COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  N   ALA A   1       3.965  -1.950   0.065  1.00  0.00           N  
ATOM      2  CA  ALA A   1       2.673  -2.320  -0.517  1.00  0.00           C  
ATOM      3  C   ALA A   1       1.803  -1.095  -0.630  1.00  0.00           C  
ATOM      4  O   ALA A   1       2.221  -0.018  -0.259  1.00  0.00           O  
ATOM      5  CB  ALA A   1       1.986  -3.353   0.379  1.00  0.00           C  
ATOM      6  N   LEU A   2       0.560  -1.195  -1.142  1.00  0.00           N  
HETATM    7  C   UNK A   0       0.055  -2.495  -1.589  1.00  0.00           C  
ATOM      8  CA  LEU A   2      -0.285  -0.004  -1.251  1.00  0.00           C  
ATOM      9  CB  LEU A   2      -0.728   0.176  -2.704  1.00  0.00           C  
ATOM     10  CG  LEU A   2       0.499   0.429  -3.583  1.00  0.00           C  
ATOM     11  CD1 LEU A   2       0.072   0.481  -5.052  1.00  0.00           C  
ATOM     12  CD2 LEU A   2       1.141   1.761  -3.192  1.00  0.00           C  
ATOM     13  C   LEU A   2      -1.499  -0.167  -0.373  1.00  0.00           C  
ATOM     14  O   LEU A   2      -1.644  -1.179   0.280  1.00  0.00           O  
ATOM     15  N   TYR A   3      -2.424   0.812  -0.313  1.00  0.00           N  
ATOM     16  CA  TYR A   3      -3.604   0.653   0.541  1.00  0.00           C  
ATOM     17  C   TYR A   3      -4.727   1.506   0.010  1.00  0.00           C  
ATOM     18  O   TYR A   3      -4.558   2.181  -0.984  1.00  0.00           O  
ATOM     19  CB  TYR A   3      -3.263   1.089   1.968  1.00  0.00           C  
ATOM     20  CG  TYR A   3      -2.227   0.158   2.543  1.00  0.00           C  
ATOM     21  CD1 TYR A   3      -0.883   0.439   2.383  1.00  0.00           C  
ATOM     22  CD2 TYR A   3      -2.622  -0.972   3.235  1.00  0.00           C  
ATOM     23  CE1 TYR A   3       0.069  -0.412   2.910  1.00  0.00           C  
ATOM     24  CE2 TYR A   3      -1.674  -1.826   3.764  1.00  0.00           C  
ATOM     25  CZ  TYR A   3      -0.324  -1.550   3.600  1.00  0.00           C  
ATOM     26  OH  TYR A   3       0.610  -2.389   4.118  1.00  0.00           O  
ATOM     27  N   TYR A   4      -5.918   1.520   0.639  1.00  0.00           N  
ATOM     28  CA  TYR A   4      -7.010   2.350   0.123  1.00  0.00           C  
ATOM     29  C   TYR A   4      -6.873   3.751   0.659  1.00  0.00           C  
ATOM     30  O   TYR A   4      -5.958   4.029   1.397  1.00  0.00           O  
ATOM     31  CB  TYR A   4      -8.351   1.762   0.567  1.00  0.00           C  
ATOM     32  CG  TYR A   4      -8.542   0.410  -0.070  1.00  0.00           C  
ATOM     33  CD1 TYR A   4      -8.093  -0.727   0.576  1.00  0.00           C  
ATOM     34  CD2 TYR A   4      -9.172   0.307  -1.296  1.00  0.00           C  
ATOM     35  CE1 TYR A   4      -8.267  -1.968  -0.005  1.00  0.00           C  
ATOM     36  CE2 TYR A   4      -9.349  -0.932  -1.882  1.00  0.00           C  
ATOM     37  CZ  TYR A   4      -8.894  -2.073  -1.238  1.00  0.00           C  
ATOM     38  OH  TYR A   4      -9.066  -3.293  -1.813  1.00  0.00           O  
ATOM     39  OXT TYR A   4      -7.768   4.691   0.317  1.00  0.00           O  
HETATM   40  C   UNK A   0      13.659   4.533   0.476  1.00  0.00           C  
HETATM   41  C   UNK A   0      12.255   4.206  -0.036  1.00  0.00           C  
HETATM   42  C   UNK A   0      11.853   2.807   0.434  1.00  0.00           C  
HETATM   43  C   UNK A   0      10.449   2.480  -0.078  1.00  0.00           C  
HETATM   44  C   UNK A   0      10.048   1.081   0.393  1.00  0.00           C  
HETATM   45  C   UNK A   0       8.644   0.754  -0.119  1.00  0.00           C  
HETATM   46  C   UNK A   0       8.242  -0.646   0.351  1.00  0.00           C  
HETATM   47  C   UNK A   0       6.838  -0.973  -0.161  1.00  0.00           C  
HETATM   48  N   UNK A   0       6.857  -1.046  -1.628  1.00  0.00           N  
HETATM   49  C   UNK A   0       6.386  -2.318   0.412  1.00  0.00           C  
HETATM   50  O   UNK A   0       7.356  -3.319   0.096  1.00  0.00           O  
HETATM   51  C   UNK A   0       5.057  -2.698  -0.188  1.00  0.00           C  
HETATM   52  O   UNK A   0       4.970  -3.677  -0.898  1.00  0.00           O  
ATOM     53  H   ALA A   1       4.035  -1.165   0.630  1.00  0.00           H  
ATOM     54  HA  ALA A   1       2.830  -2.746  -1.508  1.00  0.00           H  
ATOM     55  HB1 ALA A   1       1.829  -2.927   1.370  1.00  0.00           H  
ATOM     56  HB2 ALA A   1       1.024  -3.628  -0.055  1.00  0.00           H  
ATOM     57  HB3 ALA A   1       2.615  -4.239   0.460  1.00  0.00           H  
HETATM   58  H   UNK A   0      -0.444  -2.996  -0.759  1.00  0.00           H  
HETATM   59  H   UNK A   0      -0.654  -2.349  -2.404  1.00  0.00           H  
HETATM   60  H   UNK A   0       0.887  -3.108  -1.937  1.00  0.00           H  
ATOM     61  HA  LEU A   2       0.279   0.873  -0.932  1.00  0.00           H  
ATOM     62  HB1 LEU A   2      -1.238  -0.725  -3.043  1.00  0.00           H  
ATOM     63  HB2 LEU A   2      -1.407   1.026  -2.775  1.00  0.00           H  
ATOM     64  HG  LEU A   2       1.219  -0.377  -3.442  1.00  0.00           H  
ATOM     65 HD11 LEU A   2      -0.709   1.230  -5.177  1.00  0.00           H  
ATOM     66 HD12 LEU A   2       0.930   0.743  -5.670  1.00  0.00           H  
ATOM     67 HD13 LEU A   2      -0.309  -0.495  -5.354  1.00  0.00           H  
ATOM     68 HD21 LEU A   2       1.445   1.724  -2.146  1.00  0.00           H  
ATOM     69 HD22 LEU A   2       2.015   1.941  -3.818  1.00  0.00           H  
ATOM     70 HD23 LEU A   2       0.421   2.567  -3.333  1.00  0.00           H  
ATOM     71  H   TYR A   3      -2.308   1.621  -0.835  1.00  0.00           H  
ATOM     72  HA  TYR A   3      -3.912  -0.392   0.544  1.00  0.00           H  
ATOM     73  HB1 TYR A   3      -2.871   2.105   1.953  1.00  0.00           H  
ATOM     74  HB2 TYR A   3      -4.163   1.055   2.582  1.00  0.00           H  
ATOM     75  HD1 TYR A   3      -0.577   1.325   1.846  1.00  0.00           H  
ATOM     76  HD2 TYR A   3      -3.673  -1.187   3.362  1.00  0.00           H  
ATOM     77  HE1 TYR A   3       1.119  -0.192   2.785  1.00  0.00           H  
ATOM     78  HE2 TYR A   3      -1.983  -2.708   4.305  1.00  0.00           H  
ATOM     79  HH  TYR A   3       0.875  -2.172   5.023  1.00  0.00           H  
ATOM     80  H   TYR A   4      -6.054   0.981   1.434  1.00  0.00           H  
ATOM     81  HA  TYR A   4      -6.966   2.372  -0.966  1.00  0.00           H  
ATOM     82  HB1 TYR A   4      -8.361   1.658   1.652  1.00  0.00           H  
ATOM     83  HB2 TYR A   4      -9.159   2.426   0.259  1.00  0.00           H  
ATOM     84  HD1 TYR A   4      -7.605  -0.645   1.536  1.00  0.00           H  
ATOM     85  HD2 TYR A   4      -9.527   1.196  -1.797  1.00  0.00           H  
ATOM     86  HE1 TYR A   4      -7.916  -2.856   0.500  1.00  0.00           H  
ATOM     87  HE2 TYR A   4      -9.842  -1.011  -2.840  1.00  0.00           H  
ATOM     88  HH  TYR A   4      -9.898  -3.726  -1.575  1.00  0.00           H  
ATOM     89  HXT TYR A   4      -7.639   5.576   0.686  1.00  0.00           H  
HETATM   90  H   UNK A   0      14.367   3.802   0.086  1.00  0.00           H  
HETATM   91  H   UNK A   0      13.945   5.530   0.140  1.00  0.00           H  
HETATM   92  H   UNK A   0      13.665   4.501   1.565  1.00  0.00           H  
HETATM   93  H   UNK A   0      11.547   4.938   0.353  1.00  0.00           H  
HETATM   94  H   UNK A   0      12.249   4.239  -1.126  1.00  0.00           H  
HETATM   95  H   UNK A   0      12.562   2.076   0.045  1.00  0.00           H  
HETATM   96  H   UNK A   0      11.860   2.774   1.524  1.00  0.00           H  
HETATM   97  H   UNK A   0       9.741   3.211   0.311  1.00  0.00           H  
HETATM   98  H   UNK A   0      10.443   2.513  -1.168  1.00  0.00           H  
HETATM   99  H   UNK A   0      10.756   0.349   0.003  1.00  0.00           H  
HETATM  100  H   UNK A   0      10.054   1.048   1.482  1.00  0.00           H  
HETATM  101  H   UNK A   0       7.935   1.485   0.270  1.00  0.00           H  
HETATM  102  H   UNK A   0       8.637   0.786  -1.209  1.00  0.00           H  
HETATM  103  H   UNK A   0       8.950  -1.377  -0.038  1.00  0.00           H  
HETATM  104  H   UNK A   0       8.248  -0.678   1.441  1.00  0.00           H  
HETATM  105  H   UNK A   0       6.145  -0.192   0.155  1.00  0.00           H  
HETATM  106  H   UNK A   0       7.089  -0.152  -2.032  1.00  0.00           H  
HETATM  107  H   UNK A   0       7.492  -1.763  -1.946  1.00  0.00           H  
HETATM  108  H   UNK A   0       7.496  -3.445  -0.852  1.00  0.00           H  
HETATM  109  H   UNK A   0       6.287  -2.237   1.494  1.00  0.00           H  
CONECT    1    2   53   51                                            
CONECT    2    1    3    5   54                                       
CONECT    3    2    4    4    6                                       
CONECT    4    3    3                                                 
CONECT    5    2   55   56   57                                       
CONECT    6    7    8    3                                            
CONECT    7    6   58   59   60                                       
CONECT    8    6    9   13   61                                       
CONECT    9    8   10   62   63                                       
CONECT   10    9   11   12   64                                       
CONECT   11   10   65   66   67                                       
CONECT   12   10   68   69   70                                       
CONECT   13    8   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   16   71   13                                            
CONECT   16   15   17   19   72                                       
CONECT   17   16   18   18   27                                       
CONECT   18   17   17                                                 
CONECT   19   16   20   73   74                                       
CONECT   20   19   21   21   22                                       
CONECT   21   20   20   23   75                                       
CONECT   22   20   24   24   76                                       
CONECT   23   21   25   25   77                                       
CONECT   24   22   22   25   78                                       
CONECT   25   23   23   24   26                                       
CONECT   26   25   79                                                 
CONECT   27   28   80   17                                            
CONECT   28   27   29   31   81                                       
CONECT   29   28   30   30   39                                       
CONECT   30   29   29                                                 
CONECT   31   28   32   82   83                                       
CONECT   32   31   33   33   34                                       
CONECT   33   32   32   35   84                                       
CONECT   34   32   36   36   85                                       
CONECT   35   33   37   37   86                                       
CONECT   36   34   34   37   87                                       
CONECT   37   35   35   36   38                                       
CONECT   38   37   88                                                 
CONECT   39   29   89                                                 
CONECT   40   41   90   91   92                                       
CONECT   41   40   42   93   94                                       
CONECT   42   41   43   95   96                                       
CONECT   43   42   44   97   98                                       
CONECT   44   43   45   99  100                                       
CONECT   45   44   46  101  102                                       
CONECT   46   45   47  103  104                                       
CONECT   47   46  105   48   49                                       
CONECT   48   47  106  107                                            
CONECT   49   47  109   50   51                                       
CONECT   50   49  108                                                 
CONECT   51   49   52   52    1                                       
CONECT   52   51   51                                                 
CONECT   53    1                                                      
CONECT   54    2                                                      
CONECT   55    5                                                      
CONECT   56    5                                                      
CONECT   57    5                                                      
CONECT   58    7                                                      
CONECT   59    7                                                      
CONECT   60    7                                                      
CONECT   61    8                                                      
CONECT   62    9                                                      
CONECT   63    9                                                      
CONECT   64   10                                                      
CONECT   65   11                                                      
CONECT   66   11                                                      
CONECT   67   11                                                      
CONECT   68   12                                                      
CONECT   69   12                                                      
CONECT   70   12                                                      
CONECT   71   15                                                      
CONECT   72   16                                                      
CONECT   73   19                                                      
CONECT   74   19                                                      
CONECT   75   21                                                      
CONECT   76   22                                                      
CONECT   77   23                                                      
CONECT   78   24                                                      
CONECT   79   26                                                      
CONECT   80   27                                                      
CONECT   81   28                                                      
CONECT   82   31                                                      
CONECT   83   31                                                      
CONECT   84   33                                                      
CONECT   85   34                                                      
CONECT   86   35                                                      
CONECT   87   36                                                      
CONECT   88   38                                                      
CONECT   89   39                                                      
CONECT   90   40                                                      
CONECT   91   40                                                      
CONECT   92   40                                                      
CONECT   93   41                                                      
CONECT   94   41                                                      
CONECT   95   42                                                      
CONECT   96   42                                                      
CONECT   97   43                                                      
CONECT   98   43                                                      
CONECT   99   44                                                      
CONECT  100   44                                                      
CONECT  101   45                                                      
CONECT  102   45                                                      
CONECT  103   46                                                      
CONECT  104   46                                                      
CONECT  105   47                                                      
CONECT  106   48                                                      
CONECT  107   48                                                      
CONECT  108   50                                                      
CONECT  109   49                                                      
MASTER        0    0    0    0    0    0    0    0  109    0  109    0
END
