COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  N   SER A   1     -69.648 -36.659  20.039  1.00  0.00           N  
ATOM      2  CA  SER A   1     -70.021 -37.977  19.454  1.00  0.00           C  
ATOM      3  C   SER A   1     -68.847 -38.882  19.810  1.00  0.00           C  
ATOM      4  O   SER A   1     -67.749 -38.688  19.272  1.00  0.00           O  
ATOM      5  CB  SER A   1     -71.386 -38.444  20.013  1.00  0.00           C  
ATOM      6  OG  SER A   1     -71.386 -39.786  20.465  1.00  0.00           O  
ATOM      7  N   ALA A   2     -69.070 -39.879  20.666  1.00  0.00           N  
ATOM      8  CA  ALA A   2     -68.028 -40.370  21.583  1.00  0.00           C  
ATOM      9  C   ALA A   2     -66.705 -41.106  21.151  1.00  0.00           C  
ATOM     10  O   ALA A   2     -65.823 -41.244  22.002  1.00  0.00           O  
ATOM     11  CB  ALA A   2     -68.686 -41.087  22.772  1.00  0.00           C  
HETATM   12  C   UNK A   3     -65.030 -43.614  20.241  1.00  0.00           C  
HETATM   13  C   UNK A   3     -65.261 -42.298  19.503  1.00  0.00           C  
HETATM   14  C   UNK A   3     -63.955 -41.474  19.650  1.00  0.00           C  
HETATM   15  C   UNK A   3     -63.616 -40.655  18.412  1.00  0.00           C  
HETATM   16  C   UNK A   3     -62.417 -39.718  18.565  1.00  0.00           C  
HETATM   17  C   UNK A   3     -61.530 -38.377  20.395  1.00  0.00           C  
HETATM   18  C   UNK A   3     -60.232 -39.038  20.013  1.00  0.00           C  
HETATM   19  N   UNK A   3     -66.526 -41.561  19.902  1.00  0.00           N  
HETATM   20  N   UNK A   3     -62.586 -38.746  19.654  1.00  0.00           N  
HETATM   21  O   UNK A   3     -64.221 -43.667  21.195  1.00  0.00           O  
HETATM   22  O   UNK A   3     -63.689 -38.243  19.869  1.00  0.00           O  
HETATM   23  O   UNK A   3     -61.533 -37.574  21.316  1.00  0.00           O  
HETATM   24  N   UNK A   4     -65.707 -44.687  19.807  1.00  0.00           N  
HETATM   25  C   UNK A   4     -65.891 -45.894  20.673  1.00  0.00           C  
HETATM   26  C   UNK A   4     -64.576 -46.613  21.067  1.00  0.00           C  
HETATM   27  C   UNK A   4     -64.777 -47.943  21.820  1.00  0.00           C  
HETATM   28  C   UNK A   4     -63.682 -48.352  22.846  1.00  0.00           C  
HETATM   29  N   UNK A   4     -63.961 -47.914  24.234  1.00  0.00           N  
HETATM   30  C   UNK A   4     -66.613 -45.452  21.936  1.00  0.00           C  
HETATM   31  O   UNK A   4     -67.278 -44.396  21.943  1.00  0.00           O  
ATOM     32  N   ASP A   5     -66.487 -46.249  22.995  1.00  0.00           N  
ATOM     33  CA  ASP A   5     -67.080 -45.893  24.292  1.00  0.00           C  
ATOM     34  C   ASP A   5     -66.715 -44.483  24.789  1.00  0.00           C  
ATOM     35  O   ASP A   5     -67.553 -43.700  25.267  1.00  0.00           O  
ATOM     36  CB  ASP A   5     -68.571 -46.339  24.497  1.00  0.00           C  
ATOM     37  CG  ASP A   5     -69.544 -45.697  23.503  1.00  0.00           C  
ATOM     38  OD1 ASP A   5     -69.559 -44.441  23.479  1.00  0.00           O  
ATOM     39  OD2 ASP A   5     -70.291 -46.431  22.782  1.00  0.00           O  
HETATM   40  C   UNK A   6     -64.571 -44.877  26.498  1.00  0.00           C  
HETATM   41  C   UNK A   6     -64.492 -43.680  25.553  1.00  0.00           C  
HETATM   42  C   UNK A   6     -64.690 -42.250  26.089  1.00  0.00           C  
HETATM   43  C   UNK A   6     -64.712 -41.202  24.969  1.00  0.00           C  
HETATM   44  C   UNK A   6     -63.345 -40.638  24.603  1.00  0.00           C  
HETATM   45  C   UNK A   6     -62.975 -38.208  24.348  1.00  0.00           C  
HETATM   46  C   UNK A   6     -62.384 -38.309  25.726  1.00  0.00           C  
HETATM   47  N   UNK A   6     -65.437 -44.172  24.531  1.00  0.00           N  
HETATM   48  N   UNK A   6     -63.434 -39.350  23.887  1.00  0.00           N  
HETATM   49  O   UNK A   6     -64.845 -44.760  27.702  1.00  0.00           O  
HETATM   50  O   UNK A   6     -63.905 -39.234  22.764  1.00  0.00           O  
HETATM   51  O   UNK A   3     -63.062 -37.160  23.696  1.00  0.00           O  
HETATM   52  N   UNK A   7     -64.309 -46.044  25.884  1.00  0.00           N  
HETATM   53  C   UNK A   4     -64.784 -47.394  26.286  1.00  0.00           C  
HETATM   54  C   UNK A   4     -64.928 -48.286  25.005  1.00  0.00           C  
HETATM   55  O   UNK A   4     -66.049 -48.562  24.535  1.00  0.00           O  
HETATM   56  C   UNK A   4     -66.109 -47.307  27.104  1.00  0.00           C  
HETATM   57  O   UNK A   7     -66.822 -48.530  27.111  1.00  0.00           O  
HETATM   58  O   UNK A   0     -67.770 -26.268  23.997  1.00  0.00           O  
HETATM   59  C   UNK A   0     -68.241 -27.322  23.484  1.00  0.00           C  
HETATM   60  O   UNK A   0     -68.565 -28.241  24.277  1.00  0.00           O  
HETATM   61  C   UNK A   0     -68.314 -27.462  21.929  1.00  0.00           C  
HETATM   62  C   UNK A   0     -69.484 -28.101  21.102  1.00  0.00           C  
HETATM   63  C   UNK A   0     -68.919 -29.178  19.882  1.00  0.00           C  
HETATM   64  O   UNK A   0     -69.085 -29.415  18.685  1.00  0.00           O  
HETATM   65  N   UNK A   0     -68.479 -30.019  20.828  1.00  0.00           N  
HETATM   66  C   UNK A   0     -68.123 -31.406  20.844  1.00  0.00           C  
HETATM   67  C   UNK A   0     -66.781 -31.821  20.960  1.00  0.00           C  
HETATM   68  C   UNK A   0     -66.439 -33.180  21.068  1.00  0.00           C  
HETATM   69  C   UNK A   0     -65.095 -33.588  21.157  1.00  0.00           C  
HETATM   70  C   UNK A   3     -64.786 -34.960  21.252  1.00  0.00           C  
HETATM   71  O   UNK A   3     -63.516 -35.504  21.351  1.00  0.00           O  
HETATM   72  C   UNK A   3     -65.812 -35.868  21.268  1.00  0.00           C  
HETATM   73  O   UNK A   3     -65.453 -37.164  21.359  1.00  0.00           O  
HETATM   74  C   UNK A   3     -67.135 -35.467  21.191  1.00  0.00           C  
HETATM   75  C   UNK A   0     -67.483 -34.119  21.084  1.00  0.00           C  
HETATM   76  N   UNK A   0     -68.786 -33.718  20.964  1.00  0.00           N1+
HETATM   77  C   UNK A   0     -69.891 -34.705  20.957  1.00  0.00           C  
HETATM   78  C   UNK A   0     -69.994 -35.492  19.652  1.00  0.00           C  
HETATM   79  O   UNK A   0     -69.774 -35.020  18.526  1.00  0.00           O  
HETATM   80  C   UNK A   0     -69.095 -32.410  20.870  1.00  0.00           C  
HETATM   81  N   UNK A   0     -70.384 -32.030  20.774  1.00  0.00           N  
HETATM   82  C   UNK A   0     -71.415 -32.910  20.264  1.00  0.00           C  
HETATM   83  C   UNK A   0     -71.257 -34.091  21.205  1.00  0.00           C  
HETATM   84 FE   UNK A   3     -63.490 -37.514  21.749  1.00  0.00          Fe3+
ATOM     85  H   SER A   1     -69.049 -36.692  20.839  1.00  0.00           H  
ATOM     86  HA  SER A   1     -70.094 -37.890  18.360  1.00  0.00           H  
ATOM     87  HB1 SER A   1     -71.657 -37.793  20.857  1.00  0.00           H  
ATOM     88  HB2 SER A   1     -72.139 -38.345  19.218  1.00  0.00           H  
ATOM     89  H   SER A   1     -72.249 -40.010  20.794  1.00  0.00           H  
ATOM     90  H   ALA A   2     -69.974 -40.307  20.686  1.00  0.00           H  
ATOM     91  HA  ALA A   2     -67.644 -39.447  22.042  1.00  0.00           H  
ATOM     92  HB1 ALA A   2     -67.907 -41.453  23.457  1.00  0.00           H  
ATOM     93  HB2 ALA A   2     -69.342 -40.384  23.306  1.00  0.00           H  
ATOM     94  HB3 ALA A   2     -69.280 -41.937  22.404  1.00  0.00           H  
HETATM   95  H   UNK A   3     -65.357 -42.544  18.435  1.00  0.00           H  
HETATM   96  H   UNK A   3     -64.070 -40.788  20.502  1.00  0.00           H  
HETATM   97  H   UNK A   3     -63.125 -42.168  19.847  1.00  0.00           H  
HETATM   98  H   UNK A   3     -63.401 -41.353  17.590  1.00  0.00           H  
HETATM   99  H   UNK A   3     -64.495 -40.045  18.155  1.00  0.00           H  
HETATM  100  H   UNK A   3     -61.522 -40.324  18.771  1.00  0.00           H  
HETATM  101  H   UNK A   3     -62.279 -39.168  17.622  1.00  0.00           H  
HETATM  102  H   UNK A   3     -59.427 -38.672  20.667  1.00  0.00           H  
HETATM  103  H   UNK A   3     -60.329 -40.128  20.126  1.00  0.00           H  
HETATM  104  H   UNK A   3     -59.992 -38.797  18.967  1.00  0.00           H  
HETATM  105  H   UNK A   3     -67.241 -41.411  19.219  1.00  0.00           H  
HETATM  106  H   UNK A   4     -66.097 -44.681  18.886  1.00  0.00           H  
HETATM  107  H   UNK A   4     -66.529 -46.616  20.142  1.00  0.00           H  
HETATM  108  H   UNK A   4     -64.009 -46.821  20.148  1.00  0.00           H  
HETATM  109  H   UNK A   4     -63.995 -45.937  21.712  1.00  0.00           H  
HETATM  110  H   UNK A   4     -65.731 -47.874  22.364  1.00  0.00           H  
HETATM  111  H   UNK A   4     -64.841 -48.743  21.067  1.00  0.00           H  
HETATM  112  H   UNK A   4     -63.595 -49.449  22.840  1.00  0.00           H  
HETATM  113  H   UNK A   4     -62.727 -47.907  22.528  1.00  0.00           H  
HETATM  114  H   UNK A   4     -63.322 -47.249  24.621  1.00  0.00           H  
ATOM    115  H   ASP A   5     -65.979 -47.106  22.906  1.00  0.00           H  
ATOM    116  HA  ASP A   5     -66.542 -46.542  24.999  1.00  0.00           H  
ATOM    117  HB1 ASP A   5     -68.626 -47.432  24.382  1.00  0.00           H  
ATOM    118  HB2 ASP A   5     -68.880 -46.061  25.515  1.00  0.00           H  
ATOM    119  HD2 ASP A   5     -70.845 -45.883  22.239  1.00  0.00           H  
HETATM  120  H   UNK A   6     -63.489 -43.705  25.103  1.00  0.00           H  
HETATM  121  H   UNK A   6     -65.645 -42.206  26.632  1.00  0.00           H  
HETATM  122  H   UNK A   6     -63.865 -42.014  26.777  1.00  0.00           H  
HETATM  123  H   UNK A   6     -65.143 -41.668  24.071  1.00  0.00           H  
HETATM  124  H   UNK A   6     -65.352 -40.368  25.292  1.00  0.00           H  
HETATM  125  H   UNK A   6     -62.767 -40.488  25.527  1.00  0.00           H  
HETATM  126  H   UNK A   6     -62.826 -41.363  23.959  1.00  0.00           H  
HETATM  127  H   UNK A   6     -62.047 -37.315  26.055  1.00  0.00           H  
HETATM  128  H   UNK A   6     -63.145 -38.688  26.424  1.00  0.00           H  
HETATM  129  H   UNK A   6     -61.528 -38.999  25.708  1.00  0.00           H  
HETATM  130  H   UNK A   6     -65.105 -44.279  23.594  1.00  0.00           H  
HETATM  131  H   UNK A   7     -63.732 -45.999  25.069  1.00  0.00           H  
HETATM  132  H   UNK A   4     -64.022 -47.857  26.931  1.00  0.00           H  
HETATM  133  H   UNK A   7     -65.866 -47.034  28.142  1.00  0.00           H  
HETATM  134  H   UNK A   7     -66.747 -46.529  26.660  1.00  0.00           H  
HETATM  135  H   UNK A   7     -66.785 -48.924  26.247  1.00  0.00           H  
HETATM  136  H   UNK A   0     -68.389 -27.966  25.169  1.00  0.00           H  
HETATM  137  H   UNK A   0     -68.221 -26.435  21.545  1.00  0.00           H  
HETATM  138  H   UNK A   0     -67.420 -28.040  21.652  1.00  0.00           H  
HETATM  139  H   UNK A   0     -70.138 -28.658  21.789  1.00  0.00           H  
HETATM  140  H   UNK A   0     -70.058 -27.295  20.622  1.00  0.00           H  
HETATM  141  H   UNK A   0     -68.377 -29.581  21.721  1.00  0.00           H  
HETATM  142  H   UNK A   0     -65.997 -31.078  20.966  1.00  0.00           H  
HETATM  143  H   UNK A   0     -64.304 -32.853  21.153  1.00  0.00           H  
HETATM  144  H   UNK A   3     -67.915 -36.214  21.214  1.00  0.00           H  
HETATM  145  H   UNK A   0     -69.703 -35.429  21.763  1.00  0.00           H  
HETATM  146  H   UNK A   0     -72.043 -34.835  21.007  1.00  0.00           H  
HETATM  147  H   UNK A   0     -71.330 -33.750  22.248  1.00  0.00           H  
HETATM  148  H   UNK A   0     -70.638 -31.108  21.065  1.00  0.00           H  
HETATM  149  H   UNK A   0     -72.414 -32.456  20.345  1.00  0.00           H  
HETATM  150  H   UNK A   0     -71.226 -33.195  19.219  1.00  0.00           H  
CONECT    1    2   85   78                                            
CONECT    2    1    3    5   86                                       
CONECT    3    2    4    4    7                                       
CONECT    4    3    3                                                 
CONECT    5    2    6   87   88                                       
CONECT    6    5   89                                                 
CONECT    7    8   90    3                                            
CONECT    8    7    9   11   91                                       
CONECT    9    8   10   10   19                                       
CONECT   10    9    9                                                 
CONECT   11    8   92   93   94                                       
CONECT   12   13   21   21   24                                       
CONECT   13   12   14   19   95                                       
CONECT   14   13   15   96   97                                       
CONECT   15   14   16   98   99                                       
CONECT   16   15   20  100  101                                       
CONECT   17   18   20   23   23                                       
CONECT   18   17  102  103  104                                       
CONECT   19   13  105    9                                            
CONECT   20   16   17   22                                            
CONECT   21   12   12                                                 
CONECT   22   20   84                                                 
CONECT   23   17   17   84                                            
CONECT   24   25  106   12                                            
CONECT   25   24   26   30  107                                       
CONECT   26   25   27  108  109                                       
CONECT   27   26   28  110  111                                       
CONECT   28   27   29  112  113                                       
CONECT   29   28  114   54                                            
CONECT   30   25   31   31   32                                       
CONECT   31   30   30                                                 
CONECT   32   33  115   30                                            
CONECT   33   32   34   36  116                                       
CONECT   34   33   35   35   47                                       
CONECT   35   34   34                                                 
CONECT   36   33   37  117  118                                       
CONECT   37   36   38   38   39                                       
CONECT   38   37   37                                                 
CONECT   39   37  119                                                 
CONECT   40   41   49   49   52                                       
CONECT   41   40   42   47  120                                       
CONECT   42   41   43  121  122                                       
CONECT   43   42   44  123  124                                       
CONECT   44   43   48  125  126                                       
CONECT   45   46   48   51   51                                       
CONECT   46   45  127  128  129                                       
CONECT   47   41  130   34                                            
CONECT   48   44   45   50                                            
CONECT   49   40   40                                                 
CONECT   50   48   84                                                 
CONECT   51   45   45   84                                            
CONECT   52   53  131   40                                            
CONECT   53   52   54   56  132                                       
CONECT   54   53   55   55   29                                       
CONECT   55   54   54                                                 
CONECT   56   53   57  133  134                                       
CONECT   57   56  135                                                 
CONECT   58   59   59                                                 
CONECT   59   58   58   60   61                                       
CONECT   60   59  136                                                 
CONECT   61   59   62  137  138                                       
CONECT   62   61   63  139  140                                       
CONECT   63   62   64   64   65                                       
CONECT   64   63   63                                                 
CONECT   65   63   66  141                                            
CONECT   66   65   67   67   80                                       
CONECT   67   66   66   68  142                                       
CONECT   68   67   69   75   75                                       
CONECT   69   68   70   70  143                                       
CONECT   70   69   69   71   72                                       
CONECT   71   70   84                                                 
CONECT   72   70   73   74   74                                       
CONECT   73   72   84                                                 
CONECT   74   72   72   75  144                                       
CONECT   75   68   68   74   76                                       
CONECT   76   75   77   80   80                                       
CONECT   77   76   78   83  145                                       
CONECT   78   77   79   79    1                                       
CONECT   79   78   78                                                 
CONECT   80   66   76   76   81                                       
CONECT   81   80   82  148                                            
CONECT   82   81   83  149  150                                       
CONECT   83   77   82  146  147                                       
CONECT   84   51   50   23   22                                       
CONECT   84   73   71                                                 
CONECT   85    1                                                      
CONECT   86    2                                                      
CONECT   87    5                                                      
CONECT   88    5                                                      
CONECT   89    6                                                      
CONECT   90    7                                                      
CONECT   91    8                                                      
CONECT   92   11                                                      
CONECT   93   11                                                      
CONECT   94   11                                                      
CONECT   95   13                                                      
CONECT   96   14                                                      
CONECT   97   14                                                      
CONECT   98   15                                                      
CONECT   99   15                                                      
CONECT  100   16                                                      
CONECT  101   16                                                      
CONECT  102   18                                                      
CONECT  103   18                                                      
CONECT  104   18                                                      
CONECT  105   19                                                      
CONECT  106   24                                                      
CONECT  107   25                                                      
CONECT  108   26                                                      
CONECT  109   26                                                      
CONECT  110   27                                                      
CONECT  111   27                                                      
CONECT  112   28                                                      
CONECT  113   28                                                      
CONECT  114   29                                                      
CONECT  115   32                                                      
CONECT  116   33                                                      
CONECT  117   36                                                      
CONECT  118   36                                                      
CONECT  119   39                                                      
CONECT  120   41                                                      
CONECT  121   42                                                      
CONECT  122   42                                                      
CONECT  123   43                                                      
CONECT  124   43                                                      
CONECT  125   44                                                      
CONECT  126   44                                                      
CONECT  127   46                                                      
CONECT  128   46                                                      
CONECT  129   46                                                      
CONECT  130   47                                                      
CONECT  131   52                                                      
CONECT  132   53                                                      
CONECT  133   56                                                      
CONECT  134   56                                                      
CONECT  135   57                                                      
CONECT  136   60                                                      
CONECT  137   61                                                      
CONECT  138   61                                                      
CONECT  139   62                                                      
CONECT  140   62                                                      
CONECT  141   65                                                      
CONECT  142   67                                                      
CONECT  143   69                                                      
CONECT  144   74                                                      
CONECT  145   77                                                      
CONECT  146   83                                                      
CONECT  147   83                                                      
CONECT  148   81                                                      
CONECT  149   82                                                      
CONECT  150   82                                                      
MASTER        0    0    0    0    0    0    0    0  150    0  150    0
END
