COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK A   0      -7.012  -1.406  -0.539  1.00  0.00           N  
HETATM    2  C   UNK A   0      -7.772  -0.332  -0.579  1.00  0.00           C  
HETATM    3  N   UNK A   0      -9.009  -0.409  -1.168  1.00  0.00           N  
HETATM    4  N   UNK A   0      -7.361   0.853  -0.050  1.00  0.00           N  
HETATM    5  C   UNK A   0      -6.148   0.950   0.536  1.00  0.00           C  
HETATM    6  O   UNK A   0      -5.769   2.008   1.017  1.00  0.00           O  
HETATM    7  C   UNK A   0      -5.335  -0.188   0.582  1.00  0.00           C  
HETATM    8  N   UNK A   0      -4.060  -0.141   1.186  1.00  0.00           N  
HETATM    9  C   UNK A   0      -3.111  -1.231   0.906  1.00  0.00           C  
HETATM   10  C   UNK A   0      -3.874  -2.560   0.995  1.00  0.00           C  
HETATM   11  N   UNK A   0      -5.006  -2.507   0.060  1.00  0.00           N  
HETATM   12  C   UNK A   0      -5.800  -1.371   0.026  1.00  0.00           C  
HETATM   13  C   UNK A   0      -2.529  -1.062  -0.498  1.00  0.00           C  
HETATM   14  N   UNK A   0      -1.935   0.271  -0.624  1.00  0.00           N  
HETATM   15  C   UNK A   0       2.071   0.867   0.351  1.00  0.00           C  
HETATM   16  C   UNK A   0       1.066   1.441   1.135  1.00  0.00           C  
HETATM   17  C   UNK A   0      -0.256   1.242   0.810  1.00  0.00           C  
HETATM   18  C   UNK A   0      -0.594   0.471  -0.298  1.00  0.00           C  
HETATM   19  C   UNK A   0       0.404  -0.102  -1.080  1.00  0.00           C  
HETATM   20  C   UNK A   0       1.729   0.097  -0.764  1.00  0.00           C  
HETATM   21  C   UNK A   0       3.490   1.078   0.697  1.00  0.00           C  
ATOM     22  N   GLU A   1       4.458   0.524  -0.060  1.00  0.00           N  
ATOM     23  CA  GLU A   1       5.867   0.733   0.283  1.00  0.00           C  
ATOM     24  CB  GLU A   1       6.704  -0.421  -0.272  1.00  0.00           C  
ATOM     25  CG  GLU A   1       6.306  -1.722   0.428  1.00  0.00           C  
ATOM     26  CD  GLU A   1       7.130  -2.859  -0.118  1.00  0.00           C  
ATOM     27  OE2 GLU A   1       6.952  -4.104   0.352  1.00  0.00           O  
ATOM     28  OE1 GLU A   1       7.952  -2.651  -0.979  1.00  0.00           O  
ATOM     29  C   GLU A   1       6.342   2.032  -0.317  1.00  0.00           C  
ATOM     30  O   GLU A   1       5.582   2.712  -0.964  1.00  0.00           O  
ATOM     31  OXT GLU A   1       7.610   2.432  -0.131  1.00  0.00           O  
HETATM   32  C   UNK A   0      -2.684   1.305  -1.055  1.00  0.00           C  
HETATM   33  O   UNK A   0      -2.172   2.388  -1.244  1.00  0.00           O  
HETATM   34  O   UNK A   0       3.787   1.752   1.665  1.00  0.00           O  
HETATM   35  H   UNK A   0      -9.313  -1.247  -1.548  1.00  0.00           H  
HETATM   36  H   UNK A   0      -9.578   0.376  -1.204  1.00  0.00           H  
HETATM   37  H   UNK A   0      -7.940   1.630  -0.095  1.00  0.00           H  
HETATM   38  H   UNK A   0      -3.814   0.593   1.771  1.00  0.00           H  
HETATM   39  H   UNK A   0      -2.307  -1.217   1.642  1.00  0.00           H  
HETATM   40  H   UNK A   0      -3.212  -3.383   0.724  1.00  0.00           H  
HETATM   41  H   UNK A   0      -4.243  -2.705   2.011  1.00  0.00           H  
HETATM   42  H   UNK A   0      -1.762  -1.819  -0.668  1.00  0.00           H  
HETATM   43  H   UNK A   0      -3.322  -1.177  -1.237  1.00  0.00           H  
HETATM   44  H   UNK A   0       1.328   2.040   1.995  1.00  0.00           H  
HETATM   45  H   UNK A   0      -1.033   1.685   1.416  1.00  0.00           H  
HETATM   46  H   UNK A   0       0.139  -0.697  -1.942  1.00  0.00           H  
HETATM   47  H   UNK A   0       2.503  -0.347  -1.372  1.00  0.00           H  
ATOM     48  H   GLU A   1       4.221  -0.014  -0.832  1.00  0.00           H  
ATOM     49  HA  GLU A   1       5.975   0.772   1.367  1.00  0.00           H  
ATOM     50  HB1 GLU A   1       6.527  -0.516  -1.343  1.00  0.00           H  
ATOM     51  HB2 GLU A   1       7.760  -0.222  -0.094  1.00  0.00           H  
ATOM     52  HG1 GLU A   1       6.483  -1.627   1.500  1.00  0.00           H  
ATOM     53  HG2 GLU A   1       5.249  -1.922   0.251  1.00  0.00           H  
ATOM     54  HE2 GLU A   1       7.504  -4.800  -0.029  1.00  0.00           H  
ATOM     55  HXT GLU A   1       7.868   3.272  -0.535  1.00  0.00           H  
HETATM   56  H   UNK A   0      -3.741   1.169  -1.232  1.00  0.00           H  
HETATM   57  H   UNK A   0      -5.196  -3.257  -0.526  1.00  0.00           H  
CONECT    1   12    2    2                                            
CONECT    2    1    1    4    3                                       
CONECT    3    2   35   36                                            
CONECT    4    2    5   37                                            
CONECT    5    7    4    6    6                                       
CONECT    6    5    5                                                 
CONECT    7    8   12   12    5                                       
CONECT    8    9    7   38                                            
CONECT    9   10    8   13   39                                       
CONECT   10   11    9   40   41                                       
CONECT   11   10   12   57                                            
CONECT   12   11    7    7    1                                       
CONECT   13    9   14   42   43                                       
CONECT   14   32   18   13                                            
CONECT   15   20   21   16   16                                       
CONECT   16   15   15   17   44                                       
CONECT   17   18   18   16   45                                       
CONECT   18   19   14   17   17                                       
CONECT   19   20   20   18   46                                       
CONECT   20   19   19   15   47                                       
CONECT   21   15   34   34   22                                       
CONECT   22   21   23   48                                            
CONECT   23   22   29   24   49                                       
CONECT   24   23   25   50   51                                       
CONECT   25   24   26   52   53                                       
CONECT   26   25   28   28   27                                       
CONECT   27   26   54                                                 
CONECT   28   26   26                                                 
CONECT   29   23   30   30   31                                       
CONECT   30   29   29                                                 
CONECT   31   29   55                                                 
CONECT   32   33   33   14   56                                       
CONECT   33   32   32                                                 
CONECT   34   21   21                                                 
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   25                                                      
CONECT   54   27                                                      
CONECT   55   31                                                      
CONECT   56   32                                                      
CONECT   57   11                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
