COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
ATOM      1  N   THR A   1       1.294   8.212   0.139  1.00  0.00           N  
ATOM      2  CA  THR A   1       0.938   6.810   0.398  1.00  0.00           C  
ATOM      3  C   THR A   1       0.592   6.131  -0.902  1.00  0.00           C  
ATOM      4  O   THR A   1       0.283   6.794  -1.869  1.00  0.00           O  
ATOM      5  CB  THR A   1      -0.268   6.756   1.338  1.00  0.00           C  
ATOM      6  OG1 THR A   1      -1.407   7.321   0.685  1.00  0.00           O  
ATOM      7  CG2 THR A   1       0.038   7.553   2.608  1.00  0.00           C  
HETATM    8  N   UNK A   2       0.627   4.786  -0.989  1.00  0.00           N  
HETATM    9  C   UNK A   2       0.291   4.126  -2.253  1.00  0.00           C  
HETATM   10  C   UNK A   2      -1.203   3.949  -2.347  1.00  0.00           C  
HETATM   11  O   UNK A   2      -1.946   4.821  -1.951  1.00  0.00           O  
HETATM   12  C   UNK A   2       0.967   2.753  -2.308  1.00  0.00           C  
HETATM   13  O   UNK A   2       1.559   2.461  -1.014  1.00  0.00           O  
HETATM   14  C   UNK A   2       2.059   2.764  -3.379  1.00  0.00           C  
ATOM     15  N   LEU A   3      -1.709   2.816  -2.874  1.00  0.00           N  
ATOM     16  CA  LEU A   3      -3.157   2.639  -2.989  1.00  0.00           C  
ATOM     17  C   LEU A   3      -3.584   1.409  -2.234  1.00  0.00           C  
ATOM     18  O   LEU A   3      -2.772   0.784  -1.585  1.00  0.00           O  
ATOM     19  CB  LEU A   3      -3.534   2.488  -4.464  1.00  0.00           C  
ATOM     20  CG  LEU A   3      -3.224   3.789  -5.206  1.00  0.00           C  
ATOM     21  CD1 LEU A   3      -3.484   3.598  -6.702  1.00  0.00           C  
ATOM     22  CD2 LEU A   3      -4.120   4.908  -4.672  1.00  0.00           C  
HETATM   23  N   UNK A   4      -4.867   0.999  -2.280  1.00  0.00           N  
HETATM   24  C   UNK A   4      -5.275  -0.202  -1.547  1.00  0.00           C  
HETATM   25  C   UNK A   4      -5.424   0.134  -0.085  1.00  0.00           C  
HETATM   26  O   UNK A   4      -6.517   0.382   0.375  1.00  0.00           O  
HETATM   27  C   UNK A   4      -4.204  -1.283  -1.713  1.00  0.00           C  
HETATM   28  C   UNK A   4      -4.869  -2.589  -2.153  1.00  0.00           C  
HETATM   29  C   UNK A   4      -4.147  -3.773  -1.507  1.00  0.00           C  
HETATM   30  C   UNK A   4      -3.571  -4.672  -2.603  1.00  0.00           C  
HETATM   31  N   UNK A   4      -3.103  -5.931  -2.008  1.00  0.00           N1+
ATOM     32  N   PHE A   5      -4.331   0.156   0.709  1.00  0.00           N  
ATOM     33  CA  PHE A   5      -4.460   0.488   2.129  1.00  0.00           C  
ATOM     34  C   PHE A   5      -3.105   0.793   2.713  1.00  0.00           C  
ATOM     35  O   PHE A   5      -2.199   1.147   1.988  1.00  0.00           O  
ATOM     36  CB  PHE A   5      -5.078  -0.696   2.874  1.00  0.00           C  
ATOM     37  CG  PHE A   5      -6.376  -1.083   2.212  1.00  0.00           C  
ATOM     38  CD1 PHE A   5      -6.381  -2.019   1.194  1.00  0.00           C  
ATOM     39  CD2 PHE A   5      -7.562  -0.508   2.628  1.00  0.00           C  
ATOM     40  CE1 PHE A   5      -7.571  -2.374   0.587  1.00  0.00           C  
ATOM     41  CE2 PHE A   5      -8.752  -0.863   2.021  1.00  0.00           C  
ATOM     42  CZ  PHE A   5      -8.756  -1.794   0.999  1.00  0.00           C  
ATOM     43  N   PRO A   6      -2.898   0.674   4.042  1.00  0.00           N  
ATOM     44  CA  PRO A   6      -1.641   0.966   4.735  1.00  0.00           C  
ATOM     45  C   PRO A   6      -0.530   0.103   4.204  1.00  0.00           C  
ATOM     46  O   PRO A   6      -0.660  -1.103   4.206  1.00  0.00           O  
ATOM     47  CB  PRO A   6      -1.841   0.683   6.226  1.00  0.00           C  
ATOM     48  CG  PRO A   6      -3.349   0.469   6.422  1.00  0.00           C  
ATOM     49  CD  PRO A   6      -3.897   0.232   5.010  1.00  0.00           C  
HETATM   50  N   UNK A   7       0.608   0.648   3.726  1.00  0.00           N  
HETATM   51  C   UNK A   7       1.762  -0.214   3.454  1.00  0.00           C  
HETATM   52  C   UNK A   7       3.028   0.568   3.430  1.00  0.00           C  
HETATM   53  O   UNK A   7       3.499   0.855   4.510  1.00  0.00           O  
HETATM   54  C   UNK A   7       1.552  -0.985   2.151  1.00  0.00           C  
HETATM   55  O   UNK A   7       1.500  -2.407   2.456  1.00  0.00           O  
HETATM   56  N   UNK A   8       3.701   0.988   2.372  1.00  0.00           N  
HETATM   57  C   UNK A   8       3.198   1.068   1.007  1.00  0.00           C  
HETATM   58  C   UNK A   8       3.833  -0.011   0.165  1.00  0.00           C  
HETATM   59  O   UNK A   8       3.878   0.106  -1.041  1.00  0.00           O  
HETATM   60  C   UNK A   8       3.568   2.435   0.421  1.00  0.00           C  
HETATM   61  C   UNK A   2       2.886   2.624  -0.905  1.00  0.00           C  
HETATM   62  O   UNK A   2       3.536   2.926  -1.877  1.00  0.00           O  
ATOM     63  N   TRP A   9       4.352  -1.104   0.757  1.00  0.00           N  
ATOM     64  CA  TRP A   9       4.967  -2.168  -0.045  1.00  0.00           C  
ATOM     65  C   TRP A   9       4.645  -3.491   0.600  1.00  0.00           C  
ATOM     66  O   TRP A   9       5.231  -3.830   1.607  1.00  0.00           O  
ATOM     67  CB  TRP A   9       6.483  -1.969  -0.088  1.00  0.00           C  
ATOM     68  CG  TRP A   9       6.802  -0.690  -0.817  1.00  0.00           C  
ATOM     69  CD1 TRP A   9       7.107  -0.567  -2.118  1.00  0.00           C  
ATOM     70  CD2 TRP A   9       6.833   0.657  -0.241  1.00  0.00           C  
ATOM     71  NE1 TRP A   9       7.336   0.748  -2.422  1.00  0.00           N  
ATOM     72  CE2 TRP A   9       7.176   1.523  -1.295  1.00  0.00           C  
ATOM     73  CE3 TRP A   9       6.604   1.171   1.037  1.00  0.00           C  
ATOM     74  CZ2 TRP A   9       7.284   2.888  -1.048  1.00  0.00           C  
ATOM     75  CZ3 TRP A   9       6.716   2.515   1.257  1.00  0.00           C  
ATOM     76  CH2 TRP A   9       7.054   3.374   0.220  1.00  0.00           C  
HETATM   77  N   UNK A  10       3.710  -4.300   0.065  1.00  0.00           N  
HETATM   78  C   UNK A  10       3.129  -5.370   0.884  1.00  0.00           C  
HETATM   79  C   UNK A  10       2.368  -6.327   0.007  1.00  0.00           C  
HETATM   80  O   UNK A  10       2.699  -7.492  -0.050  1.00  0.00           O  
HETATM   81  C   UNK A  10       2.161  -4.721   1.884  1.00  0.00           C  
HETATM   82  C   UNK A   7       2.119  -3.238   1.607  1.00  0.00           C  
HETATM   83  O   UNK A   7       2.645  -2.798   0.613  1.00  0.00           O  
HETATM   84  N   UNK A  11       1.318  -5.889  -0.716  1.00  0.00           N  
HETATM   85  C   UNK A  11       0.548  -6.828  -1.534  1.00  0.00           C  
HETATM   86  C   UNK A  11       0.660  -6.439  -2.986  1.00  0.00           C  
HETATM   87  O   UNK A  11       0.991  -5.317  -3.287  1.00  0.00           O  
HETATM   88  C   UNK A  11      -0.922  -6.786  -1.107  1.00  0.00           C  
HETATM   89  C   UNK A   4      -1.712  -6.008  -2.121  1.00  0.00           C  
HETATM   90  O   UNK A   4      -1.146  -5.452  -3.032  1.00  0.00           O  
HETATM   91  O   UNK A  11       0.393  -7.340  -3.944  1.00  0.00           O  
ATOM     92  H1  THR A   1       2.126   8.274  -0.427  1.00  0.00           H  
ATOM     93  H2  THR A   1       0.526   8.706  -0.291  1.00  0.00           H  
ATOM     94  HA  THR A   1       1.783   6.300   0.861  1.00  0.00           H  
ATOM     95  HB  THR A   1      -0.477   5.719   1.602  1.00  0.00           H  
ATOM     96  HG1 THR A   1      -2.210   7.319   1.224  1.00  0.00           H  
ATOM     97 HG21 THR A   1      -0.821   7.514   3.278  1.00  0.00           H  
ATOM     98 HG22 THR A   1       0.907   7.122   3.106  1.00  0.00           H  
ATOM     99 HG23 THR A   1       0.248   8.589   2.345  1.00  0.00           H  
HETATM  100  H   UNK A   2       0.874   4.256  -0.216  1.00  0.00           H  
HETATM  101  H   UNK A   2       0.638   4.737  -3.087  1.00  0.00           H  
HETATM  102  H   UNK A   2       0.225   1.992  -2.549  1.00  0.00           H  
HETATM  103  H   UNK A   2       2.655   3.671  -3.283  1.00  0.00           H  
HETATM  104  H   UNK A   2       2.701   1.892  -3.252  1.00  0.00           H  
HETATM  105  H   UNK A   2       1.599   2.735  -4.367  1.00  0.00           H  
ATOM    106  H   LEU A   3      -1.111   2.115  -3.177  1.00  0.00           H  
ATOM    107  HA  LEU A   3      -3.662   3.512  -2.575  1.00  0.00           H  
ATOM    108  HB1 LEU A   3      -2.960   1.673  -4.904  1.00  0.00           H  
ATOM    109  HB2 LEU A   3      -4.599   2.268  -4.546  1.00  0.00           H  
ATOM    110  HG  LEU A   3      -2.178   4.056  -5.050  1.00  0.00           H  
ATOM    111 HD11 LEU A   3      -4.529   3.331  -6.858  1.00  0.00           H  
ATOM    112 HD12 LEU A   3      -3.262   4.525  -7.231  1.00  0.00           H  
ATOM    113 HD13 LEU A   3      -2.845   2.801  -7.083  1.00  0.00           H  
ATOM    114 HD21 LEU A   3      -5.166   4.641  -4.828  1.00  0.00           H  
ATOM    115 HD22 LEU A   3      -3.935   5.044  -3.607  1.00  0.00           H  
ATOM    116 HD23 LEU A   3      -3.899   5.835  -5.201  1.00  0.00           H  
HETATM  117  H   UNK A   4      -5.519   1.499  -2.796  1.00  0.00           H  
HETATM  118  H   UNK A   4      -6.221  -0.570  -1.943  1.00  0.00           H  
HETATM  119  H   UNK A   4      -3.483  -0.969  -2.468  1.00  0.00           H  
HETATM  120  H   UNK A   4      -3.692  -1.437  -0.762  1.00  0.00           H  
HETATM  121  H   UNK A   4      -5.914  -2.587  -1.842  1.00  0.00           H  
HETATM  122  H   UNK A   4      -4.813  -2.677  -3.238  1.00  0.00           H  
HETATM  123  H   UNK A   4      -3.338  -3.405  -0.875  1.00  0.00           H  
HETATM  124  H   UNK A   4      -4.851  -4.343  -0.901  1.00  0.00           H  
HETATM  125  H   UNK A   4      -4.343  -4.884  -3.342  1.00  0.00           H  
HETATM  126  H   UNK A   4      -2.735  -4.166  -3.086  1.00  0.00           H  
HETATM  127  H   UNK A   4      -3.364  -5.960  -1.034  1.00  0.00           H  
HETATM  128  H   UNK A   4      -3.525  -6.709  -2.493  1.00  0.00           H  
ATOM    129  H   PHE A   5      -3.459  -0.049   0.337  1.00  0.00           H  
ATOM    130  HA  PHE A   5      -5.105   1.360   2.240  1.00  0.00           H  
ATOM    131  HB1 PHE A   5      -4.391  -1.541   2.847  1.00  0.00           H  
ATOM    132  HB2 PHE A   5      -5.268  -0.415   3.910  1.00  0.00           H  
ATOM    133  HD1 PHE A   5      -5.454  -2.471   0.873  1.00  0.00           H  
ATOM    134  HD2 PHE A   5      -7.559   0.219   3.426  1.00  0.00           H  
ATOM    135  HE1 PHE A   5      -7.574  -3.104  -0.208  1.00  0.00           H  
ATOM    136  HE2 PHE A   5      -9.679  -0.413   2.345  1.00  0.00           H  
ATOM    137  HZ  PHE A   5      -9.686  -2.071   0.525  1.00  0.00           H  
ATOM    138  HA  PRO A   6      -1.385   2.020   4.600  1.00  0.00           H  
ATOM    139  HB1 PRO A   6      -1.295  -0.216   6.513  1.00  0.00           H  
ATOM    140  HB2 PRO A   6      -1.502   1.532   6.818  1.00  0.00           H  
ATOM    141  HG1 PRO A   6      -3.531  -0.402   7.051  1.00  0.00           H  
ATOM    142  HG2 PRO A   6      -3.805   1.357   6.862  1.00  0.00           H  
ATOM    143  HD1 PRO A   6      -4.817   0.801   4.873  1.00  0.00           H  
ATOM    144  HD2 PRO A   6      -4.100  -0.829   4.869  1.00  0.00           H  
HETATM  145  H   UNK A   7       0.662   1.603   3.563  1.00  0.00           H  
HETATM  146  H   UNK A   7       1.826  -0.952   4.272  1.00  0.00           H  
HETATM  147  H   UNK A   7       0.614  -0.675   1.690  1.00  0.00           H  
HETATM  148  H   UNK A   7       2.380  -0.786   1.471  1.00  0.00           H  
HETATM  149  H   UNK A   8       4.618   1.270   2.518  1.00  0.00           H  
HETATM  150  H   UNK A   8       2.116   0.952   0.994  1.00  0.00           H  
HETATM  151  H   UNK A   8       3.253   3.220   1.108  1.00  0.00           H  
HETATM  152  H   UNK A   8       4.648   2.489   0.283  1.00  0.00           H  
ATOM    153  H   TRP A   9       4.318  -1.189   1.722  1.00  0.00           H  
ATOM    154  HA  TRP A   9       4.564  -2.145  -1.057  1.00  0.00           H  
ATOM    155  HB1 TRP A   9       6.872  -1.915   0.929  1.00  0.00           H  
ATOM    156  HB2 TRP A   9       6.945  -2.809  -0.608  1.00  0.00           H  
ATOM    157  HD1 TRP A   9       7.164  -1.384  -2.822  1.00  0.00           H  
ATOM    158  HE1 TRP A   9       7.573   1.084  -3.300  1.00  0.00           H  
ATOM    159  HE3 TRP A   9       6.340   0.509   1.849  1.00  0.00           H  
ATOM    160  HZ2 TRP A   9       7.547   3.564  -1.848  1.00  0.00           H  
ATOM    161  HZ3 TRP A   9       6.539   2.912   2.246  1.00  0.00           H  
ATOM    162  HH2 TRP A   9       7.137   4.434   0.410  1.00  0.00           H  
HETATM  163  H   UNK A  10       3.424  -4.177  -0.854  1.00  0.00           H  
HETATM  164  H   UNK A  10       3.913  -5.895   1.421  1.00  0.00           H  
HETATM  165  H   UNK A  10       1.166  -5.148   1.761  1.00  0.00           H  
HETATM  166  H   UNK A  10       2.513  -4.895   2.901  1.00  0.00           H  
HETATM  167  H   UNK A  11       1.073  -4.951  -0.695  1.00  0.00           H  
HETATM  168  H   UNK A  11       0.938  -7.836  -1.396  1.00  0.00           H  
HETATM  169  H   UNK A  11      -1.311  -7.802  -1.044  1.00  0.00           H  
HETATM  170  H   UNK A  11      -1.004  -6.304  -0.133  1.00  0.00           H  
HETATM  171  H   UNK A  11       0.479  -7.045  -4.861  1.00  0.00           H  
CONECT    1    2   92   93                                            
CONECT    2    1    3    5   94                                       
CONECT    3    2    4    4    8                                       
CONECT    4    3    3                                                 
CONECT    5    2    6    7   95                                       
CONECT    6    5   96                                                 
CONECT    7    5   97   98   99                                       
CONECT    8    9  100    3                                            
CONECT    9    8   10   12  101                                       
CONECT   10    9   11   11   15                                       
CONECT   11   10   10                                                 
CONECT   12    9   13   14  102                                       
CONECT   13   12   61                                                 
CONECT   14   12  103  104  105                                       
CONECT   15   16  106   10                                            
CONECT   16   15   17   19  107                                       
CONECT   17   16   18   18   23                                       
CONECT   18   17   17                                                 
CONECT   19   16   20  108  109                                       
CONECT   20   19   21   22  110                                       
CONECT   21   20  111  112  113                                       
CONECT   22   20  114  115  116                                       
CONECT   23   24  117   17                                            
CONECT   24   23   25   27  118                                       
CONECT   25   24   26   26   32                                       
CONECT   26   25   25                                                 
CONECT   27   24   28  119  120                                       
CONECT   28   27   29  121  122                                       
CONECT   29   28   30  123  124                                       
CONECT   30   29   31  125  126                                       
CONECT   31   30  127  128   89                                       
CONECT   32   33  129   25                                            
CONECT   33   32   34   36  130                                       
CONECT   34   33   35   35   43                                       
CONECT   35   34   34                                                 
CONECT   36   33   37  131  132                                       
CONECT   37   36   38   38   39                                       
CONECT   38   37   37   40  133                                       
CONECT   39   37   41   41  134                                       
CONECT   40   38   42   42  135                                       
CONECT   41   39   39   42  136                                       
CONECT   42   40   40   41  137                                       
CONECT   43   44   49   34                                            
CONECT   44   43   45   47  138                                       
CONECT   45   44   46   46   50                                       
CONECT   46   45   45                                                 
CONECT   47   44   48  139  140                                       
CONECT   48   47   49  141  142                                       
CONECT   49   43   48  143  144                                       
CONECT   50   51  145   45                                            
CONECT   51   50   52   54  146                                       
CONECT   52   51   53   53   56                                       
CONECT   53   52   52                                                 
CONECT   54   51   55  147  148                                       
CONECT   55   54   82                                                 
CONECT   56   57  149   52                                            
CONECT   57   56   58   60  150                                       
CONECT   58   57   59   59   63                                       
CONECT   59   58   58                                                 
CONECT   60   57   61  151  152                                       
CONECT   61   60   62   62   13                                       
CONECT   62   61   61                                                 
CONECT   63   64  153   58                                            
CONECT   64   63   65   67  154                                       
CONECT   65   64   66   66   77                                       
CONECT   66   65   65                                                 
CONECT   67   64   68  155  156                                       
CONECT   68   67   69   69   70                                       
CONECT   69   68   68   71  157                                       
CONECT   70   68   72   72   73                                       
CONECT   71   69   72  158                                            
CONECT   72   70   70   71   74                                       
CONECT   73   70   75   75  159                                       
CONECT   74   72   76   76  160                                       
CONECT   75   73   73   76  161                                       
CONECT   76   74   74   75  162                                       
CONECT   77   78  163   65                                            
CONECT   78   77   79   81  164                                       
CONECT   79   78   80   80   84                                       
CONECT   80   79   79                                                 
CONECT   81   78   82  165  166                                       
CONECT   82   81   83   83   55                                       
CONECT   83   82   82                                                 
CONECT   84   85  167   79                                            
CONECT   85   84   86   88  168                                       
CONECT   86   85   87   87   91                                       
CONECT   87   86   86                                                 
CONECT   88   85   89  169  170                                       
CONECT   89   88   90   90   31                                       
CONECT   90   89   89                                                 
CONECT   91   86  171                                                 
CONECT   92    1                                                      
CONECT   93    1                                                      
CONECT   94    2                                                      
CONECT   95    5                                                      
CONECT   96    6                                                      
CONECT   97    7                                                      
CONECT   98    7                                                      
CONECT   99    7                                                      
CONECT  100    8                                                      
CONECT  101    9                                                      
CONECT  102   12                                                      
CONECT  103   14                                                      
CONECT  104   14                                                      
CONECT  105   14                                                      
CONECT  106   15                                                      
CONECT  107   16                                                      
CONECT  108   19                                                      
CONECT  109   19                                                      
CONECT  110   20                                                      
CONECT  111   21                                                      
CONECT  112   21                                                      
CONECT  113   21                                                      
CONECT  114   22                                                      
CONECT  115   22                                                      
CONECT  116   22                                                      
CONECT  117   23                                                      
CONECT  118   24                                                      
CONECT  119   27                                                      
CONECT  120   27                                                      
CONECT  121   28                                                      
CONECT  122   28                                                      
CONECT  123   29                                                      
CONECT  124   29                                                      
CONECT  125   30                                                      
CONECT  126   30                                                      
CONECT  127   31                                                      
CONECT  128   31                                                      
CONECT  129   32                                                      
CONECT  130   33                                                      
CONECT  131   36                                                      
CONECT  132   36                                                      
CONECT  133   38                                                      
CONECT  134   39                                                      
CONECT  135   40                                                      
CONECT  136   41                                                      
CONECT  137   42                                                      
CONECT  138   44                                                      
CONECT  139   47                                                      
CONECT  140   47                                                      
CONECT  141   48                                                      
CONECT  142   48                                                      
CONECT  143   49                                                      
CONECT  144   49                                                      
CONECT  145   50                                                      
CONECT  146   51                                                      
CONECT  147   54                                                      
CONECT  148   54                                                      
CONECT  149   56                                                      
CONECT  150   57                                                      
CONECT  151   60                                                      
CONECT  152   60                                                      
CONECT  153   63                                                      
CONECT  154   64                                                      
CONECT  155   67                                                      
CONECT  156   67                                                      
CONECT  157   69                                                      
CONECT  158   71                                                      
CONECT  159   73                                                      
CONECT  160   74                                                      
CONECT  161   75                                                      
CONECT  162   76                                                      
CONECT  163   77                                                      
CONECT  164   78                                                      
CONECT  165   81                                                      
CONECT  166   81                                                      
CONECT  167   84                                                      
CONECT  168   85                                                      
CONECT  169   88                                                      
CONECT  170   88                                                      
CONECT  171   91                                                      
MASTER        0    0    0    0    0    0    0    0  171    0  171    0
END
