COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK A   1      -0.396   2.886  -1.430  1.00  0.00           N  
HETATM    2  C   UNK A   1       0.508   2.852  -0.271  1.00  0.00           C  
HETATM    3  C   UNK A   1       1.892   2.511  -0.742  1.00  0.00           C  
HETATM    4  O   UNK A   1       2.731   3.384  -0.821  1.00  0.00           O  
HETATM    5  C   UNK A   1       0.007   1.798   0.721  1.00  0.00           C  
HETATM    6  C   UNK A   1      -1.341   2.214   1.259  1.00  0.00           C  
HETATM    7  C   UNK A   5      -2.485   1.492   1.240  1.00  0.00           C  
HETATM    8  C   UNK A   1      -1.660   3.503   1.876  1.00  0.00           C  
HETATM    9  N   UNK A   5      -3.477   2.186   1.887  1.00  0.00           N  
HETATM   10  C   UNK A   5      -3.012   3.432   2.261  1.00  0.00           C  
HETATM   11  C   UNK A   1      -0.924   4.669   2.113  1.00  0.00           C  
HETATM   12  C   UNK A   5      -3.593   4.527   2.888  1.00  0.00           C  
HETATM   13  C   UNK A   1      -1.517   5.732   2.737  1.00  0.00           C  
HETATM   14  C   UNK A   1      -2.849   5.664   3.128  1.00  0.00           C  
HETATM   15  C   UNK A   2       5.990   1.522  -1.125  1.00  0.00           C  
HETATM   16  C   UNK A   2       4.560   1.787  -0.649  1.00  0.00           C  
HETATM   17  C   UNK A   2       3.590   0.895  -1.426  1.00  0.00           C  
HETATM   18  N   UNK A   2       2.213   1.246  -1.077  1.00  0.00           N  
HETATM   19  C   UNK A   2       3.828  -0.548  -1.062  1.00  0.00           C  
HETATM   20  O   UNK A   2       3.598  -1.431  -1.861  1.00  0.00           O  
HETATM   21  O   UNK A   2       6.060   1.697  -2.542  1.00  0.00           O  
HETATM   22  C   UNK A   2       6.945   2.503  -0.442  1.00  0.00           C  
HETATM   23  C   UNK A   2       6.389   0.089  -0.768  1.00  0.00           C  
HETATM   24  O   UNK A   2       8.280   2.255  -0.887  1.00  0.00           O  
ATOM     25  N   ALA A   3       4.300  -0.843   0.164  1.00  0.00           N  
ATOM     26  CA  ALA A   3       4.583  -2.233   0.533  1.00  0.00           C  
ATOM     27  C   ALA A   3       3.461  -2.768   1.375  1.00  0.00           C  
ATOM     28  O   ALA A   3       3.645  -2.972   2.556  1.00  0.00           O  
ATOM     29  CB  ALA A   3       5.890  -2.294   1.327  1.00  0.00           C  
ATOM     30  N   THR A   4       2.255  -3.025   0.840  1.00  0.00           N  
ATOM     31  CA  THR A   4       1.176  -3.559   1.671  1.00  0.00           C  
ATOM     32  CB  THR A   4       0.974  -5.042   1.352  1.00  0.00           C  
ATOM     33  CG2 THR A   4       2.267  -5.807   1.640  1.00  0.00           C  
ATOM     34  OG1 THR A   4       0.630  -5.189  -0.028  1.00  0.00           O  
ATOM     35  C   THR A   4      -0.099  -2.810   1.396  1.00  0.00           C  
ATOM     36  O   THR A   4      -0.055  -1.631   1.115  1.00  0.00           O  
HETATM   37  N   UNK A   5      -1.288  -3.439   1.460  1.00  0.00           N  
HETATM   38  C   UNK A   5      -2.510  -2.691   1.166  1.00  0.00           C  
HETATM   39  C   UNK A   5      -2.644  -2.516  -0.327  1.00  0.00           C  
HETATM   40  O   UNK A   5      -1.716  -2.788  -1.059  1.00  0.00           O  
HETATM   41  C   UNK A   5      -2.425  -1.283   1.783  1.00  0.00           C  
HETATM   42  S   UNK A   5      -2.704  -0.071   0.462  1.00  0.00           S  
ATOM     43  N   HYP A   6      -3.796  -2.059  -0.839  1.00  0.00           N  
ATOM     44  CA  HYP A   6      -3.958  -1.396  -2.136  1.00  0.00           C  
ATOM     45  C   HYP A   6      -3.671   0.073  -1.972  1.00  0.00           C  
ATOM     46  O   HYP A   6      -4.220   0.693  -1.086  1.00  0.00           O  
ATOM     47  CB  HYP A   6      -5.424  -1.589  -2.575  1.00  0.00           C  
ATOM     48  CG  HYP A   6      -6.172  -2.067  -1.316  1.00  0.00           C  
ATOM     49  CD  HYP A   6      -5.119  -2.184  -0.204  1.00  0.00           C  
ATOM     50  OD  HYP A   6      -6.775  -3.340  -1.558  1.00  0.00           O  
ATOM     51  N   ALA A   7      -2.816   0.709  -2.793  1.00  0.00           N  
ATOM     52  CA  ALA A   7      -2.481   2.121  -2.540  1.00  0.00           C  
ATOM     53  C   ALA A   7      -1.554   2.192  -1.357  1.00  0.00           C  
ATOM     54  O   ALA A   7      -1.847   1.620  -0.328  1.00  0.00           O  
ATOM     55  CB  ALA A   7      -3.760   2.905  -2.239  1.00  0.00           C  
HETATM   56  H   UNK A   1      -0.169   3.395  -2.224  1.00  0.00           H  
HETATM   57  H   UNK A   1       0.511   3.835   0.204  1.00  0.00           H  
HETATM   58  H   UNK A   1      -0.085   0.837   0.214  1.00  0.00           H  
HETATM   59  H   UNK A   1       0.715   1.709   1.544  1.00  0.00           H  
HETATM   60  H   UNK A   5      -4.372   1.852   2.057  1.00  0.00           H  
HETATM   61  H   UNK A   1       0.109   4.729   1.804  1.00  0.00           H  
HETATM   62  H   UNK A   5      -4.630   4.488   3.187  1.00  0.00           H  
HETATM   63  H   UNK A   1      -0.947   6.629   2.928  1.00  0.00           H  
HETATM   64  H   UNK A   1      -3.305   6.508   3.624  1.00  0.00           H  
HETATM   65  H   UNK A   2       4.485   1.565   0.415  1.00  0.00           H  
HETATM   66  H   UNK A   2       4.308   2.833  -0.821  1.00  0.00           H  
HETATM   67  H   UNK A   2       3.743   1.034  -2.497  1.00  0.00           H  
HETATM   68  H   UNK A   2       1.525   0.562  -1.087  1.00  0.00           H  
HETATM   69  H   UNK A   2       5.894   2.604  -2.835  1.00  0.00           H  
HETATM   70  H   UNK A   2       6.661   3.524  -0.696  1.00  0.00           H  
HETATM   71  H   UNK A   2       6.891   2.369   0.639  1.00  0.00           H  
HETATM   72  H   UNK A   2       7.448  -0.058  -0.983  1.00  0.00           H  
HETATM   73  H   UNK A   2       6.206  -0.086   0.292  1.00  0.00           H  
HETATM   74  H   UNK A   2       5.798  -0.611  -1.359  1.00  0.00           H  
HETATM   75  H   UNK A   2       8.941   2.842  -0.493  1.00  0.00           H  
ATOM     76  H   ALA A   3       4.454  -0.132   0.806  1.00  0.00           H  
ATOM     77  HA  ALA A   3       4.679  -2.836  -0.370  1.00  0.00           H  
ATOM     78  HB1 ALA A   3       5.795  -1.691   2.230  1.00  0.00           H  
ATOM     79  HB2 ALA A   3       6.101  -3.328   1.601  1.00  0.00           H  
ATOM     80  HB3 ALA A   3       6.705  -1.907   0.715  1.00  0.00           H  
ATOM     81  H   THR A   4       2.100  -2.855  -0.103  1.00  0.00           H  
ATOM     82  HA  THR A   4       1.441  -3.448   2.723  1.00  0.00           H  
ATOM     83  HB  THR A   4       0.170  -5.440   1.971  1.00  0.00           H  
ATOM     84 HG21 THR A   4       2.529  -5.694   2.692  1.00  0.00           H  
ATOM     85 HG22 THR A   4       2.122  -6.863   1.412  1.00  0.00           H  
ATOM     86 HG23 THR A   4       3.070  -5.408   1.020  1.00  0.00           H  
ATOM     87  HG1 THR A   4       1.301  -4.854  -0.638  1.00  0.00           H  
HETATM   88  H   UNK A   5      -1.334  -4.378   1.699  1.00  0.00           H  
HETATM   89  H   UNK A   5      -3.373  -3.219   1.554  1.00  0.00           H  
HETATM   90  H   UNK A   5      -3.189  -1.171   2.553  1.00  0.00           H  
HETATM   91  H   UNK A   5      -1.438  -1.130   2.218  1.00  0.00           H  
ATOM     92  HA  HYP A   6      -3.278  -1.832  -2.866  1.00  0.00           H  
ATOM     93  HB1 HYP A   6      -5.840  -0.644  -2.924  1.00  0.00           H  
ATOM     94  HB2 HYP A   6      -5.487  -2.343  -3.359  1.00  0.00           H  
ATOM     95  HG  HYP A   6      -6.934  -1.341  -1.035  1.00  0.00           H  
ATOM     96  HD1 HYP A   6      -5.205  -3.154   0.287  1.00  0.00           H  
ATOM     97  HD2 HYP A   6      -5.258  -1.385   0.524  1.00  0.00           H  
ATOM     98  HD  HYP A   6      -7.261  -3.695  -0.801  1.00  0.00           H  
ATOM     99  H   ALA A   7      -2.423   0.242  -3.548  1.00  0.00           H  
ATOM    100  HA  ALA A   7      -1.989   2.543  -3.416  1.00  0.00           H  
ATOM    101  HB1 ALA A   7      -4.150   2.605  -1.267  1.00  0.00           H  
ATOM    102  HB2 ALA A   7      -3.538   3.972  -2.228  1.00  0.00           H  
ATOM    103  HB3 ALA A   7      -4.503   2.697  -3.009  1.00  0.00           H  
CONECT    1    2   56   53                                            
CONECT    2    1    3    5   57                                       
CONECT    3    2    4    4   18                                       
CONECT    4    3    3                                                 
CONECT    5    2    6   58   59                                       
CONECT    6    5    7    7    8                                       
CONECT    7    6    6    9   42                                       
CONECT    8    6   10   10   11                                       
CONECT    9    7   10   60                                            
CONECT   10    8    8    9   12                                       
CONECT   11    8   13   13   61                                       
CONECT   12   10   14   14   62                                       
CONECT   13   11   11   14   63                                       
CONECT   14   12   12   13   64                                       
CONECT   15   22   16   23   21                                       
CONECT   16   15   17   65   66                                       
CONECT   17   16   18   19   67                                       
CONECT   18   17   68    3                                            
CONECT   19   17   20   20   25                                       
CONECT   20   19   19                                                 
CONECT   21   15   69                                                 
CONECT   22   24   15   70   71                                       
CONECT   23   15   72   73   74                                       
CONECT   24   22   75                                                 
CONECT   25   26   76   19                                            
CONECT   26   25   27   29   77                                       
CONECT   27   26   28   28   30                                       
CONECT   28   27   27                                                 
CONECT   29   26   78   79   80                                       
CONECT   30   31   81   27                                            
CONECT   31   30   32   35   82                                       
CONECT   32   31   33   34   83                                       
CONECT   33   32   84   85   86                                       
CONECT   34   32   87                                                 
CONECT   35   31   36   36   37                                       
CONECT   36   35   35                                                 
CONECT   37   38   88   35                                            
CONECT   38   37   39   41   89                                       
CONECT   39   38   40   40   43                                       
CONECT   40   39   39                                                 
CONECT   41   38   42   90   91                                       
CONECT   42   41    7                                                 
CONECT   43   44   49   39                                            
CONECT   44   43   45   47   92                                       
CONECT   45   44   46   46   51                                       
CONECT   46   45   45                                                 
CONECT   47   44   48   93   94                                       
CONECT   48   47   49   50   95                                       
CONECT   49   43   48   96   97                                       
CONECT   50   48   98                                                 
CONECT   51   52   99   45                                            
CONECT   52   51   53   55  100                                       
CONECT   53   52   54   54    1                                       
CONECT   54   53   53                                                 
CONECT   55   52  101  102  103                                       
CONECT   56    1                                                      
CONECT   57    2                                                      
CONECT   58    5                                                      
CONECT   59    5                                                      
CONECT   60    9                                                      
CONECT   61   11                                                      
CONECT   62   12                                                      
CONECT   63   13                                                      
CONECT   64   14                                                      
CONECT   65   16                                                      
CONECT   66   16                                                      
CONECT   67   17                                                      
CONECT   68   18                                                      
CONECT   69   21                                                      
CONECT   70   22                                                      
CONECT   71   22                                                      
CONECT   72   23                                                      
CONECT   73   23                                                      
CONECT   74   23                                                      
CONECT   75   24                                                      
CONECT   76   25                                                      
CONECT   77   26                                                      
CONECT   78   29                                                      
CONECT   79   29                                                      
CONECT   80   29                                                      
CONECT   81   30                                                      
CONECT   82   31                                                      
CONECT   83   32                                                      
CONECT   84   33                                                      
CONECT   85   33                                                      
CONECT   86   33                                                      
CONECT   87   34                                                      
CONECT   88   37                                                      
CONECT   89   38                                                      
CONECT   90   41                                                      
CONECT   91   41                                                      
CONECT   92   44                                                      
CONECT   93   47                                                      
CONECT   94   47                                                      
CONECT   95   48                                                      
CONECT   96   49                                                      
CONECT   97   49                                                      
CONECT   98   50                                                      
CONECT   99   51                                                      
CONECT  100   52                                                      
CONECT  101   55                                                      
CONECT  102   55                                                      
CONECT  103   55                                                      
MASTER        0    0    0    0    0    0    0    0  103    0  103    0
END
