8.753
  264    H4*    U  25           H4*        U  25  -4.584  -4.825   8.949
  265    H3*    U  25           H3*        U  25  -3.921  -5.892   6.233
  266    H2*    U  25           H2*        U  25  -6.225  -5.727   5.578
  267   2HO*    U  25          2HO*        U  25  -7.834  -5.551   7.035
  268    H1*    U  25           H1*        U  25  -6.673  -3.201   6.607
  269    H3     U  25           H3         U  25  -6.354  -2.308   2.218
  270    H5     U  25           H5         U  25  -2.393  -3.107   3.364
  271    H6     U  25           H6         U  25  -3.228  -3.733   5.534
  272   1H5*    U  26          1H5*        U  26  -7.403  -7.970   8.209
  273   2H5*    U  26          2H5*        U  26  -7.346  -9.669   7.700
  274    H4*    U  26           H4*        U  26  -9.562  -8.588   7.436
  275    H3*    U  26           H3*        U  26  -8.198  -9.853   5.083
  276    H2*    U  26           H2*        U  26 -10.034  -9.189   3.673
  277   2HO*    U  26          2HO*        U  26 -11.608  -7.805   5.300
  278    H1*    U  26           H1*        U  26 -10.229  -6.593   4.653
  279    H3     U  26           H3         U  26  -8.273  -6.217   0.566
  280    H5     U  26           H5         U  26  -5.146  -7.177   3.203
  281    H6     U  26           H6         U  26  -6.805  -7.561   4.904
  282   1H5*    U  27          1H5*        U  27 -12.032 -10.637   4.608
  283   2H5*    U  27          2H5*        U  27 -12.342 -12.304   4.085
  284    H4*    U  27           H4*        U  27 -13.219 -10.692   2.497
  285    H3*    U  27           H3*        U  27 -11.059 -12.544   1.571
  286    H2*    U  27           H2*        U  27 -11.017 -11.465  -0.579
  287   2HO*    U  27          2HO*        U  27 -12.911 -10.769  -1.252
  288    H1*    U  27           H1*        U  27 -11.058  -8.859   0.376
  289    H3     U  27           H3         U  27  -6.725  -9.362  -0.803
  290    H5     U  27           H5         U  27  -7.046 -11.409   2.840
  291    H6     U  27           H6         U  27  -9.428 -11.160   2.691
  292   1H5*    U  28          1H5*        U  28 -14.577 -13.472  -1.281
  293   2H5*    U  28          2H5*        U  28 -14.312 -15.173  -1.712
  294    H4*    U  28           H4*        U  28 -14.435 -13.649  -3.653
  295    H3*    U  28           H3*        U  28 -11.912 -15.248  -3.249
  296    H2*    U  28           H2*        U  28 -11.112 -14.320  -5.332
  297   2HO*    U  28          2HO*        U  28 -13.512 -12.851  -5.637
  298    H1*    U  28           H1*        U  28 -11.896 -11.702  -4.716
  299    H3     U  28           H3         U  28  -7.395 -11.636  -4.314
  300    H5     U  28           H5         U  28  -8.736 -13.469  -0.783
  301    H6     U  28           H6         U  28 -10.946 -13.510  -1.737
  302   1H5*    G  29          1H5*        G  29 -12.921 -17.724  -6.658
  303   2H5*    G  29          2H5*        G  29 -12.625 -19.372  -6.072
  304    H4*    G  29           H4*        G  29 -11.129 -18.690  -7.911
  305    H3*    G  29           H3*        G  29  -9.882 -19.443  -5.272
  306    H2*    G  29           H2*        G  29  -7.737 -19.013  -6.213
  307   2HO*    G  29          2HO*        G  29  -7.558 -18.789  -8.552
  308    H1*    G  29           H1*        G  29  -8.647 -16.910  -7.978
  309    H8     G  29           H8         G  29  -9.616 -16.100  -4.500
  310    H1     G  29           H1         G  29  -3.450 -14.856  -5.758
  311   1H2     G  29          H21         G  29  -3.972 -16.704  -8.636
  312   2H2     G  29          H22         G  29  -2.857 -15.775  -7.659
  313   1H5*    C  30          1H5*        C  30  -8.012 -21.252  -8.416
  314   2H5*    C  30          2H5*        C  30  -7.637 -22.967  -8.158
  315    H4*    C  30           H4*        C  30  -5.670 -21.853  -8.917
  316    H3*    C  30           H3*        C  30  -5.557 -22.692  -6.030
  317    H2*    C  30           H2*        C  30  -3.332 -21.790  -5.905
  318   2HO*    C  30          2HO*        C  30  -3.297 -22.460  -8.469
  319    H1*    C  30           H1*        C  30  -3.895 -19.477  -7.425
  320   1H4     C  30          H41         C  30  -5.895 -18.235  -1.253
  321   2H4     C  30          H42         C  30  -4.371 -17.392  -1.468
  322    H5     C  30           H5         C  30  -6.841 -19.684  -2.942
  323    H6     C  30           H6         C  30  -6.530 -20.616  -5.171
  324   1H5*    U  31          1H5*        U  31  -2.063 -23.994  -8.005
  325   2H5*    U  31          2H5*        U  31  -1.813 -25.726  -7.711
  326    H4*    U  31           H4*        U  31   0.259 -24.606  -7.390
  327    H3*    U  31           H3*        U  31  -0.992 -25.567  -4.830
  328    H2*    U  31           H2*        U  31   0.902 -24.702  -3.632
  329   2HO*    U  31          2HO*        U  31   2.020 -24.537  -6.244
  330    H1*    U  31           H1*        U  31   1.070 -22.307  -5.109
  331    H3     U  31           H3         U  31  -0.291 -20.929  -1.030
  332    H5     U  31           H5         U  31  -3.733 -22.585  -2.776
  333    H6     U  31           H6         U  31  -2.349 -23.363  -4.584
  334    H3T    U  31           H3T        U  31   1.171 -26.377  -6.434
  Start of MODEL   29
    1   1H5*    A   1          1H5*        A   1   0.601 -12.340   6.906
    2   2H5*    A   1          2H5*        A   1  -0.375 -13.779   7.249
    3    H4*    A   1           H4*        A   1   2.614 -13.878   7.383
    4    H3*    A   1           H3*        A   1   1.001 -13.874   4.854
    5    H2*    A   1           H2*        A   1   2.342 -15.697   4.017
    6   2HO*    A   1          2HO*        A   1   4.340 -15.916   4.716
    7    H1*    A   1           H1*        A   1   2.241 -17.203   6.348
    8    H8     A   1           H8         A   1  -1.103 -15.835   6.512
    9   1H6     A   1          H61         A   1  -2.837 -19.670   1.971
   10   2H6     A   1          H62         A   1  -3.395 -18.586   3.225
   11    H2     A   1           H2         A   1   1.645 -19.638   2.131
   12    H5T    A   1           H5T        A   1   1.692 -13.104   9.017
   13   1H5*    G   2          1H5*        G   2   4.837 -13.674   2.821
   14   2H5*    G   2          2H5*        G   2   4.709 -12.072   2.069
   15    H4*    G   2           H4*        G   2   5.378 -13.713   0.438
   16    H3*    G   2           H3*        G   2   2.647 -12.520   0.038
   17    H2*    G   2           H2*        G   2   2.392 -13.871  -1.937
   18   2HO*    G   2          2HO*        G   2   4.565 -15.315  -2.106
   19    H1*    G   2           H1*        G   2   3.458 -16.208  -0.806
   20    H8     G   2           H8         G   2   1.532 -15.088   2.018
   21    H1     G   2           H1         G   2  -2.283 -16.960  -2.785
   22   1H2     G   2          H21         G   2   0.568 -16.756  -4.735
   23   2H2     G   2          H22         G   2  -1.142 -17.114  -4.653
   24   1H5*    U   3          1H5*        U   3   4.836 -11.398  -3.817
   25   2H5*    U   3          2H5*        U   3   4.150  -9.808  -4.205
   26    H4*    U   3           H4*        U   3   3.946 -11.391  -6.055
   27    H3*    U   3           H3*        U   3   1.371 -10.391  -4.849
   28    H2*    U   3           H2*        U   3   0.215 -11.629  -6.577
   29   2HO*    U   3          2HO*        U   3   1.315 -11.639  -8.421
   30    H1*    U   3           H1*        U   3   1.738 -13.943  -6.228
   31    H3     U   3           H3         U   3  -2.261 -14.957  -4.359
   32    H5     U   3           H5         U   3  -0.334 -12.569  -1.492
   33    H6     U   3           H6         U   3   1.393 -12.147  -3.114
   34   1H5*    A   4          1H5*        A   4   1.559  -8.842  -9.293
   35   2H5*    A   4          2H5*        A   4   0.681  -7.307  -9.162
   36    H4*    A   4           H4*        A   4  -0.062  -8.769 -11.019
   37    H3*    A   4           H3*        A   4  -2.050  -7.873  -8.956
   38    H2*    A   4           H2*        A   4  -3.769  -9.084 -10.180
   39   2HO*    A   4          2HO*        A   4  -3.365  -9.955 -12.166
   40    H1*    A   4           H1*        A   4  -2.338 -11.425 -10.262
   41    H8     A   4           H8         A   4  -0.923 -10.005  -7.221
   42   1H6     A   4          H61         A   4  -6.021 -11.601  -4.120
   43   2H6     A   4          H62         A   4  -4.364 -11.057  -3.985
   44    H2     A   4           H2         A   4  -6.893 -11.977  -8.512
   45   1H5*    G   5          1H5*        G   5  -3.969  -5.487 -12.088
   46   2H5*    G   5          2H5*        G   5  -4.347  -3.964 -11.262
   47    H4*    G   5           H4*        G   5  -6.323  -5.257 -12.030
   48    H3*    G   5           H3*        G   5  -6.093  -4.564  -9.105
   49    H2*    G   5           H2*        G   5  -8.234  -5.630  -8.775
   50   2HO*    G   5          2HO*        G   5  -9.484  -6.286 -10.554
   51    H1*    G   5           H1*        G   5  -7.648  -7.865 -10.374
   52    H8     G   5           H8         G   5  -4.487  -7.338  -8.611
   53    H1     G   5           H1         G   5  -9.127  -9.517  -4.751
   54   1H2     G   5          H21         G   5 -11.258  -8.675  -7.321
   55   2H2     G   5          H22         G   5 -11.070  -9.336  -5.712
   56   1H5*    A   6          1H5*        A   6  -9.796  -4.476 -10.066
   57   2H5*    A   6          2H5*        A   6 -10.525  -2.873  -9.876
   58    H4*    A   6           H4*        A   6 -11.873  -4.757  -8.970
   59    H3*    A   6           H3*        A   6 -11.779  -2.259  -7.936
   60    H2*    A   6           H2*        A   6 -10.078  -2.681  -6.268
   61   2HO*    A   6          2HO*        A   6 -12.580  -3.496  -5.152
   62    H1*    A   6           H1*        A   6 -11.418  -5.400  -5.741
   63    H8     A   6           H8         A   6  -7.813  -4.599  -6.757
   64   1H6     A   6          H61         A   6  -6.235  -6.364  -1.034
   65   2H6     A   6          H62         A   6  -5.649  -5.880  -2.614
   66    H2     A   6           H2         A   6 -10.727  -6.372  -1.314
   67   1H5*    A   7          1H5*        A   7 -14.423  -4.202  -4.672
   68   2H5*    A   7          2H5*        A   7 -15.758  -3.053  -4.465
   69    H4*    A   7           H4*        A   7 -14.944  -3.423  -2.314
   70    H3*    A   7           H3*        A   7 -13.915  -0.803  -3.367
   71    H2*    A   7           H2*        A   7 -12.534  -0.554  -1.468
   72   2HO*    A   7          2HO*        A   7 -13.943  -2.503   0.005
   73    H1*    A   7           H1*        A   7 -12.466  -3.434  -0.834
   74    H8     A   7           H8         A   7 -10.750  -2.091  -3.974
   75   1H6     A   7          H61         A   7  -5.589  -2.043  -0.544
   76   2H6     A   7          H62         A   7  -6.240  -1.831  -2.156
   77    H2     A   7           H2         A   7  -9.044  -2.986   2.146
   78   1H5*    A   8          1H5*        A   8 -16.021   2.587   0.130
   79   2H5*    A   8          2H5*        A   8 -14.329   2.706  -0.392
   80    H4*    A   8           H4*        A   8 -15.477   1.917   2.235
   81    H3*    A   8           H3*        A   8 -13.256   3.728   1.352
   82    H2*    A   8           H2*        A   8 -12.049   3.239   3.376
   83   2HO*    A   8          2HO*        A   8 -14.216   1.616   4.245
   84    H1*    A   8           H1*        A   8 -12.475   0.493   3.322
   85    H8     A   8           H8         A   8 -12.016   2.085  -0.131
   86   1H6     A   8          H61         A   8  -6.025   0.668   0.551
   87   2H6     A   8          H62         A   8  -7.236   1.280  -0.553
   88    H2     A   8           H2         A   8  -8.117  -0.220   4.417
   89   1H5*    C   9          1H5*        C   9 -13.879   5.746   6.389
   90   2H5*    C   9          2H5*        C   9 -12.931   6.886   5.414
   91    H4*    C   9           H4*        C   9 -12.029   5.229   7.478
   92    H3*    C   9           H3*        C   9 -10.666   7.088   5.573
   93    H2*    C   9           H2*        C   9  -8.533   6.095   6.057
   94   2HO*    C   9          2HO*        C   9  -9.878   4.553   8.054
   95    H1*    C   9           H1*        C   9  -9.374   3.448   5.965
   96   1H4     C   9          H41         C   9  -9.195   5.305  -0.368
   97   2H4     C   9          H42         C   9  -7.686   4.462  -0.043
   98    H5     C   9           H5         C   9 -10.824   5.788   1.376
   99    H6     C   9           H6         C   9 -11.323   5.552   3.748
  100   1H5*    A  10          1H5*        A  10  -7.197   9.775   8.202
  101   2H5*    A  10          2H5*        A  10  -7.535   9.699   6.462
  102    H4*    A  10           H4*        A  10  -5.610   8.096   8.101
  103    H3*    A  10           H3*        A  10  -5.351   9.874   5.701
  104    H2*    A  10           H2*        A  10  -3.598   8.461   4.842
  105   2HO*    A  10          2HO*        A  10  -2.357   7.697   6.423
  106    H1*    A  10           H1*        A  10  -4.875   6.045   5.394
  107    H8     A  10           H8         A  10  -7.807   7.882   4.368
  108   1H6     A  10          H61         A  10  -5.924   7.494  -1.517
  109   2H6     A  10          H62         A  10  -7.268   7.870  -0.462
  110    H2     A  10           H2         A  10  -2.476   6.376   1.122
  111   1H5*    A  11          1H5*        A  11  -2.079  13.013   5.403
  112   2H5*    A  11          2H5*        A  11  -1.866  11.452   4.587
  113    H4*    A  11           H4*        A  11   0.065  12.900   6.383
  114    H3*    A  11           H3*        A  11   0.003  13.329   3.797
  115    H2*    A  11           H2*        A  11  -0.095  11.067   2.982
  116   2HO*    A  11          2HO*        A  11   2.685  11.543   3.441
  117    H1*    A  11           H1*        A  11   2.008  10.064   4.922
  118    H8     A  11           H8         A  11  -1.335   9.073   5.930
  119   1H6     A  11          H61         A  11  -0.884   4.112   2.256
  120   2H6     A  11          H62         A  11  -1.791   4.864   3.548
  121    H2     A  11           H2         A  11   2.445   6.931   1.206
  122   1H5*    G  12          1H5*        G  12   4.409  12.149   3.354
  123   2H5*    G  12          2H5*        G  12   5.080  13.762   3.046
  124    H4*    G  12           H4*        G  12   6.036  12.463   1.397
  125    H3*    G  12           H3*        G  12   3.691  13.960   0.286
  126    H2*    G  12           H2*        G  12   3.923  12.841  -1.810
  127   2HO*    G  12          2HO*        G  12   6.512  12.441  -0.834
  128    H1*    G  12           H1*        G  12   4.547  10.310  -0.789
  129    H8     G  12           H8         G  12   1.768  12.134   1.061
  130    H1     G  12           H1         G  12  -0.127   8.592  -3.941
  131   1H2     G  12          H21         G  12   3.250   8.255  -4.601
  132   2H2     G  12          H22         G  12   1.609   7.871  -5.068
  133   1H5*    G  13          1H5*        G  13   7.206  13.857  -2.503
  134   2H5*    G  13          2H5*        G  13   7.442  15.569  -2.903
  135    H4*    G  13           H4*        G  13   7.664  14.355  -4.910
  136    H3*    G  13           H3*        G  13   5.099  15.889  -4.735
  137    H2*    G  13           H2*        G  13   4.438  15.010  -6.895
  138   2HO*    G  13          2HO*        G  13   7.131  14.098  -6.905
  139    H1*    G  13           H1*        G  13   4.960  12.386  -6.260
  140    H8     G  13           H8         G  13   4.084  14.360  -3.148
  141    H1     G  13           H1         G  13  -0.938  11.869  -6.261
  142   1H2     G  13          H21         G  13   1.356  11.080  -8.727
  143   2H2     G  13          H22         G  13  -0.306  11.031  -8.186
  144   1H5*    C  14          1H5*        C  14   6.170  17.929  -8.674
  145   2H5*    C  14          2H5*        C  14   5.794  19.569  -8.114
  146    H4*    C  14           H4*        C  14   4.499  18.853 -10.096
  147    H3*    C  14           H3*        C  14   2.927  19.568  -7.615
  148    H2*    C  14           H2*        C  14   0.953  19.323  -8.995
  149   2HO*    C  14          2HO*        C  14   1.310  19.998 -11.002
  150    H1*    C  14           H1*        C  14   1.875  16.941 -10.195
  151   1H4     C  14          H41         C  14  -0.537  15.123  -4.347
  152   2H4     C  14          H42         C  14  -1.960  15.405  -5.336
  153    H5     C  14           H5         C  14   1.698  15.662  -5.099
  154    H6     C  14           H6         C  14   3.025  16.545  -6.947
  155   1H5*    U  15          1H5*        U  15   0.751  22.630  -9.845
  156   2H5*    U  15          2H5*        U  15   0.657  23.832  -8.544
  157    H4*    U  15           H4*        U  15  -1.527  22.883  -9.332
  158    H3*    U  15           H3*        U  15  -0.783  22.823  -6.418
  159    H2*    U  15           H2*        U  15  -2.952  21.819  -5.975
  160   2HO*    U  15          2HO*        U  15  -4.275  22.787  -7.494
  161    H1*    U  15           H1*        U  15  -2.640  19.858  -7.872
  162    H3     U  15           H3         U  15  -1.519  18.128  -3.756
  163    H5     U  15           H5         U  15   2.039  19.603  -5.422
  164    H6     U  15           H6         U  15   0.715  20.641  -7.143
  165   1H5*    U  16          1H5*        U  16  -4.143  26.875  -5.012
  166   2H5*    U  16          2H5*        U  16  -4.067  25.663  -3.718
  167    H4*    U  16           H4*        U  16  -6.347  26.347  -4.088
  168    H3*    U  16           H3*        U  16  -5.832  23.819  -3.681
  169    H2*    U  16           H2*        U  16  -5.167  23.258  -5.957
  170   2HO*    U  16          2HO*        U  16  -6.615  21.729  -6.288
  171    H1*    U  16           H1*        U  16  -7.681  24.644  -7.015
  172    H3     U  16           H3         U  16  -6.065  23.382 -11.063
  173    H5     U  16           H5         U  16  -3.050  25.814  -9.434
  174    H6     U  16           H6         U  16  -4.302  25.837  -7.369
  175   1H5*    C  17          1H5*        C  17  -8.927  21.652  -4.463
  176   2H5*    C  17          2H5*        C  17  -9.612  21.093  -2.925
  177    H4*    C  17           H4*        C  17  -8.518  19.370  -4.485
  178    H3*    C  17           H3*        C  17  -8.797  19.184  -1.754
  179    H2*    C  17           H2*        C  17  -6.609  20.109  -1.238
  180   2HO*    C  17          2HO*        C  17  -5.981  17.384  -1.823
  181    H1*    C  17           H1*        C  17  -5.589  18.455  -3.636
  182   1H4     C  17          H41         C  17  -0.870  22.957  -2.941
  183   2H4     C  17          H42         C  17  -0.196  21.530  -2.168
  184    H5     C  17           H5         C  17  -3.162  23.102  -3.674
  185    H6     C  17           H6         C  17  -5.267  21.889  -3.877
  186   1H5*    G  18          1H5*        G  18 -10.475  18.481  -2.944
  187   2H5*    G  18          2H5*        G  18 -11.751  17.918  -1.849
  188    H4*    G  18           H4*        G  18 -13.081  17.399  -3.539
  189    H3*    G  18           H3*        G  18 -10.797  15.761  -4.527
  190    H2*    G  18           H2*        G  18 -11.379  16.077  -6.771
  191   2HO*    G  18          2HO*        G  18 -13.395  15.602  -7.368
  192    H1*    G  18           H1*        G  18 -13.372  18.241  -6.132
  193    H8     G  18           H8         G  18 -13.250  19.277  -8.470
  194    H1     G  18           H1         G  18  -6.834  19.433  -8.227
  195   1H2     G  18          H21         G  18  -7.203  17.654  -5.290
  196   2H2     G  18          H22         G  18  -6.116  18.392  -6.445
  197   1H5*    G  19          1H5*        G  19  -9.296  12.674  -3.879
  198   2H5*    G  19          2H5*        G  19  -9.885  14.336  -4.050
  199    H4*    G  19           H4*        G  19 -10.693  12.902  -6.348
  200    H3*    G  19           H3*        G  19  -8.003  12.038  -5.501
  201    H2*    G  19           H2*        G  19  -6.948  12.710  -7.535
  202   2HO*    G  19          2HO*        G  19  -9.537  12.393  -8.464
  203    H1*    G  19           H1*        G  19  -8.241  15.099  -7.951
  204    H8     G  19           H8         G  19  -7.871  14.797  -4.247
  205    H1     G  19           H1         G  19  -2.546  16.793  -7.203
  206   1H2     G  19          H21         G  19  -4.149  15.871 -10.109
  207   2H2     G  19          H22         G  19  -2.713  16.538  -9.347
  208   1H5*    C  20          1H5*        C  20  -8.733  10.413  -9.112
  209   2H5*    C  20          2H5*        C  20  -8.707   8.641  -9.213
  210    H4*    C  20           H4*        C  20  -7.403   9.475 -10.997
  211    H3*    C  20           H3*        C  20  -5.872   8.137  -8.819
  212    H2*    C  20           H2*        C  20  -3.765   8.756  -9.793
  213   2HO*    C  20          2HO*        C  20  -3.830   9.897 -11.880
  214    H1*    C  20           H1*        C  20  -4.402  11.376 -10.371
  215   1H4     C  20          H41         C  20  -3.805  11.548  -3.837
  216   2H4     C  20          H42         C  20  -2.175  11.764  -4.425
  217    H5     C  20           H5         C  20  -5.661  11.049  -5.239
  218    H6     C  20           H6         C  20  -6.389  10.615  -7.501
  219   1H5*    C  21          1H5*        C  21  -3.482   7.119 -11.414
  220   2H5*    C  21          2H5*        C  21  -3.646   5.396 -11.808
  221    H4*    C  21           H4*        C  21  -1.376   5.659 -11.466
  222    H3*    C  21           H3*        C  21  -2.652   4.541  -8.990
  223    H2*    C  21           H2*        C  21  -0.528   4.598  -7.872
  224   2HO*    C  21          2HO*        C  21   0.539   5.222 -10.451
  225    H1*    C  21           H1*        C  21   0.267   7.103  -8.870
  226   1H4     C  21          H41         C  21  -3.818   8.490  -3.885
  227   2H4     C  21          H42         C  21  -2.257   8.224  -3.127
  228    H5     C  21           H5         C  21  -4.220   8.091  -6.239
  229    H6     C  21           H6         C  21  -3.209   7.386  -8.344
  230   1H5*    U  22          1H5*        U  22  -1.347   0.312  -7.833
  231   2H5*    U  22          2H5*        U  22  -2.227   1.102  -6.510
  232    H4*    U  22           H4*        U  22   0.658   1.013  -7.105
  233    H3*    U  22           H3*        U  22  -1.011   1.017  -4.616
  234    H2*    U  22           H2*        U  22   0.778   2.067  -3.401
  235   2HO*    U  22          2HO*        U  22   2.327   1.636  -5.769
  236    H1*    U  22           H1*        U  22   1.419   3.943  -5.356
  237    H3     U  22           H3         U  22  -0.761   6.134  -1.993
  238    H5     U  22           H5         U  22  -3.768   4.683  -4.542
  239    H6     U  22           H6         U  22  -2.073   3.419  -5.694
  240   1H5*    G  23          1H5*        G  23   2.432   0.904  -2.242
  241   2H5*    G  23          2H5*        G  23   2.136  -0.675  -1.488
  242    H4*    G  23           H4*        G  23   2.190   1.222   0.104
  243    H3*    G  23           H3*        G  23  -0.261  -0.510  -0.068
  244    H2*    G  23           H2*        G  23  -1.331   0.840   1.571
  245   2HO*    G  23          2HO*        G  23   0.744   2.496   2.228
  246    H1*    G  23           H1*        G  23  -0.118   3.309   0.768
  247    H8     G  23           H8         G  23  -1.510   2.149  -2.336
  248    H1     G  23           H1         G  23  -6.116   3.814   1.815
  249   1H2     G  23          H21         G  23  -3.625   3.683   4.186
  250   2H2     G  23          H22         G  23  -5.315   3.968   3.831
  251   1H5*    C  24          1H5*        C  24  -1.635  -1.607   4.157
  252   2H5*    C  24          2H5*        C  24  -1.348  -0.011   3.443
  253    H4*    C  24           H4*        C  24   0.261   0.008   5.669
  254    H3*    C  24           H3*        C  24  -2.144  -1.656   6.340
  255    H2*    C  24           H2*        C  24  -2.465  -0.395   8.354
  256   2HO*    C  24          2HO*        C  24   0.182  -0.132   8.165
  257    H1*    C  24           H1*        C  24  -1.892   2.120   7.237
  258   1H4     C  24          H41         C  24  -8.139   1.167   5.500
  259   2H4     C  24          H42         C  24  -8.232   1.496   7.220
  260    H5     C  24           H5         C  24  -6.037   0.837   4.340
  261    H6     C  24           H6         C  24  -3.612   0.762   4.590
  262   1H5*    U  25          1H5*        U  25  -3.016  -2.649   8.951
  263   2H5*    U  25          2H5*        U  25  -2.754  -4.402   9.042
  264    H4*    U  25           H4*        U  25  -5.113  -3.879   8.882
  265    H3*    U  25           H3*        U  25  -3.950  -5.318   6.500
  266    H2*    U  25           H2*        U  25  -6.174  -5.391   5.589
  267   2HO*    U  25          2HO*        U  25  -7.614  -5.741   7.146
  268    H1*    U  25           H1*        U  25  -6.805  -2.744   6.306
  269    H3     U  25           H3         U  25  -6.540  -2.396   1.822
  270    H5     U  25           H5         U  25  -2.582  -3.116   2.981
  271    H6     U  25           H6         U  25  -3.367  -3.407   5.241
  272   1H5*    U  26          1H5*        U  26  -7.614  -7.490   8.126
  273   2H5*    U  26          2H5*        U  26  -7.337  -9.191   7.705
  274    H4*    U  26           H4*        U  26  -9.522  -8.330   6.958
  275    H3*    U  26           H3*        U  26  -7.629  -9.311   4.821
  276    H2*    U  26           H2*        U  26  -9.406  -8.919   3.241
  277   2HO*    U  26          2HO*        U  26 -11.283  -7.946   4.982
  278    H1*    U  26           H1*        U  26 -10.194  -6.461   4.410
  279    H3     U  26           H3         U  26  -8.519  -5.289   0.367
  280    H5     U  26           H5         U  26  -5.139  -6.101   2.726
  281    H6     U  26           H6         U  26  -6.621  -6.940   4.424
  282   1H5*    U  27          1H5*        U  27 -11.436 -10.476   4.160
  283   2H5*    U  27          2H5*        U  27 -11.537 -12.244   4.052
  284    H4*    U  27           H4*        U  27 -12.866 -11.315   2.316
  285    H3*    U  27           H3*        U  27 -10.318 -12.546   1.276
  286    H2*    U  27           H2*        U  27 -11.099 -12.030  -0.950
  287   2HO*    U  27          2HO*        U  27 -13.190 -11.760  -1.350
  288    H1*    U  27           H1*        U  27 -11.965  -9.437  -0.286
  289    H3     U  27           H3         U  27  -8.303  -8.843  -2.869
  290    H5     U  27           H5         U  27  -6.783  -9.804   0.929
  291    H6     U  27           H6         U  27  -9.039 -10.298   1.612
  292   1H5*    U  28          1H5*        U  28 -13.789 -14.555  -0.880
  293   2H5*    U  28          2H5*        U  28 -13.244 -16.238  -1.022
  294    H4*    U  28           H4*        U  28 -14.035 -15.222  -3.143
  295    H3*    U  28           H3*        U  28 -11.245 -16.336  -2.987
  296    H2*    U  28           H2*        U  28 -10.969 -15.769  -5.325
  297   2HO*    U  28          2HO*        U  28 -12.873 -14.640  -6.317
  298    H1*    U  28           H1*        U  28 -11.941 -13.186  -5.039
  299    H3     U  28           H3         U  28  -7.393 -12.843  -5.251
  300    H5     U  28           H5         U  28  -8.264 -13.687  -1.226
  301    H6     U  28           H6         U  28 -10.544 -14.088  -1.881
  302   1H5*    G  29          1H5*        G  29 -12.307 -19.522  -5.673
  303   2H5*    G  29          2H5*        G  29 -11.619 -20.961  -4.896
  304    H4*    G  29           H4*        G  29 -10.573 -20.390  -7.063
  305    H3*    G  29           H3*        G  29  -8.821 -20.459  -4.611
  306    H2*    G  29           H2*        G  29  -6.963 -19.863  -5.979
  307   2HO*    G  29          2HO*        G  29  -8.537 -21.125  -7.896
  308    H1*    G  29           H1*        G  29  -8.516 -18.286  -7.845
  309    H8     G  29           H8         G  29  -9.054 -17.034  -4.401
  310    H1     G  29           H1         G  29  -3.538 -15.028  -6.992
  311   1H2     G  29          H21         G  29  -4.147 -17.419  -9.415
  312   2H2     G  29          H22         G  29  -3.094 -16.158  -8.816
  313   1H5*    C  30          1H5*        C  30  -6.741 -22.821  -7.635
  314   2H5*    C  30          2H5*        C  30  -5.884 -24.089  -6.736
  315    H4*    C  30           H4*        C  30  -4.418 -22.640  -8.112
  316    H3*    C  30           H3*        C  30  -3.942 -22.866  -5.153
  317    H2*    C  30           H2*        C  30  -2.090 -21.350  -5.362
  318   2HO*    C  30          2HO*        C  30  -1.811 -20.640  -7.782
  319    H1*    C  30           H1*        C  30  -3.362 -19.597  -7.166
  320   1H4     C  30          H41         C  30  -5.544 -17.949  -1.159
  321   2H4     C  30          H42         C  30  -4.310 -16.775  -1.583
  322    H5     C  30           H5         C  30  -6.075 -19.855  -2.550
  323    H6     C  30           H6         C  30  -5.523 -21.034  -4.611
  324   1H5*    U  31          1H5*        U  31  -0.283 -22.564  -6.549
  325   2H5*    U  31          2H5*        U  31   0.569 -24.083  -6.212
  326    H4*    U  31           H4*        U  31   1.987 -22.334  -5.519
  327    H3*    U  31           H3*        U  31   0.700 -23.745  -3.199
  328    H2*    U  31           H2*        U  31   1.871 -22.276  -1.700
  329   2HO*    U  31          2HO*        U  31   3.835 -22.332  -3.071
  330    H1*    U  31           H1*        U  31   1.412 -19.944  -3.199
  331    H3     U  31           H3         U  31  -1.226 -19.351   0.415
  332    H5     U  31           H5         U  31  -3.286 -22.167  -1.923
  333    H6     U  31           H6         U  31  -1.358 -22.270  -3.361
  334    H3T    U  31           H3T        U  31   2.544 -24.359  -4.791
  Start of MODEL   30
    1   1H5*    A   1          1H5*        A   1  -2.773 -12.920  10.176
    2   2H5*    A   1          2H5*        A   1  -3.005 -12.052   8.647
    3    H4*    A   1           H4*        A   1  -0.623 -12.535   9.389
    4    H3*    A   1           H3*        A   1  -1.674 -12.990   6.630
    5    H2*    A   1           H2*        A   1   0.403 -14.012   5.958
    6   2HO*    A   1          2HO*        A   1   1.292 -12.679   8.231
    7    H1*    A   1           H1*        A   1   0.657 -15.667   8.150
    8    H8     A   1           H8         A   1  -2.991 -15.578   7.884
    9   1H6     A   1          H61         A   1  -2.616 -19.561   3.158
   10   2H6     A   1          H62         A   1  -3.688 -18.799   4.312
   11    H2     A   1           H2         A   1   1.501 -17.977   3.973
   12    H5T    A   1           H5T        A   1  -3.734 -14.589   9.357
   13   1H5*    G   2          1H5*        G   2   1.840 -10.933   5.572
   14   2H5*    G   2          2H5*        G   2   1.420  -9.714   4.353
   15    H4*    G   2           H4*        G   2   3.100 -11.386   3.613
   16    H3*    G   2           H3*        G   2   0.553 -11.025   2.058
   17    H2*    G   2           H2*        G   2   1.271 -12.733   0.534
   18   2HO*    G   2          2HO*        G   2   3.375 -12.466   0.140
   19    H1*    G   2           H1*        G   2   2.372 -14.432   2.505
   20    H8     G   2           H8         G   2  -0.749 -13.477   4.082
   21    H1     G   2           H1         G   2  -1.721 -17.424  -0.879
   22   1H2     G   2          H21         G   2   1.552 -16.684  -1.730
   23   2H2     G   2          H22         G   2   0.088 -17.562  -2.113
   24   1H5*    U   3          1H5*        U   3   3.472  -9.921  -1.155
   25   2H5*    U   3          2H5*        U   3   2.612  -8.673  -2.078
   26    H4*    U   3           H4*        U   3   3.213 -10.638  -3.426
   27    H3*    U   3           H3*        U   3   0.310  -9.917  -3.142
   28    H2*    U   3           H2*        U   3  -0.265 -11.789  -4.522
   29   2HO*    U   3          2HO*        U   3   1.861 -13.011  -5.232
   30    H1*    U   3           H1*        U   3   1.582 -13.574  -3.375
   31    H3     U   3           H3         U   3  -2.341 -15.266  -1.959
   32    H5     U   3           H5         U   3  -1.889 -11.746   0.285
   33    H6     U   3           H6         U   3   0.047 -11.233  -1.050
   34   1H5*    A   4          1H5*        A   4   1.749 -10.010  -7.750
   35   2H5*    A   4          2H5*        A   4   0.957  -8.497  -8.226
   36    H4*    A   4           H4*        A   4   0.703 -10.126  -9.962
   37    H3*    A   4           H3*        A   4  -1.812  -9.324  -8.552
   38    H2*    A   4           H2*        A   4  -3.069 -10.892  -9.921
   39   2HO*    A   4          2HO*        A   4  -1.297 -12.250 -11.249
   40    H1*    A   4           H1*        A   4  -1.445 -13.024  -9.381
   41    H8     A   4           H8         A   4  -0.758 -11.085  -6.399
   42   1H6     A   4          H61         A   4  -6.183 -12.791  -3.995
   43   2H6     A   4          H62         A   4  -4.630 -12.054  -3.670
   44    H2     A   4           H2         A   4  -6.201 -13.862  -8.359
   45   1H5*    G   5          1H5*        G   5  -3.229  -7.579 -12.305
   46   2H5*    G   5          2H5*        G   5  -3.876  -6.006 -11.799
   47    H4*    G   5           H4*        G   5  -5.567  -7.565 -12.719
   48    H3*    G   5           H3*        G   5  -5.931  -6.477  -9.939
   49    H2*    G   5           H2*        G   5  -8.000  -7.719  -9.789
   50   2HO*    G   5          2HO*        G   5  -8.000  -7.417 -12.404
   51    H1*    G   5           H1*        G   5  -6.942 -10.090 -10.790
   52    H8     G   5           H8         G   5  -4.068  -8.891  -8.916
   53    H1     G   5           H1         G   5  -8.854 -10.702  -5.047
   54   1H2     G   5          H21         G   5 -10.796 -10.615  -7.893
   55   2H2     G   5          H22         G   5 -10.708 -10.916  -6.171
   56   1H5*    A   6          1H5*        A   6  -9.544  -6.799 -11.272
   57   2H5*    A   6          2H5*        A   6 -10.290  -5.197 -11.416
   58    H4*    A   6           H4*        A   6 -11.710  -6.905 -10.317
   59    H3*    A   6           H3*        A   6 -11.691  -4.284  -9.693
   60    H2*    A   6           H2*        A   6 -10.117  -4.374  -7.866
   61   2HO*    A   6          2HO*        A   6 -12.196  -3.702  -7.015
   62    H1*    A   6           H1*        A   6 -11.396  -6.995  -6.924
   63    H8     A   6           H8         A   6  -7.804  -6.228  -8.051
   64   1H6     A   6          H61         A   6  -6.246  -6.906  -2.096
   65   2H6     A   6          H62         A   6  -5.657  -6.653  -3.727
   66    H2     A   6           H2         A   6 -10.720  -7.282  -2.426
   67   1H5*    A   7          1H5*        A   7 -14.554  -5.885  -6.396
   68   2H5*    A   7          2H5*        A   7 -15.914  -4.746  -6.400
   69    H4*    A   7           H4*        A   7 -15.264  -4.914  -4.167
   70    H3*    A   7           H3*        A   7 -14.178  -2.374  -5.358
   71    H2*    A   7           H2*        A   7 -13.012  -1.931  -3.351
   72   2HO*    A   7          2HO*        A   7 -15.294  -2.702  -2.325
   73    H1*    A   7           H1*        A   7 -12.937  -4.754  -2.501
   74    H8     A   7           H8         A   7 -10.958  -3.679  -5.564
   75   1H6     A   7          H61         A   7  -6.172  -3.022  -1.685
   76   2H6     A   7          H62         A   7  -6.665  -3.033  -3.364
   77    H2     A   7           H2         A   7  -9.854  -3.771   0.757
   78   1H5*    A   8          1H5*        A   8 -16.953   1.012  -2.343
   79   2H5*    A   8          2H5*        A   8 -15.273   1.524  -2.602
   80    H4*    A   8           H4*        A   8 -16.637   0.656  -0.167
   81    H3*    A   8           H3*        A   8 -14.296   2.421  -0.786
   82    H2*    A   8           H2*        A   8 -13.394   2.001   1.411
   83   2HO*    A   8          2HO*        A   8 -14.856   0.349   2.649
   84    H1*    A   8           H1*        A   8 -13.763  -0.744   1.354
   85    H8     A   8           H8         A   8 -13.010   0.595  -2.119
   86   1H6     A   8          H61         A   8  -7.043  -0.321  -0.736
   87   2H6     A   8          H62         A   8  -8.175   0.092  -2.005
   88    H2     A   8           H2         A   8  -9.452  -0.972   2.989
   89   1H5*    C   9          1H5*        C   9 -15.175   5.023   3.244
   90   2H5*    C   9          2H5*        C   9 -14.501   6.368   2.304
   91    H4*    C   9           H4*        C   9 -13.295   5.426   4.446
   92    H3*    C   9           H3*        C   9 -12.053   6.532   1.957
   93    H2*    C   9           H2*        C   9  -9.865   5.899   2.735
   94   2HO*    C   9          2HO*        C   9  -9.551   5.935   4.836
   95    H1*    C   9           H1*        C   9 -10.567   3.350   3.582
   96   1H4     C   9          H41         C   9 -10.511   2.856  -2.992
   97   2H4     C   9          H42         C   9  -8.867   2.504  -2.479
   98    H5     C   9           H5         C   9 -12.241   3.609  -1.459
   99    H6     C   9           H6         C   9 -12.734   4.170   0.861
  100   1H5*    A  10          1H5*        A  10 -10.145   7.632   5.460
  101   2H5*    A  10          2H5*        A  10  -9.399   9.243   5.506
  102    H4*    A  10           H4*        A  10  -7.942   7.186   5.986
  103    H3*    A  10           H3*        A  10  -7.170   9.504   4.263
  104    H2*    A  10           H2*        A  10  -5.139   8.405   3.609
  105   2HO*    A  10          2HO*        A  10  -5.705   6.211   5.304
  106    H1*    A  10           H1*        A  10  -6.245   5.875   3.215
  107    H8     A  10           H8         A  10  -8.968   7.821   1.851
  108   1H6     A  10          H61         A  10  -5.557   8.940  -3.190
  109   2H6     A  10          H62         A  10  -7.163   9.006  -2.500
  110    H2     A  10           H2         A  10  -2.845   7.312  -0.012
  111   1H5*    A  11          1H5*        A  11  -3.599  11.706   4.832
  112   2H5*    A  11          2H5*        A  11  -3.584  10.084   4.112
  113    H4*    A  11           H4*        A  11  -1.710  11.124   6.233
  114    H3*    A  11           H3*        A  11  -1.365  11.819   3.696
  115    H2*    A  11           H2*        A  11  -1.536   9.632   2.687
  116   2HO*    A  11          2HO*        A  11   0.486   9.245   2.011
  117    H1*    A  11           H1*        A  11   0.201   8.443   4.907
  118    H8     A  11           H8         A  11  -3.286   7.315   4.913
  119   1H6     A  11          H61         A  11  -1.611   2.602   1.265
  120   2H6     A  11          H62         A  11  -2.880   3.252   2.278
  121    H2     A  11           H2         A  11   1.768   5.548   1.371
  122   1H5*    G  12          1H5*        G  12   2.968  10.206   4.099
  123   2H5*    G  12          2H5*        G  12   3.821  11.761   4.036
  124    H4*    G  12           H4*        G  12   5.003  10.282   2.642
  125    H3*    G  12           H3*        G  12   3.406  12.300   1.102
  126    H2*    G  12           H2*        G  12   4.161  11.294  -0.962
  127   2HO*    G  12          2HO*        G  12   5.566   9.213   0.149
  128    H1*    G  12           H1*        G  12   3.652   8.687  -0.191
  129    H8     G  12           H8         G  12   1.199  11.159   1.339
  130    H1     G  12           H1         G  12  -0.500   8.831  -4.392
  131   1H2     G  12          H21         G  12   2.680   7.470  -4.451
  132   2H2     G  12          H22         G  12   1.147   7.678  -5.268
  133   1H5*    G  13          1H5*        G  13   6.801  12.228  -0.947
  134   2H5*    G  13          2H5*        G  13   7.372  13.855  -1.367
  135    H4*    G  13           H4*        G  13   7.043  12.600  -3.372
  136    H3*    G  13           H3*        G  13   5.029  14.799  -2.962
  137    H2*    G  13           H2*        G  13   4.054  14.205  -5.087
  138   2HO*    G  13          2HO*        G  13   5.098  12.865  -6.514
  139    H1*    G  13           H1*        G  13   4.118  11.447  -4.621
  140    H8     G  13           H8         G  13   3.268  13.137  -1.397
  141    H1     G  13           H1         G  13  -1.715  12.388  -5.371
  142   1H2     G  13          H21         G  13   0.670  11.554  -7.726
  143   2H2     G  13          H22         G  13  -1.024  11.783  -7.355
  144   1H5*    C  14          1H5*        C  14   6.734  16.379  -7.040
  145   2H5*    C  14          2H5*        C  14   6.908  18.050  -6.469
  146    H4*    C  14           H4*        C  14   5.610  17.920  -8.525
  147    H3*    C  14           H3*        C  14   4.120  18.901  -6.092
  148    H2*    C  14           H2*        C  14   2.233  19.290  -7.545
  149   2HO*    C  14          2HO*        C  14   2.929  18.478  -9.909
  150    H1*    C  14           H1*        C  14   2.532  16.853  -8.937
  151   1H4     C  14          H41         C  14  -0.606  15.354  -3.341
  152   2H4     C  14          H42         C  14  -1.848  16.040  -4.378
  153    H5     C  14           H5         C  14   1.730  15.320  -3.960
  154    H6     C  14           H6         C  14   3.352  15.962  -5.657
  155   1H5*    U  15          1H5*        U  15   2.850  22.459  -7.975
  156   2H5*    U  15          2H5*        U  15   3.102  23.573  -6.616
  157    H4*    U  15           H4*        U  15   0.711  23.120  -7.383
  158    H3*    U  15           H3*        U  15   1.580  23.081  -4.511
  159    H2*    U  15           H2*        U  15  -0.677  22.503  -3.873
  160   2HO*    U  15          2HO*        U  15  -1.181  23.182  -6.576
  161    H1*    U  15           H1*        U  15  -0.944  20.472  -5.715
  162    H3     U  15           H3         U  15  -0.016  18.490  -1.704
  163    H5     U  15           H5         U  15   3.710  19.334  -3.446
  164    H6     U  15           H6         U  15   2.552  20.613  -5.123
  165   1H5*    U  16          1H5*        U  16  -0.854  27.744  -3.234
  166   2H5*    U  16          2H5*        U  16  -1.037  26.633  -1.863
  167    H4*    U  16           H4*        U  16  -3.130  27.676  -2.201
  168    H3*    U  16           H3*        U  16  -3.150  25.077  -1.961
  169    H2*    U  16           H2*        U  16  -2.644  24.475  -4.250
  170   2HO*    U  16          2HO*        U  16  -4.610  23.772  -5.151
  171    H1*    U  16           H1*        U  16  -4.693  26.455  -5.329
  172    H3     U  16           H3         U  16  -2.966  24.843  -9.229
  173    H5     U  16           H5         U  16   0.151  27.020  -7.441
  174    H6     U  16           H6         U  16  -1.215  27.191  -5.461
  175   1H5*    C  17          1H5*        C  17  -6.404  23.486  -2.904
  176   2H5*    C  17          2H5*        C  17  -7.246  23.010  -1.417
  177    H4*    C  17           H4*        C  17  -6.384  21.169  -2.970
  178    H3*    C  17           H3*        C  17  -6.818  20.955  -0.281
  179    H2*    C  17           H2*        C  17  -4.544  21.533   0.370
  180   2HO*    C  17          2HO*        C  17  -4.542  18.726  -0.198
  181    H1*    C  17           H1*        C  17  -3.659  19.764  -1.997
  182   1H4     C  17          H41         C  17   1.673  23.426  -1.012
  183   2H4     C  17          H42         C  17   2.082  21.890  -0.259
  184    H5     C  17           H5         C  17  -0.538  23.981  -1.770
  185    H6     C  17           H6         C  17  -2.796  23.131  -2.109
  186   1H5*    G  18          1H5*        G  18  -8.558  21.101  -1.680
  187   2H5*    G  18          2H5*        G  18  -9.909  20.501  -0.698
  188    H4*    G  18           H4*        G  18 -11.262  20.994  -2.371
  189    H3*    G  18           H3*        G  18  -9.874  18.658  -3.577
  190    H2*    G  18           H2*        G  18 -10.142  19.396  -5.763
  191   2HO*    G  18          2HO*        G  18 -12.607  19.332  -4.928
  192    H1*    G  18           H1*        G  18 -11.180  22.106  -4.946
  193    H8     G  18           H8         G  18 -10.653  23.028  -7.293
  194    H1     G  18           H1         G  18  -4.549  21.114  -6.757
  195   1H2     G  18          H21         G  18  -5.621  19.485  -3.909
  196   2H2     G  18          H22         G  18  -4.295  19.861  -4.987
  197   1H5*    G  19          1H5*        G  19 -10.009  15.019  -3.869
  198   2H5*    G  19          2H5*        G  19  -9.427  16.690  -3.778
  199    H4*    G  19           H4*        G  19 -10.753  15.989  -6.292
  200    H3*    G  19           H3*        G  19  -8.531  14.266  -5.396
  201    H2*    G  19           H2*        G  19  -7.116  14.753  -7.248
  202   2HO*    G  19          2HO*        G  19  -9.581  15.444  -8.398
  203    H1*    G  19           H1*        G  19  -7.648  17.451  -7.548
  204    H8     G  19           H8         G  19  -7.567  16.374  -3.900
  205    H1     G  19           H1         G  19  -1.898  18.116  -6.330
  206   1H2     G  19          H21         G  19  -3.520  18.124  -9.369
  207   2H2     G  19          H22         G  19  -2.017  18.356  -8.493
  208   1H5*    C  20          1H5*        C  20  -9.565  12.509  -9.239
  209   2H5*    C  20          2H5*        C  20  -9.652  10.745  -9.062
  210    H4*    C  20           H4*        C  20  -8.068  11.418 -10.787
  211    H3*    C  20           H3*        C  20  -7.071   9.882  -8.424
  212    H2*    C  20           H2*        C  20  -4.797  10.075  -9.205
  213   2HO*    C  20          2HO*        C  20  -6.057  11.074 -11.561
  214    H1*    C  20           H1*        C  20  -4.892  12.764  -9.785
  215   1H4     C  20          H41         C  20  -5.003  12.734  -3.211
  216   2H4     C  20          H42         C  20  -3.305  12.666  -3.621
  217    H5     C  20           H5         C  20  -6.758  12.585  -4.826
  218    H6     C  20           H6         C  20  -7.287  12.387  -7.179
  219   1H5*    C  21          1H5*        C  21  -4.764   8.521 -11.397
  220   2H5*    C  21          2H5*        C  21  -5.298   6.872 -11.776
  221    H4*    C  21           H4*        C  21  -2.990   6.726 -11.801
  222    H3*    C  21           H3*        C  21  -4.085   5.691  -9.217
  223    H2*    C  21           H2*        C  21  -1.862   5.365  -8.362
  224   2HO*    C  21          2HO*        C  21  -1.237   4.850 -10.781
  225    H1*    C  21           H1*        C  21  -0.835   7.799  -9.219
  226   1H4     C  21          H41         C  21  -4.678   9.333  -4.074
  227   2H4     C  21          H42         C  21  -3.110   8.937  -3.384
  228    H5     C  21           H5         C  21  -5.183   9.053  -6.426
  229    H6     C  21           H6         C  21  -4.284   8.329  -8.587
  230   1H5*    U  22          1H5*        U  22  -2.073   0.823  -8.849
  231   2H5*    U  22          2H5*        U  22  -2.675   1.952  -7.620
  232    H4*    U  22           H4*        U  22   0.128   1.380  -8.482
  233    H3*    U  22           H3*        U  22  -1.303   1.403  -5.846
  234    H2*    U  22           H2*        U  22   0.723   2.120  -4.761
  235   2HO*    U  22          2HO*        U  22   1.913   0.733  -6.548
  236    H1*    U  22           H1*        U  22   1.399   4.045  -6.667
  237    H3     U  22           H3         U  22  -0.059   6.299  -2.985
  238    H5     U  22           H5         U  22  -3.527   5.319  -5.140
  239    H6     U  22           H6         U  22  -2.162   3.935  -6.559
  240   1H5*    G  23          1H5*        G  23   1.477   0.022  -3.828
  241   2H5*    G  23          2H5*        G  23   0.807  -1.360  -2.940
  242    H4*    G  23           H4*        G  23   1.490   0.746  -1.639
  243    H3*    G  23           H3*        G  23  -1.034  -0.810  -1.210
  244    H2*    G  23           H2*        G  23  -1.767   0.800   0.419
  245   2HO*    G  23          2HO*        G  23  -0.054   1.427   1.583
  246    H1*    G  23           H1*        G  23  -1.067   3.059  -1.051
  247    H8     G  23           H8         G  23  -2.189   0.979  -3.780
  248    H1     G  23           H1         G  23  -7.092   2.767  -0.050
  249   1H2     G  23          H21         G  23  -4.649   3.645   2.235
  250   2H2     G  23          H22         G  23  -6.355   3.551   1.858
  251   1H5*    C  24          1H5*        C  24  -2.042  -2.010   2.990
  252   2H5*    C  24          2H5*        C  24  -2.486  -0.489   2.194
  253    H4*    C  24           H4*        C  24  -0.744  -0.072   4.477
  254    H3*    C  24           H3*        C  24  -3.245  -1.659   4.988
  255    H2*    C  24           H2*        C  24  -3.698  -0.269   6.898
  256   2HO*    C  24          2HO*        C  24  -1.306  -0.198   7.383
  257    H1*    C  24           H1*        C  24  -3.039   2.148   5.639
  258   1H4     C  24          H41         C  24  -9.081   0.823   3.412
  259   2H4     C  24          H42         C  24  -9.340   1.495   5.013
  260    H5     C  24           H5         C  24  -6.882   0.300   2.549
  261    H6     C  24           H6         C  24  -4.492   0.318   3.037
  262   1H5*    U  25          1H5*        U  25  -3.512  -3.086   7.683
  263   2H5*    U  25          2H5*        U  25  -3.439  -4.854   7.552
  264    H4*    U  25           H4*        U  25  -5.718  -3.935   7.894
  265    H3*    U  25           H3*        U  25  -5.148  -5.645   5.486
  266    H2*    U  25           H2*        U  25  -7.479  -5.424   4.867
  267   2HO*    U  25          2HO*        U  25  -8.456  -3.723   6.622
  268    H1*    U  25           H1*        U  25  -7.559  -2.678   5.235
  269    H3     U  25           H3         U  25  -7.328  -3.185   0.735
  270    H5     U  25           H5         U  25  -3.371  -3.637   2.065
  271    H6     U  25           H6         U  25  -4.208  -3.618   4.323
  272   1H5*    U  26          1H5*        U  26  -8.631  -7.584   7.087
  273   2H5*    U  26          2H5*        U  26  -8.414  -9.319   6.785
  274    H4*    U  26           H4*        U  26 -10.431  -8.319   5.728
  275    H3*    U  26           H3*        U  26  -8.396  -9.687   3.972
  276    H2*    U  26           H2*        U  26  -9.858  -9.266   2.110
  277   2HO*    U  26          2HO*        U  26 -11.727  -9.494   3.956
  278    H1*    U  26           H1*        U  26 -10.577  -6.655   2.962
  279    H3     U  26           H3         U  26  -8.274  -6.424  -0.995
  280    H5     U  26           H5         U  26  -5.379  -6.399   2.048
  281    H6     U  26           H6         U  26  -7.126  -6.952   3.608
  282   1H5*    U  27          1H5*        U  27 -12.517 -11.542   3.329
  283   2H5*    U  27          2H5*        U  27 -12.160 -13.247   2.994
  284    H4*    U  27           H4*        U  27 -13.651 -12.157   1.338
  285    H3*    U  27           H3*        U  27 -11.086 -13.432   0.431
  286    H2*    U  27           H2*        U  27 -11.642 -12.813  -1.841
  287   2HO*    U  27          2HO*        U  27 -13.787 -12.956  -2.108
  288    H1*    U  27           H1*        U  27 -12.279 -10.185  -1.222
  289    H3     U  27           H3         U  27  -8.131  -9.981  -3.018
  290    H5     U  27           H5         U  27  -7.504 -11.104   0.981
  291    H6     U  27           H6         U  27  -9.883 -11.396   1.186
  292   1H5*    U  28          1H5*        U  28 -14.198 -15.938  -1.837
  293   2H5*    U  28          2H5*        U  28 -13.498 -17.565  -1.736
  294    H4*    U  28           H4*        U  28 -14.028 -16.853  -4.034
  295    H3*    U  28           H3*        U  28 -11.185 -17.562  -3.367
  296    H2*    U  28           H2*        U  28 -10.606 -17.139  -5.682
  297   2HO*    U  28          2HO*        U  28 -12.266 -17.696  -6.956
  298    H1*    U  28           H1*        U  28 -11.843 -14.673  -5.761
  299    H3     U  28           H3         U  28  -7.313 -14.138  -5.121
  300    H5     U  28           H5         U  28  -9.049 -14.283  -1.296
  301    H6     U  28           H6         U  28 -11.105 -14.970  -2.339
  302   1H5*    G  29          1H5*        G  29 -11.294 -20.973  -5.905
  303   2H5*    G  29          2H5*        G  29 -10.540 -22.243  -4.922
  304    H4*    G  29           H4*        G  29  -9.237 -21.554  -6.930
  305    H3*    G  29           H3*        G  29  -7.936 -21.334  -4.217
  306    H2*    G  29           H2*        G  29  -5.959 -20.546  -5.310
  307   2HO*    G  29          2HO*        G  29  -6.815 -20.832  -7.911
  308    H1*    G  29           H1*        G  29  -7.374 -19.104  -7.362
  309    H8     G  29           H8         G  29  -8.814 -17.997  -4.182
  310    H1     G  29           H1         G  29  -3.024 -15.458  -5.276
  311   1H2     G  29          H21         G  29  -2.762 -17.864  -7.744
  312   2H2     G  29          H22         G  29  -2.019 -16.519  -6.906
  313   1H5*    C  30          1H5*        C  30  -4.924 -23.121  -6.728
  314   2H5*    C  30          2H5*        C  30  -4.453 -24.567  -5.814
  315    H4*    C  30           H4*        C  30  -2.519 -23.255  -6.487
  316    H3*    C  30           H3*        C  30  -3.036 -23.555  -3.546
  317    H2*    C  30           H2*        C  30  -1.091 -22.208  -3.087
  318   2HO*    C  30          2HO*        C  30  -0.597 -22.090  -5.891
  319    H1*    C  30           H1*        C  30  -1.653 -20.251  -4.993
  320   1H4     C  30          H41         C  30  -5.830 -19.077  -0.019
  321   2H4     C  30          H42         C  30  -4.439 -18.047   0.266
  322    H5     C  30           H5         C  30  -5.919 -20.701  -1.805
  323    H6     C  30           H6         C  30  -4.703 -21.671  -3.683
  324   1H5*    U  31          1H5*        U  31   1.000 -23.789  -4.148
  325   2H5*    U  31          2H5*        U  31   1.579 -25.367  -3.579
  326    H4*    U  31           H4*        U  31   3.076 -23.716  -2.779
  327    H3*    U  31           H3*        U  31   1.318 -24.855  -0.623
  328    H2*    U  31           H2*        U  31   2.416 -23.433   0.973
  329   2HO*    U  31          2HO*        U  31   4.486 -23.106   0.615
  330    H1*    U  31           H1*        U  31   2.460 -21.159  -0.685
  331    H3     U  31           H3         U  31  -0.569 -19.982   2.434
  332    H5     U  31           H5         U  31  -2.587 -22.803   0.066
  333    H6     U  31           H6         U  31  -0.509 -23.217  -1.076
  334    H3T    U  31           H3T        U  31   2.728 -26.286  -1.033
  Start of MODEL   31
    1   1H5*    A   1          1H5*        A   1  -3.137 -12.599   8.664
    2   2H5*    A   1          2H5*        A   1  -3.905 -14.056   8.008
    3    H4*    A   1           H4*        A   1  -1.153 -13.863   9.225
    4    H3*    A   1           H3*        A   1  -2.044 -13.929   6.364
    5    H2*    A   1           H2*        A   1  -0.221 -15.420   5.831
    6   2HO*    A   1          2HO*        A   1   1.501 -14.842   7.016
    7    H1*    A   1           H1*        A   1  -0.637 -17.140   7.956
    8    H8     A   1           H8         A   1  -4.103 -16.278   7.385
    9   1H6     A   1          H61         A   1  -4.111 -19.852   2.329
   10   2H6     A   1          H62         A   1  -5.107 -18.983   3.474
   11    H2     A   1           H2         A   1   0.150 -19.218   3.581
   12    H5T    A   1           H5T        A   1  -3.067 -14.674  10.423
   13   1H5*    G   2          1H5*        G   2   2.070 -12.662   5.550
   14   2H5*    G   2          2H5*        G   2   1.827 -11.229   4.533
   15    H4*    G   2           H4*        G   2   3.279 -12.949   3.514
   16    H3*    G   2           H3*        G   2   0.766 -12.131   2.076
   17    H2*    G   2           H2*        G   2   1.346 -13.654   0.307
   18   2HO*    G   2          2HO*        G   2   3.692 -13.026   0.589
   19    H1*    G   2           H1*        G   2   2.227 -15.719   2.016
   20    H8     G   2           H8         G   2  -0.759 -14.714   3.771
   21    H1     G   2           H1         G   2  -2.188 -17.602  -1.774
   22   1H2     G   2          H21         G   2   1.143 -17.086  -2.561
   23   2H2     G   2          H22         G   2  -0.411 -17.717  -3.056
   24   1H5*    U   3          1H5*        U   3   4.078 -11.159  -0.916
   25   2H5*    U   3          2H5*        U   3   3.507  -9.633  -1.616
   26    H4*    U   3           H4*        U   3   4.028 -11.247  -3.343
   27    H3*    U   3           H3*        U   3   1.127 -10.480  -3.105
   28    H2*    U   3           H2*        U   3   0.683 -11.891  -5.012
   29   2HO*    U   3          2HO*        U   3   2.551 -12.951  -6.025
   30    H1*    U   3           H1*        U   3   2.269 -14.015  -4.105
   31    H3     U   3           H3         U   3  -1.938 -15.561  -3.541
   32    H5     U   3           H5         U   3  -1.397 -12.847  -0.382
   33    H6     U   3           H6         U   3   0.697 -12.214  -1.385
   34   1H5*    A   4          1H5*        A   4   2.529  -9.167  -7.387
   35   2H5*    A   4          2H5*        A   4   1.687  -7.611  -7.519
   36    H4*    A   4           H4*        A   4   1.435  -9.059  -9.500
   37    H3*    A   4           H3*        A   4  -0.998  -8.113  -8.029
   38    H2*    A   4           H2*        A   4  -2.397  -9.364  -9.569
   39   2HO*    A   4          2HO*        A   4  -0.224 -10.513 -10.896
   40    H1*    A   4           H1*        A   4  -1.012 -11.715  -9.292
   41    H8     A   4           H8         A   4  -0.292 -10.293  -6.018
   42   1H6     A   4          H61         A   4  -6.002 -11.774  -4.168
   43   2H6     A   4          H62         A   4  -4.409 -11.268  -3.652
   44    H2     A   4           H2         A   4  -5.848 -12.148  -8.640
   45   1H5*    G   5          1H5*        G   5  -2.086  -5.808 -11.589
   46   2H5*    G   5          2H5*        G   5  -2.557  -4.233 -10.923
   47    H4*    G   5           H4*        G   5  -4.398  -5.432 -12.039
   48    H3*    G   5           H3*        G   5  -4.714  -4.719  -9.132
   49    H2*    G   5           H2*        G   5  -6.929  -5.695  -9.214
   50   2HO*    G   5          2HO*        G   5  -6.453  -6.166 -11.991
   51    H1*    G   5           H1*        G   5  -6.116  -8.016 -10.511
   52    H8     G   5           H8         G   5  -3.202  -7.351  -8.404
   53    H1     G   5           H1         G   5  -8.268  -9.318  -4.994
   54   1H2     G   5          H21         G   5 -10.072  -8.678  -7.864
   55   2H2     G   5          H22         G   5 -10.085  -9.228  -6.202
   56   1H5*    A   6          1H5*        A   6  -8.185  -4.269 -10.705
   57   2H5*    A   6          2H5*        A   6  -8.818  -2.619 -10.558
   58    H4*    A   6           H4*        A   6 -10.415  -4.401  -9.913
   59    H3*    A   6           H3*        A   6 -10.268  -1.967  -8.755
   60    H2*    A   6           H2*        A   6  -8.852  -2.564  -6.892
   61   2HO*    A   6          2HO*        A   6 -11.052  -1.962  -6.136
   62    H1*    A   6           H1*        A   6 -10.383  -5.210  -6.636
   63    H8     A   6           H8         A   6  -6.659  -4.550  -7.289
   64   1H6     A   6          H61         A   6  -5.716  -6.686  -1.556
   65   2H6     A   6          H62         A   6  -4.953  -6.140  -3.038
   66    H2     A   6           H2         A   6 -10.147  -6.477  -2.253
   67   1H5*    A   7          1H5*        A   7 -13.431  -3.849  -5.998
   68   2H5*    A   7          2H5*        A   7 -14.738  -2.651  -5.928
   69    H4*    A   7           H4*        A   7 -14.309  -3.094  -3.704
   70    H3*    A   7           H3*        A   7 -12.816  -0.595  -4.463
   71    H2*    A   7           H2*        A   7 -11.776  -0.563  -2.341
   72   2HO*    A   7          2HO*        A   7 -14.236  -1.670  -1.641
   73    H1*    A   7           H1*        A   7 -12.144  -3.450  -1.858
   74    H8     A   7           H8         A   7  -9.772  -2.276  -4.594
   75   1H6     A   7          H61         A   7  -5.308  -2.844  -0.340
   76   2H6     A   7          H62         A   7  -5.650  -2.555  -2.031
   77    H2     A   7           H2         A   7  -9.262  -3.382   1.707
   78   1H5*    A   8          1H5*        A   8 -16.111   1.876  -1.052
   79   2H5*    A   8          2H5*        A   8 -14.749   3.014  -1.031
   80    H4*    A   8           H4*        A   8 -15.747   1.533   1.103
   81    H3*    A   8           H3*        A   8 -13.257   3.189   0.775
   82    H2*    A   8           H2*        A   8 -12.474   2.340   2.885
   83   2HO*    A   8          2HO*        A   8 -14.205   0.713   3.826
   84    H1*    A   8           H1*        A   8 -13.303  -0.310   2.436
   85    H8     A   8           H8         A   8 -11.796   1.274  -0.656
   86   1H6     A   8          H61         A   8  -6.337  -0.802   1.402
   87   2H6     A   8          H62         A   8  -7.174  -0.058   0.059
   88    H2     A   8           H2         A   8  -9.379  -1.457   4.630
   89   1H5*    C   9          1H5*        C   9 -14.357   4.438   5.272
   90   2H5*    C   9          2H5*        C   9 -13.784   6.091   4.974
   91    H4*    C   9           H4*        C   9 -12.647   4.734   6.810
   92    H3*    C   9           H3*        C   9 -11.218   6.354   4.743
   93    H2*    C   9           H2*        C   9  -9.089   5.558   5.521
   94   2HO*    C   9          2HO*        C   9  -8.891   5.072   7.581
   95    H1*    C   9           H1*        C   9  -9.814   2.886   5.777
   96   1H4     C   9          H41         C   9  -9.212   3.778  -0.733
   97   2H4     C   9          H42         C   9  -7.698   3.072  -0.187
   98    H5     C   9           H5         C   9 -10.984   4.438   0.790
   99    H6     C   9           H6         C   9 -11.663   4.532   3.128
  100   1H5*    A  10          1H5*        A  10  -9.036   7.328   8.185
  101   2H5*    A  10          2H5*        A  10  -8.512   9.018   8.054
  102    H4*    A  10           H4*        A  10  -6.733   7.172   8.089
  103    H3*    A  10           H3*        A  10  -6.752   9.504   6.208
  104    H2*    A  10           H2*        A  10  -4.809   8.634   5.091
  105   2HO*    A  10          2HO*        A  10  -4.189   6.399   6.225
  106    H1*    A  10           H1*        A  10  -5.659   5.972   5.030
  107    H8     A  10           H8         A  10  -8.837   7.525   4.301
  108   1H6     A  10          H61         A  10  -6.852   8.765  -1.430
  109   2H6     A  10          H62         A  10  -8.249   8.683  -0.380
  110    H2     A  10           H2         A  10  -3.298   7.617   1.055
  111   1H5*    A  11          1H5*        A  11  -3.508  12.243   5.976
  112   2H5*    A  11          2H5*        A  11  -3.199  10.576   5.452
  113    H4*    A  11           H4*        A  11  -1.394  12.312   7.132
  114    H3*    A  11           H3*        A  11  -1.456  12.639   4.520
  115    H2*    A  11           H2*        A  11  -1.362  10.324   3.838
  116   2HO*    A  11          2HO*        A  11   1.118   9.932   3.688
  117    H1*    A  11           H1*        A  11   0.838   9.726   5.864
  118    H8     A  11           H8         A  11  -2.430   8.252   6.646
  119   1H6     A  11          H61         A  11  -0.737   3.209   3.481
  120   2H6     A  11          H62         A  11  -1.905   3.881   4.596
  121    H2     A  11           H2         A  11   2.194   6.479   2.560
  122   1H5*    G  12          1H5*        G  12   2.836  11.573   4.327
  123   2H5*    G  12          2H5*        G  12   3.592  13.168   4.145
  124    H4*    G  12           H4*        G  12   4.737  11.858   2.629
  125    H3*    G  12           H3*        G  12   2.614  13.425   1.203
  126    H2*    G  12           H2*        G  12   3.212  12.343  -0.863
  127   2HO*    G  12          2HO*        G  12   5.085  11.149  -1.056
  128    H1*    G  12           H1*        G  12   3.376   9.778   0.185
  129    H8     G  12           H8         G  12   0.659  11.952   1.748
  130    H1     G  12           H1         G  12  -1.161   8.531  -3.364
  131   1H2     G  12          H21         G  12   2.198   7.764  -3.674
  132   2H2     G  12          H22         G  12   0.575   7.572  -4.299
  133   1H5*    G  13          1H5*        G  13   5.949  12.910  -1.108
  134   2H5*    G  13          2H5*        G  13   6.658  14.499  -1.459
  135    H4*    G  13           H4*        G  13   6.778  13.321  -3.467
  136    H3*    G  13           H3*        G  13   4.487  15.263  -3.511
  137    H2*    G  13           H2*        G  13   3.953  14.518  -5.745
  138   2HO*    G  13          2HO*        G  13   5.534  12.612  -6.373
  139    H1*    G  13           H1*        G  13   4.180  11.803  -5.172
  140    H8     G  13           H8         G  13   2.790  13.716  -2.222
  141    H1     G  13           H1         G  13  -1.588  11.778  -6.495
  142   1H2     G  13          H21         G  13   1.127  10.965  -8.468
  143   2H2     G  13          H22         G  13  -0.613  11.013  -8.296
  144   1H5*    C  14          1H5*        C  14   6.156  16.604  -7.327
  145   2H5*    C  14          2H5*        C  14   6.502  18.294  -6.911
  146    H4*    C  14           H4*        C  14   5.231  18.380  -8.869
  147    H3*    C  14           H3*        C  14   3.474  18.998  -6.497
  148    H2*    C  14           H2*        C  14   1.675  19.374  -8.059
  149   2HO*    C  14          2HO*        C  14   2.094  19.413 -10.304
  150    H1*    C  14           H1*        C  14   2.280  17.120  -9.641
  151   1H4     C  14          H41         C  14  -1.092  14.883  -4.432
  152   2H4     C  14          H42         C  14  -2.307  15.394  -5.596
  153    H5     C  14           H5         C  14   1.271  15.244  -4.785
  154    H6     C  14           H6         C  14   2.944  16.176  -6.290
  155   1H5*    U  15          1H5*        U  15   1.912  22.187  -8.929
  156   2H5*    U  15          2H5*        U  15   1.994  23.502  -7.741
  157    H4*    U  15           H4*        U  15  -0.282  23.054  -8.582
  158    H3*    U  15           H3*        U  15   0.265  22.856  -5.636
  159    H2*    U  15           H2*        U  15  -2.046  22.273  -5.278
  160   2HO*    U  15          2HO*        U  15  -2.364  22.781  -8.076
  161    H1*    U  15           H1*        U  15  -2.165  20.398  -7.312
  162    H3     U  15           H3         U  15  -1.870  17.927  -3.515
  163    H5     U  15           H5         U  15   2.078  19.076  -4.363
  164    H6     U  15           H6         U  15   1.209  20.517  -6.083
  165   1H5*    U  16          1H5*        U  16  -2.724  27.275  -4.608
  166   2H5*    U  16          2H5*        U  16  -2.903  26.165  -3.235
  167    H4*    U  16           H4*        U  16  -5.068  26.890  -3.827
  168    H3*    U  16           H3*        U  16  -4.750  24.310  -3.542
  169    H2*    U  16           H2*        U  16  -3.945  23.777  -5.760
  170   2HO*    U  16          2HO*        U  16  -5.535  22.386  -6.042
  171    H1*    U  16           H1*        U  16  -6.120  25.469  -7.060
  172    H3     U  16           H3         U  16  -3.866  24.082 -10.764
  173    H5     U  16           H5         U  16  -1.197  26.604  -8.722
  174    H6     U  16           H6         U  16  -2.750  26.619  -6.878
  175   1H5*    C  17          1H5*        C  17  -7.776  22.276  -4.705
  176   2H5*    C  17          2H5*        C  17  -8.633  21.745  -3.245
  177    H4*    C  17           H4*        C  17  -7.452  19.991  -4.716
  178    H3*    C  17           H3*        C  17  -8.086  19.757  -2.068
  179    H2*    C  17           H2*        C  17  -5.962  20.619  -1.247
  180   2HO*    C  17          2HO*        C  17  -4.636  18.621  -0.916
  181    H1*    C  17           H1*        C  17  -4.670  18.930  -3.481
  182   1H4     C  17          H41         C  17   0.069  23.244  -2.153
  183   2H4     C  17          H42         C  17   0.586  21.791  -1.305
  184    H5     C  17           H5         C  17  -2.111  23.496  -3.135
  185    H6     C  17           H6         C  17  -4.208  22.364  -3.638
  186   1H5*    G  18          1H5*        G  18  -9.727  19.695  -3.582
  187   2H5*    G  18          2H5*        G  18 -11.061  18.923  -2.703
  188    H4*    G  18           H4*        G  18 -12.326  19.280  -4.480
  189    H3*    G  18           H3*        G  18 -10.630  17.069  -5.512
  190    H2*    G  18           H2*        G  18 -10.791  17.730  -7.731
  191   2HO*    G  18          2HO*        G  18 -13.451  18.515  -7.020
  192    H1*    G  18           H1*        G  18 -12.157  20.337  -7.082
  193    H8     G  18           H8         G  18 -11.548  21.236  -9.418
  194    H1     G  18           H1         G  18  -5.335  20.040  -8.333
  195   1H2     G  18          H21         G  18  -6.448  18.374  -5.524
  196   2H2     G  18          H22         G  18  -5.089  18.868  -6.508
  197   1H5*    G  19          1H5*        G  19 -10.386  13.422  -5.664
  198   2H5*    G  19          2H5*        G  19  -9.971  15.142  -5.564
  199    H4*    G  19           H4*        G  19 -10.974  14.261  -8.173
  200    H3*    G  19           H3*        G  19  -8.692  12.796  -7.014
  201    H2*    G  19           H2*        G  19  -7.147  13.397  -8.720
  202   2HO*    G  19          2HO*        G  19  -9.246  13.177 -10.238
  203    H1*    G  19           H1*        G  19  -7.946  16.018  -9.177
  204    H8     G  19           H8         G  19  -8.084  15.056  -5.501
  205    H1     G  19           H1         G  19  -2.448  17.386  -7.476
  206   1H2     G  19          H21         G  19  -3.771  17.135 -10.646
  207   2H2     G  19          H22         G  19  -2.398  17.566  -9.639
  208   1H5*    C  20          1H5*        C  20  -9.119  10.561 -10.937
  209   2H5*    C  20          2H5*        C  20  -9.078   8.866 -10.414
  210    H4*    C  20           H4*        C  20  -7.383   9.409 -12.113
  211    H3*    C  20           H3*        C  20  -6.554   8.317  -9.454
  212    H2*    C  20           H2*        C  20  -4.228   8.532 -10.060
  213   2HO*    C  20          2HO*        C  20  -3.735   9.339 -12.224
  214    H1*    C  20           H1*        C  20  -4.410  11.107 -11.019
  215   1H4     C  20          H41         C  20  -5.204  11.908  -4.536
  216   2H4     C  20          H42         C  20  -3.472  11.928  -4.774
  217    H5     C  20           H5         C  20  -6.769  11.410  -6.271
  218    H6     C  20           H6         C  20  -7.040  10.863  -8.613
  219   1H5*    C  21          1H5*        C  21  -3.738   6.785 -11.530
  220   2H5*    C  21          2H5*        C  21  -3.903   5.019 -11.554
  221    H4*    C  21           H4*        C  21  -1.669   5.518 -10.958
  222    H3*    C  21           H3*        C  21  -3.295   4.538  -8.623
  223    H2*    C  21           H2*        C  21  -1.339   4.732  -7.242
  224   2HO*    C  21          2HO*        C  21   0.381   5.615  -9.214
  225    H1*    C  21           H1*        C  21  -0.453   7.169  -8.377
  226   1H4     C  21          H41         C  21  -4.934   8.880  -3.864
  227   2H4     C  21          H42         C  21  -3.454   8.633  -2.951
  228    H5     C  21           H5         C  21  -5.125   8.355  -6.223
  229    H6     C  21           H6         C  21  -3.931   7.515  -8.182
  230   1H5*    U  22          1H5*        U  22  -1.561   0.839  -6.293
  231   2H5*    U  22          2H5*        U  22  -2.032   2.534  -6.065
  232    H4*    U  22           H4*        U  22   0.842   1.671  -6.222
  233    H3*    U  22           H3*        U  22  -0.934   1.526  -3.807
  234    H2*    U  22           H2*        U  22   0.834   2.451  -2.463
  235   2HO*    U  22          2HO*        U  22   2.930   2.616  -3.246
  236    H1*    U  22           H1*        U  22   1.584   4.428  -4.294
  237    H3     U  22           H3         U  22  -0.640   6.115  -0.583
  238    H5     U  22           H5         U  22  -3.449   5.709  -3.678
  239    H6     U  22           H6         U  22  -1.802   4.457  -4.906
  240   1H5*    G  23          1H5*        G  23   2.104   0.606  -1.761
  241   2H5*    G  23          2H5*        G  23   1.915  -1.077  -1.232
  242    H4*    G  23           H4*        G  23   2.373   0.355   0.650
  243    H3*    G  23           H3*        G  23  -0.296  -0.991   0.561
  244    H2*    G  23           H2*        G  23  -0.987   0.148   2.565
  245   2HO*    G  23          2HO*        G  23   0.460   1.134   3.894
  246    H1*    G  23           H1*        G  23  -0.080   2.660   1.825
  247    H8     G  23           H8         G  23  -1.067   1.543  -1.458
  248    H1     G  23           H1         G  23  -6.179   2.470   2.305
  249   1H2     G  23          H21         G  23  -3.891   2.481   4.904
  250   2H2     G  23          H22         G  23  -5.563   2.611   4.409
  251   1H5*    C  24          1H5*        C  24  -1.543  -3.249   4.366
  252   2H5*    C  24          2H5*        C  24  -1.860  -1.573   3.877
  253    H4*    C  24           H4*        C  24  -0.169  -1.761   6.237
  254    H3*    C  24           H3*        C  24  -2.826  -3.162   6.362
  255    H2*    C  24           H2*        C  24  -3.210  -2.148   8.512
  256   2HO*    C  24          2HO*        C  24  -1.008  -0.616   8.766
  257    H1*    C  24           H1*        C  24  -2.309   0.396   7.762
  258   1H4     C  24          H41         C  24  -8.359   0.038   5.204
  259   2H4     C  24          H42         C  24  -8.616   0.424   6.897
  260    H5     C  24           H5         C  24  -6.180  -0.501   4.298
  261    H6     C  24           H6         C  24  -3.814  -0.779   4.825
  262   1H5*    U  25          1H5*        U  25  -3.394  -4.488   8.656
  263   2H5*    U  25          2H5*        U  25  -3.461  -6.261   8.669
  264    H4*    U  25           H4*        U  25  -5.675  -5.370   8.868
  265    H3*    U  25           H3*        U  25  -5.095  -6.785   6.283
  266    H2*    U  25           H2*        U  25  -7.367  -6.330   5.579
  267   2HO*    U  25          2HO*        U  25  -7.643  -5.482   8.285
  268    H1*    U  25           H1*        U  25  -7.314  -3.655   6.277
  269    H3     U  25           H3         U  25  -6.684  -3.399   1.819
  270    H5     U  25           H5         U  25  -2.979  -4.702   3.293
  271    H6     U  25           H6         U  25  -3.998  -4.907   5.463
  272   1H5*    U  26          1H5*        U  26  -8.846  -8.522   7.323
  273   2H5*    U  26          2H5*        U  26  -8.749 -10.219   6.817
  274    H4*    U  26           H4*        U  26 -10.550  -8.905   5.717
  275    H3*    U  26           H3*        U  26  -8.466 -10.239   3.994
  276    H2*    U  26           H2*        U  26  -9.677  -9.451   2.075
  277   2HO*    U  26          2HO*        U  26 -11.766  -8.523   2.338
  278    H1*    U  26           H1*        U  26 -10.285  -6.914   3.206
  279    H3     U  26           H3         U  26  -7.608  -6.297  -0.449
  280    H5     U  26           H5         U  26  -5.013  -7.057   2.765
  281    H6     U  26           H6         U  26  -6.938  -7.660   4.076
  282   1H5*    U  27          1H5*        U  27 -12.565 -11.520   2.905
  283   2H5*    U  27          2H5*        U  27 -12.503 -13.165   2.243
  284    H4*    U  27           H4*        U  27 -13.652 -11.507   0.797
  285    H3*    U  27           H3*        U  27 -11.315 -13.067  -0.265
  286    H2*    U  27           H2*        U  27 -11.580 -11.928  -2.385
  287   2HO*    U  27          2HO*        U  27 -13.335 -10.317  -2.507
  288    H1*    U  27           H1*        U  27 -11.737  -9.396  -1.274
  289    H3     U  27           H3         U  27  -7.493  -9.746  -2.835
  290    H5     U  27           H5         U  27  -7.423 -11.664   0.899
  291    H6     U  27           H6         U  27  -9.820 -11.485   0.947
  292   1H5*    U  28          1H5*        U  28 -14.534 -14.473  -3.137
  293   2H5*    U  28          2H5*        U  28 -14.106 -16.175  -3.402
  294    H4*    U  28           H4*        U  28 -14.221 -14.833  -5.471
  295    H3*    U  28           H3*        U  28 -11.620 -16.182  -4.778
  296    H2*    U  28           H2*        U  28 -10.740 -15.354  -6.878
  297   2HO*    U  28          2HO*        U  28 -13.471 -14.930  -7.355
  298    H1*    U  28           H1*        U  28 -11.650 -12.758  -6.474
  299    H3     U  28           H3         U  28  -7.150 -12.871  -5.628
  300    H5     U  28           H5         U  28  -9.033 -13.813  -1.993
  301    H6     U  28           H6         U  28 -11.105 -13.998  -3.203
  302   1H5*    G  29          1H5*        G  29 -11.955 -18.895  -8.021
  303   2H5*    G  29          2H5*        G  29 -11.565 -20.465  -7.292
  304    H4*    G  29           H4*        G  29  -9.897 -19.698  -8.939
  305    H3*    G  29           H3*        G  29  -8.965 -20.145  -6.107
  306    H2*    G  29           H2*        G  29  -6.769 -19.513  -6.788
  307   2HO*    G  29          2HO*        G  29  -6.069 -19.880  -8.801
  308    H1*    G  29           H1*        G  29  -7.665 -17.626  -8.792
  309    H8     G  29           H8         G  29  -9.206 -16.753  -5.550
  310    H1     G  29           H1         G  29  -3.087 -14.883  -6.010
  311   1H2     G  29          H21         G  29  -2.978 -16.933  -8.792
  312   2H2     G  29          H22         G  29  -2.126 -15.830  -7.735
  313   1H5*    C  30          1H5*        C  30  -5.913 -21.867  -8.534
  314   2H5*    C  30          2H5*        C  30  -5.732 -23.507  -7.882
  315    H4*    C  30           H4*        C  30  -3.587 -22.426  -8.022
  316    H3*    C  30           H3*        C  30  -4.573 -22.939  -5.224
  317    H2*    C  30           H2*        C  30  -2.515 -22.004  -4.395
  318   2HO*    C  30          2HO*        C  30  -1.460 -23.019  -6.485
  319    H1*    C  30           H1*        C  30  -2.463 -19.852  -6.210
  320   1H4     C  30          H41         C  30  -6.651 -18.130  -1.404
  321   2H4     C  30          H42         C  30  -5.119 -17.359  -1.027
  322    H5     C  30           H5         C  30  -6.928 -19.663  -3.255
  323    H6     C  30           H6         C  30  -5.800 -20.769  -5.114
  324   1H5*    U  31          1H5*        U  31  -0.387 -24.087  -5.353
  325   2H5*    U  31          2H5*        U  31  -0.380 -25.727  -4.676
  326    H4*    U  31           H4*        U  31   1.311 -24.308  -3.646
  327    H3*    U  31           H3*        U  31  -0.895 -25.300  -1.853
  328    H2*    U  31           H2*        U  31   0.177 -24.191  -0.016
  329   2HO*    U  31          2HO*        U  31   2.345 -23.526  -1.737
  330    H1*    U  31           H1*        U  31   0.889 -21.879  -1.496
  331    H3     U  31           H3         U  31  -2.122 -20.365   1.521
  332    H5     U  31           H5         U  31  -4.432 -22.324  -1.389
  333    H6     U  31           H6         U  31  -2.382 -23.120  -2.369
  334    H3T    U  31           H3T        U  31   0.382 -26.870  -2.466
  Start of MODEL   32
    1   1H5*    A   1          1H5*        A   1  -2.831 -12.706   8.957
    2   2H5*    A   1          2H5*        A   1  -3.106 -14.279   8.186
    3    H4*    A   1           H4*        A   1  -0.470 -13.174   9.144
    4    H3*    A   1           H3*        A   1  -1.666 -13.328   6.402
    5    H2*    A   1           H2*        A   1   0.472 -13.986   5.499
    6   2HO*    A   1          2HO*        A   1   1.465 -12.552   7.366
    7    H1*    A   1           H1*        A   1   1.018 -15.901   7.421
    8    H8     A   1           H8         A   1  -2.568 -16.362   7.320
    9   1H6     A   1          H61         A   1  -1.999 -19.272   1.888
   10   2H6     A   1          H62         A   1  -3.068 -18.932   3.230
   11    H2     A   1           H2         A   1   1.875 -17.186   2.759
   12    H5T    A   1           H5T        A   1  -3.357 -13.925  10.638
   13   1H5*    G   2          1H5*        G   2   1.578 -11.024   5.655
   14   2H5*    G   2          2H5*        G   2   1.232  -9.699   4.527
   15    H4*    G   2           H4*        G   2   2.922 -11.332   3.723
   16    H3*    G   2           H3*        G   2   0.450 -10.823   2.084
   17    H2*    G   2           H2*        G   2   1.282 -12.376   0.447
   18   2HO*    G   2          2HO*        G   2   3.573 -11.503   1.024
   19    H1*    G   2           H1*        G   2   2.196 -14.269   2.325
   20    H8     G   2           H8         G   2  -0.963 -13.426   3.839
   21    H1     G   2           H1         G   2  -1.803 -16.664  -1.634
   22   1H2     G   2          H21         G   2   1.520 -15.914  -2.243
   23   2H2     G   2          H22         G   2   0.055 -16.691  -2.800
   24   1H5*    U   3          1H5*        U   3   3.788  -9.523  -0.756
   25   2H5*    U   3          2H5*        U   3   3.068  -8.117  -1.564
   26    H4*    U   3           H4*        U   3   3.877  -9.771  -3.156
   27    H3*    U   3           H3*        U   3   0.921  -9.223  -3.133
   28    H2*    U   3           H2*        U   3   0.672 -10.802  -4.944
   29   2HO*    U   3          2HO*        U   3   2.346 -10.753  -6.282
   30    H1*    U   3           H1*        U   3   2.288 -12.758  -3.792
   31    H3     U   3           H3         U   3  -1.889 -14.379  -3.158
   32    H5     U   3           H5         U   3  -1.466 -11.406  -0.227
   33    H6     U   3           H6         U   3   0.624 -10.797  -1.251
   34   1H5*    A   4          1H5*        A   4   2.164  -7.886  -7.361
   35   2H5*    A   4          2H5*        A   4   1.135  -6.465  -7.621
   36    H4*    A   4           H4*        A   4   0.992  -8.189  -9.398
   37    H3*    A   4           H3*        A   4  -1.476  -7.283  -7.959
   38    H2*    A   4           H2*        A   4  -2.790  -8.850  -9.270
   39   2HO*    A   4          2HO*        A   4  -1.856  -8.901 -11.259
   40    H1*    A   4           H1*        A   4  -1.166 -11.004  -8.761
   41    H8     A   4           H8         A   4  -0.524  -9.173  -5.683
   42   1H6     A   4          H61         A   4  -6.070 -10.915  -3.564
   43   2H6     A   4          H62         A   4  -4.518 -10.231  -3.134
   44    H2     A   4           H2         A   4  -5.943 -11.737  -7.974
   45   1H5*    G   5          1H5*        G   5  -2.873  -5.559 -11.738
   46   2H5*    G   5          2H5*        G   5  -3.456  -3.953 -11.260
   47    H4*    G   5           H4*        G   5  -5.218  -5.429 -12.147
   48    H3*    G   5           H3*        G   5  -5.519  -4.384  -9.339
   49    H2*    G   5           H2*        G   5  -7.666  -5.504  -9.252
   50   2HO*    G   5          2HO*        G   5  -8.607  -6.344 -11.071
   51    H1*    G   5           H1*        G   5  -6.704  -7.906 -10.283
   52    H8     G   5           H8         G   5  -3.822  -6.819  -8.325
   53    H1     G   5           H1         G   5  -8.704  -8.685  -4.602
   54   1H2     G   5          H21         G   5 -10.594  -8.474  -7.483
   55   2H2     G   5          H22         G   5 -10.544  -8.823  -5.769
   56   1H5*    A   6          1H5*        A   6  -9.098  -4.282 -10.871
   57   2H5*    A   6          2H5*        A   6  -9.765  -2.638 -10.875
   58    H4*    A   6           H4*        A   6 -11.305  -4.364  -9.998
   59    H3*    A   6           H3*        A   6 -11.147  -1.827  -9.073
   60    H2*    A   6           H2*        A   6  -9.661  -2.252  -7.214
   61   2HO*    A   6          2HO*        A   6 -11.631  -3.208  -5.637
   62    H1*    A   6           H1*        A   6 -11.180  -4.871  -6.695
   63    H8     A   6           H8         A   6  -7.462  -4.228  -7.432
   64   1H6     A   6          H61         A   6  -6.466  -5.916  -1.560
   65   2H6     A   6          H62         A   6  -5.714  -5.474  -3.082
   66    H2     A   6           H2         A   6 -10.900  -5.831  -2.252
   67   1H5*    A   7          1H5*        A   7 -14.182  -3.564  -6.058
   68   2H5*    A   7          2H5*        A   7 -15.478  -2.356  -5.962
   69    H4*    A   7           H4*        A   7 -14.934  -2.698  -3.751
   70    H3*    A   7           H3*        A   7 -13.419  -0.270  -4.682
   71    H2*    A   7           H2*        A   7 -12.285  -0.185  -2.611
   72   2HO*    A   7          2HO*        A   7 -14.063  -1.906  -1.295
   73    H1*    A   7           H1*        A   7 -12.727  -3.042  -2.004
   74    H8     A   7           H8         A   7 -10.396  -2.011  -4.843
   75   1H6     A   7          H61         A   7  -5.837  -2.639  -0.696
   76   2H6     A   7          H62         A   7  -6.213  -2.369  -2.383
   77    H2     A   7           H2         A   7  -9.748  -3.016   1.463
   78   1H5*    A   8          1H5*        A   8 -16.012   3.071  -1.397
   79   2H5*    A   8          2H5*        A   8 -14.315   3.568  -1.537
   80    H4*    A   8           H4*        A   8 -15.771   2.599   0.750
   81    H3*    A   8           H3*        A   8 -13.111   3.933   0.348
   82    H2*    A   8           H2*        A   8 -12.419   3.159   2.523
   83   2HO*    A   8          2HO*        A   8 -14.735   1.761   3.102
   84    H1*    A   8           H1*        A   8 -13.366   0.562   2.211
   85    H8     A   8           H8         A   8 -12.023   2.015  -1.037
   86   1H6     A   8          H61         A   8  -6.561  -0.377   0.634
   87   2H6     A   8          H62         A   8  -7.451   0.410  -0.651
   88    H2     A   8           H2         A   8  -9.392  -0.830   4.082
   89   1H5*    C   9          1H5*        C   9 -13.965   6.271   4.839
   90   2H5*    C   9          2H5*        C   9 -12.803   7.387   4.095
   91    H4*    C   9           H4*        C   9 -12.304   5.905   6.292
   92    H3*    C   9           H3*        C   9 -10.436   7.093   4.277
   93    H2*    C   9           H2*        C   9  -8.592   5.874   5.234
   94   2HO*    C   9          2HO*        C   9 -10.285   5.847   7.393
   95    H1*    C   9           H1*        C   9  -9.910   3.441   5.441
   96   1H4     C   9          H41         C   9  -8.761   4.037  -1.024
   97   2H4     C   9          H42         C   9  -7.373   3.184  -0.366
   98    H5     C   9           H5         C   9 -10.526   4.957   0.371
   99    H6     C   9           H6         C   9 -11.309   5.230   2.662
  100   1H5*    A  10          1H5*        A  10  -8.575   7.312   8.048
  101   2H5*    A  10          2H5*        A  10  -7.613   8.797   8.191
  102    H4*    A  10           H4*        A  10  -6.450   6.512   8.429
  103    H3*    A  10           H3*        A  10  -5.402   8.877   6.931
  104    H2*    A  10           H2*        A  10  -3.561   7.593   6.083
  105   2HO*    A  10          2HO*        A  10  -3.435   6.445   8.247
  106    H1*    A  10           H1*        A  10  -5.011   5.300   5.454
  107    H8     A  10           H8         A  10  -7.492   7.729   4.448
  108   1H6     A  10          H61         A  10  -4.127   8.995  -0.588
  109   2H6     A  10          H62         A  10  -5.685   9.183   0.184
  110    H2     A  10           H2         A  10  -1.555   6.660   2.252
  111   1H5*    A  11          1H5*        A  11  -2.812  11.305   7.221
  112   2H5*    A  11          2H5*        A  11  -2.679   9.746   6.382
  113    H4*    A  11           H4*        A  11  -0.551  11.300   7.822
  114    H3*    A  11           H3*        A  11  -1.055  11.535   5.227
  115    H2*    A  11           H2*        A  11  -0.975   9.211   4.598
  116   2HO*    A  11          2HO*        A  11   0.917   8.986   3.513
  117    H1*    A  11           H1*        A  11   1.469   8.743   6.367
  118    H8     A  11           H8         A  11  -1.545   7.121   7.617
  119   1H6     A  11          H61         A  11  -0.137   2.137   4.226
  120   2H6     A  11          H62         A  11  -1.144   2.760   5.513
  121    H2     A  11           H2         A  11   2.450   5.534   2.849
  122   1H5*    G  12          1H5*        G  12   3.331  11.011   4.697
  123   2H5*    G  12          2H5*        G  12   3.921  12.634   4.291
  124    H4*    G  12           H4*        G  12   5.034  11.148   2.857
  125    H3*    G  12           H3*        G  12   2.868  12.682   1.455
  126    H2*    G  12           H2*        G  12   3.368  11.496  -0.582
  127   2HO*    G  12          2HO*        G  12   5.194   9.793  -0.173
  128    H1*    G  12           H1*        G  12   3.537   8.982   0.585
  129    H8     G  12           H8         G  12   0.873  10.975   2.342
  130    H1     G  12           H1         G  12  -1.073   8.143  -3.075
  131   1H2     G  12          H21         G  12   2.287   7.497  -3.590
  132   2H2     G  12          H22         G  12   0.646   7.343  -4.177
  133   1H5*    G  13          1H5*        G  13   6.450  12.391  -1.146
  134   2H5*    G  13          2H5*        G  13   6.700  14.067  -1.672
  135    H4*    G  13           H4*        G  13   6.799  12.551  -3.551
  136    H3*    G  13           H3*        G  13   4.486  14.473  -3.534
  137    H2*    G  13           H2*        G  13   3.788  13.556  -5.654
  138   2HO*    G  13          2HO*        G  13   5.116  12.221  -6.840
  139    H1*    G  13           H1*        G  13   4.149  10.889  -4.902
  140    H8     G  13           H8         G  13   2.858  12.825  -1.961
  141    H1     G  13           H1         G  13  -1.686  10.874  -6.053
  142   1H2     G  13          H21         G  13   0.948  10.081  -8.139
  143   2H2     G  13          H22         G  13  -0.784  10.117  -7.893
  144   1H5*    C  14          1H5*        C  14   6.210  15.804  -7.659
  145   2H5*    C  14          2H5*        C  14   6.225  17.529  -7.242
  146    H4*    C  14           H4*        C  14   5.043  17.169  -9.313
  147    H3*    C  14           H3*        C  14   3.298  18.069  -7.022
  148    H2*    C  14           H2*        C  14   1.469  18.152  -8.594
  149   2HO*    C  14          2HO*        C  14   3.479  17.649 -10.569
  150    H1*    C  14           H1*        C  14   2.136  15.706  -9.829
  151   1H4     C  14          H41         C  14  -1.090  14.131  -4.302
  152   2H4     C  14          H42         C  14  -2.348  14.569  -5.448
  153    H5     C  14           H5         C  14   1.261  14.372  -4.800
  154    H6     C  14           H6         C  14   2.882  15.123  -6.455
  155   1H5*    U  15          1H5*        U  15   1.838  21.335  -9.600
  156   2H5*    U  15          2H5*        U  15   1.996  22.637  -8.406
  157    H4*    U  15           H4*        U  15  -0.307  22.282  -9.261
  158    H3*    U  15           H3*        U  15   0.261  22.184  -6.319
  159    H2*    U  15           H2*        U  15  -2.060  21.687  -5.897
  160   2HO*    U  15          2HO*        U  15  -3.411  21.488  -7.933
  161    H1*    U  15           H1*        U  15  -2.277  19.722  -7.827
  162    H3     U  15           H3         U  15  -1.894  17.558  -3.827
  163    H5     U  15           H5         U  15   2.043  18.319  -5.067
  164    H6     U  15           H6         U  15   1.143  19.690  -6.829
  165   1H5*    U  16          1H5*        U  16  -2.540  26.762  -5.487
  166   2H5*    U  16          2H5*        U  16  -2.698  25.768  -4.026
  167    H4*    U  16           H4*        U  16  -4.865  26.488  -4.571
  168    H3*    U  16           H3*        U  16  -4.595  23.915  -4.180
  169    H2*    U  16           H2*        U  16  -3.894  23.263  -6.401
  170   2HO*    U  16          2HO*        U  16  -6.437  23.084  -7.305
  171    H1*    U  16           H1*        U  16  -6.082  24.951  -7.687
  172    H3     U  16           H3         U  16  -4.039  23.356 -11.426
  173    H5     U  16           H5         U  16  -1.200  25.858  -9.601
  174    H6     U  16           H6         U  16  -2.669  25.999  -7.695
  175   1H5*    C  17          1H5*        C  17  -7.764  21.874  -5.044
  176   2H5*    C  17          2H5*        C  17  -8.523  21.480  -3.489
  177    H4*    C  17           H4*        C  17  -7.469  19.600  -4.926
  178    H3*    C  17           H3*        C  17  -8.003  19.536  -2.248
  179    H2*    C  17           H2*        C  17  -5.828  20.379  -1.554
  180   2HO*    C  17          2HO*        C  17  -5.221  17.623  -1.937
  181    H1*    C  17           H1*        C  17  -4.652  18.542  -3.735
  182   1H4     C  17          H41         C  17   0.198  22.837  -2.872
  183   2H4     C  17          H42         C  17   0.714  21.452  -1.919
  184    H5     C  17           H5         C  17  -2.003  23.051  -3.812
  185    H6     C  17           H6         C  17  -4.136  21.929  -4.154
  186   1H5*    G  18          1H5*        G  18  -9.661  19.229  -3.661
  187   2H5*    G  18          2H5*        G  18 -10.976  18.674  -2.607
  188    H4*    G  18           H4*        G  18 -12.341  18.711  -4.338
  189    H3*    G  18           H3*        G  18 -10.628  16.449  -5.221
  190    H2*    G  18           H2*        G  18 -10.900  16.879  -7.485
  191   2HO*    G  18          2HO*        G  18 -12.988  16.297  -7.689
  192    H1*    G  18           H1*        G  18 -12.326  19.498  -7.036
  193    H8     G  18           H8         G  18 -11.860  20.179  -9.470
  194    H1     G  18           H1         G  18  -5.562  19.296  -8.595
  195   1H2     G  18          H21         G  18  -6.479  17.864  -5.591
  196   2H2     G  18          H22         G  18  -5.188  18.307  -6.684
  197   1H5*    G  19          1H5*        G  19 -10.377  12.739  -5.080
  198   2H5*    G  19          2H5*        G  19  -9.943  14.457  -5.137
  199    H4*    G  19           H4*        G  19 -11.092  13.387  -7.611
  200    H3*    G  19           H3*        G  19  -8.756  11.991  -6.472
  201    H2*    G  19           H2*        G  19  -7.303  12.453  -8.301
  202   2HO*    G  19          2HO*        G  19  -9.674  12.427  -9.627
  203    H1*    G  19           H1*        G  19  -8.095  15.050  -8.882
  204    H8     G  19           H8         G  19  -8.084  14.304  -5.151
  205    H1     G  19           H1         G  19  -2.526  16.476  -7.488
  206   1H2     G  19          H21         G  19  -3.979  16.060 -10.581
  207   2H2     G  19          H22         G  19  -2.565  16.535  -9.652
  208   1H5*    C  20          1H5*        C  20  -9.373   9.488 -10.193
  209   2H5*    C  20          2H5*        C  20  -9.309   7.833  -9.554
  210    H4*    C  20           H4*        C  20  -7.688   8.262 -11.361
  211    H3*    C  20           H3*        C  20  -6.752   7.331  -8.675
  212    H2*    C  20           H2*        C  20  -4.452   7.491  -9.395
  213   2HO*    C  20          2HO*        C  20  -4.760   8.558 -11.850
  214    H1*    C  20           H1*        C  20  -4.665  10.007 -10.493
  215   1H4     C  20          H41         C  20  -5.197  11.173  -4.035
  216   2H4     C  20          H42         C  20  -3.476  11.171  -4.347
  217    H5     C  20           H5         C  20  -6.833  10.591  -5.678
  218    H6     C  20           H6         C  20  -7.198   9.914  -7.973
  219   1H5*    C  21          1H5*        C  21  -4.039   5.660 -10.801
  220   2H5*    C  21          2H5*        C  21  -4.196   3.896 -10.696
  221    H4*    C  21           H4*        C  21  -1.936   4.447 -10.256
  222    H3*    C  21           H3*        C  21  -3.427   3.601  -7.783
  223    H2*    C  21           H2*        C  21  -1.402   3.887  -6.525
  224   2HO*    C  21          2HO*        C  21   0.312   3.227  -7.622
  225    H1*    C  21           H1*        C  21  -0.606   6.261  -7.838
  226   1H4     C  21          H41         C  21  -4.903   8.167  -3.221
  227   2H4     C  21          H42         C  21  -3.384   7.980  -2.360
  228    H5     C  21           H5         C  21  -5.188   7.524  -5.539
  229    H6     C  21           H6         C  21  -4.073   6.583  -7.500
  230   1H5*    U  22          1H5*        U  22  -0.926  -0.569  -5.946
  231   2H5*    U  22          2H5*        U  22  -1.723   0.825  -5.192
  232    H4*    U  22           H4*        U  22   1.214   0.408  -5.699
  233    H3*    U  22           H3*        U  22  -0.430   0.504  -3.191
  234    H2*    U  22           H2*        U  22   1.363   1.652  -2.068
  235   2HO*    U  22          2HO*        U  22   2.868   1.096  -4.438
  236    H1*    U  22           H1*        U  22   1.937   3.412  -4.164
  237    H3     U  22           H3         U  22  -0.106   5.707  -0.759
  238    H5     U  22           H5         U  22  -3.186   4.318  -3.253
  239    H6     U  22           H6         U  22  -1.548   2.977  -4.399
  240   1H5*    G  23          1H5*        G  23   2.303  -0.161  -0.942
  241   2H5*    G  23          2H5*        G  23   2.168  -1.826  -0.343
  242    H4*    G  23           H4*        G  23   2.301  -0.474   1.560
  243    H3*    G  23           H3*        G  23  -0.490  -1.443   1.060
  244    H2*    G  23           H2*        G  23  -1.274  -0.191   2.959
  245   2HO*    G  23          2HO*        G  23   0.638  -0.672   4.254
  246    H1*    G  23           H1*        G  23   0.128   2.142   2.373
  247    H8     G  23           H8         G  23  -0.681   1.193  -1.006
  248    H1     G  23           H1         G  23  -5.936   2.964   2.219
  249   1H2     G  23          H21         G  23  -3.963   2.608   5.040
  250   2H2     G  23          H22         G  23  -5.530   3.011   4.374
  251   1H5*    C  24          1H5*        C  24  -2.456  -3.389   4.927
  252   2H5*    C  24          2H5*        C  24  -2.374  -1.735   4.292
  253    H4*    C  24           H4*        C  24  -0.867  -1.938   6.726
  254    H3*    C  24           H3*        C  24  -3.637  -3.093   6.903
  255    H2*    C  24           H2*        C  24  -3.974  -1.865   8.946
  256   2HO*    C  24          2HO*        C  24  -1.345  -0.829   8.819
  257    H1*    C  24           H1*        C  24  -2.840   0.520   8.012
  258   1H4     C  24          H41         C  24  -8.832   0.481   5.306
  259   2H4     C  24          H42         C  24  -9.104   0.992   6.963
  260    H5     C  24           H5         C  24  -6.682  -0.290   4.507
  261    H6     C  24           H6         C  24  -4.363  -0.726   5.127
  262   1H5*    U  25          1H5*        U  25  -4.443  -4.406   8.830
  263   2H5*    U  25          2H5*        U  25  -4.669  -6.166   8.794
  264    H4*    U  25           H4*        U  25  -6.792  -5.056   8.594
  265    H3*    U  25           H3*        U  25  -5.903  -6.499   6.102
  266    H2*    U  25           H2*        U  25  -8.020  -5.884   5.117
  267   2HO*    U  25          2HO*        U  25  -9.709  -5.262   6.331
  268    H1*    U  25           H1*        U  25  -7.937  -3.241   6.022
  269    H3     U  25           H3         U  25  -7.182  -2.830   1.589
  270    H5     U  25           H5         U  25  -3.538  -4.222   3.132
  271    H6     U  25           H6         U  25  -4.633  -4.510   5.258
  272   1H5*    U  26          1H5*        U  26 -10.014  -8.019   7.047
  273   2H5*    U  26          2H5*        U  26  -9.966  -9.716   6.533
  274    H4*    U  26           H4*        U  26 -11.804  -8.394   5.527
  275    H3*    U  26           H3*        U  26  -9.807  -9.726   3.706
  276    H2*    U  26           H2*        U  26 -11.085  -8.906   1.835
  277   2HO*    U  26          2HO*        U  26 -13.086  -9.093   3.557
  278    H1*    U  26           H1*        U  26 -11.503  -6.344   2.930
  279    H3     U  26           H3         U  26  -8.686  -5.896  -0.633
  280    H5     U  26           H5         U  26  -6.239  -6.911   2.623
  281    H6     U  26           H6         U  26  -8.238  -7.354   3.887
  282   1H5*    U  27          1H5*        U  27 -13.718 -11.094   2.289
  283   2H5*    U  27          2H5*        U  27 -13.478 -12.744   1.683
  284    H4*    U  27           H4*        U  27 -14.407 -11.153   0.019
  285    H3*    U  27           H3*        U  27 -11.858 -12.629  -0.575
  286    H2*    U  27           H2*        U  27 -11.795 -11.531  -2.735
  287   2HO*    U  27          2HO*        U  27 -14.285 -10.347  -1.969
  288    H1*    U  27           H1*        U  27 -12.198  -8.998  -1.712
  289    H3     U  27           H3         U  27  -7.725  -9.332  -2.466
  290    H5     U  27           H5         U  27  -8.327 -11.106   1.291
  291    H6     U  27           H6         U  27 -10.695 -10.976   0.886
  292   1H5*    U  28          1H5*        U  28 -14.525 -14.263  -3.905
  293   2H5*    U  28          2H5*        U  28 -13.959 -15.936  -4.070
  294    H4*    U  28           H4*        U  28 -13.838 -14.646  -6.162
  295    H3*    U  28           H3*        U  28 -11.274 -15.762  -5.045
  296    H2*    U  28           H2*        U  28 -10.151 -14.892  -7.006
  297   2HO*    U  28          2HO*        U  28 -12.757 -14.843  -7.945
  298    H1*    U  28           H1*        U  28 -11.323 -12.378  -6.818
  299    H3     U  28           H3         U  28  -7.038 -12.012  -5.288
  300    H5     U  28           H5         U  28  -9.315 -13.238  -1.979
  301    H6     U  28           H6         U  28 -11.158 -13.609  -3.483
  302   1H5*    G  29          1H5*        G  29 -10.946 -18.545  -8.271
  303   2H5*    G  29          2H5*        G  29 -10.514 -20.064  -7.461
  304    H4*    G  29           H4*        G  29  -8.734 -19.157  -8.921
  305    H3*    G  29           H3*        G  29  -8.122 -19.553  -5.998
  306    H2*    G  29           H2*        G  29  -5.931 -18.706  -6.380
  307   2HO*    G  29          2HO*        G  29  -6.502 -19.276  -9.119
  308    H1*    G  29           H1*        G  29  -6.714 -16.915  -8.519
  309    H8     G  29           H8         G  29  -8.696 -16.187  -5.476
  310    H1     G  29           H1         G  29  -2.774 -13.729  -5.294
  311   1H2     G  29          H21         G  29  -2.177 -15.744  -8.042
  312   2H2     G  29          H22         G  29  -1.547 -14.565  -6.916
  313   1H5*    C  30          1H5*        C  30  -4.890 -21.289  -8.575
  314   2H5*    C  30          2H5*        C  30  -4.410 -22.771  -7.726
  315    H4*    C  30           H4*        C  30  -2.530 -21.266  -8.317
  316    H3*    C  30           H3*        C  30  -2.976 -22.077  -5.462
  317    H2*    C  30           H2*        C  30  -1.075 -20.747  -4.810
  318   2HO*    C  30          2HO*        C  30  -0.547 -19.829  -7.390
  319    H1*    C  30           H1*        C  30  -1.758 -18.520  -6.340
  320   1H4     C  30          H41         C  30  -5.901 -18.401  -1.205
  321   2H4     C  30          H42         C  30  -4.555 -17.365  -0.764
  322    H5     C  30           H5         C  30  -5.944 -19.706  -3.237
  323    H6     C  30           H6         C  30  -4.711 -20.297  -5.256
  324   1H5*    U  31          1H5*        U  31   1.107 -22.070  -6.047
  325   2H5*    U  31          2H5*        U  31   1.640 -23.755  -5.880
  326    H4*    U  31           H4*        U  31   3.212 -22.530  -4.689
  327    H3*    U  31           H3*        U  31   1.213 -23.727  -2.788
  328    H2*    U  31           H2*        U  31   2.403 -22.715  -0.964
  329   2HO*    U  31          2HO*        U  31   4.366 -21.378  -2.130
  330    H1*    U  31           H1*        U  31   2.833 -20.253  -2.266
  331    H3     U  31           H3         U  31  -0.157 -19.024   0.853
  332    H5     U  31           H5         U  31  -2.401 -21.375  -1.809
  333    H6     U  31           H6         U  31  -0.350 -21.904  -2.951
  334    H3T    U  31           H3T        U  31   2.891 -24.852  -4.070


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