COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNK A   4      -3.353  -0.694  -1.563  1.00  0.00           O  
HETATM    2  C   UNK A   4      -3.237  -0.459  -0.379  1.00  0.00           C  
ATOM      3  N   ILE A   1      -3.431  -1.445   0.522  1.00  0.00           N  
ATOM      4  CA  ILE A   1      -3.023  -2.812   0.144  1.00  0.00           C  
ATOM      5  CB  ILE A   1      -3.563  -3.153  -1.247  1.00  0.00           C  
ATOM      6  CG1 ILE A   1      -5.091  -3.226  -1.197  1.00  0.00           C  
ATOM      7  CD1 ILE A   1      -5.637  -3.443  -2.609  1.00  0.00           C  
ATOM      8  CG2 ILE A   1      -3.003  -4.505  -1.694  1.00  0.00           C  
ATOM      9  C   ILE A   1      -1.517  -2.829   0.130  1.00  0.00           C  
ATOM     10  O   ILE A   1      -0.927  -1.770   0.147  1.00  0.00           O  
ATOM     11  N   LYS A   2      -0.799  -3.961   0.100  1.00  0.00           N  
ATOM     12  CE  LYS A   2      -1.454  -5.260  -0.060  1.00  0.00           C  
ATOM     13  CD  LYS A   2      -0.931  -6.240   0.991  1.00  0.00           C  
ATOM     14  CG  LYS A   2       0.599  -6.267   0.952  1.00  0.00           C  
ATOM     15  CB  LYS A   2       1.137  -4.873   1.284  1.00  0.00           C  
ATOM     16  CA  LYS A   2       0.660  -3.882   0.221  1.00  0.00           C  
ATOM     17  C   LYS A   2       1.047  -2.482   0.627  1.00  0.00           C  
ATOM     18  O   LYS A   2       1.918  -1.888   0.026  1.00  0.00           O  
HETATM   19  N   UNK A   3       0.409  -1.894   1.674  1.00  0.00           N  
HETATM   20  C   UNK A   3       0.313  -0.417   1.657  1.00  0.00           C  
HETATM   21  C   UNK A   3       1.207   0.148   0.552  1.00  0.00           C  
HETATM   22  C   UNK A   3       2.673   0.040   0.975  1.00  0.00           C  
HETATM   23  C   UNK A   3       3.572   0.467  -0.186  1.00  0.00           C  
HETATM   24  C   UNK A   3       5.038   0.358   0.237  1.00  0.00           C  
HETATM   25  C   UNK A   3       5.938   0.786  -0.924  1.00  0.00           C  
HETATM   26  C   UNK A   3       7.404   0.677  -0.500  1.00  0.00           C  
HETATM   27  O   UNK A   3       7.698  -0.675  -0.143  1.00  0.00           O  
HETATM   28  C   UNK A   3       8.304   1.104  -1.662  1.00  0.00           C  
HETATM   29  C   UNK A   3       9.770   0.996  -1.238  1.00  0.00           C  
HETATM   30  O   UNK A   3       7.640   1.528   0.623  1.00  0.00           O  
HETATM   31  C   UNK A   3      -1.121  -0.050   1.390  1.00  0.00           C  
HETATM   32  O   UNK A   3      -2.002  -0.611   2.007  1.00  0.00           O  
HETATM   33  N   UNK A   4      -1.451   0.892   0.475  1.00  0.00           N  
HETATM   34  C   UNK A   4      -2.873   0.932   0.075  1.00  0.00           C  
HETATM   35  C   UNK A   4      -3.063   1.925  -1.073  1.00  0.00           C  
HETATM   36  C   UNK A   4      -2.814   3.325  -0.573  1.00  0.00           C  
HETATM   37  C   UNK A   4      -3.740   4.193  -0.135  1.00  0.00           C  
HETATM   38  N   UNK A   4      -3.141   5.365   0.238  1.00  0.00           N  
HETATM   39  O   UNK A   4      -3.820   6.499   0.748  1.00  0.00           O  
HETATM   40  C   UNK A   4      -5.235   6.331   0.851  1.00  0.00           C  
HETATM   41  C   UNK A   4      -1.516   3.994  -0.466  1.00  0.00           C  
HETATM   42  C   UNK A   4      -1.781   5.278   0.044  1.00  0.00           C  
HETATM   43  C   UNK A   4      -0.203   3.617  -0.756  1.00  0.00           C  
HETATM   44  C   UNK A   4       0.819   4.498  -0.538  1.00  0.00           C  
HETATM   45  C   UNK A   4       0.563   5.765  -0.032  1.00  0.00           C  
HETATM   46  C   UNK A   4      -0.725   6.160   0.254  1.00  0.00           C  
ATOM     47  H   ILE A   1      -3.824  -1.261   1.389  1.00  0.00           H  
ATOM     48  HA  ILE A   1      -3.399  -3.528   0.875  1.00  0.00           H  
ATOM     49  HB  ILE A   1      -3.259  -2.382  -1.954  1.00  0.00           H  
ATOM     50 HG11 ILE A   1      -5.394  -4.055  -0.558  1.00  0.00           H  
ATOM     51 HG12 ILE A   1      -5.486  -2.293  -0.794  1.00  0.00           H  
ATOM     52 HD11 ILE A   1      -6.725  -3.495  -2.574  1.00  0.00           H  
ATOM     53 HD12 ILE A   1      -5.333  -2.614  -3.248  1.00  0.00           H  
ATOM     54 HD13 ILE A   1      -5.242  -4.376  -3.012  1.00  0.00           H  
ATOM     55 HG21 ILE A   1      -3.368  -5.288  -1.029  1.00  0.00           H  
ATOM     56 HG22 ILE A   1      -3.327  -4.713  -2.713  1.00  0.00           H  
ATOM     57 HG23 ILE A   1      -1.914  -4.476  -1.658  1.00  0.00           H  
ATOM     58  HE1 LYS A   2      -2.530  -5.140   0.061  1.00  0.00           H  
ATOM     59  HE2 LYS A   2      -1.242  -5.652  -1.055  1.00  0.00           H  
ATOM     60  HD1 LYS A   2      -1.263  -5.923   1.980  1.00  0.00           H  
ATOM     61  HD2 LYS A   2      -1.317  -7.237   0.781  1.00  0.00           H  
ATOM     62  HG1 LYS A   2       0.968  -6.984   1.686  1.00  0.00           H  
ATOM     63  HG2 LYS A   2       0.932  -6.559  -0.043  1.00  0.00           H  
ATOM     64  HB1 LYS A   2       0.769  -4.564   2.262  1.00  0.00           H  
ATOM     65  HB2 LYS A   2       2.227  -4.898   1.296  1.00  0.00           H  
ATOM     66  HA  LYS A   2       1.117  -4.123  -0.738  1.00  0.00           H  
HETATM   67  H   UNK A   3       0.033  -2.418   2.398  1.00  0.00           H  
HETATM   68  H   UNK A   3       0.622  -0.016   2.623  1.00  0.00           H  
HETATM   69  H   UNK A   3       1.051  -0.418  -0.366  1.00  0.00           H  
HETATM   70  H   UNK A   3       0.955   1.195   0.380  1.00  0.00           H  
HETATM   71  H   UNK A   3       2.852   0.689   1.832  1.00  0.00           H  
HETATM   72  H   UNK A   3       2.897  -0.992   1.248  1.00  0.00           H  
HETATM   73  H   UNK A   3       3.392  -0.182  -1.043  1.00  0.00           H  
HETATM   74  H   UNK A   3       3.348   1.498  -0.459  1.00  0.00           H  
HETATM   75  H   UNK A   3       5.218   1.008   1.094  1.00  0.00           H  
HETATM   76  H   UNK A   3       5.262  -0.673   0.510  1.00  0.00           H  
HETATM   77  H   UNK A   3       5.758   0.136  -1.781  1.00  0.00           H  
HETATM   78  H   UNK A   3       5.714   1.817  -1.196  1.00  0.00           H  
HETATM   79  H   UNK A   3       7.560  -1.310  -0.859  1.00  0.00           H  
HETATM   80  H   UNK A   3       8.124   0.455  -2.518  1.00  0.00           H  
HETATM   81  H   UNK A   3       8.080   2.136  -1.934  1.00  0.00           H  
HETATM   82  H   UNK A   3      10.411   1.300  -2.065  1.00  0.00           H  
HETATM   83  H   UNK A   3       9.950   1.645  -0.381  1.00  0.00           H  
HETATM   84  H   UNK A   3       9.994  -0.036  -0.965  1.00  0.00           H  
HETATM   85  H   UNK A   3       7.460   2.463   0.453  1.00  0.00           H  
HETATM   86  H   UNK A   4      -0.795   1.502   0.104  1.00  0.00           H  
HETATM   87  H   UNK A   4      -3.491   1.221   0.926  1.00  0.00           H  
HETATM   88  H   UNK A   4      -2.359   1.695  -1.872  1.00  0.00           H  
HETATM   89  H   UNK A   4      -4.082   1.851  -1.453  1.00  0.00           H  
HETATM   90  H   UNK A   4      -4.801   3.995  -0.085  1.00  0.00           H  
HETATM   91  H   UNK A   4      -5.650   6.125  -0.135  1.00  0.00           H  
HETATM   92  H   UNK A   4      -5.454   5.498   1.519  1.00  0.00           H  
HETATM   93  H   UNK A   4      -5.681   7.243   1.250  1.00  0.00           H  
HETATM   94  H   UNK A   4       0.004   2.633  -1.150  1.00  0.00           H  
HETATM   95  H   UNK A   4       1.835   4.206  -0.762  1.00  0.00           H  
HETATM   96  H   UNK A   4       1.382   6.449   0.135  1.00  0.00           H  
HETATM   97  H   UNK A   4      -0.914   7.147   0.649  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1   34    3                                       
CONECT    3    2    4   47                                            
CONECT    4    9    3    5   48                                       
CONECT    5    4    8    6   49                                       
CONECT    6    5    7   50   51                                       
CONECT    7    6   52   53   54                                       
CONECT    8    5   55   56   57                                       
CONECT    9   11   10   10    4                                       
CONECT   10    9    9                                                 
CONECT   11   12   16    9                                            
CONECT   12   13   11   58   59                                       
CONECT   13   12   14   60   61                                       
CONECT   14   13   15   62   63                                       
CONECT   15   14   16   64   65                                       
CONECT   16   17   11   15   66                                       
CONECT   17   18   18   19   16                                       
CONECT   18   17   17                                                 
CONECT   19   20   17   67                                            
CONECT   20   31   19   21   68                                       
CONECT   21   20   22   69   70                                       
CONECT   22   21   23   71   72                                       
CONECT   23   22   24   73   74                                       
CONECT   24   23   25   75   76                                       
CONECT   25   26   24   77   78                                       
CONECT   26   30   27   25   28                                       
CONECT   27   26   79                                                 
CONECT   28   26   29   80   81                                       
CONECT   29   28   82   83   84                                       
CONECT   30   26   85                                                 
CONECT   31   32   32   20   33                                       
CONECT   32   31   31                                                 
CONECT   33   31   34   86                                            
CONECT   34   33    2   35   87                                       
CONECT   35   34   36   88   89                                       
CONECT   36   35   37   37   41                                       
CONECT   37   36   36   38   90                                       
CONECT   38   37   39   42                                            
CONECT   39   40   38                                                 
CONECT   40   39   91   92   93                                       
CONECT   41   36   42   42   43                                       
CONECT   42   38   41   41   46                                       
CONECT   43   41   44   44   94                                       
CONECT   44   43   43   45   95                                       
CONECT   45   46   46   44   96                                       
CONECT   46   42   45   45   97                                       
CONECT   47    3                                                      
CONECT   48    4                                                      
CONECT   49    5                                                      
CONECT   50    6                                                      
CONECT   51    6                                                      
CONECT   52    7                                                      
CONECT   53    7                                                      
CONECT   54    7                                                      
CONECT   55    8                                                      
CONECT   56    8                                                      
CONECT   57    8                                                      
CONECT   58   12                                                      
CONECT   59   12                                                      
CONECT   60   13                                                      
CONECT   61   13                                                      
CONECT   62   14                                                      
CONECT   63   14                                                      
CONECT   64   15                                                      
CONECT   65   15                                                      
CONECT   66   16                                                      
CONECT   67   19                                                      
CONECT   68   20                                                      
CONECT   69   21                                                      
CONECT   70   21                                                      
CONECT   71   22                                                      
CONECT   72   22                                                      
CONECT   73   23                                                      
CONECT   74   23                                                      
CONECT   75   24                                                      
CONECT   76   24                                                      
CONECT   77   25                                                      
CONECT   78   25                                                      
CONECT   79   27                                                      
CONECT   80   28                                                      
CONECT   81   28                                                      
CONECT   82   29                                                      
CONECT   83   29                                                      
CONECT   84   29                                                      
CONECT   85   30                                                      
CONECT   86   33                                                      
CONECT   87   34                                                      
CONECT   88   35                                                      
CONECT   89   35                                                      
CONECT   90   37                                                      
CONECT   91   40                                                      
CONECT   92   40                                                      
CONECT   93   40                                                      
CONECT   94   43                                                      
CONECT   95   44                                                      
CONECT   96   45                                                      
CONECT   97   46                                                      
MASTER        0    0    0    0    0    0    0    0   97    0   97    0
END
