COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNK A   0       3.325   0.472  -0.228  1.00  0.00           P  
HETATM    2  O   UNK A   0       2.630  -0.287  -1.466  1.00  0.00           O  
HETATM    3  O   UNK A   0       3.975   1.711  -0.710  1.00  0.00           O  
HETATM    4  C   UNK A   0       4.578  -0.617   0.526  1.00  0.00           C  
HETATM    5  C   UNK A   0       5.640  -0.971  -0.517  1.00  0.00           C  
HETATM    6  C   UNK A   0       6.692  -1.885   0.115  1.00  0.00           C  
HETATM    7  C   UNK A   0       7.684  -2.339  -0.957  1.00  0.00           C  
HETATM    8  C   UNK A   0       7.439  -1.121   1.211  1.00  0.00           C  
HETATM    9  N   UNK A   0       2.157   0.860   0.920  1.00  0.00           N  
HETATM   10  C   UNK A   0       1.128   1.739   0.347  1.00  0.00           C  
HETATM   11  C   UNK A   0      -0.236   1.252   0.762  1.00  0.00           C  
HETATM   12  O   UNK A   0      -0.341   0.270   1.466  1.00  0.00           O  
HETATM   13  N   UNK A   0      -1.339   1.908   0.352  1.00  0.00           N  
HETATM   14  C   UNK A   0      -2.725   1.544   0.681  1.00  0.00           C  
HETATM   15  C   UNK A   0      -3.021   0.152   0.186  1.00  0.00           C  
HETATM   16  O   UNK A   0      -2.161  -0.483  -0.388  1.00  0.00           O  
HETATM   17  C   UNK A   0      -3.646   2.560  -0.027  1.00  0.00           C  
HETATM   18  C   UNK A   0      -2.752   3.099  -1.174  1.00  0.00           C  
HETATM   19  C   UNK A   0      -1.356   3.114  -0.497  1.00  0.00           C  
ATOM     20  N   ALA A   1      -4.240  -0.388   0.381  1.00  0.00           N  
ATOM     21  CA  ALA A   1      -4.527  -1.742  -0.100  1.00  0.00           C  
ATOM     22  C   ALA A   1      -6.009  -1.889  -0.330  1.00  0.00           C  
ATOM     23  O   ALA A   1      -6.750  -0.959  -0.114  1.00  0.00           O  
ATOM     24  CB  ALA A   1      -4.069  -2.762   0.944  1.00  0.00           C  
ATOM     25  OXT ALA A   1      -6.507  -3.053  -0.775  1.00  0.00           O  
HETATM   26  H   UNK A   0       5.049  -0.104   1.364  1.00  0.00           H  
HETATM   27  H   UNK A   0       4.100  -1.530   0.881  1.00  0.00           H  
HETATM   28  H   UNK A   0       5.170  -1.484  -1.355  1.00  0.00           H  
HETATM   29  H   UNK A   0       6.119  -0.058  -0.873  1.00  0.00           H  
HETATM   30  H   UNK A   0       6.202  -2.756   0.549  1.00  0.00           H  
HETATM   31  H   UNK A   0       8.174  -1.467  -1.391  1.00  0.00           H  
HETATM   32  H   UNK A   0       8.434  -2.990  -0.507  1.00  0.00           H  
HETATM   33  H   UNK A   0       7.152  -2.883  -1.738  1.00  0.00           H  
HETATM   34  H   UNK A   0       7.929  -0.250   0.776  1.00  0.00           H  
HETATM   35  H   UNK A   0       6.732  -0.798   1.974  1.00  0.00           H  
HETATM   36  H   UNK A   0       8.188  -1.772   1.661  1.00  0.00           H  
HETATM   37  H   UNK A   0       2.184  -1.110  -1.223  1.00  0.00           H  
HETATM   38  H   UNK A   0       2.577   1.280   1.736  1.00  0.00           H  
HETATM   39  H   UNK A   0       1.277   2.756   0.708  1.00  0.00           H  
HETATM   40  H   UNK A   0       1.204   1.725  -0.741  1.00  0.00           H  
HETATM   41  H   UNK A   0      -2.875   1.594   1.760  1.00  0.00           H  
HETATM   42  H   UNK A   0      -4.530   2.064  -0.428  1.00  0.00           H  
HETATM   43  H   UNK A   0      -3.928   3.364   0.652  1.00  0.00           H  
HETATM   44  H   UNK A   0      -2.767   2.426  -2.031  1.00  0.00           H  
HETATM   45  H   UNK A   0      -3.054   4.106  -1.465  1.00  0.00           H  
HETATM   46  H   UNK A   0      -1.237   4.009   0.113  1.00  0.00           H  
HETATM   47  H   UNK A   0      -0.569   3.059  -1.250  1.00  0.00           H  
ATOM     48  H   ALA A   1      -4.927   0.119   0.841  1.00  0.00           H  
ATOM     49  HA  ALA A   1      -3.995  -1.915  -1.035  1.00  0.00           H  
ATOM     50  HB1 ALA A   1      -4.602  -2.589   1.880  1.00  0.00           H  
ATOM     51  HB2 ALA A   1      -4.283  -3.769   0.586  1.00  0.00           H  
ATOM     52  HB3 ALA A   1      -2.998  -2.656   1.111  1.00  0.00           H  
ATOM     53  HXT ALA A   1      -7.464  -3.100  -0.907  1.00  0.00           H  
CONECT    1    2    3    3    4                                       
CONECT    1    9                                                      
CONECT    2    1   37                                                 
CONECT    3    1    1                                                 
CONECT    4    1    5   26   27                                       
CONECT    5    4    6   28   29                                       
CONECT    6    5    7    8   30                                       
CONECT    7    6   31   32   33                                       
CONECT    8    6   34   35   36                                       
CONECT    9   10   38    1                                            
CONECT   10    9   11   39   40                                       
CONECT   11   10   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   14   19   11                                            
CONECT   14   13   15   17   41                                       
CONECT   15   14   16   16   20                                       
CONECT   16   15   15                                                 
CONECT   17   14   18   42   43                                       
CONECT   18   17   19   44   45                                       
CONECT   19   13   18   46   47                                       
CONECT   20   21   48   15                                            
CONECT   21   20   22   24   49                                       
CONECT   22   21   23   23   25                                       
CONECT   23   22   22                                                 
CONECT   24   21   50   51   52                                       
CONECT   25   22   53                                                 
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    2                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   14                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
