COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  CE1 PHE A   1      -0.205   3.770   1.220  1.00  0.00           C  
ATOM      2  CD1 PHE A   1       0.853   2.966   0.838  1.00  0.00           C  
ATOM      3  N   PHE A   1       0.562  -0.721  -0.611  1.00  0.00           N  
ATOM      4  CD2 PHE A   1      -0.399   2.222  -1.062  1.00  0.00           C  
HETATM    5  N   UNK A   0      -8.846  -0.674   0.134  1.00  0.00           N1+
ATOM      6  CZ  PHE A   1      -1.360   3.800   0.461  1.00  0.00           C  
ATOM      7  CA  THR A   2       5.374  -1.302  -0.309  1.00  0.00           C  
ATOM      8  C   THR A   2       5.545  -2.360   0.750  1.00  0.00           C  
ATOM      9  CB  THR A   2       6.614  -0.407  -0.343  1.00  0.00           C  
ATOM     10  O   THR A   2       4.763  -2.428   1.668  1.00  0.00           O  
ATOM     11  OG1 THR A   2       6.852   0.126   0.961  1.00  0.00           O  
ATOM     12  CG2 THR A   2       6.389   0.740  -1.330  1.00  0.00           C  
ATOM     13  N   THR A   2       4.194  -0.490  -0.002  1.00  0.00           N  
ATOM     14  C   PHE A   1       2.972  -0.900  -0.396  1.00  0.00           C  
ATOM     15  O   PHE A   1       2.849  -1.941  -1.005  1.00  0.00           O  
ATOM     16  CA  PHE A   1       1.758  -0.064  -0.080  1.00  0.00           C  
ATOM     17  CB  PHE A   1       1.909   1.317  -0.720  1.00  0.00           C  
HETATM   18  C   UNK A   0      -0.643  -0.476  -0.058  1.00  0.00           C  
ATOM     19  CG  PHE A   1       0.756   2.193  -0.303  1.00  0.00           C  
ATOM     20  CE2 PHE A   1      -1.455   3.030  -0.683  1.00  0.00           C  
HETATM   21  C   UNK A   0      -1.874  -1.151  -0.605  1.00  0.00           C  
HETATM   22  C   UNK A   0      -3.099  -0.704   0.195  1.00  0.00           C  
HETATM   23  C   UNK A   0      -4.349  -1.389  -0.360  1.00  0.00           C  
HETATM   24  C   UNK A   0      -5.574  -0.942   0.440  1.00  0.00           C  
HETATM   25  C   UNK A   0      -6.824  -1.627  -0.115  1.00  0.00           C  
HETATM   26  N   UNK A   0      -7.997  -1.199   0.651  1.00  0.00           N  
HETATM   27  N   UNK A   0      -9.694  -0.150  -0.384  1.00  0.00           N1-
HETATM   28  O   UNK A   0      -0.736   0.288   0.879  1.00  0.00           O  
ATOM     29  HE1 PHE A   1      -0.131   4.371   2.115  1.00  0.00           H  
ATOM     30  HD1 PHE A   1       1.755   2.943   1.431  1.00  0.00           H  
ATOM     31  H   PHE A   1       0.636  -1.332  -1.361  1.00  0.00           H  
ATOM     32  HD2 PHE A   1      -0.473   1.621  -1.956  1.00  0.00           H  
ATOM     33  HZ  PHE A   1      -2.188   4.424   0.763  1.00  0.00           H  
ATOM     34  HA  THR A   2       5.243  -1.779  -1.281  1.00  0.00           H  
ATOM     35  H   THR A   2       6.368  -3.057   0.689  1.00  0.00           H  
ATOM     36  HB  THR A   2       7.477  -0.994  -0.658  1.00  0.00           H  
ATOM     37  HG1 THR A   2       6.124   0.661   1.306  1.00  0.00           H  
ATOM     38 HG21 THR A   2       5.527   1.327  -1.015  1.00  0.00           H  
ATOM     39 HG22 THR A   2       7.273   1.377  -1.354  1.00  0.00           H  
ATOM     40 HG23 THR A   2       6.208   0.333  -2.325  1.00  0.00           H  
ATOM     41  H   THR A   2       4.292   0.343   0.485  1.00  0.00           H  
ATOM     42  HA  PHE A   1       1.664   0.045   1.001  1.00  0.00           H  
ATOM     43  HB1 PHE A   1       2.845   1.769  -0.393  1.00  0.00           H  
ATOM     44  HB2 PHE A   1       1.915   1.216  -1.805  1.00  0.00           H  
ATOM     45  HE2 PHE A   1      -2.357   3.054  -1.276  1.00  0.00           H  
HETATM   46  H   UNK A   0      -2.004  -0.878  -1.652  1.00  0.00           H  
HETATM   47  H   UNK A   0      -1.762  -2.232  -0.523  1.00  0.00           H  
HETATM   48  H   UNK A   0      -2.969  -0.977   1.242  1.00  0.00           H  
HETATM   49  H   UNK A   0      -3.211   0.378   0.113  1.00  0.00           H  
HETATM   50  H   UNK A   0      -4.479  -1.116  -1.407  1.00  0.00           H  
HETATM   51  H   UNK A   0      -4.237  -2.470  -0.278  1.00  0.00           H  
HETATM   52  H   UNK A   0      -5.444  -1.215   1.487  1.00  0.00           H  
HETATM   53  H   UNK A   0      -5.686   0.140   0.359  1.00  0.00           H  
HETATM   54  H   UNK A   0      -6.954  -1.354  -1.162  1.00  0.00           H  
HETATM   55  H   UNK A   0      -6.712  -2.708  -0.033  1.00  0.00           H  
CONECT    1    2    2    6   29                                       
CONECT    2    1    1   19   30                                       
CONECT    3   18   16   31                                            
CONECT    4   19   19   20   32                                       
CONECT    5   26   26   27   27                                       
CONECT    6    1   20   20   33                                       
CONECT    7   13    8    9   34                                       
CONECT    8   10   10    7   35                                       
CONECT    9    7   11   12   36                                       
CONECT   10    8    8                                                 
CONECT   11    9   37                                                 
CONECT   12    9   38   39   40                                       
CONECT   13   14    7   41                                            
CONECT   14   16   15   15   13                                       
CONECT   15   14   14                                                 
CONECT   16    3   17   14   42                                       
CONECT   17   19   16   43   44                                       
CONECT   18   21   28   28    3                                       
CONECT   19    2   17    4    4                                       
CONECT   20    6    6    4   45                                       
CONECT   21   22   18   46   47                                       
CONECT   22   23   21   48   49                                       
CONECT   23   24   22   50   51                                       
CONECT   24   25   23   52   53                                       
CONECT   25   26   24   54   55                                       
CONECT   26   25    5    5                                            
CONECT   27    5    5                                                 
CONECT   28   18   18                                                 
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   25                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
