COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK A   0       2.783   2.593  -0.076  1.00  0.00           N  
HETATM    2  C   UNK A   0       3.639   2.758  -1.062  1.00  0.00           C  
HETATM    3  N   UNK A   0       4.598   1.831  -1.332  1.00  0.00           N  
HETATM    4  C   UNK A   0       4.686   0.695  -0.571  1.00  0.00           C  
HETATM    5  C   UNK A   0       3.805   0.514   0.457  1.00  0.00           C  
HETATM    6  C   UNK A   0       2.827   1.499   0.702  1.00  0.00           C  
HETATM    7  N   UNK A   0       5.649  -0.258  -0.840  1.00  0.00           N  
HETATM    8  C   UNK A   0       5.973  -1.259   0.187  1.00  0.00           C  
HETATM    9  C   UNK A   0       4.655  -1.794   0.768  1.00  0.00           C  
HETATM   10  N   UNK A   0       3.878  -0.645   1.261  1.00  0.00           N  
HETATM   11  C   UNK A   0       3.866  -2.523  -0.321  1.00  0.00           C  
HETATM   12  N   UNK A   0       2.561  -2.925   0.207  1.00  0.00           N  
HETATM   13  C   UNK A   0       1.472  -2.068   0.097  1.00  0.00           C  
HETATM   14  C   UNK A   0       1.622  -0.830  -0.521  1.00  0.00           C  
HETATM   15  C   UNK A   0       0.546   0.020  -0.632  1.00  0.00           C  
HETATM   16  C   UNK A   0      -0.699  -0.360  -0.123  1.00  0.00           C  
HETATM   17  C   UNK A   0      -0.847  -1.604   0.497  1.00  0.00           C  
HETATM   18  C   UNK A   0       0.232  -2.453   0.600  1.00  0.00           C  
HETATM   19  C   UNK A   0      -1.855   0.549  -0.240  1.00  0.00           C  
ATOM     20  N   GLU A   1      -3.055   0.181   0.251  1.00  0.00           N  
ATOM     21  CA  GLU A   1      -4.202   1.084   0.135  1.00  0.00           C  
ATOM     22  C   GLU A   1      -4.193   2.059   1.285  1.00  0.00           C  
ATOM     23  O   GLU A   1      -3.317   2.005   2.115  1.00  0.00           O  
ATOM     24  OXT GLU A   1      -5.157   2.987   1.386  1.00  0.00           O  
ATOM     25  CB  GLU A   1      -5.497   0.270   0.168  1.00  0.00           C  
ATOM     26  CG  GLU A   1      -5.565  -0.631  -1.067  1.00  0.00           C  
ATOM     27  CD  GLU A   1      -6.840  -1.432  -1.035  1.00  0.00           C  
ATOM     28  OE2 GLU A   1      -7.115  -2.296  -2.024  1.00  0.00           O  
ATOM     29  OE1 GLU A   1      -7.616  -1.297  -0.118  1.00  0.00           O  
HETATM   30  O   UNK A   0      -1.725   1.631  -0.779  1.00  0.00           O  
HETATM   31  O   UNK A   0       2.025   1.359   1.616  1.00  0.00           O  
HETATM   32  N   UNK A   0       3.562   3.889  -1.834  1.00  0.00           N  
HETATM   33  C   UNK A   0       2.403  -4.231   0.852  1.00  0.00           C  
HETATM   34  H   UNK A   0       6.535  -2.077  -0.263  1.00  0.00           H  
HETATM   35  H   UNK A   0       6.563  -0.797   0.978  1.00  0.00           H  
HETATM   36  H   UNK A   0       4.866  -2.477   1.591  1.00  0.00           H  
HETATM   37  H   UNK A   0       3.427  -0.682   2.119  1.00  0.00           H  
HETATM   38  H   UNK A   0       3.724  -1.858  -1.173  1.00  0.00           H  
HETATM   39  H   UNK A   0       4.418  -3.407  -0.639  1.00  0.00           H  
HETATM   40  H   UNK A   0       2.584  -0.537  -0.914  1.00  0.00           H  
HETATM   41  H   UNK A   0       0.663   0.981  -1.112  1.00  0.00           H  
HETATM   42  H   UNK A   0      -1.808  -1.901   0.892  1.00  0.00           H  
HETATM   43  H   UNK A   0       0.117  -3.416   1.075  1.00  0.00           H  
ATOM     44  H   GLU A   1      -3.158  -0.682   0.682  1.00  0.00           H  
ATOM     45  HA  GLU A   1      -4.141   1.631  -0.805  1.00  0.00           H  
ATOM     46  HXT GLU A   1      -5.108   3.590   2.140  1.00  0.00           H  
ATOM     47  HB1 GLU A   1      -5.517  -0.345   1.068  1.00  0.00           H  
ATOM     48  HB2 GLU A   1      -6.352   0.947   0.171  1.00  0.00           H  
ATOM     49  HG1 GLU A   1      -5.545  -0.015  -1.967  1.00  0.00           H  
ATOM     50  HG2 GLU A   1      -4.710  -1.307  -1.070  1.00  0.00           H  
ATOM     51  HE2 GLU A   1      -7.945  -2.788  -1.960  1.00  0.00           H  
HETATM   52  H   UNK A   0       2.882   4.556  -1.650  1.00  0.00           H  
HETATM   53  H   UNK A   0       4.187   4.022  -2.563  1.00  0.00           H  
HETATM   54  H   UNK A   0       2.602  -4.136   1.920  1.00  0.00           H  
HETATM   55  H   UNK A   0       1.385  -4.589   0.703  1.00  0.00           H  
HETATM   56  H   UNK A   0       3.105  -4.940   0.414  1.00  0.00           H  
HETATM   57  H   UNK A   0       5.218   1.975  -2.064  1.00  0.00           H  
HETATM   58  H   UNK A   0       6.105  -0.266  -1.695  1.00  0.00           H  
CONECT    1    2    2    6                                            
CONECT    2    3   32    1    1                                       
CONECT    3    4    2   57                                            
CONECT    4    7    3    5    5                                       
CONECT    5    4    4   10    6                                       
CONECT    6    5    1   31   31                                       
CONECT    7    8    4   58                                            
CONECT    8    7    9   34   35                                       
CONECT    9    8   11   10   36                                       
CONECT   10    9    5   37                                            
CONECT   11    9   12   38   39                                       
CONECT   12   11   33   13                                            
CONECT   13   12   18   18   14                                       
CONECT   14   13   15   15   40                                       
CONECT   15   14   14   16   41                                       
CONECT   16   17   17   15   19                                       
CONECT   17   18   16   16   42                                       
CONECT   18   13   13   17   43                                       
CONECT   19   16   30   30   20                                       
CONECT   20   19   21   44                                            
CONECT   21   20   25   22   45                                       
CONECT   22   21   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   46                                                 
CONECT   25   21   26   47   48                                       
CONECT   26   25   27   49   50                                       
CONECT   27   26   29   29   28                                       
CONECT   28   27   51                                                 
CONECT   29   27   27                                                 
CONECT   30   19   19                                                 
CONECT   31    6    6                                                 
CONECT   32    2   52   53                                            
CONECT   33   12   54   55   56                                       
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   28                                                      
CONECT   52   32                                                      
CONECT   53   32                                                      
CONECT   54   33                                                      
CONECT   55   33                                                      
CONECT   56   33                                                      
CONECT   57    3                                                      
CONECT   58    7                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
