COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  N   TYR A   1      -2.914  -1.050  -0.582  1.00  0.00           N  
HETATM    2  C   UNK A   0      -1.705  -1.082   0.011  1.00  0.00           C  
HETATM    3  O   UNK A   0      -1.603  -1.457   1.160  1.00  0.00           O  
HETATM    4  C   UNK A   0      -0.479  -0.651  -0.752  1.00  0.00           C  
HETATM    5  C   UNK A   0       0.753  -0.782   0.145  1.00  0.00           C  
HETATM    6  C   UNK A   0       1.998  -0.345  -0.630  1.00  0.00           C  
HETATM    7  C   UNK A   0       3.230  -0.476   0.268  1.00  0.00           C  
HETATM    8  C   UNK A   0       4.474  -0.039  -0.507  1.00  0.00           C  
HETATM    9  C   UNK A   0       5.706  -0.170   0.390  1.00  0.00           C  
HETATM   10  C   UNK A   0       6.951   0.267  -0.385  1.00  0.00           C  
HETATM   11  C   UNK A   0       8.183   0.136   0.513  1.00  0.00           C  
HETATM   12  C   UNK A   0       9.428   0.573  -0.263  1.00  0.00           C  
HETATM   13  C   UNK A   0      10.660   0.441   0.635  1.00  0.00           C  
HETATM   14  C   UNK A   0      11.904   0.879  -0.140  1.00  0.00           C  
ATOM     15  CA  TYR A   1      -4.106  -1.469   0.160  1.00  0.00           C  
ATOM     16  CB  TYR A   1      -5.342  -0.791  -0.436  1.00  0.00           C  
ATOM     17  CG  TYR A   1      -5.246   0.699  -0.229  1.00  0.00           C  
ATOM     18  CD1 TYR A   1      -5.774   1.272   0.913  1.00  0.00           C  
ATOM     19  CE1 TYR A   1      -5.682   2.637   1.107  1.00  0.00           C  
ATOM     20  CZ  TYR A   1      -5.071   3.433   0.150  1.00  0.00           C  
ATOM     21  CE2 TYR A   1      -4.548   2.856  -0.998  1.00  0.00           C  
ATOM     22  CD2 TYR A   1      -4.637   1.490  -1.185  1.00  0.00           C  
ATOM     23  OH  TYR A   1      -4.985   4.777   0.336  1.00  0.00           O  
ATOM     24  C   TYR A   1      -4.258  -2.965   0.063  1.00  0.00           C  
ATOM     25  O   TYR A   1      -5.287  -3.576   0.671  1.00  0.00           O  
ATOM     26  OXT TYR A   1      -3.454  -3.615  -0.561  1.00  0.00           O  
ATOM     27  H   TYR A   1      -2.996  -0.750  -1.501  1.00  0.00           H  
HETATM   28  H   UNK A   0      -0.592   0.387  -1.065  1.00  0.00           H  
HETATM   29  H   UNK A   0      -0.357  -1.284  -1.631  1.00  0.00           H  
HETATM   30  H   UNK A   0       0.866  -1.820   0.458  1.00  0.00           H  
HETATM   31  H   UNK A   0       0.631  -0.149   1.024  1.00  0.00           H  
HETATM   32  H   UNK A   0       1.885   0.693  -0.943  1.00  0.00           H  
HETATM   33  H   UNK A   0       2.119  -0.978  -1.509  1.00  0.00           H  
HETATM   34  H   UNK A   0       3.342  -1.514   0.581  1.00  0.00           H  
HETATM   35  H   UNK A   0       3.108   0.157   1.147  1.00  0.00           H  
HETATM   36  H   UNK A   0       4.361   0.999  -0.820  1.00  0.00           H  
HETATM   37  H   UNK A   0       4.596  -0.672  -1.386  1.00  0.00           H  
HETATM   38  H   UNK A   0       5.819  -1.208   0.703  1.00  0.00           H  
HETATM   39  H   UNK A   0       5.585   0.463   1.269  1.00  0.00           H  
HETATM   40  H   UNK A   0       6.838   1.305  -0.698  1.00  0.00           H  
HETATM   41  H   UNK A   0       7.073  -0.366  -1.264  1.00  0.00           H  
HETATM   42  H   UNK A   0       8.296  -0.903   0.825  1.00  0.00           H  
HETATM   43  H   UNK A   0       8.061   0.769   1.391  1.00  0.00           H  
HETATM   44  H   UNK A   0       9.315   1.611  -0.575  1.00  0.00           H  
HETATM   45  H   UNK A   0       9.549  -0.061  -1.141  1.00  0.00           H  
HETATM   46  H   UNK A   0      10.772  -0.597   0.948  1.00  0.00           H  
HETATM   47  H   UNK A   0      10.538   1.075   1.514  1.00  0.00           H  
HETATM   48  H   UNK A   0      12.782   0.785   0.499  1.00  0.00           H  
HETATM   49  H   UNK A   0      12.026   0.245  -1.019  1.00  0.00           H  
HETATM   50  H   UNK A   0      11.791   1.917  -0.453  1.00  0.00           H  
ATOM     51  HA  TYR A   1      -4.002  -1.181   1.206  1.00  0.00           H  
ATOM     52  HB1 TYR A   1      -5.396  -1.007  -1.503  1.00  0.00           H  
ATOM     53  HB2 TYR A   1      -6.237  -1.170   0.058  1.00  0.00           H  
ATOM     54  HD1 TYR A   1      -6.250   0.652   1.658  1.00  0.00           H  
ATOM     55  HE1 TYR A   1      -6.090   3.084   2.002  1.00  0.00           H  
ATOM     56  HE2 TYR A   1      -4.071   3.474  -1.744  1.00  0.00           H  
ATOM     57  HD2 TYR A   1      -4.230   1.040  -2.078  1.00  0.00           H  
ATOM     58  HH  TYR A   1      -5.781   5.164  -0.053  1.00  0.00           H  
ATOM     59  H   TYR A   1      -5.385  -4.536   0.610  1.00  0.00           H  
CONECT    1    2   15   27                                            
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   28   29                                       
CONECT    5    4    6   30   31                                       
CONECT    6    5    7   32   33                                       
CONECT    7    6    8   34   35                                       
CONECT    8    7    9   36   37                                       
CONECT    9    8   10   38   39                                       
CONECT   10    9   11   40   41                                       
CONECT   11   10   12   42   43                                       
CONECT   12   11   13   44   45                                       
CONECT   13   12   14   46   47                                       
CONECT   14   13   48   49   50                                       
CONECT   15    1   16   24   51                                       
CONECT   16   15   17   52   53                                       
CONECT   17   16   18   22   22                                       
CONECT   18   17   19   19   54                                       
CONECT   19   18   18   20   55                                       
CONECT   20   19   21   21   23                                       
CONECT   21   20   20   22   56                                       
CONECT   22   17   17   21   57                                       
CONECT   23   20   58                                                 
CONECT   24   15   25   26   26                                       
CONECT   25   24   59                                                 
CONECT   26   24   24                                                 
CONECT   27    1                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   21                                                      
CONECT   57   22                                                      
CONECT   58   23                                                      
CONECT   59   25                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
