COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK A   0      -5.556  -0.075   4.695  1.00  0.00           N  
HETATM    2  C   UNK A   0      -5.309   0.347   5.920  1.00  0.00           C  
HETATM    3  N   UNK A   0      -6.243   0.095   6.908  1.00  0.00           N  
HETATM    4  N   UNK A   0      -4.197   1.001   6.245  1.00  0.00           N  
HETATM    5  C   UNK A   0      -3.267   1.272   5.344  1.00  0.00           C  
HETATM    6  O   UNK A   0      -2.142   1.938   5.689  1.00  0.00           O  
HETATM    7  C   UNK A   0      -3.479   0.848   4.011  1.00  0.00           C  
HETATM    8  C   UNK A   0      -4.677   0.154   3.709  1.00  0.00           C  
HETATM    9  C   UNK A   0      -4.908  -0.275   2.395  1.00  0.00           C  
HETATM   10  C   UNK A   0      -3.979  -0.021   1.430  1.00  0.00           C  
HETATM   11  C   UNK A   0      -2.803   0.660   1.728  1.00  0.00           C  
HETATM   12  C   UNK A   0      -1.799   0.923   0.636  1.00  0.00           C  
HETATM   13  C   UNK A   0      -0.896  -0.300   0.468  1.00  0.00           C  
HETATM   14  O   UNK A   0      -1.672  -1.402  -0.005  1.00  0.00           O  
HETATM   15  C   UNK A   0       0.209   0.016  -0.540  1.00  0.00           C  
HETATM   16  C   UNK A   0      -2.547   1.093   2.996  1.00  0.00           C  
HETATM   17  C   UNK A   0      -0.255  -1.972   2.215  1.00  0.00           C  
HETATM   18  C   UNK A   0       0.309  -2.304   3.429  1.00  0.00           C  
HETATM   19  C   UNK A   0       0.858  -1.305   4.235  1.00  0.00           C  
HETATM   20  C   UNK A   0       1.465  -1.653   5.538  1.00  0.00           C  
HETATM   21  O   UNK A   0       1.486  -2.811   5.909  1.00  0.00           O  
HETATM   22  C   UNK A   0       0.831   0.022   3.807  1.00  0.00           C  
HETATM   23  C   UNK A   0       0.268   0.339   2.588  1.00  0.00           C  
HETATM   24  C   UNK A   0      -0.278  -0.654   1.796  1.00  0.00           C  
ATOM     25  N   GLU A   1       1.994  -0.687   6.314  1.00  0.00           N  
ATOM     26  CA  GLU A   1       2.595  -1.031   7.605  1.00  0.00           C  
ATOM     27  C   GLU A   1       1.542  -0.970   8.682  1.00  0.00           C  
ATOM     28  O   GLU A   1       0.512  -0.117   8.566  1.00  0.00           O  
ATOM     29  OXT GLU A   1       1.625  -1.689   9.650  1.00  0.00           O  
ATOM     30  CB  GLU A   1       3.713  -0.039   7.928  1.00  0.00           C  
ATOM     31  CG  GLU A   1       4.782  -0.101   6.835  1.00  0.00           C  
ATOM     32  CD  GLU A   1       5.884   0.876   7.153  1.00  0.00           C  
ATOM     33  OE1 GLU A   1       5.821   1.553   8.152  1.00  0.00           O  
ATOM     34  OE2 GLU A   1       6.935   0.994   6.327  1.00  0.00           O  
HETATM   35  C   UNK A   0       1.352   2.183  -8.646  1.00  0.00           C  
HETATM   36  O   UNK A   0       0.870   3.248  -9.468  1.00  0.00           O  
HETATM   37  C   UNK A   0       1.436   2.633  -7.168  1.00  0.00           C  
HETATM   38  O   UNK A   0       1.011   3.990  -7.033  1.00  0.00           O  
HETATM   39  C   UNK A   0       0.468   1.680  -6.432  1.00  0.00           C  
HETATM   40  O   UNK A   0       0.388   0.509  -7.274  1.00  0.00           O  
HETATM   41  C   UNK A   0       0.341   1.014  -8.626  1.00  0.00           C  
HETATM   42  C   UNK A   0       0.761  -0.072  -9.616  1.00  0.00           C  
HETATM   43  O   UNK A   0      -0.145  -1.173  -9.528  1.00  0.00           O  
HETATM   44  N   UNK A   0       1.004   1.326  -5.115  1.00  0.00           N  
HETATM   45  C   UNK A   0       0.164   1.017  -4.107  1.00  0.00           C  
HETATM   46  O   UNK A   0      -1.034   1.032  -4.290  1.00  0.00           O  
HETATM   47  C   UNK A   0       0.715   0.653  -2.752  1.00  0.00           C  
HETATM   48  N   UNK A   0      -0.393   0.362  -1.835  1.00  0.00           N  
HETATM   49  P   UNK A   0       0.354  -2.274 -10.592  1.00  0.00           P  
HETATM   50  O   UNK A   0      -0.628  -3.548 -10.546  1.00  0.00           O  
HETATM   51  O   UNK A   0       0.339  -1.637 -12.070  1.00  0.00           O  
HETATM   52  O   UNK A   0       1.730  -2.700 -10.251  1.00  0.00           O  
HETATM   53  H   UNK A   0      -6.080   0.393   7.817  1.00  0.00           H  
HETATM   54  H   UNK A   0      -7.062  -0.377   6.693  1.00  0.00           H  
HETATM   55  H   UNK A   0      -1.491   1.272   5.949  1.00  0.00           H  
HETATM   56  H   UNK A   0      -5.817  -0.804   2.148  1.00  0.00           H  
HETATM   57  H   UNK A   0      -4.159  -0.353   0.418  1.00  0.00           H  
HETATM   58  H   UNK A   0      -2.323   1.119  -0.299  1.00  0.00           H  
HETATM   59  H   UNK A   0      -1.192   1.789   0.901  1.00  0.00           H  
HETATM   60  H   UNK A   0      -1.066  -2.151  -0.097  1.00  0.00           H  
HETATM   61  H   UNK A   0       0.800   0.858  -0.179  1.00  0.00           H  
HETATM   62  H   UNK A   0       0.852  -0.854  -0.660  1.00  0.00           H  
HETATM   63  H   UNK A   0      -1.631   1.621   3.216  1.00  0.00           H  
HETATM   64  H   UNK A   0      -0.680  -2.744   1.590  1.00  0.00           H  
HETATM   65  H   UNK A   0       0.327  -3.333   3.755  1.00  0.00           H  
HETATM   66  H   UNK A   0       1.254   0.799   4.426  1.00  0.00           H  
HETATM   67  H   UNK A   0       0.247   1.366   2.255  1.00  0.00           H  
ATOM     68  H   GLU A   1       1.976   0.236   6.019  1.00  0.00           H  
ATOM     69  HA  GLU A   1       3.006  -2.040   7.557  1.00  0.00           H  
ATOM     70  H   GLU A   1      -0.162  -0.077   9.257  1.00  0.00           H  
ATOM     71  HB1 GLU A   1       3.302   0.968   7.977  1.00  0.00           H  
ATOM     72  HB2 GLU A   1       4.160  -0.295   8.889  1.00  0.00           H  
ATOM     73  HG1 GLU A   1       5.194  -1.109   6.787  1.00  0.00           H  
ATOM     74  HG2 GLU A   1       4.335   0.154   5.875  1.00  0.00           H  
ATOM     75  HE2 GLU A   1       7.642   1.622   6.532  1.00  0.00           H  
HETATM   76  H   UNK A   0       2.325   1.840  -8.998  1.00  0.00           H  
HETATM   77  H   UNK A   0       1.539   3.945  -9.442  1.00  0.00           H  
HETATM   78  H   UNK A   0       2.450   2.512  -6.789  1.00  0.00           H  
HETATM   79  H   UNK A   0       1.084   4.215  -6.096  1.00  0.00           H  
HETATM   80  H   UNK A   0      -0.514   2.141  -6.330  1.00  0.00           H  
HETATM   81  H   UNK A   0      -0.659   1.375  -8.861  1.00  0.00           H  
HETATM   82  H   UNK A   0       0.746   0.331 -10.628  1.00  0.00           H  
HETATM   83  H   UNK A   0       1.769  -0.413  -9.376  1.00  0.00           H  
HETATM   84  H   UNK A   0       1.962   1.314  -4.969  1.00  0.00           H  
HETATM   85  H   UNK A   0       1.300   1.486  -2.362  1.00  0.00           H  
HETATM   86  H   UNK A   0       1.352  -0.226  -2.844  1.00  0.00           H  
HETATM   87  H   UNK A   0      -0.842  -0.473  -2.178  1.00  0.00           H  
HETATM   88  H   UNK A   0      -0.294  -4.182 -11.196  1.00  0.00           H  
HETATM   89  H   UNK A   0      -0.573  -1.374 -12.252  1.00  0.00           H  
CONECT    1    2    2    8                                            
CONECT    2    1    1    3    4                                       
CONECT    3    2   53   54                                            
CONECT    4    2    5    5                                            
CONECT    5    4    4    6    7                                       
CONECT    6    5   55                                                 
CONECT    7    5    8    8   16                                       
CONECT    8    1    7    7    9                                       
CONECT    9    8   10   10   56                                       
CONECT   10    9    9   11   57                                       
CONECT   11   10   12   16   16                                       
CONECT   12   11   13   58   59                                       
CONECT   13   12   14   15   24                                       
CONECT   14   13   60                                                 
CONECT   15   13   48   61   62                                       
CONECT   16    7   11   11   63                                       
CONECT   17   18   18   24   64                                       
CONECT   18   17   17   19   65                                       
CONECT   19   18   20   22   22                                       
CONECT   20   19   21   21   25                                       
CONECT   21   20   20                                                 
CONECT   22   19   19   23   66                                       
CONECT   23   22   24   24   67                                       
CONECT   24   13   17   23   23                                       
CONECT   25   20   26   68                                            
CONECT   26   25   27   30   69                                       
CONECT   27   26   28   29   29                                       
CONECT   28   27   70                                                 
CONECT   29   27   27                                                 
CONECT   30   26   31   71   72                                       
CONECT   31   30   32   73   74                                       
CONECT   32   31   33   33   34                                       
CONECT   33   32   32                                                 
CONECT   34   32   75                                                 
CONECT   35   36   37   41   76                                       
CONECT   36   35   77                                                 
CONECT   37   35   38   39   78                                       
CONECT   38   37   79                                                 
CONECT   39   37   40   44   80                                       
CONECT   40   39   41                                                 
CONECT   41   35   40   42   81                                       
CONECT   42   41   43   82   83                                       
CONECT   43   42   49                                                 
CONECT   44   39   45   84                                            
CONECT   45   44   46   46   47                                       
CONECT   46   45   45                                                 
CONECT   47   45   48   85   86                                       
CONECT   48   15   47   87                                            
CONECT   49   43   50   51   52                                       
CONECT   49   52                                                      
CONECT   50   49   88                                                 
CONECT   51   49   89                                                 
CONECT   52   49   49                                                 
CONECT   53    3                                                      
CONECT   54    3                                                      
CONECT   55    6                                                      
CONECT   56    9                                                      
CONECT   57   10                                                      
CONECT   58   12                                                      
CONECT   59   12                                                      
CONECT   60   14                                                      
CONECT   61   15                                                      
CONECT   62   15                                                      
CONECT   63   16                                                      
CONECT   64   17                                                      
CONECT   65   18                                                      
CONECT   66   22                                                      
CONECT   67   23                                                      
CONECT   68   25                                                      
CONECT   69   26                                                      
CONECT   70   28                                                      
CONECT   71   30                                                      
CONECT   72   30                                                      
CONECT   73   31                                                      
CONECT   74   31                                                      
CONECT   75   34                                                      
CONECT   76   35                                                      
CONECT   77   36                                                      
CONECT   78   37                                                      
CONECT   79   38                                                      
CONECT   80   39                                                      
CONECT   81   41                                                      
CONECT   82   42                                                      
CONECT   83   42                                                      
CONECT   84   44                                                      
CONECT   85   47                                                      
CONECT   86   47                                                      
CONECT   87   48                                                      
CONECT   88   50                                                      
CONECT   89   51                                                      
MASTER        0    0    0    0    0    0    0    0   89    0   89    0
END
