COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK A   0      -2.221   0.376   5.462  1.00  0.00           N  
HETATM    2  C   UNK A   0      -3.348   0.038   4.867  1.00  0.00           C  
HETATM    3  N   UNK A   0      -4.545   0.379   5.469  1.00  0.00           N  
HETATM    4  N   UNK A   0      -3.381  -0.614   3.707  1.00  0.00           N  
HETATM    5  C   UNK A   0      -2.271  -0.968   3.082  1.00  0.00           C  
HETATM    6  O   UNK A   0      -2.320  -1.630   1.904  1.00  0.00           O  
HETATM    7  C   UNK A   0      -1.030  -0.636   3.677  1.00  0.00           C  
HETATM    8  C   UNK A   0      -1.041   0.058   4.912  1.00  0.00           C  
HETATM    9  C   UNK A   0       0.175   0.396   5.519  1.00  0.00           C  
HETATM   10  C   UNK A   0       1.348   0.054   4.914  1.00  0.00           C  
HETATM   11  C   UNK A   0       2.672  -0.988   3.061  1.00  0.00           C  
HETATM   12  C   UNK A   0       3.188   0.200   2.249  1.00  0.00           C  
HETATM   13  C   UNK A   0       4.560  -0.115   1.712  1.00  0.00           C  
HETATM   14  O   UNK A   0       4.848  -1.252   1.420  1.00  0.00           O  
HETATM   15  C   UNK A   0       1.356  -0.627   3.701  1.00  0.00           C  
HETATM   16  C   UNK A   0       0.190  -0.972   3.083  1.00  0.00           C  
HETATM   17  C   UNK A   0       1.164  -0.269  -0.900  1.00  0.00           C  
HETATM   18  C   UNK A   0       0.525   0.966  -1.007  1.00  0.00           C  
HETATM   19  C   UNK A   0      -0.395   1.231  -2.133  1.00  0.00           C  
HETATM   20  O   UNK A   0      -0.950   2.309  -2.223  1.00  0.00           O  
HETATM   21  C   UNK A   0       0.759   1.951  -0.046  1.00  0.00           C  
HETATM   22  C   UNK A   0       1.619   1.698   1.001  1.00  0.00           C  
HETATM   23  C   UNK A   0       2.249   0.470   1.101  1.00  0.00           C  
HETATM   24  C   UNK A   0       2.026  -0.508   0.150  1.00  0.00           C  
ATOM     25  N   GLU A   1      -0.619   0.278  -3.059  1.00  0.00           N  
ATOM     26  CA  GLU A   1      -1.532   0.540  -4.174  1.00  0.00           C  
ATOM     27  C   GLU A   1      -2.931   0.136  -3.785  1.00  0.00           C  
ATOM     28  O   GLU A   1      -3.880   0.713  -4.258  1.00  0.00           O  
ATOM     29  CB  GLU A   1      -1.089  -0.266  -5.396  1.00  0.00           C  
ATOM     30  CG  GLU A   1       0.330   0.143  -5.791  1.00  0.00           C  
ATOM     31  CD  GLU A   1       0.766  -0.651  -6.995  1.00  0.00           C  
ATOM     32  OE1 GLU A   1       0.018  -1.463  -7.486  1.00  0.00           O  
ATOM     33  OE2 GLU A   1       1.985  -0.457  -7.521  1.00  0.00           O  
ATOM     34  OXT GLU A   1      -3.121  -0.865  -2.912  1.00  0.00           O  
HETATM   35  O   UNK A   0       5.463   0.865   1.557  1.00  0.00           O  
HETATM   36  H   UNK A   0      -5.386   0.143   5.046  1.00  0.00           H  
HETATM   37  H   UNK A   0      -4.544   0.851   6.316  1.00  0.00           H  
HETATM   38  H   UNK A   0      -2.328  -0.960   1.206  1.00  0.00           H  
HETATM   39  H   UNK A   0       0.183   0.925   6.461  1.00  0.00           H  
HETATM   40  H   UNK A   0       2.284   0.317   5.383  1.00  0.00           H  
HETATM   41  H   UNK A   0       3.396  -1.241   3.836  1.00  0.00           H  
HETATM   42  H   UNK A   0       2.532  -1.845   2.402  1.00  0.00           H  
HETATM   43  H   UNK A   0       3.243   1.081   2.889  1.00  0.00           H  
HETATM   44  H   UNK A   0       0.210  -1.502   2.142  1.00  0.00           H  
HETATM   45  H   UNK A   0       0.986  -1.036  -1.640  1.00  0.00           H  
HETATM   46  H   UNK A   0       0.268   2.910  -0.123  1.00  0.00           H  
HETATM   47  H   UNK A   0       1.801   2.459   1.745  1.00  0.00           H  
HETATM   48  H   UNK A   0       2.520  -1.464   0.234  1.00  0.00           H  
ATOM     49  H   GLU A   1      -0.176  -0.581  -2.986  1.00  0.00           H  
ATOM     50  HA  GLU A   1      -1.515   1.603  -4.415  1.00  0.00           H  
ATOM     51  HB1 GLU A   1      -1.106  -1.329  -5.155  1.00  0.00           H  
ATOM     52  HB2 GLU A   1      -1.768  -0.071  -6.226  1.00  0.00           H  
ATOM     53  HG1 GLU A   1       0.347   1.206  -6.032  1.00  0.00           H  
ATOM     54  HG2 GLU A   1       1.009  -0.051  -4.961  1.00  0.00           H  
ATOM     55  HE2 GLU A   1       2.265  -0.967  -8.294  1.00  0.00           H  
ATOM     56  HXT GLU A   1      -4.018  -1.125  -2.662  1.00  0.00           H  
HETATM   57  H   UNK A   0       6.344   0.662   1.213  1.00  0.00           H  
CONECT    1    2    2    8                                            
CONECT    2    1    1    3    4                                       
CONECT    3    2   36   37                                            
CONECT    4    2    5    5                                            
CONECT    5    4    4    6    7                                       
CONECT    6    5   38                                                 
CONECT    7    5    8    8   16                                       
CONECT    8    1    7    7    9                                       
CONECT    9    8   10   10   39                                       
CONECT   10    9    9   15   40                                       
CONECT   11   12   15   41   42                                       
CONECT   12   11   13   23   43                                       
CONECT   13   12   14   14   35                                       
CONECT   14   13   13                                                 
CONECT   15   10   11   16   16                                       
CONECT   16    7   15   15   44                                       
CONECT   17   18   18   24   45                                       
CONECT   18   17   17   19   21                                       
CONECT   19   18   20   20   25                                       
CONECT   20   19   19                                                 
CONECT   21   18   22   22   46                                       
CONECT   22   21   21   23   47                                       
CONECT   23   12   22   24   24                                       
CONECT   24   17   23   23   48                                       
CONECT   25   19   26   49                                            
CONECT   26   25   27   29   50                                       
CONECT   27   26   28   28   34                                       
CONECT   28   27   27                                                 
CONECT   29   26   30   51   52                                       
CONECT   30   29   31   53   54                                       
CONECT   31   30   32   32   33                                       
CONECT   32   31   31                                                 
CONECT   33   31   55                                                 
CONECT   34   27   56                                                 
CONECT   35   13   57                                                 
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    6                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
CONECT   54   30                                                      
CONECT   55   33                                                      
CONECT   56   34                                                      
CONECT   57   35                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
