COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  OE1 GLU A   1      -4.503  -0.298   9.128  1.00  0.00           O  
ATOM      2  CD  GLU A   1      -3.283  -0.058   9.634  1.00  0.00           C  
ATOM      3  OE2 GLU A   1      -2.991  -0.477  10.729  1.00  0.00           O  
ATOM      4  CG  GLU A   1      -2.279   0.734   8.838  1.00  0.00           C  
ATOM      5  CB  GLU A   1      -0.981   0.862   9.637  1.00  0.00           C  
ATOM      6  CA  GLU A   1       0.038   1.667   8.828  1.00  0.00           C  
ATOM      7  N   GLU A   1       0.309   0.980   7.563  1.00  0.00           N  
HETATM    8  C   UNK A   0       0.647   1.691   6.469  1.00  0.00           C  
HETATM    9  O   UNK A   0       0.727   2.903   6.532  1.00  0.00           O  
HETATM   10  C   UNK A   0       0.920   0.999   5.194  1.00  0.00           C  
HETATM   11  C   UNK A   0       1.271   1.735   4.059  1.00  0.00           C  
HETATM   12  C   UNK A   0       1.526   1.087   2.872  1.00  0.00           C  
HETATM   13  C   UNK A   0       1.435  -0.299   2.801  1.00  0.00           C  
HETATM   14  C   UNK A   0       1.080  -1.035   3.928  1.00  0.00           C  
HETATM   15  C   UNK A   0       0.829  -0.393   5.120  1.00  0.00           C  
HETATM   16  N   UNK A   0       1.693  -0.952   1.598  1.00  0.00           N  
HETATM   17  C   UNK A   0       2.189  -0.264   0.551  1.00  0.00           C  
HETATM   18  O   UNK A   0       2.526   0.896   0.690  1.00  0.00           O  
HETATM   19  C   UNK A   0       2.322  -0.913  -0.753  1.00  0.00           C  
HETATM   20  C   UNK A   0       2.724  -0.196  -1.827  1.00  0.00           C  
HETATM   21  C   UNK A   0       2.753  -0.816  -3.152  1.00  0.00           C  
HETATM   22  C   UNK A   0       3.439  -1.973  -3.521  1.00  0.00           C  
HETATM   23  N   UNK A   0       3.190  -2.182  -4.826  1.00  0.00           N  
HETATM   24  C   UNK A   0       2.411  -1.239  -5.278  1.00  0.00           C  
HETATM   25  N   UNK A   0       2.119  -0.373  -4.286  1.00  0.00           N  
HETATM   26  C   UNK A   0       1.273   0.817  -4.396  1.00  0.00           C  
HETATM   27  O   UNK A   0       0.304   0.649  -5.453  1.00  0.00           O  
HETATM   28  C   UNK A   0      -0.112   1.987  -5.804  1.00  0.00           C  
HETATM   29  C   UNK A   0      -0.726   2.004  -7.205  1.00  0.00           C  
HETATM   30  O   UNK A   0      -1.882   1.166  -7.228  1.00  0.00           O  
HETATM   31  P   UNK A   0      -2.474   1.230  -8.724  1.00  0.00           P  
HETATM   32  O   UNK A   0      -1.454   0.745  -9.680  1.00  0.00           O  
HETATM   33  O   UNK A   0      -3.786   0.303  -8.823  1.00  0.00           O  
HETATM   34  O   UNK A   0      -2.863   2.751  -9.082  1.00  0.00           O  
HETATM   35  C   UNK A   0       1.185   2.825  -5.772  1.00  0.00           C  
HETATM   36  O   UNK A   0       0.925   4.131  -5.252  1.00  0.00           O  
HETATM   37  C   UNK A   0       2.118   2.039  -4.822  1.00  0.00           C  
HETATM   38  O   UNK A   0       2.465   2.836  -3.688  1.00  0.00           O  
HETATM   39  C   UNK A   0       4.275  -2.813  -2.643  1.00  0.00           C  
HETATM   40  O   UNK A   0       4.496  -2.465  -1.499  1.00  0.00           O  
HETATM   41  N   UNK A   0       4.794  -3.966  -3.109  1.00  0.00           N  
HETATM   42  C   UNK A   0       1.425  -2.387   1.472  1.00  0.00           C  
HETATM   43  C   UNK A   0       0.051  -2.592   0.889  1.00  0.00           C  
HETATM   44  N   UNK A   0      -0.645  -1.547   0.503  1.00  0.00           N  
HETATM   45  C   UNK A   0      -1.856  -1.683  -0.019  1.00  0.00           C  
HETATM   46  C   UNK A   0      -2.433  -2.963  -0.163  1.00  0.00           C  
HETATM   47  N   UNK A   0      -3.672  -3.077  -0.694  1.00  0.00           N  
HETATM   48  C   UNK A   0      -4.352  -2.026  -1.080  1.00  0.00           C  
HETATM   49  N   UNK A   0      -5.603  -2.215  -1.611  1.00  0.00           N  
HETATM   50  N   UNK A   0      -3.872  -0.753  -0.977  1.00  0.00           N  
HETATM   51  C   UNK A   0      -2.644  -0.519  -0.461  1.00  0.00           C  
HETATM   52  O   UNK A   0      -2.206   0.611  -0.365  1.00  0.00           O  
HETATM   53  C   UNK A   0      -1.701  -4.085   0.250  1.00  0.00           C  
HETATM   54  C   UNK A   0      -0.454  -3.883   0.777  1.00  0.00           C  
ATOM     55  C   GLU A   1       1.316   1.793   9.615  1.00  0.00           C  
ATOM     56  O   GLU A   1       1.475   2.728  10.364  1.00  0.00           O  
ATOM     57  OXT GLU A   1       2.279   0.867   9.484  1.00  0.00           O  
ATOM     58  HE1 GLU A   1      -5.147  -0.806   9.639  1.00  0.00           H  
ATOM     59  HG1 GLU A   1      -2.680   1.727   8.633  1.00  0.00           H  
ATOM     60  HG2 GLU A   1      -2.078   0.223   7.896  1.00  0.00           H  
ATOM     61  HB1 GLU A   1      -0.581  -0.130   9.841  1.00  0.00           H  
ATOM     62  HB2 GLU A   1      -1.183   1.373  10.578  1.00  0.00           H  
ATOM     63  HA  GLU A   1      -0.362   2.660   8.624  1.00  0.00           H  
ATOM     64  H   GLU A   1       0.245   0.013   7.512  1.00  0.00           H  
HETATM   65  H   UNK A   0       1.343   2.811   4.114  1.00  0.00           H  
HETATM   66  H   UNK A   0       1.797   1.655   1.994  1.00  0.00           H  
HETATM   67  H   UNK A   0       1.009  -2.111   3.870  1.00  0.00           H  
HETATM   68  H   UNK A   0       0.558  -0.964   5.995  1.00  0.00           H  
HETATM   69  H   UNK A   0       2.099  -1.965  -0.858  1.00  0.00           H  
HETATM   70  H   UNK A   0       3.023   0.834  -1.707  1.00  0.00           H  
HETATM   71  H   UNK A   0       2.055  -1.162  -6.295  1.00  0.00           H  
HETATM   72  H   UNK A   0       0.772   1.015  -3.449  1.00  0.00           H  
HETATM   73  H   UNK A   0      -0.826   2.366  -5.073  1.00  0.00           H  
HETATM   74  H   UNK A   0      -1.011   3.024  -7.464  1.00  0.00           H  
HETATM   75  H   UNK A   0       0.004   1.636  -7.926  1.00  0.00           H  
HETATM   76  H   UNK A   0      -4.108   0.370  -9.733  1.00  0.00           H  
HETATM   77  H   UNK A   0      -3.529   3.028  -8.438  1.00  0.00           H  
HETATM   78  H   UNK A   0       1.621   2.892  -6.769  1.00  0.00           H  
HETATM   79  H   UNK A   0       1.767   4.606  -5.257  1.00  0.00           H  
HETATM   80  H   UNK A   0       3.016   1.715  -5.349  1.00  0.00           H  
HETATM   81  H   UNK A   0       2.936   3.610  -4.024  1.00  0.00           H  
HETATM   82  H   UNK A   0       5.344  -4.519  -2.531  1.00  0.00           H  
HETATM   83  H   UNK A   0       4.614  -4.246  -4.020  1.00  0.00           H  
HETATM   84  H   UNK A   0       1.477  -2.854   2.455  1.00  0.00           H  
HETATM   85  H   UNK A   0       2.169  -2.839   0.815  1.00  0.00           H  
HETATM   86  H   UNK A   0      -5.965  -3.111  -1.693  1.00  0.00           H  
HETATM   87  H   UNK A   0      -6.125  -1.451  -1.903  1.00  0.00           H  
HETATM   88  H   UNK A   0      -4.417  -0.009  -1.278  1.00  0.00           H  
HETATM   89  H   UNK A   0      -2.109  -5.080   0.155  1.00  0.00           H  
HETATM   90  H   UNK A   0       0.137  -4.725   1.105  1.00  0.00           H  
ATOM     91  HXT GLU A   1       3.100   0.948   9.989  1.00  0.00           H  
CONECT    1    2   58                                                 
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   59   60                                       
CONECT    5    4    6   61   62                                       
CONECT    6    5    7   55   63                                       
CONECT    7    6    8   64                                            
CONECT    8    7    9    9   10                                       
CONECT    9    8    8                                                 
CONECT   10    8   11   11   15                                       
CONECT   11   10   10   12   65                                       
CONECT   12   11   13   13   66                                       
CONECT   13   12   12   14   16                                       
CONECT   14   13   15   15   67                                       
CONECT   15   10   14   14   68                                       
CONECT   16   13   17   42                                            
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   20   69                                       
CONECT   20   19   19   21   70                                       
CONECT   21   20   22   22   25                                       
CONECT   22   21   21   23   39                                       
CONECT   23   22   24   24                                            
CONECT   24   23   23   25   71                                       
CONECT   25   21   24   26                                            
CONECT   26   25   27   37   72                                       
CONECT   27   26   28                                                 
CONECT   28   27   29   35   73                                       
CONECT   29   28   30   74   75                                       
CONECT   30   29   31                                                 
CONECT   31   30   32   32   33                                       
CONECT   31   34                                                      
CONECT   32   31   31                                                 
CONECT   33   31   76                                                 
CONECT   34   31   77                                                 
CONECT   35   28   36   37   78                                       
CONECT   36   35   79                                                 
CONECT   37   26   35   38   80                                       
CONECT   38   37   81                                                 
CONECT   39   22   40   40   41                                       
CONECT   40   39   39                                                 
CONECT   41   39   82   83                                            
CONECT   42   16   43   84   85                                       
CONECT   43   42   44   44   54                                       
CONECT   44   43   43   45                                            
CONECT   45   44   46   46   51                                       
CONECT   46   45   45   47   53                                       
CONECT   47   46   48   48                                            
CONECT   48   47   47   49   50                                       
CONECT   49   48   86   87                                            
CONECT   50   48   51   88                                            
CONECT   51   45   50   52   52                                       
CONECT   52   51   51                                                 
CONECT   53   46   54   54   89                                       
CONECT   54   43   53   53   90                                       
CONECT   55    6   56   56   57                                       
CONECT   56   55   55                                                 
CONECT   57   55   91                                                 
CONECT   58    1                                                      
CONECT   59    4                                                      
CONECT   60    4                                                      
CONECT   61    5                                                      
CONECT   62    5                                                      
CONECT   63    6                                                      
CONECT   64    7                                                      
CONECT   65   11                                                      
CONECT   66   12                                                      
CONECT   67   14                                                      
CONECT   68   15                                                      
CONECT   69   19                                                      
CONECT   70   20                                                      
CONECT   71   24                                                      
CONECT   72   26                                                      
CONECT   73   28                                                      
CONECT   74   29                                                      
CONECT   75   29                                                      
CONECT   76   33                                                      
CONECT   77   34                                                      
CONECT   78   35                                                      
CONECT   79   36                                                      
CONECT   80   37                                                      
CONECT   81   38                                                      
CONECT   82   41                                                      
CONECT   83   41                                                      
CONECT   84   42                                                      
CONECT   85   42                                                      
CONECT   86   49                                                      
CONECT   87   49                                                      
CONECT   88   50                                                      
CONECT   89   53                                                      
CONECT   90   54                                                      
CONECT   91   57                                                      
MASTER        0    0    0    0    0    0    0    0   91    0   91    0
END
