test_charmm_peptide_4.pdb

REMARK   1 CREATED WITH OPENMM 8.3, 2025-07-01
CRYST1   24.000   24.000   24.000  90.00  90.00  90.00 P 1           1 
ATOM      1  N   GLY A   1      -6.191  -2.039   4.188  1.00  0.00           N  
ATOM      2  CA  GLY A   1      -6.574  -1.518   2.835  1.00  0.00           C  
ATOM      3  C   GLY A   1      -5.473  -1.646   1.823  1.00  0.00           C  
ATOM      4  O   GLY A   1      -4.677  -2.572   1.903  1.00  0.00           O  
ATOM      5  H   GLY A   1      -5.431  -1.491   4.651  1.00  0.00           H  
ATOM      6  H2  GLY A   1      -5.835  -3.033   4.159  1.00  0.00           H  
ATOM      7  H3  GLY A   1      -7.016  -1.993   4.837  1.00  0.00           H  
ATOM      8  HA2 GLY A   1      -7.400  -2.118   2.484  1.00  0.00           H  
ATOM      9  HA3 GLY A   1      -6.818  -0.470   2.946  1.00  0.00           H  
ATOM     10  N   TYR A   2      -5.379  -0.733   0.839  1.00  0.00           N  
ATOM     11  CA  TYR A   2      -4.240  -0.662  -0.063  1.00  0.00           C  
ATOM     12  C   TYR A   2      -3.482   0.623   0.248  1.00  0.00           C  
ATOM     13  O   TYR A   2      -4.062   1.712   0.284  1.00  0.00           O  
ATOM     14  CB  TYR A   2      -4.695  -0.745  -1.551  1.00  0.00           C  
ATOM     15  CG  TYR A   2      -3.549  -0.650  -2.533  1.00  0.00           C  
ATOM     16  CD1 TYR A   2      -2.939  -1.803  -3.061  1.00  0.00           C  
ATOM     17  CD2 TYR A   2      -3.104   0.608  -2.969  1.00  0.00           C  
ATOM     18  CE1 TYR A   2      -1.889  -1.691  -3.988  1.00  0.00           C  
ATOM     19  CE2 TYR A   2      -2.051   0.724  -3.882  1.00  0.00           C  
ATOM     20  CZ  TYR A   2      -1.447  -0.426  -4.393  1.00  0.00           C  
ATOM     21  OH  TYR A   2      -0.404  -0.301  -5.330  1.00  0.00           O  
ATOM     22  H   TYR A   2      -6.087  -0.036   0.692  1.00  0.00           H  
ATOM     23  HA  TYR A   2      -3.557  -1.481   0.125  1.00  0.00           H  
ATOM     24  HB2 TYR A   2      -5.211  -1.713  -1.717  1.00  0.00           H  
ATOM     25  HB3 TYR A   2      -5.418   0.069  -1.769  1.00  0.00           H  
ATOM     26  HD1 TYR A   2      -3.279  -2.779  -2.749  1.00  0.00           H  
ATOM     27  HD2 TYR A   2      -3.570   1.499  -2.582  1.00  0.00           H  
ATOM     28  HE1 TYR A   2      -1.418  -2.577  -4.389  1.00  0.00           H  
ATOM     29  HE2 TYR A   2      -1.721   1.705  -4.193  1.00  0.00           H  
ATOM     30  HH  TYR A   2      -0.102   0.626  -5.304  1.00  0.00           H  
ATOM     31  N   ASP A   3      -2.166   0.517   0.508  1.00  0.00           N  
ATOM     32  CA  ASP A   3      -1.372   1.605   1.037  1.00  0.00           C  
ATOM     33  C   ASP A   3      -0.423   2.141  -0.041  1.00  0.00           C  
ATOM     34  O   ASP A   3       0.328   1.357  -0.630  1.00  0.00           O  
ATOM     35  CB  ASP A   3      -0.626   1.085   2.298  1.00  0.00           C  
ATOM     36  CG  ASP A   3       0.189   2.117   3.052  1.00  0.00           C  
ATOM     37  OD1 ASP A   3       0.360   3.268   2.576  1.00  0.00           O  
ATOM     38  OD2 ASP A   3       0.661   1.778   4.167  1.00  0.00           O  
ATOM     39  H   ASP A   3      -1.691  -0.360   0.411  1.00  0.00           H  
ATOM     40  HA  ASP A   3      -2.032   2.392   1.367  1.00  0.00           H  
ATOM     41  HB2 ASP A   3      -1.387   0.685   3.002  1.00  0.00           H  
ATOM     42  HB3 ASP A   3       0.048   0.251   2.023  1.00  0.00           H  
ATOM     43  N   PRO A   4      -0.382   3.440  -0.363  1.00  0.00           N  
ATOM     44  CA  PRO A   4       0.552   3.962  -1.349  1.00  0.00           C  
ATOM     45  C   PRO A   4       1.974   4.066  -0.812  1.00  0.00           C  
ATOM     46  O   PRO A   4       2.859   4.420  -1.595  1.00  0.00           O  
ATOM     47  CB  PRO A   4      -0.039   5.346  -1.681  1.00  0.00           C  
ATOM     48  CG  PRO A   4      -0.713   5.789  -0.381  1.00  0.00           C  
ATOM     49  CD  PRO A   4      -1.289   4.476   0.145  1.00  0.00           C  
ATOM     50  HA  PRO A   4       0.579   3.303  -2.204  1.00  0.00           H  
ATOM     51  HB2 PRO A   4       0.710   6.077  -2.040  1.00  0.00           H  
ATOM     52  HB3 PRO A   4      -0.819   5.221  -2.466  1.00  0.00           H  
ATOM     53  HG2 PRO A   4       0.052   6.171   0.333  1.00  0.00           H  
ATOM     54  HG3 PRO A   4      -1.492   6.562  -0.538  1.00  0.00           H  
ATOM     55  HD2 PRO A   4      -1.335   4.474   1.256  1.00  0.00           H  
ATOM     56  HD3 PRO A   4      -2.302   4.297  -0.274  1.00  0.00           H  
ATOM     57  N   GLU A   5       2.254   3.753   0.473  1.00  0.00           N  
ATOM     58  CA  GLU A   5       3.621   3.669   0.969  1.00  0.00           C  
ATOM     59  C   GLU A   5       4.192   2.323   0.555  1.00  0.00           C  
ATOM     60  O   GLU A   5       5.140   2.244  -0.227  1.00  0.00           O  
ATOM     61  CB  GLU A   5       3.667   3.813   2.519  1.00  0.00           C  
ATOM     62  CG  GLU A   5       4.984   4.426   3.079  1.00  0.00           C  
ATOM     63  CD  GLU A   5       6.212   3.526   3.148  1.00  0.00           C  
ATOM     64  OE1 GLU A   5       6.170   2.311   2.847  1.00  0.00           O  
ATOM     65  OE2 GLU A   5       7.281   4.077   3.530  1.00  0.00           O  
ATOM     66  H   GLU A   5       1.518   3.535   1.131  1.00  0.00           H  
ATOM     67  HA  GLU A   5       4.221   4.445   0.515  1.00  0.00           H  
ATOM     68  HB2 GLU A   5       2.846   4.523   2.774  1.00  0.00           H  
ATOM     69  HB3 GLU A   5       3.414   2.874   3.053  1.00  0.00           H  
ATOM     70  HG2 GLU A   5       5.268   5.314   2.475  1.00  0.00           H  
ATOM     71  HG3 GLU A   5       4.803   4.744   4.130  1.00  0.00           H  
ATOM     72  N   THR A   6       3.579   1.221   1.034  1.00  0.00           N  
ATOM     73  CA  THR A   6       3.987  -0.141   0.719  1.00  0.00           C  
ATOM     74  C   THR A   6       3.840  -0.485  -0.752  1.00  0.00           C  
ATOM     75  O   THR A   6       4.681  -1.168  -1.343  1.00  0.00           O  
ATOM     76  CB  THR A   6       3.272  -1.212   1.556  1.00  0.00           C  
ATOM     77  OG1 THR A   6       1.889  -1.330   1.245  1.00  0.00           O  
ATOM     78  CG2 THR A   6       3.369  -0.873   3.049  1.00  0.00           C  
ATOM     79  H   THR A   6       2.805   1.308   1.657  1.00  0.00           H  
ATOM     80  HA  THR A   6       5.038  -0.208   0.951  1.00  0.00           H  
ATOM     81  HB  THR A   6       3.767  -2.197   1.384  1.00  0.00           H  
ATOM     82  HG1 THR A   6       1.657  -2.261   1.404  1.00  0.00           H  
ATOM     83 HG21 THR A   6       4.424  -0.720   3.349  1.00  0.00           H  
ATOM     84 HG22 THR A   6       2.947  -1.697   3.661  1.00  0.00           H  
ATOM     85 HG23 THR A   6       2.798   0.049   3.292  1.00  0.00           H  
ATOM     86  N   GLY A   7       2.732  -0.041  -1.385  1.00  0.00           N  
ATOM     87  CA  GLY A   7       2.302  -0.493  -2.702  1.00  0.00           C  
ATOM     88  C   GLY A   7       1.750  -1.894  -2.643  1.00  0.00           C  
ATOM     89  O   GLY A   7       1.892  -2.675  -3.579  1.00  0.00           O  
ATOM     90  H   GLY A   7       2.078   0.531  -0.876  1.00  0.00           H  
ATOM     91  HA2 GLY A   7       1.499   0.151  -3.025  1.00  0.00           H  
ATOM     92  HA3 GLY A   7       3.147  -0.494  -3.376  1.00  0.00           H  
ATOM     93  N   THR A   8       1.141  -2.254  -1.498  1.00  0.00           N  
ATOM     94  CA  THR A   8       0.625  -3.588  -1.230  1.00  0.00           C  
ATOM     95  C   THR A   8      -0.757  -3.456  -0.639  1.00  0.00           C  
ATOM     96  O   THR A   8      -1.149  -2.430  -0.089  1.00  0.00           O  
ATOM     97  CB  THR A   8       1.470  -4.455  -0.255  1.00  0.00           C  
ATOM     98  OG1 THR A   8       1.363  -4.125   1.136  1.00  0.00           O  
ATOM     99  CG2 THR A   8       2.952  -4.400  -0.639  1.00  0.00           C  
ATOM    100  H   THR A   8       1.070  -1.594  -0.748  1.00  0.00           H  
ATOM    101  HA  THR A   8       0.526  -4.117  -2.167  1.00  0.00           H  
ATOM    102  HB  THR A   8       1.138  -5.515  -0.366  1.00  0.00           H  
ATOM    103  HG1 THR A   8       0.495  -4.474   1.420  1.00  0.00           H  
ATOM    104 HG21 THR A   8       3.089  -4.702  -1.697  1.00  0.00           H  
ATOM    105 HG22 THR A   8       3.545  -5.084   0.004  1.00  0.00           H  
ATOM    106 HG23 THR A   8       3.359  -3.377  -0.512  1.00  0.00           H  
ATOM    107  N   TRP A   9      -1.528  -4.559  -0.691  1.00  0.00           N  
ATOM    108  CA  TRP A   9      -2.595  -4.799   0.257  1.00  0.00           C  
ATOM    109  C   TRP A   9      -2.062  -4.963   1.681  1.00  0.00           C  
ATOM    110  O   TRP A   9      -0.974  -5.504   1.901  1.00  0.00           O  
ATOM    111  CB  TRP A   9      -3.447  -6.025  -0.153  1.00  0.00           C  
ATOM    112  CG  TRP A   9      -4.210  -5.810  -1.420  1.00  0.00           C  
ATOM    113  CD1 TRP A   9      -3.956  -6.325  -2.664  1.00  0.00           C  
ATOM    114  CD2 TRP A   9      -5.368  -4.971  -1.551  1.00  0.00           C  
ATOM    115  NE1 TRP A   9      -4.890  -5.842  -3.556  1.00  0.00           N  
ATOM    116  CE2 TRP A   9      -5.750  -5.007  -2.911  1.00  0.00           C  
ATOM    117  CE3 TRP A   9      -6.122  -4.226  -0.644  1.00  0.00           C  
ATOM    118  CZ2 TRP A   9      -6.823  -4.270  -3.384  1.00  0.00           C  
ATOM    119  CZ3 TRP A   9      -7.203  -3.484  -1.123  1.00  0.00           C  
ATOM    120  CH2 TRP A   9      -7.538  -3.490  -2.472  1.00  0.00           C  
ATOM    121  H   TRP A   9      -1.270  -5.342  -1.246  1.00  0.00           H  
ATOM    122  HA  TRP A   9      -3.229  -3.922   0.265  1.00  0.00           H  
ATOM    123  HB2 TRP A   9      -2.787  -6.916  -0.255  1.00  0.00           H  
ATOM    124  HB3 TRP A   9      -4.182  -6.247   0.649  1.00  0.00           H  
ATOM    125  HD1 TRP A   9      -3.159  -7.020  -2.896  1.00  0.00           H  
ATOM    126  HE1 TRP A   9      -5.114  -6.222  -4.435  1.00  0.00           H  
ATOM    127  HE3 TRP A   9      -5.864  -4.205   0.404  1.00  0.00           H  
ATOM    128  HZ2 TRP A   9      -7.091  -4.279  -4.430  1.00  0.00           H  
ATOM    129  HZ3 TRP A   9      -7.772  -2.872  -0.432  1.00  0.00           H  
ATOM    130  HH2 TRP A   9      -8.359  -2.874  -2.827  1.00  0.00           H  
ATOM    131  N   GLY A  10      -2.809  -4.465   2.675  1.00  0.00           N  
ATOM    132  CA  GLY A  10      -2.426  -4.476   4.071  1.00  0.00           C  
ATOM    133  C   GLY A  10      -3.648  -4.236   4.957  1.00  0.00           C  
ATOM    134  O   GLY A  10      -3.453  -3.944   6.166  1.00  0.00           O  
ATOM    135  OXT GLY A  10      -4.818  -4.338   4.490  1.00  0.00           O  
ATOM    136  H   GLY A  10      -3.662  -3.971   2.483  1.00  0.00           H  
ATOM    137  HA2 GLY A  10      -2.015  -5.440   4.333  1.00  0.00           H  
ATOM    138  HA3 GLY A  10      -1.745  -3.651   4.231  1.00  0.00           H  
TER     139      GLY A  10
HETATM  140  O   HOH B   1       5.842   2.828  -7.968  1.00  0.00           O  
HETATM  141  H1  HOH B   1       6.062   2.010  -8.412  1.00  0.00           H  
HETATM  142  H2  HOH B   1       5.015   3.101  -8.365  1.00  0.00           H  
HETATM  143 OM   HOH B   1       5.777   2.770  -8.057  1.00  0.00          EP  
HETATM  144  O   HOH B   2       5.088  -9.709   9.042  1.00  0.00           O  
HETATM  145  H1  HOH B   2       4.906 -10.365   8.369  1.00  0.00           H  
HETATM  146  H2  HOH B   2       4.427  -9.032   8.903  1.00  0.00           H  
HETATM  147 OM   HOH B   2       4.998  -9.707   8.955  1.00  0.00          EP  
HETATM  148  O   HOH B   3      -5.915   6.231  10.326  1.00  0.00           O  
HETATM  149  H1  HOH B   3      -6.797   5.862  10.356  1.00  0.00           H  
HETATM  150  H2  HOH B   3      -5.356   5.497  10.072  1.00  0.00           H  
HETATM  151 OM   HOH B   3      -5.949   6.114  10.302  1.00  0.00          EP  
HETATM  152  O   HOH B   4     -10.746  -0.382  -3.096  1.00  0.00           O  
HETATM  153  H1  HOH B   4     -10.769   0.558  -3.274  1.00  0.00           H  
HETATM  154  H2  HOH B   4     -10.529  -0.780  -3.939  1.00  0.00           H  
HETATM  155 OM   HOH B   4     -10.725  -0.325  -3.205  1.00  0.00          EP  
HETATM  156  O   HOH B   5       4.958   6.074  -1.815  1.00  0.00           O  
HETATM  157  H1  HOH B   5       4.310   5.383  -1.683  1.00  0.00           H  
HETATM  158  H2  HOH B   5       4.931   6.253  -2.755  1.00  0.00           H  
HETATM  159 OM   HOH B   5       4.886   6.020  -1.901  1.00  0.00          EP  
HETATM  160  O   HOH B   6       7.952  -1.734  -4.429  1.00  0.00           O  
HETATM  161  H1  HOH B   6       7.791  -1.027  -5.055  1.00  0.00           H  
HETATM  162  H2  HOH B   6       8.050  -1.291  -3.587  1.00  0.00           H  
HETATM  163 OM   HOH B   6       7.946  -1.611  -4.406  1.00  0.00          EP  
HETATM  164  O   HOH B   7       6.849   8.946  -9.342  1.00  0.00           O  
HETATM  165  H1  HOH B   7       6.647   9.802  -8.963  1.00  0.00           H  
HETATM  166  H2  HOH B   7       7.798   8.859  -9.245  1.00  0.00           H  
HETATM  167 OM   HOH B   7       6.929   9.028  -9.291  1.00  0.00          EP  
HETATM  168  O   HOH B   8      -8.905   8.941  -7.411  1.00  0.00           O  
HETATM  169  H1  HOH B   8      -8.008   9.226  -7.240  1.00  0.00           H  
HETATM  170  H2  HOH B   8      -9.000   8.132  -6.907  1.00  0.00           H  
HETATM  171 OM   HOH B   8      -8.820   8.885  -7.339  1.00  0.00          EP  
HETATM  172  O   HOH B   9       0.740   2.395 -10.734  1.00  0.00           O  
HETATM  173  H1  HOH B   9       1.037   2.203 -11.624  1.00  0.00           H  
HETATM  174  H2  HOH B   9       1.456   2.896 -10.345  1.00  0.00           H  
HETATM  175 OM   HOH B   9       0.848   2.428 -10.788  1.00  0.00          EP  
HETATM  176  O   HOH B  10       4.606   8.811   1.851  1.00  0.00           O  
HETATM  177  H1  HOH B  10       5.335   9.147   2.373  1.00  0.00           H  
HETATM  178  H2  HOH B  10       4.978   8.674   0.980  1.00  0.00           H  
HETATM  179 OM   HOH B  10       4.723   8.832   1.813  1.00  0.00          EP  
HETATM  180  O   HOH B  11       0.355  10.462  -2.761  1.00  0.00           O  
HETATM  181  H1  HOH B  11       0.493  11.337  -3.122  1.00  0.00           H  
HETATM  182  H2  HOH B  11       0.321   9.889  -3.527  1.00  0.00           H  
HETATM  183 OM   HOH B  11       0.366  10.494  -2.881  1.00  0.00          EP  
HETATM  184  O   HOH B  12      -9.476  -5.983  -5.436  1.00  0.00           O  
HETATM  185  H1  HOH B  12     -10.006  -6.201  -6.203  1.00  0.00           H  
HETATM  186  H2  HOH B  12      -8.672  -5.610  -5.798  1.00  0.00           H  
HETATM  187 OM   HOH B  12      -9.446  -5.967  -5.556  1.00  0.00          EP  
HETATM  188  O   HOH B  13      -6.767 -11.861   4.899  1.00  0.00           O  
HETATM  189  H1  HOH B  13      -6.466 -12.159   5.757  1.00  0.00           H  
HETATM  190  H2  HOH B  13      -7.259 -12.602   4.547  1.00  0.00           H  
HETATM  191 OM   HOH B  13      -6.787 -11.972   4.953  1.00  0.00          EP  
HETATM  192  O   HOH B  14      -0.294  -7.964   5.056  1.00  0.00           O  
HETATM  193  H1  HOH B  14       0.123  -7.143   5.315  1.00  0.00           H  
HETATM  194  H2  HOH B  14       0.138  -8.632   5.588  1.00  0.00           H  
HETATM  195 OM   HOH B  14      -0.204  -7.948   5.140  1.00  0.00          EP  
HETATM  196  O   HOH B  15       1.029 -10.881  -3.463  1.00  0.00           O  
HETATM  197  H1  HOH B  15       1.961 -10.664  -3.445  1.00  0.00           H  
HETATM  198  H2  HOH B  15       0.747 -10.649  -4.348  1.00  0.00           H  
HETATM  199 OM   HOH B  15       1.098 -10.833  -3.556  1.00  0.00          EP  
HETATM  200  O   HOH B  16      -4.397  -5.767  -8.191  1.00  0.00           O  
HETATM  201  H1  HOH B  16      -4.029  -4.890  -8.301  1.00  0.00           H  
HETATM  202  H2  HOH B  16      -3.791  -6.209  -7.596  1.00  0.00           H  
HETATM  203 OM   HOH B  16      -4.293  -5.721  -8.139  1.00  0.00          EP  
HETATM  204  O   HOH B  17      -2.894 -10.357   1.134  1.00  0.00           O  
HETATM  205  H1  HOH B  17      -2.685 -10.384   0.201  1.00  0.00           H  
HETATM  206  H2  HOH B  17      -2.142  -9.922   1.536  1.00  0.00           H  
HETATM  207 OM   HOH B  17      -2.792 -10.314   1.078  1.00  0.00          EP  
HETATM  208  O   HOH B  18       7.269  -7.812  -8.603  1.00  0.00           O  
HETATM  209  H1  HOH B  18       6.561  -8.036  -9.208  1.00  0.00           H  
HETATM  210  H2  HOH B  18       7.366  -6.864  -8.688  1.00  0.00           H  
HETATM  211 OM   HOH B  18       7.204  -7.735  -8.677  1.00  0.00          EP  
HETATM  212  O   HOH B  19       6.880   9.356   3.406  1.00  0.00           O  
HETATM  213  H1  HOH B  19       7.412   9.647   4.147  1.00  0.00           H  
HETATM  214  H2  HOH B  19       7.515   9.018   2.774  1.00  0.00           H  
HETATM  215 OM   HOH B  19       7.005   9.351   3.418  1.00  0.00          EP  
HETATM  216  O   HOH B  20      -6.635  -7.362   0.247  1.00  0.00           O  
HETATM  217  H1  HOH B  20      -6.755  -6.596  -0.314  1.00  0.00           H  
HETATM  218  H2  HOH B  20      -6.041  -7.929  -0.246  1.00  0.00           H  
HETATM  219 OM   HOH B  20      -6.584  -7.341   0.134  1.00  0.00          EP  
HETATM  220  O   HOH B  21       1.148  -6.867  10.795  1.00  0.00           O  
HETATM  221  H1  HOH B  21       1.766  -7.034  11.507  1.00  0.00           H  
HETATM  222  H2  HOH B  21       1.637  -7.075   9.999  1.00  0.00           H  
HETATM  223 OM   HOH B  21       1.266  -6.907  10.786  1.00  0.00          EP  
HETATM  224  O   HOH B  22       2.295   6.992  -3.964  1.00  0.00           O  
HETATM  225  H1  HOH B  22       2.068   6.080  -4.141  1.00  0.00           H  
HETATM  226  H2  HOH B  22       1.598   7.499  -4.382  1.00  0.00           H  
HETATM  227 OM   HOH B  22       2.197   6.949  -4.028  1.00  0.00          EP  
HETATM  228  O   HOH B  23      -6.301   1.635  -4.318  1.00  0.00           O  
HETATM  229  H1  HOH B  23      -6.054   0.710  -4.299  1.00  0.00           H  
HETATM  230  H2  HOH B  23      -6.882   1.743  -3.565  1.00  0.00           H  
HETATM  231 OM   HOH B  23      -6.337   1.548  -4.236  1.00  0.00          EP  
HETATM  232  O   HOH B  24      -6.605   6.566   1.107  1.00  0.00           O  
HETATM  233  H1  HOH B  24      -7.084   5.951   1.662  1.00  0.00           H  
HETATM  234  H2  HOH B  24      -5.896   6.890   1.663  1.00  0.00           H  
HETATM  235 OM   HOH B  24      -6.580   6.535   1.225  1.00  0.00          EP  
HETATM  236  O   HOH B  25       2.071   5.474  -6.828  1.00  0.00           O  
HETATM  237  H1  HOH B  25       2.412   4.995  -7.584  1.00  0.00           H  
HETATM  238  H2  HOH B  25       2.395   4.989  -6.070  1.00  0.00           H  
HETATM  239 OM   HOH B  25       2.142   5.372  -6.828  1.00  0.00          EP  
HETATM  240  O   HOH B  26      -6.792 -11.426  -6.549  1.00  0.00           O  
HETATM  241  H1  HOH B  26      -6.447 -12.319  -6.566  1.00  0.00           H  
HETATM  242  H2  HOH B  26      -6.630 -11.123  -5.655  1.00  0.00           H  
HETATM  243 OM   HOH B  26      -6.738 -11.489  -6.455  1.00  0.00          EP  
HETATM  244  O   HOH B  27      -2.262  10.593  -5.446  1.00  0.00           O  
HETATM  245  H1  HOH B  27      -2.258   9.989  -4.703  1.00  0.00           H  
HETATM  246  H2  HOH B  27      -1.451  10.400  -5.917  1.00  0.00           H  
HETATM  247 OM   HOH B  27      -2.175  10.508  -5.417  1.00  0.00          EP  
HETATM  248  O   HOH B  28      -1.161  -7.945  -4.801  1.00  0.00           O  
HETATM  249  H1  HOH B  28      -0.989  -8.127  -3.877  1.00  0.00           H  
HETATM  250  H2  HOH B  28      -0.712  -8.648  -5.271  1.00  0.00           H  
HETATM  251 OM   HOH B  28      -1.094  -8.040  -4.753  1.00  0.00          EP  
HETATM  252  O   HOH B  29      -8.777  -7.922  -2.129  1.00  0.00           O  
HETATM  253  H1  HOH B  29      -8.199  -8.369  -2.747  1.00  0.00           H  
HETATM  254  H2  HOH B  29      -9.586  -7.774  -2.620  1.00  0.00           H  
HETATM  255 OM   HOH B  29      -8.802  -7.954  -2.247  1.00  0.00          EP  
HETATM  256  O   HOH B  30      -1.087  -8.172 -10.219  1.00  0.00           O  
HETATM  257  H1  HOH B  30      -0.911  -7.242 -10.363  1.00  0.00           H  
HETATM  258  H2  HOH B  30      -0.221  -8.580 -10.198  1.00  0.00           H  
HETATM  259 OM   HOH B  30      -0.976  -8.116 -10.232  1.00  0.00          EP  
HETATM  260  O   HOH B  31      -8.062  -0.643   5.749  1.00  0.00           O  
HETATM  261  H1  HOH B  31      -8.333  -1.135   6.524  1.00  0.00           H  
HETATM  262  H2  HOH B  31      -8.027   0.267   6.043  1.00  0.00           H  
HETATM  263 OM   HOH B  31      -8.087  -0.598   5.863  1.00  0.00          EP  
HETATM  264  O   HOH B  32       0.388  -2.076  -9.237  1.00  0.00           O  
HETATM  265  H1  HOH B  32       0.555  -2.943  -8.869  1.00  0.00           H  
HETATM  266  H2  HOH B  32       1.204  -1.596  -9.100  1.00  0.00           H  
HETATM  267 OM   HOH B  32       0.493  -2.117  -9.183  1.00  0.00          EP  
HETATM  268  O   HOH B  33      -3.142   0.100  -9.642  1.00  0.00           O  
HETATM  269  H1  HOH B  33      -2.664   0.887  -9.906  1.00  0.00           H  
HETATM  270  H2  HOH B  33      -2.587  -0.305  -8.976  1.00  0.00           H  
HETATM  271 OM   HOH B  33      -3.032   0.141  -9.599  1.00  0.00          EP  
HETATM  272  O   HOH B  34       2.655   8.097  -1.531  1.00  0.00           O  
HETATM  273  H1  HOH B  34       2.491   7.722  -2.396  1.00  0.00           H  
HETATM  274  H2  HOH B  34       3.261   7.484  -1.114  1.00  0.00           H  
HETATM  275 OM   HOH B  34       2.702   7.992  -1.579  1.00  0.00          EP  
HETATM  276  O   HOH B  35       8.431  -0.234  -2.179  1.00  0.00           O  
HETATM  277  H1  HOH B  35       8.045   0.638  -2.099  1.00  0.00           H  
HETATM  278  H2  HOH B  35       9.373  -0.087  -2.100  1.00  0.00           H  
HETATM  279 OM   HOH B  35       8.490  -0.125  -2.162  1.00  0.00          EP  
HETATM  280  O   HOH B  36      -2.184   0.248   6.923  1.00  0.00           O  
HETATM  281  H1  HOH B  36      -1.532   0.073   6.244  1.00  0.00           H  
HETATM  282  H2  HOH B  36      -1.716   0.110   7.746  1.00  0.00           H  
HETATM  283 OM   HOH B  36      -2.064   0.214   6.938  1.00  0.00          EP  
HETATM  284  O   HOH B  37      -3.561  -3.178  -8.702  1.00  0.00           O  
HETATM  285  H1  HOH B  37      -3.115  -3.221  -9.547  1.00  0.00           H  
HETATM  286  H2  HOH B  37      -3.047  -2.554  -8.190  1.00  0.00           H  
HETATM  287 OM   HOH B  37      -3.459  -3.116  -8.738  1.00  0.00          EP  
HETATM  288  O   HOH B  38      -6.788   2.635  11.374  1.00  0.00           O  
HETATM  289  H1  HOH B  38      -7.290   3.274  11.880  1.00  0.00           H  
HETATM  290  H2  HOH B  38      -5.883   2.761  11.659  1.00  0.00           H  
HETATM  291 OM   HOH B  38      -6.745   2.717  11.458  1.00  0.00          EP  
HETATM  292  O   HOH B  39      -9.076   2.546   1.780  1.00  0.00           O  
HETATM  293  H1  HOH B  39      -8.535   3.264   2.110  1.00  0.00           H  
HETATM  294  H2  HOH B  39      -9.877   2.589   2.303  1.00  0.00           H  
HETATM  295 OM   HOH B  39      -9.104   2.627   1.871  1.00  0.00          EP  
HETATM  296  O   HOH B  40      -2.743 -10.274  -1.614  1.00  0.00           O  
HETATM  297  H1  HOH B  40      -1.972  -9.769  -1.873  1.00  0.00           H  
HETATM  298  H2  HOH B  40      -2.837 -10.937  -2.298  1.00  0.00           H  
HETATM  299 OM   HOH B  40      -2.671 -10.291  -1.715  1.00  0.00          EP  
HETATM  300  O   HOH B  41      -6.379  -6.445   8.337  1.00  0.00           O  
HETATM  301  H1  HOH B  41      -5.875  -6.477   9.150  1.00  0.00           H  
HETATM  302  H2  HOH B  41      -6.177  -5.588   7.963  1.00  0.00           H  
HETATM  303 OM   HOH B  41      -6.303  -6.357   8.384  1.00  0.00          EP  
HETATM  304  O   HOH B  42       3.959  -3.229   9.388  1.00  0.00           O  
HETATM  305  H1  HOH B  42       3.106  -3.383   8.982  1.00  0.00           H  
HETATM  306  H2  HOH B  42       4.256  -4.098   9.658  1.00  0.00           H  
HETATM  307 OM   HOH B  42       3.900  -3.338   9.373  1.00  0.00          EP  
HETATM  308  O   HOH B  43       4.762  -8.266   5.877  1.00  0.00           O  
HETATM  309  H1  HOH B  43       5.185  -7.411   5.963  1.00  0.00           H  
HETATM  310  H2  HOH B  43       4.124  -8.290   6.590  1.00  0.00           H  
HETATM  311 OM   HOH B  43       4.739  -8.177   5.962  1.00  0.00          EP  
HETATM  312  O   HOH B  44       8.799  -3.434   5.907  1.00  0.00           O  
HETATM  313  H1  HOH B  44       7.861  -3.334   6.072  1.00  0.00           H  
HETATM  314  H2  HOH B  44       9.219  -3.094   6.696  1.00  0.00           H  
HETATM  315 OM   HOH B  44       8.744  -3.387   6.009  1.00  0.00          EP  
HETATM  316  O   HOH B  45      -5.582   3.282  -9.567  1.00  0.00           O  
HETATM  317  H1  HOH B  45      -5.554   2.392  -9.216  1.00  0.00           H  
HETATM  318  H2  HOH B  45      -4.989   3.262 -10.318  1.00  0.00           H  
HETATM  319 OM   HOH B  45      -5.516   3.185  -9.609  1.00  0.00          EP  
HETATM  320  O   HOH B  46      -3.203  -7.706  -6.558  1.00  0.00           O  
HETATM  321  H1  HOH B  46      -2.517  -7.754  -5.893  1.00  0.00           H  
HETATM  322  H2  HOH B  46      -3.001  -8.420  -7.163  1.00  0.00           H  
HETATM  323 OM   HOH B  46      -3.108  -7.787  -6.552  1.00  0.00          EP  
HETATM  324  O   HOH B  47      -0.385  -4.885   9.323  1.00  0.00           O  
HETATM  325  H1  HOH B  47       0.319  -4.488   8.811  1.00  0.00           H  
HETATM  326  H2  HOH B  47       0.049  -5.560   9.845  1.00  0.00           H  
HETATM  327 OM   HOH B  47      -0.264  -4.915   9.324  1.00  0.00          EP  
HETATM  328  O   HOH B  48       7.858   5.117  -4.825  1.00  0.00           O  
HETATM  329  H1  HOH B  48       8.665   5.076  -5.338  1.00  0.00           H  
HETATM  330  H2  HOH B  48       7.167   5.245  -5.475  1.00  0.00           H  
HETATM  331 OM   HOH B  48       7.870   5.126  -4.949  1.00  0.00          EP  
HETATM  332  O   HOH B  49      -7.936   0.643   0.049  1.00  0.00           O  
HETATM  333  H1  HOH B  49      -8.308   1.259   0.680  1.00  0.00           H  
HETATM  334  H2  HOH B  49      -7.893   1.135  -0.771  1.00  0.00           H  
HETATM  335 OM   HOH B  49      -7.971   0.761   0.029  1.00  0.00          EP  
HETATM  336  O   HOH B  50      -8.000 -10.722  -1.075  1.00  0.00           O  
HETATM  337  H1  HOH B  50      -7.441 -10.478  -1.813  1.00  0.00           H  
HETATM  338  H2  HOH B  50      -8.664 -11.296  -1.455  1.00  0.00           H  
HETATM  339 OM   HOH B  50      -8.011 -10.757  -1.194  1.00  0.00          EP  
HETATM  340  O   HOH B  51     -10.035   3.235  -0.688  1.00  0.00           O  
HETATM  341  H1  HOH B  51      -9.800   3.059   0.223  1.00  0.00           H  
HETATM  342  H2  HOH B  51     -10.164   4.183  -0.724  1.00  0.00           H  
HETATM  343 OM   HOH B  51     -10.024   3.317  -0.595  1.00  0.00          EP  
HETATM  344  O   HOH B  52      -4.014   2.796  -6.947  1.00  0.00           O  
HETATM  345  H1  HOH B  52      -3.836   3.002  -6.029  1.00  0.00           H  
HETATM  346  H2  HOH B  52      -3.376   3.315  -7.436  1.00  0.00           H  
HETATM  347 OM   HOH B  52      -3.927   2.873  -6.901  1.00  0.00          EP  
HETATM  348  O   HOH B  53      -3.507   4.329   5.241  1.00  0.00           O  
HETATM  349  H1  HOH B  53      -3.695   3.498   5.678  1.00  0.00           H  
HETATM  350  H2  HOH B  53      -2.610   4.233   4.920  1.00  0.00           H  
HETATM  351 OM   HOH B  53      -3.431   4.230   5.254  1.00  0.00          EP  
HETATM  352  O   HOH B  54      -4.117  -8.247   2.321  1.00  0.00           O  
HETATM  353  H1  HOH B  54      -3.854  -9.015   1.814  1.00  0.00           H  
HETATM  354  H2  HOH B  54      -3.312  -7.956   2.751  1.00  0.00           H  
HETATM  355 OM   HOH B  54      -4.003  -8.298   2.313  1.00  0.00          EP  
HETATM  356  O   HOH B  55      -0.444  10.199  -7.525  1.00  0.00           O  
HETATM  357  H1  HOH B  55      -0.484   9.654  -8.311  1.00  0.00           H  
HETATM  358  H2  HOH B  55      -0.309  11.088  -7.855  1.00  0.00           H  
HETATM  359 OM   HOH B  55      -0.434  10.236  -7.644  1.00  0.00          EP  
HETATM  360  O   HOH B  56      -8.208   9.523   7.310  1.00  0.00           O  
HETATM  361  H1  HOH B  56      -7.527   9.341   6.662  1.00  0.00           H  
HETATM  362  H2  HOH B  56      -8.837   8.810   7.204  1.00  0.00           H  
HETATM  363 OM   HOH B  56      -8.202   9.428   7.230  1.00  0.00          EP  
HETATM  364  O   HOH B  57       5.601  -2.910  -5.823  1.00  0.00           O  
HETATM  365  H1  HOH B  57       5.950  -2.557  -5.005  1.00  0.00           H  
HETATM  366  H2  HOH B  57       6.060  -3.742  -5.940  1.00  0.00           H  
HETATM  367 OM   HOH B  57       5.687  -2.961  -5.748  1.00  0.00          EP  
HETATM  368  O   HOH B  58      -6.750   3.143  -6.587  1.00  0.00           O  
HETATM  369  H1  HOH B  58      -5.841   3.124  -6.887  1.00  0.00           H  
HETATM  370  H2  HOH B  58      -6.776   2.522  -5.860  1.00  0.00           H  
HETATM  371 OM   HOH B  58      -6.656   3.074  -6.542  1.00  0.00          EP  
HETATM  372  O   HOH B  59       2.779  -0.506  -8.772  1.00  0.00           O  
HETATM  373  H1  HOH B  59       3.455  -0.537  -8.095  1.00  0.00           H  
HETATM  374  H2  HOH B  59       2.191   0.194  -8.491  1.00  0.00           H  
HETATM  375 OM   HOH B  59       2.789  -0.435  -8.670  1.00  0.00          EP  
HETATM  376  O   HOH B  60      -2.763   7.112  10.361  1.00  0.00           O  
HETATM  377  H1  HOH B  60      -2.954   6.175  10.308  1.00  0.00           H  
HETATM  378  H2  HOH B  60      -1.839   7.182  10.124  1.00  0.00           H  
HETATM  379 OM   HOH B  60      -2.685   7.019  10.330  1.00  0.00          EP  
HETATM  380  O   HOH B  61      -2.964   7.059  -8.586  1.00  0.00           O  
HETATM  381  H1  HOH B  61      -3.823   6.640  -8.634  1.00  0.00           H  
HETATM  382  H2  HOH B  61      -3.120   7.874  -8.110  1.00  0.00           H  
HETATM  383 OM   HOH B  61      -3.072   7.101  -8.541  1.00  0.00          EP  
HETATM  384  O   HOH B  62       0.293  -9.949  -5.906  1.00  0.00           O  
HETATM  385  H1  HOH B  62       0.865  -9.278  -6.279  1.00  0.00           H  
HETATM  386  H2  HOH B  62       0.045 -10.495  -6.651  1.00  0.00           H  
HETATM  387 OM   HOH B  62       0.328  -9.936  -6.025  1.00  0.00          EP  
HETATM  388  O   HOH B  63      -4.355   3.709  -1.641  1.00  0.00           O  
HETATM  389  H1  HOH B  63      -4.748   4.536  -1.361  1.00  0.00           H  
HETATM  390  H2  HOH B  63      -4.353   3.165  -0.854  1.00  0.00           H  
HETATM  391 OM   HOH B  63      -4.397   3.739  -1.527  1.00  0.00          EP  
HETATM  392  O   HOH B  64      -1.701  -3.253 -10.866  1.00  0.00           O  
HETATM  393  H1  HOH B  64      -1.815  -2.966 -11.772  1.00  0.00           H  
HETATM  394  H2  HOH B  64      -1.053  -2.649 -10.502  1.00  0.00           H  
HETATM  395 OM   HOH B  64      -1.644  -3.158 -10.923  1.00  0.00          EP  
HETATM  396  O   HOH B  65       1.559   7.934   7.256  1.00  0.00           O  
HETATM  397  H1  HOH B  65       0.952   7.612   7.923  1.00  0.00           H  
HETATM  398  H2  HOH B  65       1.266   7.521   6.445  1.00  0.00           H  
HETATM  399 OM   HOH B  65       1.463   7.856   7.241  1.00  0.00          EP  
HETATM  400  O   HOH B  66       2.416  -5.794  -4.425  1.00  0.00           O  
HETATM  401  H1  HOH B  66       2.894  -6.047  -5.214  1.00  0.00           H  
HETATM  402  H2  HOH B  66       2.788  -6.340  -3.733  1.00  0.00           H  
HETATM  403 OM   HOH B  66       2.507  -5.879  -4.435  1.00  0.00          EP  
HETATM  404  O   HOH B  67      -9.332 -11.496  -3.593  1.00  0.00           O  
HETATM  405  H1  HOH B  67      -9.092 -12.418  -3.691  1.00  0.00           H  
HETATM  406  H2  HOH B  67      -8.513 -11.019  -3.725  1.00  0.00           H  
HETATM  407 OM   HOH B  67      -9.219 -11.544  -3.617  1.00  0.00          EP  
HETATM  408  O   HOH B  68      -8.301   2.194  -2.416  1.00  0.00           O  
HETATM  409  H1  HOH B  68      -8.807   2.064  -3.218  1.00  0.00           H  
HETATM  410  H2  HOH B  68      -8.937   2.531  -1.784  1.00  0.00           H  
HETATM  411 OM   HOH B  68      -8.423   2.216  -2.434  1.00  0.00          EP  
HETATM  412  O   HOH B  69      -5.674   0.114   8.146  1.00  0.00           O  
HETATM  413  H1  HOH B  69      -5.335   0.911   7.738  1.00  0.00           H  
HETATM  414  H2  HOH B  69      -5.327  -0.598   7.608  1.00  0.00           H  
HETATM  415 OM   HOH B  69      -5.601   0.123   8.045  1.00  0.00          EP  
HETATM  416  O   HOH B  70      -7.483  -9.591   1.996  1.00  0.00           O  
HETATM  417  H1  HOH B  70      -7.709  -9.733   2.915  1.00  0.00           H  
HETATM  418  H2  HOH B  70      -6.869 -10.295   1.788  1.00  0.00           H  
HETATM  419 OM   HOH B  70      -7.442  -9.681   2.072  1.00  0.00          EP  
HETATM  420  O   HOH B  71       7.350 -10.318   2.645  1.00  0.00           O  
HETATM  421  H1  HOH B  71       7.989 -10.763   3.202  1.00  0.00           H  
HETATM  422  H2  HOH B  71       7.400  -9.399   2.908  1.00  0.00           H  
HETATM  423 OM   HOH B  71       7.423 -10.268   2.733  1.00  0.00          EP  
HETATM  424  O   HOH B  72      -0.499   4.768  -6.157  1.00  0.00           O  
HETATM  425  H1  HOH B  72      -0.915   5.511  -5.720  1.00  0.00           H  
HETATM  426  H2  HOH B  72       0.344   5.107  -6.458  1.00  0.00           H  
HETATM  427 OM   HOH B  72      -0.453   4.883  -6.142  1.00  0.00          EP  
HETATM  428  O   HOH B  73      -7.761   4.442 -10.588  1.00  0.00           O  
HETATM  429  H1  HOH B  73      -6.987   3.991 -10.251  1.00  0.00           H  
HETATM  430  H2  HOH B  73      -7.546   5.372 -10.520  1.00  0.00           H  
HETATM  431 OM   HOH B  73      -7.655   4.493 -10.545  1.00  0.00          EP  
HETATM  432  O   HOH B  74      -5.248  -9.221  -1.206  1.00  0.00           O  
HETATM  433  H1  HOH B  74      -4.342  -9.506  -1.319  1.00  0.00           H  
HETATM  434  H2  HOH B  74      -5.635  -9.298  -2.078  1.00  0.00           H  
HETATM  435 OM   HOH B  74      -5.193  -9.259  -1.311  1.00  0.00          EP  
HETATM  436  O   HOH B  75       0.260   3.100   6.348  1.00  0.00           O  
HETATM  437  H1  HOH B  75       0.770   2.671   7.035  1.00  0.00           H  
HETATM  438  H2  HOH B  75       0.454   2.599   5.556  1.00  0.00           H  
HETATM  439 OM   HOH B  75       0.335   3.001   6.337  1.00  0.00          EP  
HETATM  440  O   HOH B  76       2.859  -7.403 -11.010  1.00  0.00           O  
HETATM  441  H1  HOH B  76       2.954  -6.687 -10.382  1.00  0.00           H  
HETATM  442  H2  HOH B  76       3.699  -7.861 -10.981  1.00  0.00           H  
HETATM  443 OM   HOH B  76       2.959  -7.376 -10.940  1.00  0.00          EP  
HETATM  444  O   HOH B  77      -7.575  -0.650  -7.584  1.00  0.00           O  
HETATM  445  H1  HOH B  77      -8.216  -0.384  -8.243  1.00  0.00           H  
HETATM  446  H2  HOH B  77      -6.806  -0.110  -7.766  1.00  0.00           H  
HETATM  447 OM   HOH B  77      -7.561  -0.564  -7.674  1.00  0.00          EP  
HETATM  448  O   HOH B  78       6.828   0.088   3.942  1.00  0.00           O  
HETATM  449  H1  HOH B  78       6.541   0.882   3.492  1.00  0.00           H  
HETATM  450  H2  HOH B  78       6.697   0.277   4.871  1.00  0.00           H  
HETATM  451 OM   HOH B  78       6.784   0.193   3.993  1.00  0.00          EP  
HETATM  452  O   HOH B  79      -1.705  -1.265  -7.703  1.00  0.00           O  
HETATM  453  H1  HOH B  79      -1.363  -1.013  -6.845  1.00  0.00           H  
HETATM  454  H2  HOH B  79      -0.931  -1.514  -8.207  1.00  0.00           H  
HETATM  455 OM   HOH B  79      -1.586  -1.265  -7.665  1.00  0.00          EP  
HETATM  456  O   HOH B  80       3.490   7.055   3.642  1.00  0.00           O  
HETATM  457  H1  HOH B  80       3.913   6.213   3.474  1.00  0.00           H  
HETATM  458  H2  HOH B  80       3.808   7.628   2.944  1.00  0.00           H  
HETATM  459 OM   HOH B  80       3.569   7.027   3.550  1.00  0.00          EP  
HETATM  460  O   HOH B  81      -5.765  -7.522  -5.794  1.00  0.00           O  
HETATM  461  H1  HOH B  81      -5.963  -8.174  -5.122  1.00  0.00           H  
HETATM  462  H2  HOH B  81      -4.842  -7.664  -6.002  1.00  0.00           H  
HETATM  463 OM   HOH B  81      -5.688  -7.607  -5.745  1.00  0.00          EP  
HETATM  464  O   HOH B  82       8.483   3.611  -8.077  1.00  0.00           O  
HETATM  465  H1  HOH B  82       8.460   4.326  -8.713  1.00  0.00           H  
HETATM  466  H2  HOH B  82       7.565   3.365  -7.960  1.00  0.00           H  
HETATM  467 OM   HOH B  82       8.382   3.661  -8.132  1.00  0.00          EP  
HETATM  468  O   HOH B  83       5.046  -0.548  -7.115  1.00  0.00           O  
HETATM  469  H1  HOH B  83       5.662  -0.024  -6.603  1.00  0.00           H  
HETATM  470  H2  HOH B  83       5.172  -1.443  -6.800  1.00  0.00           H  
HETATM  471 OM   HOH B  83       5.125  -0.588  -7.027  1.00  0.00          EP  
HETATM  472  O   HOH B  84      -5.657   6.115  -1.377  1.00  0.00           O  
HETATM  473  H1  HOH B  84      -5.959   6.258  -0.480  1.00  0.00           H  
HETATM  474  H2  HOH B  84      -6.401   5.708  -1.819  1.00  0.00           H  
HETATM  475 OM   HOH B  84      -5.768   6.087  -1.328  1.00  0.00          EP  
HETATM  476  O   HOH B  85      -5.421  10.207   2.308  1.00  0.00           O  
HETATM  477  H1  HOH B  85      -4.989  10.469   3.120  1.00  0.00           H  
HETATM  478  H2  HOH B  85      -5.463  11.010   1.788  1.00  0.00           H  
HETATM  479 OM   HOH B  85      -5.379  10.321   2.339  1.00  0.00          EP  
HETATM  480  O   HOH B  86      -5.359   0.830  -8.311  1.00  0.00           O  
HETATM  481  H1  HOH B  86      -4.852   1.364  -7.698  1.00  0.00           H  
HETATM  482  H2  HOH B  86      -4.701   0.419  -8.871  1.00  0.00           H  
HETATM  483 OM   HOH B  86      -5.234   0.843  -8.305  1.00  0.00          EP  
HETATM  484  O   HOH B  87       4.214  -5.710  -6.410  1.00  0.00           O  
HETATM  485  H1  HOH B  87       5.164  -5.805  -6.343  1.00  0.00           H  
HETATM  486  H2  HOH B  87       4.031  -5.789  -7.346  1.00  0.00           H  
HETATM  487 OM   HOH B  87       4.296  -5.728  -6.503  1.00  0.00          EP  
HETATM  488  O   HOH B  88       4.673  -1.062   7.679  1.00  0.00           O  
HETATM  489  H1  HOH B  88       4.260  -1.605   8.351  1.00  0.00           H  
HETATM  490  H2  HOH B  88       4.616  -0.171   8.023  1.00  0.00           H  
HETATM  491 OM   HOH B  88       4.622  -1.025   7.788  1.00  0.00          EP  
HETATM  492  O   HOH B  89       2.914  -5.498   6.157  1.00  0.00           O  
HETATM  493  H1  HOH B  89       3.869  -5.436   6.169  1.00  0.00           H  
HETATM  494  H2  HOH B  89       2.710  -6.176   6.801  1.00  0.00           H  
HETATM  495 OM   HOH B  89       2.994  -5.564   6.227  1.00  0.00          EP  
HETATM  496  O   HOH B  90      -6.454  -3.115  -8.272  1.00  0.00           O  
HETATM  497  H1  HOH B  90      -5.526  -2.991  -8.471  1.00  0.00           H  
HETATM  498  H2  HOH B  90      -6.755  -2.253  -7.987  1.00  0.00           H  
HETATM  499 OM   HOH B  90      -6.387  -3.010  -8.263  1.00  0.00          EP  
HETATM  500  O   HOH B  91      -5.658  -4.026   7.475  1.00  0.00           O  
HETATM  501  H1  HOH B  91      -5.286  -3.721   8.303  1.00  0.00           H  
HETATM  502  H2  HOH B  91      -4.915  -4.045   6.871  1.00  0.00           H  
HETATM  503 OM   HOH B  91      -5.539  -3.995   7.499  1.00  0.00          EP  
HETATM  504  O   HOH B  92      -7.256  -5.349  -6.898  1.00  0.00           O  
HETATM  505  H1  HOH B  92      -6.860  -4.578  -7.304  1.00  0.00           H  
HETATM  506  H2  HOH B  92      -6.513  -5.898  -6.649  1.00  0.00           H  
HETATM  507 OM   HOH B  92      -7.135  -5.325  -6.915  1.00  0.00          EP  
HETATM  508  O   HOH B  93       7.216   7.176  10.196  1.00  0.00           O  
HETATM  509  H1  HOH B  93       6.541   7.854  10.177  1.00  0.00           H  
HETATM  510  H2  HOH B  93       7.101   6.699   9.374  1.00  0.00           H  
HETATM  511 OM   HOH B  93       7.132   7.197  10.106  1.00  0.00          EP  
HETATM  512  O   HOH B  94       6.667   0.729   6.583  1.00  0.00           O  
HETATM  513  H1  HOH B  94       6.369  -0.127   6.891  1.00  0.00           H  
HETATM  514  H2  HOH B  94       6.105   1.356   7.037  1.00  0.00           H  
HETATM  515 OM   HOH B  94       6.575   0.704   6.664  1.00  0.00          EP  
HETATM  516  O   HOH B  95       4.738   1.583   8.458  1.00  0.00           O  
HETATM  517  H1  HOH B  95       5.114   2.233   9.051  1.00  0.00           H  
HETATM  518  H2  HOH B  95       3.792   1.676   8.568  1.00  0.00           H  
HETATM  519 OM   HOH B  95       4.677   1.662   8.533  1.00  0.00          EP  
HETATM  520  O   HOH B  96       1.828  -8.086  -7.048  1.00  0.00           O  
HETATM  521  H1  HOH B  96       2.669  -8.449  -6.769  1.00  0.00           H  
HETATM  522  H2  HOH B  96       1.750  -8.343  -7.967  1.00  0.00           H  
HETATM  523 OM   HOH B  96       1.910  -8.152  -7.117  1.00  0.00          EP  
HETATM  524  O   HOH B  97      -0.700  -0.202   9.271  1.00  0.00           O  
HETATM  525  H1  HOH B  97       0.088   0.338   9.208  1.00  0.00           H  
HETATM  526  H2  HOH B  97      -1.336   0.353   9.722  1.00  0.00           H  
HETATM  527 OM   HOH B  97      -0.684  -0.085   9.312  1.00  0.00          EP  
HETATM  528  O   HOH B  98       5.716  -5.732   6.352  1.00  0.00           O  
HETATM  529  H1  HOH B  98       6.242  -6.021   7.098  1.00  0.00           H  
HETATM  530  H2  HOH B  98       5.857  -4.786   6.312  1.00  0.00           H  
HETATM  531 OM   HOH B  98       5.788  -5.662   6.428  1.00  0.00          EP  
HETATM  532  O   HOH B  99      -0.681   4.784   4.367  1.00  0.00           O  
HETATM  533  H1  HOH B  99      -0.319   4.274   3.642  1.00  0.00           H  
HETATM  534  H2  HOH B  99      -0.401   4.315   5.153  1.00  0.00           H  
HETATM  535 OM   HOH B  99      -0.612   4.679   4.374  1.00  0.00          EP  
HETATM  536  O   HOH B 100       6.905  -2.501   3.032  1.00  0.00           O  
HETATM  537  H1  HOH B 100       6.769  -1.592   3.300  1.00  0.00           H  
HETATM  538  H2  HOH B 100       6.662  -2.517   2.106  1.00  0.00           H  
HETATM  539 OM   HOH B 100       6.865  -2.406   2.962  1.00  0.00          EP  
HETATM  540  O   HOH B 101      -6.389   9.714  -9.784  1.00  0.00           O  
HETATM  541  H1  HOH B 101      -6.228   9.821  -8.847  1.00  0.00           H  
HETATM  542  H2  HOH B 101      -7.247  10.113  -9.928  1.00  0.00           H  
HETATM  543 OM   HOH B 101      -6.463   9.768  -9.700  1.00  0.00          EP  
HETATM  544  O   HOH B 102     -10.363   5.658  -9.964  1.00  0.00           O  
HETATM  545  H1  HOH B 102     -10.251   6.514 -10.376  1.00  0.00           H  
HETATM  546  H2  HOH B 102      -9.713   5.099 -10.390  1.00  0.00           H  
HETATM  547 OM   HOH B 102     -10.282   5.689 -10.053  1.00  0.00          EP  
HETATM  548  O   HOH B 103      -5.259  -6.005  10.810  1.00  0.00           O  
HETATM  549  H1  HOH B 103      -5.162  -6.929  11.040  1.00  0.00           H  
HETATM  550  H2  HOH B 103      -6.027  -5.715  11.303  1.00  0.00           H  
HETATM  551 OM   HOH B 103      -5.331  -6.073  10.887  1.00  0.00          EP  
HETATM  552  O   HOH B 104      -9.525   0.403  -9.219  1.00  0.00           O  
HETATM  553  H1  HOH B 104     -10.412   0.380  -8.859  1.00  0.00           H  
HETATM  554  H2  HOH B 104      -9.226   1.299  -9.063  1.00  0.00           H  
HETATM  555 OM   HOH B 104      -9.588   0.496  -9.164  1.00  0.00          EP  
HETATM  556  O   HOH B 105       7.070  -7.778   3.588  1.00  0.00           O  
HETATM  557  H1  HOH B 105       7.495  -6.958   3.336  1.00  0.00           H  
HETATM  558  H2  HOH B 105       6.144  -7.639   3.389  1.00  0.00           H  
HETATM  559 OM   HOH B 105       7.017  -7.676   3.540  1.00  0.00          EP  
HETATM  560  O   HOH B 106      -1.827  -2.728  10.383  1.00  0.00           O  
HETATM  561  H1  HOH B 106      -1.304  -3.434  10.005  1.00  0.00           H  
HETATM  562  H2  HOH B 106      -1.435  -1.926  10.035  1.00  0.00           H  
HETATM  563 OM   HOH B 106      -1.729  -2.718  10.306  1.00  0.00          EP  
HETATM  564  O   HOH B 107      -9.859  -4.745   1.515  1.00  0.00           O  
HETATM  565  H1  HOH B 107      -9.937  -3.878   1.912  1.00  0.00           H  
HETATM  566  H2  HOH B 107     -10.053  -4.604   0.589  1.00  0.00           H  
HETATM  567 OM   HOH B 107      -9.888  -4.638   1.459  1.00  0.00          EP  
HETATM  568  O   HOH B 108      -2.538  -9.572  -8.436  1.00  0.00           O  
HETATM  569  H1  HOH B 108      -3.212  -9.852  -9.056  1.00  0.00           H  
HETATM  570  H2  HOH B 108      -1.992  -8.963  -8.933  1.00  0.00           H  
HETATM  571 OM   HOH B 108      -2.552  -9.537  -8.555  1.00  0.00          EP  
HETATM  572  O   HOH B 109      -0.638  -8.967  10.027  1.00  0.00           O  
HETATM  573  H1  HOH B 109      -0.097  -8.257  10.373  1.00  0.00           H  
HETATM  574  H2  HOH B 109      -0.013  -9.652   9.790  1.00  0.00           H  
HETATM  575 OM   HOH B 109      -0.514  -8.965  10.039  1.00  0.00          EP  
HETATM  576  O   HOH B 110      -7.631  -9.333   9.957  1.00  0.00           O  
HETATM  577  H1  HOH B 110      -6.720  -9.191  10.213  1.00  0.00           H  
HETATM  578  H2  HOH B 110      -8.078  -8.521  10.200  1.00  0.00           H  
HETATM  579 OM   HOH B 110      -7.582  -9.231  10.010  1.00  0.00          EP  
HETATM  580  O   HOH B 111      -4.342   3.574  -4.349  1.00  0.00           O  
HETATM  581  H1  HOH B 111      -5.026   2.904  -4.354  1.00  0.00           H  
HETATM  582  H2  HOH B 111      -4.164   3.728  -3.422  1.00  0.00           H  
HETATM  583 OM   HOH B 111      -4.396   3.519  -4.251  1.00  0.00          EP  
HETATM  584  O   HOH B 112      -0.215  -0.432   5.215  1.00  0.00           O  
HETATM  585  H1  HOH B 112       0.443  -0.695   5.858  1.00  0.00           H  
HETATM  586  H2  HOH B 112       0.161   0.339   4.789  1.00  0.00           H  
HETATM  587 OM   HOH B 112      -0.105  -0.378   5.239  1.00  0.00          EP  
HETATM  588  O   HOH B 113      -4.528  -3.457   9.908  1.00  0.00           O  
HETATM  589  H1  HOH B 113      -4.543  -4.334  10.291  1.00  0.00           H  
HETATM  590  H2  HOH B 113      -3.636  -3.144  10.060  1.00  0.00           H  
HETATM  591 OM   HOH B 113      -4.434  -3.517   9.965  1.00  0.00          EP  
HETATM  592  O   HOH B 114       1.195   1.563  -8.040  1.00  0.00           O  
HETATM  593  H1  HOH B 114       1.862   2.224  -8.223  1.00  0.00           H  
HETATM  594  H2  HOH B 114       0.625   1.577  -8.809  1.00  0.00           H  
HETATM  595 OM   HOH B 114       1.205   1.635  -8.141  1.00  0.00          EP  
HETATM  596  O   HOH B 115      -4.247  -1.387   6.151  1.00  0.00           O  
HETATM  597  H1  HOH B 115      -3.501  -0.831   6.378  1.00  0.00           H  
HETATM  598  H2  HOH B 115      -3.900  -2.278   6.180  1.00  0.00           H  
HETATM  599 OM   HOH B 115      -4.130  -1.422   6.178  1.00  0.00          EP  
HETATM  600  O   HOH B 116      -4.186   3.248  12.130  1.00  0.00           O  
HETATM  601  H1  HOH B 116      -3.975   3.589  11.261  1.00  0.00           H  
HETATM  602  H2  HOH B 116      -3.366   2.868  12.444  1.00  0.00           H  
HETATM  603 OM   HOH B 116      -4.076   3.244  12.071  1.00  0.00          EP  
HETATM  604  O   HOH B 117       6.823  -2.425  -9.115  1.00  0.00           O  
HETATM  605  H1  HOH B 117       7.375  -2.511  -8.338  1.00  0.00           H  
HETATM  606  H2  HOH B 117       6.907  -1.506  -9.369  1.00  0.00           H  
HETATM  607 OM   HOH B 117       6.891  -2.336  -9.059  1.00  0.00          EP  
HETATM  608  O   HOH B 118      -7.167   5.431  -5.189  1.00  0.00           O  
HETATM  609  H1  HOH B 118      -6.359   5.937  -5.279  1.00  0.00           H  
HETATM  610  H2  HOH B 118      -7.023   4.652  -5.726  1.00  0.00           H  
HETATM  611 OM   HOH B 118      -7.066   5.402  -5.256  1.00  0.00          EP  
HETATM  612  O   HOH B 119      -5.379  -6.863   4.745  1.00  0.00           O  
HETATM  613  H1  HOH B 119      -5.242  -5.920   4.663  1.00  0.00           H  
HETATM  614  H2  HOH B 119      -4.520  -7.211   4.986  1.00  0.00           H  
HETATM  615 OM   HOH B 119      -5.273  -6.800   4.762  1.00  0.00          EP  
HETATM  616  O   HOH B 120       2.303   4.220  -4.374  1.00  0.00           O  
HETATM  617  H1  HOH B 120       1.818   3.438  -4.637  1.00  0.00           H  
HETATM  618  H2  HOH B 120       2.639   4.012  -3.502  1.00  0.00           H  
HETATM  619 OM   HOH B 120       2.287   4.114  -4.309  1.00  0.00          EP  
HETATM  620  O   HOH B 121       3.520  -9.989   1.501  1.00  0.00           O  
HETATM  621  H1  HOH B 121       4.355 -10.191   1.079  1.00  0.00           H  
HETATM  622  H2  HOH B 121       3.745  -9.365   2.191  1.00  0.00           H  
HETATM  623 OM   HOH B 121       3.633  -9.944   1.529  1.00  0.00          EP  
HETATM  624  O   HOH B 122      -7.280   0.123  10.411  1.00  0.00           O  
HETATM  625  H1  HOH B 122      -7.077   0.953  10.842  1.00  0.00           H  
HETATM  626  H2  HOH B 122      -6.691   0.093   9.657  1.00  0.00           H  
HETATM  627 OM   HOH B 122      -7.195   0.208  10.377  1.00  0.00          EP  
HETATM  628  O   HOH B 123       3.514  11.576  -1.964  1.00  0.00           O  
HETATM  629  H1  HOH B 123       4.320  11.149  -2.254  1.00  0.00           H  
HETATM  630  H2  HOH B 123       3.563  12.458  -2.332  1.00  0.00           H  
HETATM  631 OM   HOH B 123       3.605  11.625  -2.034  1.00  0.00          EP  
HETATM  632  O   HOH B 124       7.230   5.000  11.835  1.00  0.00           O  
HETATM  633  H1  HOH B 124       7.629   5.220  12.677  1.00  0.00           H  
HETATM  634  H2  HOH B 124       7.263   5.814  11.333  1.00  0.00           H  
HETATM  635 OM   HOH B 124       7.276   5.110  11.871  1.00  0.00          EP  
HETATM  636  O   HOH B 125      -1.971   2.532 -10.313  1.00  0.00           O  
HETATM  637  H1  HOH B 125      -1.051   2.507 -10.576  1.00  0.00           H  
HETATM  638  H2  HOH B 125      -2.007   3.202  -9.630  1.00  0.00           H  
HETATM  639 OM   HOH B 125      -1.877   2.601 -10.268  1.00  0.00          EP  
HETATM  640  O   HOH B 126      -8.875  -2.100   7.970  1.00  0.00           O  
HETATM  641  H1  HOH B 126      -9.283  -1.298   8.298  1.00  0.00           H  
HETATM  642  H2  HOH B 126      -8.279  -2.368   8.669  1.00  0.00           H  
HETATM  643 OM   HOH B 126      -8.855  -2.043   8.080  1.00  0.00          EP  
HETATM  644  O   HOH B 127       1.909   8.636  -9.650  1.00  0.00           O  
HETATM  645  H1  HOH B 127       0.973   8.492  -9.783  1.00  0.00           H  
HETATM  646  H2  HOH B 127       2.327   7.860 -10.023  1.00  0.00           H  
HETATM  647 OM   HOH B 127       1.854   8.538  -9.704  1.00  0.00          EP  
HETATM  648  O   HOH B 128       3.150   4.556   9.323  1.00  0.00           O  
HETATM  649  H1  HOH B 128       4.014   4.275   9.624  1.00  0.00           H  
HETATM  650  H2  HOH B 128       2.710   3.745   9.068  1.00  0.00           H  
HETATM  651 OM   HOH B 128       3.195   4.439   9.328  1.00  0.00          EP  
HETATM  652  O   HOH B 129       1.510  -9.262  -9.570  1.00  0.00           O  
HETATM  653  H1  HOH B 129       2.221  -9.856  -9.330  1.00  0.00           H  
HETATM  654  H2  HOH B 129       1.920  -8.615 -10.144  1.00  0.00           H  
HETATM  655 OM   HOH B 129       1.629  -9.257  -9.606  1.00  0.00          EP  
HETATM  656  O   HOH B 130     -10.335  -7.010   7.783  1.00  0.00           O  
HETATM  657  H1  HOH B 130     -11.263  -6.904   7.993  1.00  0.00           H  
HETATM  658  H2  HOH B 130      -9.879  -6.799   8.597  1.00  0.00           H  
HETATM  659 OM   HOH B 130     -10.386  -6.977   7.892  1.00  0.00          EP  
HETATM  660  O   HOH B 131       1.022   6.905   4.799  1.00  0.00           O  
HETATM  661  H1  HOH B 131       0.572   6.077   4.627  1.00  0.00           H  
HETATM  662  H2  HOH B 131       1.892   6.788   4.419  1.00  0.00           H  
HETATM  663 OM   HOH B 131       1.066   6.804   4.740  1.00  0.00          EP  
HETATM  664  O   HOH B 132     -12.129  -7.059  -1.135  1.00  0.00           O  
HETATM  665  H1  HOH B 132     -11.847  -7.142  -2.046  1.00  0.00           H  
HETATM  666  H2  HOH B 132     -12.572  -6.212  -1.097  1.00  0.00           H  
HETATM  667 OM   HOH B 132     -12.146  -6.978  -1.228  1.00  0.00          EP  
HETATM  668  O   HOH B 133      -1.930   8.484   7.494  1.00  0.00           O  
HETATM  669  H1  HOH B 133      -1.245   8.119   8.054  1.00  0.00           H  
HETATM  670  H2  HOH B 133      -2.597   7.798   7.453  1.00  0.00           H  
HETATM  671 OM   HOH B 133      -1.929   8.372   7.549  1.00  0.00          EP  
HETATM  672  O   HOH B 134      -9.834   6.033  -1.130  1.00  0.00           O  
HETATM  673  H1  HOH B 134      -9.439   6.817  -0.750  1.00  0.00           H  
HETATM  674  H2  HOH B 134      -9.138   5.647  -1.662  1.00  0.00           H  
HETATM  675 OM   HOH B 134      -9.717   6.075  -1.146  1.00  0.00          EP  
HETATM  676  O   HOH B 135       0.589   2.320  -5.492  1.00  0.00           O  
HETATM  677  H1  HOH B 135       0.855   2.032  -6.366  1.00  0.00           H  
HETATM  678  H2  HOH B 135       0.070   3.109  -5.647  1.00  0.00           H  
HETATM  679 OM   HOH B 135       0.562   2.373  -5.602  1.00  0.00          EP  
HETATM  680  O   HOH B 136     -10.321  -7.464   0.831  1.00  0.00           O  
HETATM  681  H1  HOH B 136     -11.022  -7.374   0.186  1.00  0.00           H  
HETATM  682  H2  HOH B 136     -10.266  -6.604   1.248  1.00  0.00           H  
HETATM  683 OM   HOH B 136     -10.390  -7.363   0.807  1.00  0.00          EP  
HETATM  684  O   HOH B 137      -0.194   7.059   9.209  1.00  0.00           O  
HETATM  685  H1  HOH B 137      -0.430   6.235   8.782  1.00  0.00           H  
HETATM  686  H2  HOH B 137       0.427   6.806   9.892  1.00  0.00           H  
HETATM  687 OM   HOH B 137      -0.153   6.944   9.236  1.00  0.00          EP  
HETATM  688  O   HOH B 138       0.715  -4.654  -8.228  1.00  0.00           O  
HETATM  689  H1  HOH B 138       0.260  -5.076  -8.957  1.00  0.00           H  
HETATM  690  H2  HOH B 138       0.332  -5.050  -7.445  1.00  0.00           H  
HETATM  691 OM   HOH B 138       0.625  -4.741  -8.223  1.00  0.00          EP  
HETATM  692  O   HOH B 139      -1.911   6.924  -5.072  1.00  0.00           O  
HETATM  693  H1  HOH B 139      -2.761   6.634  -5.404  1.00  0.00           H  
HETATM  694  H2  HOH B 139      -2.124   7.499  -4.337  1.00  0.00           H  
HETATM  695 OM   HOH B 139      -2.024   6.954  -5.029  1.00  0.00          EP  
HETATM  696  O   HOH B 140      -0.018  -5.589  -5.749  1.00  0.00           O  
HETATM  697  H1  HOH B 140       0.798  -5.609  -5.249  1.00  0.00           H  
HETATM  698  H2  HOH B 140      -0.486  -6.378  -5.477  1.00  0.00           H  
HETATM  699 OM   HOH B 140       0.019  -5.675  -5.667  1.00  0.00          EP  
HETATM  700  O   HOH B 141     -11.742   8.551  -7.526  1.00  0.00           O  
HETATM  701  H1  HOH B 141     -10.816   8.757  -7.651  1.00  0.00           H  
HETATM  702  H2  HOH B 141     -11.778   7.594  -7.533  1.00  0.00           H  
HETATM  703 OM   HOH B 141     -11.647   8.470  -7.540  1.00  0.00          EP  
HETATM  704  O   HOH B 142       5.066   8.859   9.510  1.00  0.00           O  
HETATM  705  H1  HOH B 142       4.400   9.526   9.675  1.00  0.00           H  
HETATM  706  H2  HOH B 142       4.594   8.151   9.072  1.00  0.00           H  
HETATM  707 OM   HOH B 142       4.945   8.855   9.481  1.00  0.00          EP  
HETATM  708  O   HOH B 143      -6.247   8.868   5.575  1.00  0.00           O  
HETATM  709  H1  HOH B 143      -5.504   9.426   5.345  1.00  0.00           H  
HETATM  710  H2  HOH B 143      -5.927   7.976   5.445  1.00  0.00           H  
HETATM  711 OM   HOH B 143      -6.134   8.833   5.536  1.00  0.00          EP  
HETATM  712  O   HOH B 144      -6.890   8.571  -4.833  1.00  0.00           O  
HETATM  713  H1  HOH B 144      -6.301   8.530  -4.080  1.00  0.00           H  
HETATM  714  H2  HOH B 144      -7.712   8.909  -4.477  1.00  0.00           H  
HETATM  715 OM   HOH B 144      -6.915   8.603  -4.715  1.00  0.00          EP  
HETATM  716  O   HOH B 145      -9.438   6.660  -5.991  1.00  0.00           O  
HETATM  717  H1  HOH B 145      -9.838   6.849  -5.142  1.00  0.00           H  
HETATM  718  H2  HOH B 145      -8.603   6.244  -5.776  1.00  0.00           H  
HETATM  719 OM   HOH B 145      -9.391   6.636  -5.878  1.00  0.00          EP  
HETATM  720  O   HOH B 146      -5.348   5.728  -8.332  1.00  0.00           O  
HETATM  721  H1  HOH B 146      -6.048   6.204  -8.778  1.00  0.00           H  
HETATM  722  H2  HOH B 146      -5.369   4.852  -8.719  1.00  0.00           H  
HETATM  723 OM   HOH B 146      -5.425   5.685  -8.421  1.00  0.00          EP  
HETATM  724  O   HOH B 147       3.935   6.826   8.013  1.00  0.00           O  
HETATM  725  H1  HOH B 147       3.649   6.012   8.429  1.00  0.00           H  
HETATM  726  H2  HOH B 147       3.131   7.214   7.668  1.00  0.00           H  
HETATM  727 OM   HOH B 147       3.819   6.780   8.020  1.00  0.00          EP  
HETATM  728  O   HOH B 148      -3.533   9.581  -7.596  1.00  0.00           O  
HETATM  729  H1  HOH B 148      -3.152  10.107  -8.298  1.00  0.00           H  
HETATM  730  H2  HOH B 148      -3.111   9.902  -6.799  1.00  0.00           H  
HETATM  731 OM   HOH B 148      -3.447   9.671  -7.586  1.00  0.00          EP  
HETATM  732  O   HOH B 149      -1.798   9.295   4.880  1.00  0.00           O  
HETATM  733  H1  HOH B 149      -1.685   9.052   5.799  1.00  0.00           H  
HETATM  734  H2  HOH B 149      -1.937   8.464   4.427  1.00  0.00           H  
HETATM  735 OM   HOH B 149      -1.801   9.181   4.929  1.00  0.00          EP  
HETATM  736  O   HOH B 150      -8.597   8.123   0.087  1.00  0.00           O  
HETATM  737  H1  HOH B 150      -9.116   8.387   0.846  1.00  0.00           H  
HETATM  738  H2  HOH B 150      -7.849   7.655   0.457  1.00  0.00           H  
HETATM  739 OM   HOH B 150      -8.573   8.101   0.207  1.00  0.00          EP  
HETATM  740  O   HOH B 151      -8.710   2.901  -8.482  1.00  0.00           O  
HETATM  741  H1  HOH B 151      -8.483   3.507  -9.187  1.00  0.00           H  
HETATM  742  H2  HOH B 151      -7.983   2.968  -7.863  1.00  0.00           H  
HETATM  743 OM   HOH B 151      -8.608   2.973  -8.491  1.00  0.00          EP  
HETATM  744  O   HOH B 152      -7.797   4.937  -2.594  1.00  0.00           O  
HETATM  745  H1  HOH B 152      -7.608   5.132  -3.512  1.00  0.00           H  
HETATM  746  H2  HOH B 152      -7.853   3.982  -2.558  1.00  0.00           H  
HETATM  747 OM   HOH B 152      -7.783   4.856  -2.688  1.00  0.00          EP  
HETATM  748  O   HOH B 153     -11.491   5.751  -7.514  1.00  0.00           O  
HETATM  749  H1  HOH B 153     -10.724   5.995  -6.996  1.00  0.00           H  
HETATM  750  H2  HOH B 153     -11.162   5.679  -8.410  1.00  0.00           H  
HETATM  751 OM   HOH B 153     -11.374   5.769  -7.554  1.00  0.00          EP  
HETATM  752  O   HOH B 154      -0.542  -8.901  -2.329  1.00  0.00           O  
HETATM  753  H1  HOH B 154       0.070  -9.583  -2.605  1.00  0.00           H  
HETATM  754  H2  HOH B 154      -0.175  -8.565  -1.512  1.00  0.00           H  
HETATM  755 OM   HOH B 154      -0.438  -8.938  -2.271  1.00  0.00          EP  
HETATM  756  O   HOH B 155      -0.875   8.481  -9.757  1.00  0.00           O  
HETATM  757  H1  HOH B 155      -1.494   7.869  -9.358  1.00  0.00           H  
HETATM  758  H2  HOH B 155      -1.134   8.519 -10.677  1.00  0.00           H  
HETATM  759 OM   HOH B 155      -0.969   8.420  -9.812  1.00  0.00          EP  
HETATM  760  O   HOH B 156     -10.886   3.090  -6.892  1.00  0.00           O  
HETATM  761  H1  HOH B 156     -11.257   3.959  -7.043  1.00  0.00           H  
HETATM  762  H2  HOH B 156     -10.118   3.054  -7.462  1.00  0.00           H  
HETATM  763 OM   HOH B 156     -10.843   3.179  -6.969  1.00  0.00          EP  
HETATM  764  O   HOH B 157      -4.120   2.179   6.892  1.00  0.00           O  
HETATM  765  H1  HOH B 157      -3.949   2.755   7.637  1.00  0.00           H  
HETATM  766  H2  HOH B 157      -3.399   1.549   6.906  1.00  0.00           H  
HETATM  767 OM   HOH B 157      -4.025   2.173   6.973  1.00  0.00          EP  
HETATM  768  O   HOH B 158      -7.558   9.789  -1.820  1.00  0.00           O  
HETATM  769  H1  HOH B 158      -7.926   9.304  -1.081  1.00  0.00           H  
HETATM  770  H2  HOH B 158      -8.258   9.801  -2.473  1.00  0.00           H  
HETATM  771 OM   HOH B 158      -7.672   9.739  -1.811  1.00  0.00          EP  
HETATM  772  O   HOH B 159      -7.854   9.897   3.605  1.00  0.00           O  
HETATM  773  H1  HOH B 159      -7.160  10.022   2.958  1.00  0.00           H  
HETATM  774  H2  HOH B 159      -7.447   9.372   4.294  1.00  0.00           H  
HETATM  775 OM   HOH B 159      -7.737   9.854   3.609  1.00  0.00          EP  
HETATM  776  O   HOH B 160       5.171  -8.761 -10.211  1.00  0.00           O  
HETATM  777  H1  HOH B 160       5.590  -9.126 -10.990  1.00  0.00           H  
HETATM  778  H2  HOH B 160       4.771  -9.516  -9.778  1.00  0.00           H  
HETATM  779 OM   HOH B 160       5.173  -8.881 -10.248  1.00  0.00          EP  
HETATM  780  O   HOH B 161     -11.297   3.573   3.178  1.00  0.00           O  
HETATM  781  H1  HOH B 161     -12.234   3.468   3.341  1.00  0.00           H  
HETATM  782  H2  HOH B 161     -11.229   4.399   2.697  1.00  0.00           H  
HETATM  783 OM   HOH B 161     -11.390   3.650   3.144  1.00  0.00          EP  
HETATM  784  O   HOH B 162      -1.272  -8.316   2.548  1.00  0.00           O  
HETATM  785  H1  HOH B 162      -0.912  -8.228   3.430  1.00  0.00           H  
HETATM  786  H2  HOH B 162      -0.977  -7.530   2.089  1.00  0.00           H  
HETATM  787 OM   HOH B 162      -1.202  -8.223   2.593  1.00  0.00          EP  
HETATM  788  O   HOH B 163      -8.127   5.805   5.348  1.00  0.00           O  
HETATM  789  H1  HOH B 163      -8.488   6.286   6.093  1.00  0.00           H  
HETATM  790  H2  HOH B 163      -7.179   5.902   5.437  1.00  0.00           H  
HETATM  791 OM   HOH B 163      -8.064   5.867   5.437  1.00  0.00          EP  
HETATM  792  O   HOH B 164      -9.385   9.608  -3.931  1.00  0.00           O  
HETATM  793  H1  HOH B 164      -9.747   8.764  -3.663  1.00  0.00           H  
HETATM  794  H2  HOH B 164     -10.047   9.978  -4.516  1.00  0.00           H  
HETATM  795 OM   HOH B 164      -9.494   9.558  -3.965  1.00  0.00          EP  
HETATM  796  O   HOH B 165       2.943  10.211   6.715  1.00  0.00           O  
HETATM  797  H1  HOH B 165       3.624   9.822   6.166  1.00  0.00           H  
HETATM  798  H2  HOH B 165       2.326   9.497   6.873  1.00  0.00           H  
HETATM  799 OM   HOH B 165       2.950  10.093   6.673  1.00  0.00          EP  
HETATM  800  O   HOH B 166      -5.238   8.551  -2.597  1.00  0.00           O  
HETATM  801  H1  HOH B 166      -5.936   9.079  -2.210  1.00  0.00           H  
HETATM  802  H2  HOH B 166      -5.329   7.692  -2.184  1.00  0.00           H  
HETATM  803 OM   HOH B 166      -5.322   8.515  -2.512  1.00  0.00          EP  
HETATM  804  O   HOH B 167      -2.180   4.388  -8.253  1.00  0.00           O  
HETATM  805  H1  HOH B 167      -2.394   5.299  -8.457  1.00  0.00           H  
HETATM  806  H2  HOH B 167      -1.519   4.445  -7.563  1.00  0.00           H  
HETATM  807 OM   HOH B 167      -2.132   4.491  -8.201  1.00  0.00          EP  
HETATM  808  O   HOH B 168      -0.318 -11.149  -8.297  1.00  0.00           O  
HETATM  809  H1  HOH B 168      -1.165 -10.705  -8.338  1.00  0.00           H  
HETATM  810  H2  HOH B 168       0.248 -10.641  -8.877  1.00  0.00           H  
HETATM  811 OM   HOH B 168      -0.348 -11.048  -8.363  1.00  0.00          EP  
HETATM  812  O   HOH B 169      -9.169 -11.107  -7.902  1.00  0.00           O  
HETATM  813  H1  HOH B 169      -8.357 -11.305  -7.434  1.00  0.00           H  
HETATM  814  H2  HOH B 169      -9.845 -11.120  -7.225  1.00  0.00           H  
HETATM  815 OM   HOH B 169      -9.154 -11.129  -7.780  1.00  0.00          EP  
HETATM  816  O   HOH B 170      -2.561   8.880  -3.268  1.00  0.00           O  
HETATM  817  H1  HOH B 170      -3.484   8.811  -3.023  1.00  0.00           H  
HETATM  818  H2  HOH B 170      -2.140   9.280  -2.507  1.00  0.00           H  
HETATM  819 OM   HOH B 170      -2.615   8.916  -3.161  1.00  0.00          EP  
HETATM  820  O   HOH B 171      -4.675   7.555   2.745  1.00  0.00           O  
HETATM  821  H1  HOH B 171      -3.726   7.435   2.763  1.00  0.00           H  
HETATM  822  H2  HOH B 171      -4.796   8.475   2.512  1.00  0.00           H  
HETATM  823 OM   HOH B 171      -4.587   7.640   2.722  1.00  0.00          EP  
HETATM  824  O   HOH B 172       0.763 -10.343   1.391  1.00  0.00           O  
HETATM  825  H1  HOH B 172       1.714 -10.410   1.480  1.00  0.00           H  
HETATM  826  H2  HOH B 172       0.448 -10.205   2.284  1.00  0.00           H  
HETATM  827 OM   HOH B 172       0.831 -10.335   1.496  1.00  0.00          EP  
HETATM  828  O   HOH B 173       2.082   9.833   1.221  1.00  0.00           O  
HETATM  829  H1  HOH B 173       1.456   9.513   1.871  1.00  0.00           H  
HETATM  830  H2  HOH B 173       2.938   9.576   1.565  1.00  0.00           H  
HETATM  831 OM   HOH B 173       2.107   9.771   1.327  1.00  0.00          EP  
HETATM  832  O   HOH B 174      -5.514 -12.232   7.414  1.00  0.00           O  
HETATM  833  H1  HOH B 174      -4.907 -12.860   7.807  1.00  0.00           H  
HETATM  834  H2  HOH B 174      -6.217 -12.142   8.057  1.00  0.00           H  
HETATM  835 OM   HOH B 174      -5.524 -12.290   7.524  1.00  0.00          EP  
HETATM  836  O   HOH B 175       4.357   1.106 -10.405  1.00  0.00           O  
HETATM  837  H1  HOH B 175       4.038   1.991 -10.224  1.00  0.00           H  
HETATM  838  H2  HOH B 175       3.718   0.530  -9.985  1.00  0.00           H  
HETATM  839 OM   HOH B 175       4.255   1.139 -10.341  1.00  0.00          EP  
HETATM  840  O   HOH B 176      -2.188   1.802  10.295  1.00  0.00           O  
HETATM  841  H1  HOH B 176      -1.450   2.377  10.497  1.00  0.00           H  
HETATM  842  H2  HOH B 176      -2.837   2.377   9.890  1.00  0.00           H  
HETATM  843 OM   HOH B 176      -2.178   1.924  10.273  1.00  0.00          EP  
HETATM  844  O   HOH B 177       7.317   2.468  -4.405  1.00  0.00           O  
HETATM  845  H1  HOH B 177       7.513   3.389  -4.579  1.00  0.00           H  
HETATM  846  H2  HOH B 177       7.260   2.411  -3.451  1.00  0.00           H  
HETATM  847 OM   HOH B 177       7.332   2.560  -4.322  1.00  0.00          EP  
HETATM  848  O   HOH B 178      -5.312   6.325   5.099  1.00  0.00           O  
HETATM  849  H1  HOH B 178      -5.132   6.703   4.238  1.00  0.00           H  
HETATM  850  H2  HOH B 178      -4.760   5.544   5.137  1.00  0.00           H  
HETATM  851 OM   HOH B 178      -5.234   6.282   5.011  1.00  0.00          EP  
HETATM  852  O   HOH B 179      -5.499  -7.526  -9.908  1.00  0.00           O  
HETATM  853  H1  HOH B 179      -5.074  -6.846  -9.386  1.00  0.00           H  
HETATM  854  H2  HOH B 179      -5.815  -8.160  -9.265  1.00  0.00           H  
HETATM  855 OM   HOH B 179      -5.488  -7.521  -9.784  1.00  0.00          EP  
HETATM  856  O   HOH B 180       7.359   2.234  -1.681  1.00  0.00           O  
HETATM  857  H1  HOH B 180       6.529   2.170  -1.209  1.00  0.00           H  
HETATM  858  H2  HOH B 180       7.899   2.810  -1.141  1.00  0.00           H  
HETATM  859 OM   HOH B 180       7.328   2.289  -1.573  1.00  0.00          EP  
HETATM  860  O   HOH B 181     -10.543   5.847   1.720  1.00  0.00           O  
HETATM  861  H1  HOH B 181     -10.501   6.747   2.042  1.00  0.00           H  
HETATM  862  H2  HOH B 181     -10.560   5.933   0.767  1.00  0.00           H  
HETATM  863 OM   HOH B 181     -10.540   5.952   1.652  1.00  0.00          EP  
HETATM  864  O   HOH B 182       0.252   8.790   3.009  1.00  0.00           O  
HETATM  865  H1  HOH B 182      -0.280   9.367   3.556  1.00  0.00           H  
HETATM  866  H2  HOH B 182       0.639   8.167   3.624  1.00  0.00           H  
HETATM  867 OM   HOH B 182       0.236   8.785   3.133  1.00  0.00          EP  
HETATM  868  O   HOH B 183       0.317   8.635  -4.913  1.00  0.00           O  
HETATM  869  H1  HOH B 183       0.786   8.740  -5.741  1.00  0.00           H  
HETATM  870  H2  HOH B 183      -0.437   8.088  -5.133  1.00  0.00           H  
HETATM  871 OM   HOH B 183       0.287   8.588  -5.025  1.00  0.00          EP  
HETATM  872  O   HOH B 184      -8.029  -6.717  -9.133  1.00  0.00           O  
HETATM  873  H1  HOH B 184      -7.201  -6.844  -9.595  1.00  0.00           H  
HETATM  874  H2  HOH B 184      -7.808  -6.146  -8.397  1.00  0.00           H  
HETATM  875 OM   HOH B 184      -7.917  -6.670  -9.103  1.00  0.00          EP  
HETATM  876  O   HOH B 185       5.966  11.258  -8.197  1.00  0.00           O  
HETATM  877  H1  HOH B 185       5.058  10.955  -8.197  1.00  0.00           H  
HETATM  878  H2  HOH B 185       5.912  12.181  -8.444  1.00  0.00           H  
HETATM  879 OM   HOH B 185       5.863  11.324  -8.223  1.00  0.00          EP  
HETATM  880  O   HOH B 186     -12.293  -8.659  -5.907  1.00  0.00           O  
HETATM  881  H1  HOH B 186     -11.855  -9.509  -5.867  1.00  0.00           H  
HETATM  882  H2  HOH B 186     -13.140  -8.844  -6.313  1.00  0.00           H  
HETATM  883 OM   HOH B 186     -12.336  -8.769  -5.946  1.00  0.00          EP  
HETATM  884  O   HOH B 187       3.254  11.060   9.334  1.00  0.00           O  
HETATM  885  H1  HOH B 187       3.012  10.696   8.483  1.00  0.00           H  
HETATM  886  H2  HOH B 187       4.020  11.606   9.152  1.00  0.00           H  
HETATM  887 OM   HOH B 187       3.310  11.080   9.224  1.00  0.00          EP  
HETATM  888  O   HOH B 188      -6.844   3.352   8.740  1.00  0.00           O  
HETATM  889  H1  HOH B 188      -6.860   2.967   9.616  1.00  0.00           H  
HETATM  890  H2  HOH B 188      -5.931   3.608   8.608  1.00  0.00           H  
HETATM  891 OM   HOH B 188      -6.748   3.338   8.820  1.00  0.00          EP  
HETATM  892  O   HOH B 189      -0.110   3.570  10.422  1.00  0.00           O  
HETATM  893  H1  HOH B 189       0.525   2.968  10.034  1.00  0.00           H  
HETATM  894  H2  HOH B 189      -0.483   4.038   9.675  1.00  0.00           H  
HETATM  895 OM   HOH B 189      -0.082   3.556  10.301  1.00  0.00          EP  
HETATM  896  O   HOH B 190       1.454   5.794  11.048  1.00  0.00           O  
HETATM  897  H1  HOH B 190       0.860   5.050  11.148  1.00  0.00           H  
HETATM  898  H2  HOH B 190       2.157   5.465  10.488  1.00  0.00           H  
HETATM  899 OM   HOH B 190       1.466   5.680  10.999  1.00  0.00          EP  
HETATM  900  O   HOH B 191      -7.192   7.105  -9.987  1.00  0.00           O  
HETATM  901  H1  HOH B 191      -8.078   7.355 -10.251  1.00  0.00           H  
HETATM  902  H2  HOH B 191      -6.707   7.930  -9.964  1.00  0.00           H  
HETATM  903 OM   HOH B 191      -7.235   7.219 -10.013  1.00  0.00          EP  
HETATM  904  O   HOH B 192      -1.959   7.090   3.231  1.00  0.00           O  
HETATM  905  H1  HOH B 192      -1.626   6.270   3.597  1.00  0.00           H  
HETATM  906  H2  HOH B 192      -1.184   7.529   2.882  1.00  0.00           H  
HETATM  907 OM   HOH B 192      -1.841   7.049   3.233  1.00  0.00          EP  
HETATM  908  O   HOH B 193      -3.079  -8.350   8.866  1.00  0.00           O  
HETATM  909  H1  HOH B 193      -2.927  -7.457   8.559  1.00  0.00           H  
HETATM  910  H2  HOH B 193      -2.241  -8.621   9.241  1.00  0.00           H  
HETATM  911 OM   HOH B 193      -2.973  -8.284   8.873  1.00  0.00          EP  
HETATM  912  O   HOH B 194      -6.146   9.906  -7.006  1.00  0.00           O  
HETATM  913  H1  HOH B 194      -5.209   9.789  -7.162  1.00  0.00           H  
HETATM  914  H2  HOH B 194      -6.321   9.409  -6.207  1.00  0.00           H  
HETATM  915 OM   HOH B 194      -6.065   9.841  -6.937  1.00  0.00          EP  
HETATM  916  O   HOH B 195      -9.049  10.537  -9.616  1.00  0.00           O  
HETATM  917  H1  HOH B 195      -9.091   9.963  -8.852  1.00  0.00           H  
HETATM  918  H2  HOH B 195      -9.187  11.416  -9.264  1.00  0.00           H  
HETATM  919 OM   HOH B 195      -9.068  10.570  -9.497  1.00  0.00          EP  
HETATM  920  O   HOH B 196      -8.998   7.824  10.268  1.00  0.00           O  
HETATM  921  H1  HOH B 196      -8.749   6.900  10.293  1.00  0.00           H  
HETATM  922  H2  HOH B 196      -8.171   8.293  10.158  1.00  0.00           H  
HETATM  923 OM   HOH B 196      -8.883   7.775  10.259  1.00  0.00          EP  
HETATM  924  O   HOH B 197       1.473 -10.698   9.269  1.00  0.00           O  
HETATM  925  H1  HOH B 197       2.025 -11.467   9.410  1.00  0.00           H  
HETATM  926  H2  HOH B 197       2.090  -9.975   9.160  1.00  0.00           H  
HETATM  927 OM   HOH B 197       1.597 -10.703   9.272  1.00  0.00          EP  
HETATM  928  O   HOH B 198      -4.163   6.882   7.597  1.00  0.00           O  
HETATM  929  H1  HOH B 198      -4.531   6.713   6.729  1.00  0.00           H  
HETATM  930  H2  HOH B 198      -4.027   6.013   7.974  1.00  0.00           H  
HETATM  931 OM   HOH B 198      -4.187   6.771   7.544  1.00  0.00          EP  
HETATM  932  O   HOH B 199       6.483   5.654   7.996  1.00  0.00           O  
HETATM  933  H1  HOH B 199       6.968   5.557   7.176  1.00  0.00           H  
HETATM  934  H2  HOH B 199       5.684   6.119   7.748  1.00  0.00           H  
HETATM  935 OM   HOH B 199       6.450   5.694   7.882  1.00  0.00          EP  
HETATM  936  O   HOH B 200       1.078  -9.609   6.677  1.00  0.00           O  
HETATM  937  H1  HOH B 200       0.966 -10.305   7.325  1.00  0.00           H  
HETATM  938  H2  HOH B 200       1.629  -8.960   7.115  1.00  0.00           H  
HETATM  939 OM   HOH B 200       1.125  -9.614   6.793  1.00  0.00          EP  
HETATM  940  O   HOH B 201      -3.691  10.097   8.794  1.00  0.00           O  
HETATM  941  H1  HOH B 201      -3.007   9.668   8.280  1.00  0.00           H  
HETATM  942  H2  HOH B 201      -3.229  10.765   9.299  1.00  0.00           H  
HETATM  943 OM   HOH B 201      -3.569  10.122   8.793  1.00  0.00          EP  
HETATM  944  O   HOH B 202       4.146  -3.018  -9.149  1.00  0.00           O  
HETATM  945  H1  HOH B 202       5.091  -2.868  -9.172  1.00  0.00           H  
HETATM  946  H2  HOH B 202       3.765  -2.193  -9.451  1.00  0.00           H  
HETATM  947 OM   HOH B 202       4.206  -2.914  -9.184  1.00  0.00          EP  
HETATM  948  O   HOH B 203       2.131   8.232  -6.971  1.00  0.00           O  
HETATM  949  H1  HOH B 203       2.023   8.384  -7.910  1.00  0.00           H  
HETATM  950  H2  HOH B 203       2.230   7.283  -6.892  1.00  0.00           H  
HETATM  951 OM   HOH B 203       2.130   8.147  -7.063  1.00  0.00          EP  
HETATM  952  O   HOH B 204      -3.695  -9.232 -10.995  1.00  0.00           O  
HETATM  953  H1  HOH B 204      -2.828  -8.826 -11.004  1.00  0.00           H  
HETATM  954  H2  HOH B 204      -4.272  -8.559 -10.634  1.00  0.00           H  
HETATM  955 OM   HOH B 204      -3.664  -9.117 -10.957  1.00  0.00          EP  
HETATM  956  O   HOH B 205      -7.468 -12.005   9.328  1.00  0.00           O  
HETATM  957  H1  HOH B 205      -7.567 -11.117   9.672  1.00  0.00           H  
HETATM  958  H2  HOH B 205      -8.307 -12.193   8.906  1.00  0.00           H  
HETATM  959 OM   HOH B 205      -7.568 -11.930   9.319  1.00  0.00          EP  
HETATM  960  O   HOH B 206       5.541  -5.212   2.183  1.00  0.00           O  
HETATM  961  H1  HOH B 206       5.608  -4.432   1.632  1.00  0.00           H  
HETATM  962  H2  HOH B 206       4.680  -5.143   2.594  1.00  0.00           H  
HETATM  963 OM   HOH B 206       5.457  -5.121   2.168  1.00  0.00          EP  
HETATM  964  O   HOH B 207      10.468  -3.100   1.701  1.00  0.00           O  
HETATM  965  H1  HOH B 207      10.497  -2.187   1.415  1.00  0.00           H  
HETATM  966  H2  HOH B 207      10.623  -3.606   0.904  1.00  0.00           H  
HETATM  967 OM   HOH B 207      10.487  -3.056   1.585  1.00  0.00          EP  
HETATM  968  O   HOH B 208      10.869  -4.449  -0.785  1.00  0.00           O  
HETATM  969  H1  HOH B 208      10.368  -4.128  -1.535  1.00  0.00           H  
HETATM  970  H2  HOH B 208      11.771  -4.187  -0.970  1.00  0.00           H  
HETATM  971 OM   HOH B 208      10.912  -4.387  -0.885  1.00  0.00          EP  
HETATM  972  O   HOH B 209      -8.487  -6.331   5.795  1.00  0.00           O  
HETATM  973  H1  HOH B 209      -8.306  -5.394   5.869  1.00  0.00           H  
HETATM  974  H2  HOH B 209      -9.240  -6.476   6.368  1.00  0.00           H  
HETATM  975 OM   HOH B 209      -8.548  -6.246   5.864  1.00  0.00          EP  
HETATM  976  O   HOH B 210       6.636   0.340  -9.154  1.00  0.00           O  
HETATM  977  H1  HOH B 210       5.998   0.601  -9.818  1.00  0.00           H  
HETATM  978  H2  HOH B 210       6.107  -0.019  -8.441  1.00  0.00           H  
HETATM  979 OM   HOH B 210       6.511   0.329  -9.149  1.00  0.00          EP  
HETATM  980  O   HOH B 211       5.683  -7.159   0.310  1.00  0.00           O  
HETATM  981  H1  HOH B 211       6.018  -6.679  -0.447  1.00  0.00           H  
HETATM  982  H2  HOH B 211       5.708  -6.525   1.027  1.00  0.00           H  
HETATM  983 OM   HOH B 211       5.721  -7.040   0.305  1.00  0.00          EP  
HETATM  984  O   HOH B 212       3.198  -5.582  -9.013  1.00  0.00           O  
HETATM  985  H1  HOH B 212       2.328  -5.358  -8.682  1.00  0.00           H  
HETATM  986  H2  HOH B 212       3.598  -4.739  -9.225  1.00  0.00           H  
HETATM  987 OM   HOH B 212       3.147  -5.468  -9.001  1.00  0.00          EP  
HETATM  988  O   HOH B 213      -9.982   8.485   2.396  1.00  0.00           O  
HETATM  989  H1  HOH B 213     -10.868   8.680   2.703  1.00  0.00           H  
HETATM  990  H2  HOH B 213      -9.415   9.041   2.929  1.00  0.00           H  
HETATM  991 OM   HOH B 213     -10.016   8.565   2.485  1.00  0.00          EP  
HETATM  992  O   HOH B 214       1.253  -1.111   7.438  1.00  0.00           O  
HETATM  993  H1  HOH B 214       0.488  -1.034   8.007  1.00  0.00           H  
HETATM  994  H2  HOH B 214       1.766  -0.323   7.616  1.00  0.00           H  
HETATM  995 OM   HOH B 214       1.226  -1.019   7.517  1.00  0.00          EP  
HETATM  996  O   HOH B 215       5.854  10.338  -2.641  1.00  0.00           O  
HETATM  997  H1  HOH B 215       6.591  10.930  -2.488  1.00  0.00           H  
HETATM  998  H2  HOH B 215       6.131   9.796  -3.380  1.00  0.00           H  
HETATM  999 OM   HOH B 215       5.962  10.343  -2.703  1.00  0.00          EP  
HETATM 1000  O   HOH B 216       2.573  -3.083  -6.884  1.00  0.00           O  
HETATM 1001  H1  HOH B 216       3.187  -3.039  -7.617  1.00  0.00           H  
HETATM 1002  H2  HOH B 216       1.831  -3.584  -7.223  1.00  0.00           H  
HETATM 1003 OM   HOH B 216       2.559  -3.132  -6.998  1.00  0.00          EP  
HETATM 1004  O   HOH B 217      -5.167  -9.441   7.201  1.00  0.00           O  
HETATM 1005  H1  HOH B 217      -4.343  -9.163   7.601  1.00  0.00           H  
HETATM 1006  H2  HOH B 217      -5.162 -10.395   7.281  1.00  0.00           H  
HETATM 1007 OM   HOH B 217      -5.078  -9.513   7.252  1.00  0.00          EP  
HETATM 1008  O   HOH B 218      -2.511  -5.842   7.744  1.00  0.00           O  
HETATM 1009  H1  HOH B 218      -2.825  -5.095   7.233  1.00  0.00           H  
HETATM 1010  H2  HOH B 218      -1.778  -5.495   8.252  1.00  0.00           H  
HETATM 1011 OM   HOH B 218      -2.467  -5.725   7.744  1.00  0.00          EP  
HETATM 1012  O   HOH B 219       8.010   5.203   5.755  1.00  0.00           O  
HETATM 1013  H1  HOH B 219       7.617   4.928   4.926  1.00  0.00           H  
HETATM 1014  H2  HOH B 219       8.481   4.430   6.065  1.00  0.00           H  
HETATM 1015 OM   HOH B 219       8.018   5.091   5.699  1.00  0.00          EP  
HETATM 1016  O   HOH B 220     -10.294  -8.750 -10.176  1.00  0.00           O  
HETATM 1017  H1  HOH B 220     -10.449  -7.843 -10.443  1.00  0.00           H  
HETATM 1018  H2  HOH B 220     -11.015  -9.242 -10.570  1.00  0.00           H  
HETATM 1019 OM   HOH B 220     -10.388  -8.705 -10.247  1.00  0.00          EP  
HETATM 1020  O   HOH B 221       7.462   0.362  -6.069  1.00  0.00           O  
HETATM 1021  H1  HOH B 221       7.398   1.128  -5.499  1.00  0.00           H  
HETATM 1022  H2  HOH B 221       8.140   0.592  -6.705  1.00  0.00           H  
HETATM 1023 OM   HOH B 221       7.527   0.468  -6.076  1.00  0.00          EP  
HETATM 1024  O   HOH B 222      -9.798   1.891  -4.640  1.00  0.00           O  
HETATM 1025  H1  HOH B 222     -10.218   2.458  -5.286  1.00  0.00           H  
HETATM 1026  H2  HOH B 222      -9.718   1.044  -5.080  1.00  0.00           H  
HETATM 1027 OM   HOH B 222      -9.835   1.861  -4.756  1.00  0.00          EP  
HETATM 1028  O   HOH B 223       8.127   5.812  -9.624  1.00  0.00           O  
HETATM 1029  H1  HOH B 223       7.215   6.058  -9.470  1.00  0.00           H  
HETATM 1030  H2  HOH B 223       8.627   6.600  -9.411  1.00  0.00           H  
HETATM 1031 OM   HOH B 223       8.083   5.923  -9.585  1.00  0.00          EP  
HETATM 1032  O   HOH B 224       6.406 -10.321  -2.403  1.00  0.00           O  
HETATM 1033  H1  HOH B 224       6.255 -10.170  -1.470  1.00  0.00           H  
HETATM 1034  H2  HOH B 224       7.117 -10.961  -2.431  1.00  0.00           H  
HETATM 1035 OM   HOH B 224       6.466 -10.373  -2.306  1.00  0.00          EP  
HETATM 1036  O   HOH B 225       8.650  -5.720   0.265  1.00  0.00           O  
HETATM 1037  H1  HOH B 225       9.466  -5.357  -0.081  1.00  0.00           H  
HETATM 1038  H2  HOH B 225       8.082  -5.807  -0.501  1.00  0.00           H  
HETATM 1039 OM   HOH B 225       8.676  -5.690   0.146  1.00  0.00          EP  
HETATM 1040  O   HOH B 226      11.378   8.552   3.064  1.00  0.00           O  
HETATM 1041  H1  HOH B 226      11.022   8.072   3.812  1.00  0.00           H  
HETATM 1042  H2  HOH B 226      10.618   8.737   2.513  1.00  0.00           H  
HETATM 1043 OM   HOH B 226      11.259   8.520   3.085  1.00  0.00          EP  
HETATM 1044  O   HOH B 227      -9.884  -1.213  -0.616  1.00  0.00           O  
HETATM 1045  H1  HOH B 227      -9.188  -0.589  -0.411  1.00  0.00           H  
HETATM 1046  H2  HOH B 227     -10.262  -0.891  -1.434  1.00  0.00           H  
HETATM 1047 OM   HOH B 227      -9.850  -1.112  -0.682  1.00  0.00          EP  
HETATM 1048  O   HOH B 228       8.378  11.692  -1.989  1.00  0.00           O  
HETATM 1049  H1  HOH B 228       8.944  12.299  -1.512  1.00  0.00           H  
HETATM 1050  H2  HOH B 228       8.368  10.900  -1.451  1.00  0.00           H  
HETATM 1051 OM   HOH B 228       8.437  11.672  -1.881  1.00  0.00          EP  
HETATM 1052  O   HOH B 229     -11.044  -7.335  -3.659  1.00  0.00           O  
HETATM 1053  H1  HOH B 229     -11.556  -7.826  -4.300  1.00  0.00           H  
HETATM 1054  H2  HOH B 229     -10.535  -6.716  -4.182  1.00  0.00           H  
HETATM 1055 OM   HOH B 229     -11.044  -7.321  -3.783  1.00  0.00          EP  
HETATM 1056  O   HOH B 230      -5.508 -11.307   1.073  1.00  0.00           O  
HETATM 1057  H1  HOH B 230      -4.589 -11.048   1.141  1.00  0.00           H  
HETATM 1058  H2  HOH B 230      -5.756 -11.079   0.177  1.00  0.00           H  
HETATM 1059 OM   HOH B 230      -5.437 -11.255   0.984  1.00  0.00          EP  
HETATM 1060  O   HOH B 231      -0.313  -5.592 -10.654  1.00  0.00           O  
HETATM 1061  H1  HOH B 231      -0.875  -4.830 -10.796  1.00  0.00           H  
HETATM 1062  H2  HOH B 231       0.164  -5.696 -11.477  1.00  0.00           H  
HETATM 1063 OM   HOH B 231      -0.322  -5.522 -10.757  1.00  0.00          EP  
HETATM 1064  O   HOH B 232      -2.948  -7.606   5.676  1.00  0.00           O  
HETATM 1065  H1  HOH B 232      -2.826  -7.004   6.411  1.00  0.00           H  
HETATM 1066  H2  HOH B 232      -2.063  -7.888   5.447  1.00  0.00           H  
HETATM 1067 OM   HOH B 232      -2.841  -7.572   5.730  1.00  0.00          EP  
HETATM 1068  O   HOH B 233       6.023  -9.882   0.272  1.00  0.00           O  
HETATM 1069  H1  HOH B 233       6.558 -10.142   1.022  1.00  0.00           H  
HETATM 1070  H2  HOH B 233       5.994  -8.927   0.318  1.00  0.00           H  
HETATM 1071 OM   HOH B 233       6.077  -9.808   0.357  1.00  0.00          EP  
HETATM 1072  O   HOH B 234      -8.149   5.001   2.682  1.00  0.00           O  
HETATM 1073  H1  HOH B 234      -8.997   5.317   2.369  1.00  0.00           H  
HETATM 1074  H2  HOH B 234      -8.119   5.267   3.601  1.00  0.00           H  
HETATM 1075 OM   HOH B 234      -8.236   5.063   2.747  1.00  0.00          EP  
HETATM 1076  O   HOH B 235      -8.623  -6.715   9.883  1.00  0.00           O  
HETATM 1077  H1  HOH B 235      -7.877  -6.572   9.300  1.00  0.00           H  
HETATM 1078  H2  HOH B 235      -8.483  -6.104  10.606  1.00  0.00           H  
HETATM 1079 OM   HOH B 235      -8.529  -6.634   9.898  1.00  0.00          EP  
HETATM 1080  O   HOH B 236       7.465  -0.796   0.289  1.00  0.00           O  
HETATM 1081  H1  HOH B 236       7.445   0.085   0.663  1.00  0.00           H  
HETATM 1082  H2  HOH B 236       7.686  -0.661  -0.633  1.00  0.00           H  
HETATM 1083 OM   HOH B 236       7.486  -0.687   0.230  1.00  0.00          EP  
HETATM 1084  O   HOH B 237     -10.451  -3.897  -1.047  1.00  0.00           O  
HETATM 1085  H1  HOH B 237      -9.788  -4.222  -1.656  1.00  0.00           H  
HETATM 1086  H2  HOH B 237     -10.244  -2.969  -0.939  1.00  0.00           H  
HETATM 1087 OM   HOH B 237     -10.358  -3.833  -1.100  1.00  0.00          EP  
HETATM 1088  O   HOH B 238      -7.874  -3.726   5.996  1.00  0.00           O  
HETATM 1089  H1  HOH B 238      -7.045  -3.814   6.466  1.00  0.00           H  
HETATM 1090  H2  HOH B 238      -8.430  -3.215   6.584  1.00  0.00           H  
HETATM 1091 OM   HOH B 238      -7.845  -3.681   6.109  1.00  0.00          EP  
HETATM 1092  O   HOH B 239      -6.540  -9.077  -7.923  1.00  0.00           O  
HETATM 1093  H1  HOH B 239      -6.345  -8.495  -7.188  1.00  0.00           H  
HETATM 1094  H2  HOH B 239      -6.496  -9.958  -7.550  1.00  0.00           H  
HETATM 1095 OM   HOH B 239      -6.514  -9.109  -7.805  1.00  0.00          EP  
HETATM 1096  O   HOH B 240       7.274  -8.122  -3.870  1.00  0.00           O  
HETATM 1097  H1  HOH B 240       7.025  -8.875  -3.335  1.00  0.00           H  
HETATM 1098  H2  HOH B 240       7.182  -7.370  -3.284  1.00  0.00           H  
HETATM 1099 OM   HOH B 240       7.238  -8.122  -3.751  1.00  0.00          EP  
HETATM 1100  O   HOH B 241       9.083  -3.792  -2.774  1.00  0.00           O  
HETATM 1101  H1  HOH B 241       8.329  -4.361  -2.623  1.00  0.00           H  
HETATM 1102  H2  HOH B 241       8.774  -3.146  -3.410  1.00  0.00           H  
HETATM 1103 OM   HOH B 241       8.970  -3.784  -2.826  1.00  0.00          EP  
HETATM 1104  O   HOH B 242       6.797  -5.387  -5.343  1.00  0.00           O  
HETATM 1105  H1  HOH B 242       6.697  -5.443  -4.393  1.00  0.00           H  
HETATM 1106  H2  HOH B 242       7.546  -5.950  -5.539  1.00  0.00           H  
HETATM 1107 OM   HOH B 242       6.867  -5.453  -5.263  1.00  0.00          EP  
HETATM 1108  O   HOH B 243      -8.461   5.152  10.013  1.00  0.00           O  
HETATM 1109  H1  HOH B 243      -9.372   5.056   9.737  1.00  0.00           H  
HETATM 1110  H2  HOH B 243      -7.976   4.541   9.459  1.00  0.00           H  
HETATM 1111 OM   HOH B 243      -8.506   5.077   9.925  1.00  0.00          EP  
HETATM 1112  O   HOH B 244       0.392  -8.009   0.019  1.00  0.00           O  
HETATM 1113  H1  HOH B 244       1.317  -7.767  -0.011  1.00  0.00           H  
HETATM 1114  H2  HOH B 244       0.368  -8.804   0.551  1.00  0.00           H  
HETATM 1115 OM   HOH B 244       0.488  -8.068   0.073  1.00  0.00          EP  
HETATM 1116  O   HOH B 245      -8.029  -6.136   3.041  1.00  0.00           O  
HETATM 1117  H1  HOH B 245      -8.345  -6.142   3.944  1.00  0.00           H  
HETATM 1118  H2  HOH B 245      -8.676  -5.615   2.564  1.00  0.00           H  
HETATM 1119 OM   HOH B 245      -8.132  -6.081   3.086  1.00  0.00          EP  
HETATM 1120  O   HOH B 246     -10.619   7.204  -3.575  1.00  0.00           O  
HETATM 1121  H1  HOH B 246     -10.585   6.734  -2.742  1.00  0.00           H  
HETATM 1122  H2  HOH B 246     -11.530   7.128  -3.857  1.00  0.00           H  
HETATM 1123 OM   HOH B 246     -10.712   7.146  -3.516  1.00  0.00          EP  
HETATM 1124  O   HOH B 247      -1.002   4.761   8.125  1.00  0.00           O  
HETATM 1125  H1  HOH B 247      -0.632   4.137   7.500  1.00  0.00           H  
HETATM 1126  H2  HOH B 247      -1.911   4.481   8.235  1.00  0.00           H  
HETATM 1127 OM   HOH B 247      -1.059   4.664   8.070  1.00  0.00          EP  
HETATM 1128  O   HOH B 248       8.166  -5.326   2.907  1.00  0.00           O  
HETATM 1129  H1  HOH B 248       7.237  -5.107   2.830  1.00  0.00           H  
HETATM 1130  H2  HOH B 248       8.444  -5.513   2.011  1.00  0.00           H  
HETATM 1131 OM   HOH B 248       8.097  -5.322   2.804  1.00  0.00          EP  
HETATM 1132  O   HOH B 249      -8.632  -1.158 -11.307  1.00  0.00           O  
HETATM 1133  H1  HOH B 249      -8.994  -0.545 -10.667  1.00  0.00           H  
HETATM 1134  H2  HOH B 249      -8.209  -0.601 -11.960  1.00  0.00           H  
HETATM 1135 OM   HOH B 249      -8.625  -1.033 -11.308  1.00  0.00          EP  
HETATM 1136  O   HOH B 250       3.022   6.335 -10.623  1.00  0.00           O  
HETATM 1137  H1  HOH B 250       3.040   5.486 -10.181  1.00  0.00           H  
HETATM 1138  H2  HOH B 250       2.566   6.166 -11.447  1.00  0.00           H  
HETATM 1139 OM   HOH B 250       2.975   6.227 -10.664  1.00  0.00          EP  
HETATM 1140  O   HOH B 251       8.618   2.490   5.340  1.00  0.00           O  
HETATM 1141  H1  HOH B 251       8.121   2.850   4.606  1.00  0.00           H  
HETATM 1142  H2  HOH B 251       8.017   1.874   5.758  1.00  0.00           H  
HETATM 1143 OM   HOH B 251       8.501   2.462   5.306  1.00  0.00          EP  
HETATM 1144  O   HOH B 252       8.547 -11.294   5.129  1.00  0.00           O  
HETATM 1145  H1  HOH B 252       7.605 -11.194   5.263  1.00  0.00           H  
HETATM 1146  H2  HOH B 252       8.929 -10.505   5.513  1.00  0.00           H  
HETATM 1147 OM   HOH B 252       8.487 -11.199   5.184  1.00  0.00          EP  
HETATM 1148  O   HOH B 253      -4.446   6.003  -5.691  1.00  0.00           O  
HETATM 1149  H1  HOH B 253      -4.404   5.145  -5.268  1.00  0.00           H  
HETATM 1150  H2  HOH B 253      -4.704   5.814  -6.593  1.00  0.00           H  
HETATM 1151 OM   HOH B 253      -4.469   5.891  -5.742  1.00  0.00          EP  
HETATM 1152  O   HOH B 254     -11.838   0.602  -7.643  1.00  0.00           O  
HETATM 1153  H1  HOH B 254     -11.647   1.495  -7.356  1.00  0.00           H  
HETATM 1154  H2  HOH B 254     -12.775   0.608  -7.837  1.00  0.00           H  
HETATM 1155 OM   HOH B 254     -11.918   0.698  -7.633  1.00  0.00          EP  
HETATM 1156  O   HOH B 255       8.556  -2.996  -6.959  1.00  0.00           O  
HETATM 1157  H1  HOH B 255       9.478  -2.746  -7.030  1.00  0.00           H  
HETATM 1158  H2  HOH B 255       8.301  -2.722  -6.078  1.00  0.00           H  
HETATM 1159 OM   HOH B 255       8.627  -2.940  -6.873  1.00  0.00          EP  
HETATM 1160  O   HOH B 256       3.951  -9.618  -6.165  1.00  0.00           O  
HETATM 1161  H1  HOH B 256       3.826  -9.864  -5.248  1.00  0.00           H  
HETATM 1162  H2  HOH B 256       4.886  -9.428  -6.237  1.00  0.00           H  
HETATM 1163 OM   HOH B 256       4.037  -9.624  -6.075  1.00  0.00          EP  
HETATM 1164  O   HOH B 257       6.158  -3.235   0.381  1.00  0.00           O  
HETATM 1165  H1  HOH B 257       6.470  -2.365   0.132  1.00  0.00           H  
HETATM 1166  H2  HOH B 257       6.437  -3.805  -0.335  1.00  0.00           H  
HETATM 1167 OM   HOH B 257       6.221  -3.203   0.278  1.00  0.00          EP  
HETATM 1168  O   HOH B 258       8.868   5.743   2.357  1.00  0.00           O  
HETATM 1169  H1  HOH B 258       9.258   6.187   3.109  1.00  0.00           H  
HETATM 1170  H2  HOH B 258       8.267   5.104   2.741  1.00  0.00           H  
HETATM 1171 OM   HOH B 258       8.845   5.722   2.478  1.00  0.00          EP  
HETATM 1172  O   HOH B 259      -9.831  -0.519  -5.873  1.00  0.00           O  
HETATM 1173  H1  HOH B 259     -10.515  -0.349  -6.520  1.00  0.00           H  
HETATM 1174  H2  HOH B 259      -9.041  -0.670  -6.393  1.00  0.00           H  
HETATM 1175 OM   HOH B 259      -9.820  -0.517  -5.998  1.00  0.00          EP  
HETATM 1176  O   HOH B 260       4.931  -3.163  -3.087  1.00  0.00           O  
HETATM 1177  H1  HOH B 260       5.443  -3.860  -2.676  1.00  0.00           H  
HETATM 1178  H2  HOH B 260       4.888  -2.474  -2.424  1.00  0.00           H  
HETATM 1179 OM   HOH B 260       4.981  -3.164  -2.972  1.00  0.00          EP  
HETATM 1180  O   HOH B 261       3.116  -7.835  -0.092  1.00  0.00           O  
HETATM 1181  H1  HOH B 261       3.960  -7.438   0.126  1.00  0.00           H  
HETATM 1182  H2  HOH B 261       3.119  -8.672   0.371  1.00  0.00           H  
HETATM 1183 OM   HOH B 261       3.207  -7.882  -0.019  1.00  0.00          EP  
HETATM 1184  O   HOH B 262       7.624  -5.126  -8.559  1.00  0.00           O  
HETATM 1185  H1  HOH B 262       7.986  -4.545  -7.889  1.00  0.00           H  
HETATM 1186  H2  HOH B 262       7.319  -4.536  -9.249  1.00  0.00           H  
HETATM 1187 OM   HOH B 262       7.630  -5.001  -8.561  1.00  0.00          EP  
HETATM 1188  O   HOH B 263       8.353  -8.378   5.974  1.00  0.00           O  
HETATM 1189  H1  HOH B 263       7.833  -8.222   5.185  1.00  0.00           H  
HETATM 1190  H2  HOH B 263       8.721  -7.522   6.192  1.00  0.00           H  
HETATM 1191 OM   HOH B 263       8.337  -8.270   5.913  1.00  0.00          EP  
HETATM 1192  O   HOH B 264       9.264   0.962  -8.100  1.00  0.00           O  
HETATM 1193  H1  HOH B 264       9.167   1.914  -8.125  1.00  0.00           H  
HETATM 1194  H2  HOH B 264       8.585   0.636  -8.690  1.00  0.00           H  
HETATM 1195 OM   HOH B 264       9.181   1.029  -8.166  1.00  0.00          EP  
HETATM 1196  O   HOH B 265      -7.147  -2.654  10.089  1.00  0.00           O  
HETATM 1197  H1  HOH B 265      -7.214  -1.756  10.414  1.00  0.00           H  
HETATM 1198  H2  HOH B 265      -6.206  -2.825  10.048  1.00  0.00           H  
HETATM 1199 OM   HOH B 265      -7.054  -2.577  10.119  1.00  0.00          EP  
HETATM 1200  O   HOH B 266      -7.654  -4.856  11.650  1.00  0.00           O  
HETATM 1201  H1  HOH B 266      -7.547  -4.072  11.113  1.00  0.00           H  
HETATM 1202  H2  HOH B 266      -7.942  -4.527  12.501  1.00  0.00           H  
HETATM 1203 OM   HOH B 266      -7.673  -4.738  11.684  1.00  0.00          EP  
HETATM 1204  O   HOH B 267       5.783   5.279  -6.638  1.00  0.00           O  
HETATM 1205  H1  HOH B 267       5.707   4.373  -6.936  1.00  0.00           H  
HETATM 1206  H2  HOH B 267       5.655   5.803  -7.429  1.00  0.00           H  
HETATM 1207 OM   HOH B 267       5.761   5.238  -6.754  1.00  0.00          EP  
HETATM 1208  O   HOH B 268       7.138  -4.679  11.557  1.00  0.00           O  
HETATM 1209  H1  HOH B 268       7.888  -5.023  11.073  1.00  0.00           H  
HETATM 1210  H2  HOH B 268       6.408  -5.243  11.301  1.00  0.00           H  
HETATM 1211 OM   HOH B 268       7.140  -4.776  11.478  1.00  0.00          EP  
HETATM 1212  O   HOH B 269     -10.733  -7.122  -7.567  1.00  0.00           O  
HETATM 1213  H1  HOH B 269     -11.149  -6.730  -8.335  1.00  0.00           H  
HETATM 1214  H2  HOH B 269     -11.438  -7.599  -7.129  1.00  0.00           H  
HETATM 1215 OM   HOH B 269     -10.853  -7.131  -7.602  1.00  0.00          EP  
HETATM 1216  O   HOH B 270       4.904  -5.776   9.906  1.00  0.00           O  
HETATM 1217  H1  HOH B 270       4.235  -6.356   9.543  1.00  0.00           H  
HETATM 1218  H2  HOH B 270       5.691  -5.969   9.395  1.00  0.00           H  
HETATM 1219 OM   HOH B 270       4.917  -5.859   9.813  1.00  0.00          EP  
HETATM 1220  O   HOH B 271       7.237  -6.304   8.565  1.00  0.00           O  
HETATM 1221  H1  HOH B 271       7.419  -7.237   8.675  1.00  0.00           H  
HETATM 1222  H2  HOH B 271       8.014  -5.865   8.912  1.00  0.00           H  
HETATM 1223 OM   HOH B 271       7.339  -6.357   8.614  1.00  0.00          EP  
HETATM 1224  O   HOH B 272       6.725  -2.893   9.555  1.00  0.00           O  
HETATM 1225  H1  HOH B 272       6.892  -3.407  10.345  1.00  0.00           H  
HETATM 1226  H2  HOH B 272       5.784  -2.723   9.574  1.00  0.00           H  
HETATM 1227 OM   HOH B 272       6.643  -2.929   9.641  1.00  0.00          EP  
HETATM 1228  O   HOH B 273      10.017  -0.423   1.112  1.00  0.00           O  
HETATM 1229  H1  HOH B 273       9.168  -0.736   0.800  1.00  0.00           H  
HETATM 1230  H2  HOH B 273       9.903   0.522   1.211  1.00  0.00           H  
HETATM 1231 OM   HOH B 273       9.915  -0.356   1.089  1.00  0.00          EP  
HETATM 1232  O   HOH B 274       9.358  -4.990   9.770  1.00  0.00           O  
HETATM 1233  H1  HOH B 274       9.398  -4.136   9.340  1.00  0.00           H  
HETATM 1234  H2  HOH B 274      10.160  -5.033  10.292  1.00  0.00           H  
HETATM 1235 OM   HOH B 274       9.448  -4.904   9.780  1.00  0.00          EP  
HETATM 1236  O   HOH B 275      -9.974  -2.048   2.055  1.00  0.00           O  
HETATM 1237  H1  HOH B 275     -10.686  -1.640   2.548  1.00  0.00           H  
HETATM 1238  H2  HOH B 275     -10.063  -1.697   1.169  1.00  0.00           H  
HETATM 1239 OM   HOH B 275     -10.059  -1.967   2.013  1.00  0.00          EP  
HETATM 1240  O   HOH B 276       8.176   1.730   1.312  1.00  0.00           O  
HETATM 1241  H1  HOH B 276       8.402   2.565   0.901  1.00  0.00           H  
HETATM 1242  H2  HOH B 276       7.456   1.942   1.905  1.00  0.00           H  
HETATM 1243 OM   HOH B 276       8.124   1.842   1.331  1.00  0.00          EP  
HETATM 1244  O   HOH B 277      -9.805   3.600   5.524  1.00  0.00           O  
HETATM 1245  H1  HOH B 277      -9.263   4.384   5.438  1.00  0.00           H  
HETATM 1246  H2  HOH B 277     -10.340   3.589   4.731  1.00  0.00           H  
HETATM 1247 OM   HOH B 277      -9.804   3.682   5.431  1.00  0.00          EP  
HETATM 1248  O   HOH B 278      -8.244   1.851   6.875  1.00  0.00           O  
HETATM 1249  H1  HOH B 278      -7.689   2.405   7.425  1.00  0.00           H  
HETATM 1250  H2  HOH B 278      -8.802   2.467   6.400  1.00  0.00           H  
HETATM 1251 OM   HOH B 278      -8.244   1.976   6.883  1.00  0.00          EP  
HETATM 1252  O   HOH B 279       6.244  -3.121   6.810  1.00  0.00           O  
HETATM 1253  H1  HOH B 279       5.596  -2.417   6.800  1.00  0.00           H  
HETATM 1254  H2  HOH B 279       6.479  -3.218   7.733  1.00  0.00           H  
HETATM 1255 OM   HOH B 279       6.200  -3.056   6.907  1.00  0.00          EP  
HETATM 1256  O   HOH B 280       4.223  -7.971   3.240  1.00  0.00           O  
HETATM 1257  H1  HOH B 280       4.255  -8.138   4.182  1.00  0.00           H  
HETATM 1258  H2  HOH B 280       3.745  -7.145   3.159  1.00  0.00           H  
HETATM 1259 OM   HOH B 280       4.175  -7.900   3.332  1.00  0.00          EP  
HETATM 1260  O   HOH B 281      -5.052  -8.759  10.696  1.00  0.00           O  
HETATM 1261  H1  HOH B 281      -4.364  -8.657  10.039  1.00  0.00           H  
HETATM 1262  H2  HOH B 281      -4.595  -9.070  11.477  1.00  0.00           H  
HETATM 1263 OM   HOH B 281      -4.930  -8.781  10.709  1.00  0.00          EP  
HETATM 1264  O   HOH B 282     -11.410   2.411   8.395  1.00  0.00           O  
HETATM 1265  H1  HOH B 282     -11.626   2.234   7.479  1.00  0.00           H  
HETATM 1266  H2  HOH B 282     -10.849   1.681   8.655  1.00  0.00           H  
HETATM 1267 OM   HOH B 282     -11.373   2.314   8.325  1.00  0.00          EP  
HETATM 1268  O   HOH B 283      -9.507   0.440   8.798  1.00  0.00           O  
HETATM 1269  H1  HOH B 283      -8.842   0.379   9.484  1.00  0.00           H  
HETATM 1270  H2  HOH B 283      -9.078   0.921   8.090  1.00  0.00           H  
HETATM 1271 OM   HOH B 283      -9.390   0.485   8.796  1.00  0.00          EP  
HETATM 1272  O   HOH B 284      -8.514  -3.600 -10.104  1.00  0.00           O  
HETATM 1273  H1  HOH B 284      -8.591  -2.746 -10.531  1.00  0.00           H  
HETATM 1274  H2  HOH B 284      -7.805  -3.489  -9.471  1.00  0.00           H  
HETATM 1275 OM   HOH B 284      -8.447  -3.497 -10.082  1.00  0.00          EP  
HETATM 1276  O   HOH B 285       1.689  -3.754   7.946  1.00  0.00           O  
HETATM 1277  H1  HOH B 285       1.588  -2.860   7.618  1.00  0.00           H  
HETATM 1278  H2  HOH B 285       2.100  -4.229   7.224  1.00  0.00           H  
HETATM 1279 OM   HOH B 285       1.722  -3.709   7.834  1.00  0.00          EP  
HETATM 1280  O   HOH B 286       5.705   3.789   9.859  1.00  0.00           O  
HETATM 1281  H1  HOH B 286       6.177   4.032  10.655  1.00  0.00           H  
HETATM 1282  H2  HOH B 286       6.074   4.354   9.180  1.00  0.00           H  
HETATM 1283 OM   HOH B 286       5.795   3.875   9.871  1.00  0.00          EP  
HETATM 1284  O   HOH B 287      -7.541  -9.319   4.725  1.00  0.00           O  
HETATM 1285  H1  HOH B 287      -7.161 -10.194   4.812  1.00  0.00           H  
HETATM 1286  H2  HOH B 287      -8.285  -9.319   5.327  1.00  0.00           H  
HETATM 1287 OM   HOH B 287      -7.579  -9.413   4.798  1.00  0.00          EP  
HETATM 1288  O   HOH B 288      -8.778  -8.634  -5.881  1.00  0.00           O  
HETATM 1289  H1  HOH B 288      -8.169  -8.991  -5.234  1.00  0.00           H  
HETATM 1290  H2  HOH B 288      -8.969  -7.750  -5.568  1.00  0.00           H  
HETATM 1291 OM   HOH B 288      -8.733  -8.578  -5.779  1.00  0.00          EP  
HETATM 1292  O   HOH B 289       9.253  -2.505   8.563  1.00  0.00           O  
HETATM 1293  H1  HOH B 289       9.594  -1.616   8.663  1.00  0.00           H  
HETATM 1294  H2  HOH B 289       8.358  -2.458   8.900  1.00  0.00           H  
HETATM 1295 OM   HOH B 289       9.193  -2.405   8.609  1.00  0.00          EP  
HETATM 1296  O   HOH B 290      10.131   4.935  -6.372  1.00  0.00           O  
HETATM 1297  H1  HOH B 290       9.592   4.419  -6.971  1.00  0.00           H  
HETATM 1298  H2  HOH B 290      10.872   5.225  -6.906  1.00  0.00           H  
HETATM 1299 OM   HOH B 290      10.153   4.911  -6.493  1.00  0.00          EP  
HETATM 1300  O   HOH B 291       5.900 -10.637   5.037  1.00  0.00           O  
HETATM 1301  H1  HOH B 291       6.074 -10.551   4.100  1.00  0.00           H  
HETATM 1302  H2  HOH B 291       5.562  -9.780   5.298  1.00  0.00           H  
HETATM 1303 OM   HOH B 291       5.883 -10.536   4.965  1.00  0.00          EP  
HETATM 1304  O   HOH B 292       3.815 -10.003  -3.369  1.00  0.00           O  
HETATM 1305  H1  HOH B 292       4.733 -10.193  -3.176  1.00  0.00           H  
HETATM 1306  H2  HOH B 292       3.719  -9.069  -3.184  1.00  0.00           H  
HETATM 1307 OM   HOH B 292       3.903  -9.924  -3.329  1.00  0.00          EP  
HETATM 1308  O   HOH B 293       3.831  -7.337  -2.663  1.00  0.00           O  
HETATM 1309  H1  HOH B 293       4.659  -6.867  -2.567  1.00  0.00           H  
HETATM 1310  H2  HOH B 293       3.536  -7.490  -1.765  1.00  0.00           H  
HETATM 1311 OM   HOH B 293       3.888  -7.303  -2.557  1.00  0.00          EP  
HETATM 1312  O   HOH B 294       4.519 -11.549   7.171  1.00  0.00           O  
HETATM 1313  H1  HOH B 294       3.893 -12.218   6.894  1.00  0.00           H  
HETATM 1314  H2  HOH B 294       5.027 -11.354   6.384  1.00  0.00           H  
HETATM 1315 OM   HOH B 294       4.506 -11.600   7.058  1.00  0.00          EP  
HETATM 1316  O   HOH B 295       6.595  -9.150  -6.335  1.00  0.00           O  
HETATM 1317  H1  HOH B 295       6.891  -8.685  -5.552  1.00  0.00           H  
HETATM 1318  H2  HOH B 295       6.831  -8.572  -7.061  1.00  0.00           H  
HETATM 1319 OM   HOH B 295       6.652  -9.038  -6.329  1.00  0.00          EP  
HETATM 1320  O   HOH B 296       9.452  -0.916   3.752  1.00  0.00           O  
HETATM 1321  H1  HOH B 296       9.724  -0.613   2.886  1.00  0.00           H  
HETATM 1322  H2  HOH B 296       8.668  -0.404   3.950  1.00  0.00           H  
HETATM 1323 OM   HOH B 296       9.397  -0.829   3.681  1.00  0.00          EP  
HETATM 1324  O   HOH B 297      -9.442   7.025   7.598  1.00  0.00           O  
HETATM 1325  H1  HOH B 297      -9.339   7.389   8.477  1.00  0.00           H  
HETATM 1326  H2  HOH B 297     -10.080   6.320   7.704  1.00  0.00           H  
HETATM 1327 OM   HOH B 297      -9.499   6.989   7.703  1.00  0.00          EP  
HETATM 1328  O   HOH B 298       4.959   6.704  -4.455  1.00  0.00           O  
HETATM 1329  H1  HOH B 298       4.024   6.908  -4.479  1.00  0.00           H  
HETATM 1330  H2  HOH B 298       5.109   6.173  -5.237  1.00  0.00           H  
HETATM 1331 OM   HOH B 298       4.875   6.669  -4.541  1.00  0.00          EP  
HETATM 1332  O   HOH B 299       9.133   8.790  -6.043  1.00  0.00           O  
HETATM 1333  H1  HOH B 299       8.227   8.666  -5.760  1.00  0.00           H  
HETATM 1334  H2  HOH B 299       9.425   9.573  -5.575  1.00  0.00           H  
HETATM 1335 OM   HOH B 299       9.067   8.860  -5.963  1.00  0.00          EP  
HETATM 1336  O   HOH B 300       8.884   8.473   1.769  1.00  0.00           O  
HETATM 1337  H1  HOH B 300       8.757   8.714   0.851  1.00  0.00           H  
HETATM 1338  H2  HOH B 300       8.826   7.517   1.776  1.00  0.00           H  
HETATM 1339 OM   HOH B 300       8.864   8.396   1.672  1.00  0.00          EP  
HETATM 1340  O   HOH B 301      10.037  10.230  -3.825  1.00  0.00           O  
HETATM 1341  H1  HOH B 301       9.799   9.414  -3.384  1.00  0.00           H  
HETATM 1342  H2  HOH B 301       9.544  10.906  -3.361  1.00  0.00           H  
HETATM 1343 OM   HOH B 301       9.959  10.215  -3.728  1.00  0.00          EP  
HETATM 1344  O   HOH B 302      -6.780   9.305   9.569  1.00  0.00           O  
HETATM 1345  H1  HOH B 302      -7.245   9.315   8.732  1.00  0.00           H  
HETATM 1346  H2  HOH B 302      -6.877  10.195   9.908  1.00  0.00           H  
HETATM 1347 OM   HOH B 302      -6.840   9.401   9.516  1.00  0.00          EP  
HETATM 1348  O   HOH B 303       7.645   5.540  -2.103  1.00  0.00           O  
HETATM 1349  H1  HOH B 303       6.708   5.591  -1.916  1.00  0.00           H  
HETATM 1350  H2  HOH B 303       7.692   5.253  -3.016  1.00  0.00           H  
HETATM 1351 OM   HOH B 303       7.550   5.515  -2.181  1.00  0.00          EP  
HETATM 1352  O   HOH B 304       8.293   9.269  -0.751  1.00  0.00           O  
HETATM 1353  H1  HOH B 304       7.387   8.980  -0.646  1.00  0.00           H  
HETATM 1354  H2  HOH B 304       8.657   8.681  -1.413  1.00  0.00           H  
HETATM 1355 OM   HOH B 304       8.235   9.175  -0.810  1.00  0.00          EP  
HETATM 1356  O   HOH B 305       9.568   7.228   4.722  1.00  0.00           O  
HETATM 1357  H1  HOH B 305       9.242   8.075   5.026  1.00  0.00           H  
HETATM 1358  H2  HOH B 305       9.067   6.584   5.223  1.00  0.00           H  
HETATM 1359 OM   HOH B 305       9.480   7.249   4.808  1.00  0.00          EP  
HETATM 1360  O   HOH B 306       6.928   8.563  -4.396  1.00  0.00           O  
HETATM 1361  H1  HOH B 306       6.244   7.904  -4.508  1.00  0.00           H  
HETATM 1362  H2  HOH B 306       7.601   8.126  -3.874  1.00  0.00           H  
HETATM 1363 OM   HOH B 306       6.927   8.446  -4.353  1.00  0.00          EP  
HETATM 1364  O   HOH B 307       8.703   4.113   0.013  1.00  0.00           O  
HETATM 1365  H1  HOH B 307       8.833   4.680   0.774  1.00  0.00           H  
HETATM 1366  H2  HOH B 307       8.391   4.702  -0.674  1.00  0.00           H  
HETATM 1367 OM   HOH B 307       8.683   4.236   0.021  1.00  0.00          EP  
HETATM 1368  O   HOH B 308       4.835   8.871   5.234  1.00  0.00           O  
HETATM 1369  H1  HOH B 308       4.353   8.148   4.834  1.00  0.00           H  
HETATM 1370  H2  HOH B 308       5.532   9.070   4.608  1.00  0.00           H  
HETATM 1371 OM   HOH B 308       4.858   8.815   5.124  1.00  0.00          EP  
HETATM 1372  O   HOH B 309     -10.976   5.032   8.919  1.00  0.00           O  
HETATM 1373  H1  HOH B 309     -11.121   4.111   8.702  1.00  0.00           H  
HETATM 1374  H2  HOH B 309     -11.808   5.324   9.292  1.00  0.00           H  
HETATM 1375 OM   HOH B 309     -11.080   4.965   8.936  1.00  0.00          EP  
HETATM 1376  O   HOH B 310      -4.207  10.485   4.752  1.00  0.00           O  
HETATM 1377  H1  HOH B 310      -4.165  11.365   5.127  1.00  0.00           H  
HETATM 1378  H2  HOH B 310      -3.306  10.163   4.794  1.00  0.00           H  
HETATM 1379 OM   HOH B 310      -4.106  10.545   4.796  1.00  0.00          EP  
HETATM 1380  O   HOH B 311       3.263  10.639  -8.246  1.00  0.00           O  
HETATM 1381  H1  HOH B 311       2.912  10.107  -8.961  1.00  0.00           H  
HETATM 1382  H2  HOH B 311       3.050  10.146  -7.453  1.00  0.00           H  
HETATM 1383 OM   HOH B 311       3.203  10.529  -8.238  1.00  0.00          EP  
HETATM 1384  O   HOH B 312       3.036  -5.444   3.248  1.00  0.00           O  
HETATM 1385  H1  HOH B 312       2.783  -5.296   4.160  1.00  0.00           H  
HETATM 1386  H2  HOH B 312       2.392  -4.951   2.738  1.00  0.00           H  
HETATM 1387 OM   HOH B 312       2.940  -5.376   3.291  1.00  0.00          EP  
HETATM 1388  O   HOH B 313       9.073   7.693  -2.823  1.00  0.00           O  
HETATM 1389  H1  HOH B 313       8.629   6.912  -2.493  1.00  0.00           H  
HETATM 1390  H2  HOH B 313       9.727   7.357  -3.435  1.00  0.00           H  
HETATM 1391 OM   HOH B 313       9.095   7.574  -2.853  1.00  0.00          EP  
HETATM 1392  O   HOH B 314       5.704   8.444  -0.643  1.00  0.00           O  
HETATM 1393  H1  HOH B 314       5.496   7.597  -1.037  1.00  0.00           H  
HETATM 1394  H2  HOH B 314       5.557   9.078  -1.345  1.00  0.00           H  
HETATM 1395 OM   HOH B 314       5.666   8.422  -0.760  1.00  0.00          EP  
HETATM 1396  O   HOH B 315     -10.943 -11.069  -5.804  1.00  0.00           O  
HETATM 1397  H1  HOH B 315     -11.335 -11.941  -5.767  1.00  0.00           H  
HETATM 1398  H2  HOH B 315     -10.390 -11.021  -5.025  1.00  0.00           H  
HETATM 1399 OM   HOH B 315     -10.926 -11.157  -5.717  1.00  0.00          EP  
HETATM 1400  O   HOH B 316       3.682 -10.668  -8.686  1.00  0.00           O  
HETATM 1401  H1  HOH B 316       3.783 -10.368  -7.782  1.00  0.00           H  
HETATM 1402  H2  HOH B 316       3.480 -11.600  -8.608  1.00  0.00           H  
HETATM 1403 OM   HOH B 316       3.671 -10.735  -8.581  1.00  0.00          EP  
HETATM 1404  O   HOH B 317       9.475   8.162  -8.692  1.00  0.00           O  
HETATM 1405  H1  HOH B 317      10.386   8.416  -8.836  1.00  0.00           H  
HETATM 1406  H2  HOH B 317       9.312   8.365  -7.771  1.00  0.00           H  
HETATM 1407 OM   HOH B 317       9.555   8.211  -8.609  1.00  0.00          EP  
HETATM 1408  O   HOH B 318     -11.648  10.320  -5.382  1.00  0.00           O  
HETATM 1409  H1  HOH B 318     -11.821   9.703  -6.093  1.00  0.00           H  
HETATM 1410  H2  HOH B 318     -12.427  10.272  -4.828  1.00  0.00           H  
HETATM 1411 OM   HOH B 318     -11.749  10.249  -5.399  1.00  0.00          EP  
HETATM 1412  O   HOH B 319       5.535   6.614  -9.038  1.00  0.00           O  
HETATM 1413  H1  HOH B 319       4.821   6.520  -9.669  1.00  0.00           H  
HETATM 1414  H2  HOH B 319       5.861   7.503  -9.176  1.00  0.00           H  
HETATM 1415 OM   HOH B 319       5.493   6.699  -9.120  1.00  0.00          EP  
HETATM 1416  O   HOH B 320       6.625   9.362   7.274  1.00  0.00           O  
HETATM 1417  H1  HOH B 320       6.227   9.257   8.138  1.00  0.00           H  
HETATM 1418  H2  HOH B 320       5.939   9.097   6.660  1.00  0.00           H  
HETATM 1419 OM   HOH B 320       6.509   9.323   7.300  1.00  0.00          EP  
HETATM 1420  O   HOH B 321       7.684  -8.938   8.631  1.00  0.00           O  
HETATM 1421  H1  HOH B 321       7.871  -8.965   7.692  1.00  0.00           H  
HETATM 1422  H2  HOH B 321       6.792  -9.275   8.707  1.00  0.00           H  
HETATM 1423 OM   HOH B 321       7.609  -8.977   8.539  1.00  0.00          EP  
HETATM 1424  O   HOH B 322      -9.558   8.072 -11.023  1.00  0.00           O  
HETATM 1425  H1  HOH B 322      -9.563   8.990 -10.751  1.00  0.00           H  
HETATM 1426  H2  HOH B 322      -9.489   8.105 -11.977  1.00  0.00           H  
HETATM 1427 OM   HOH B 322      -9.551   8.174 -11.096  1.00  0.00          EP  
HETATM 1428  O   HOH B 323       6.314  -9.675  11.503  1.00  0.00           O  
HETATM 1429  H1  HOH B 323       5.766  -9.730  10.720  1.00  0.00           H  
HETATM 1430  H2  HOH B 323       7.211  -9.682  11.169  1.00  0.00           H  
HETATM 1431 OM   HOH B 323       6.351  -9.682  11.384  1.00  0.00          EP  
HETATM 1432  O   HOH B 324      10.842   7.030  -4.740  1.00  0.00           O  
HETATM 1433  H1  HOH B 324      10.690   6.189  -5.170  1.00  0.00           H  
HETATM 1434  H2  HOH B 324      10.400   7.669  -5.300  1.00  0.00           H  
HETATM 1435 OM   HOH B 324      10.779   7.009  -4.846  1.00  0.00          EP  
HETATM 1436  O   HOH B 325       8.575   9.885   5.456  1.00  0.00           O  
HETATM 1437  H1  HOH B 325       8.017   9.759   6.224  1.00  0.00           H  
HETATM 1438  H2  HOH B 325       8.734  10.829   5.428  1.00  0.00           H  
HETATM 1439 OM   HOH B 325       8.533   9.972   5.535  1.00  0.00          EP  
HETATM 1440  O   HOH B 326       9.377  -9.225  -7.262  1.00  0.00           O  
HETATM 1441  H1  HOH B 326       8.939  -8.686  -7.921  1.00  0.00           H  
HETATM 1442  H2  HOH B 326       8.668  -9.706  -6.835  1.00  0.00           H  
HETATM 1443 OM   HOH B 326       9.255  -9.219  -7.287  1.00  0.00          EP  
HETATM 1444  O   HOH B 327      -8.519  -9.036   7.370  1.00  0.00           O  
HETATM 1445  H1  HOH B 327      -8.198  -9.248   8.246  1.00  0.00           H  
HETATM 1446  H2  HOH B 327      -9.279  -8.474   7.522  1.00  0.00           H  
HETATM 1447 OM   HOH B 327      -8.566  -8.999   7.479  1.00  0.00          EP  
HETATM 1448  O   HOH B 328     -10.399  -5.952 -10.240  1.00  0.00           O  
HETATM 1449  H1  HOH B 328     -10.384  -5.012 -10.416  1.00  0.00           H  
HETATM 1450  H2  HOH B 328      -9.528  -6.145  -9.892  1.00  0.00           H  
HETATM 1451 OM   HOH B 328     -10.304  -5.872 -10.221  1.00  0.00          EP  
TER    1452      HOH B 328
HETATM 1453 Na    NA C   1       1.890  10.225  -1.030  1.00  0.00          Na  
HETATM 1454 Na    NA C   2      -6.298  -7.598   2.667  1.00  0.00          Na  
HETATM 1455 Na    NA C   3      -8.580  -8.752   0.050  1.00  0.00          Na  
HETATM 1456 Na    NA C   4      -4.766   8.110   9.595  1.00  0.00          Na  
HETATM 1457 Na    NA C   5      -6.672  -7.830   6.444  1.00  0.00          Na  
HETATM 1458 Na    NA C   6       3.494  -3.691  -4.871  1.00  0.00          Na  
HETATM 1459 Na    NA C   7       9.050  -3.228   3.597  1.00  0.00          Na  
HETATM 1460 Na    NA C   8      -8.970  -8.727  -8.217  1.00  0.00          Na  
HETATM 1461 Cl    CL C   9       1.681   1.786   8.787  1.00  0.00          Cl  
HETATM 1462 Cl    CL C  10      -3.849   4.249   9.189  1.00  0.00          Cl  
HETATM 1463 Cl    CL C  11       2.861  -7.733   8.355  1.00  0.00          Cl  
HETATM 1464 Cl    CL C  12       3.080   3.665  -9.112  1.00  0.00          Cl  
HETATM 1465 Cl    CL C  13       6.575  -5.587  -2.154  1.00  0.00          Cl  
HETATM 1466 Cl    CL C  14      -6.793  -9.728  -3.822  1.00  0.00          Cl  
TER    1467       CL C  14
END