COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNK A   0       9.651   6.129  -1.182  1.00  0.00           C  
HETATM    2  O   UNK A   0      10.679   6.049  -1.820  1.00  0.00           O  
HETATM    3  C   UNK A   0       8.969   7.462  -1.016  1.00  0.00           C  
ATOM      4  N   LEU A   1       9.114   5.024  -0.627  1.00  0.00           N  
ATOM      5  CA  LEU A   1       9.711   3.711  -0.885  1.00  0.00           C  
ATOM      6  C   LEU A   1       9.323   2.758   0.216  1.00  0.00           C  
ATOM      7  O   LEU A   1       8.582   3.125   1.103  1.00  0.00           O  
ATOM      8  CB  LEU A   1       9.204   3.175  -2.226  1.00  0.00           C  
ATOM      9  CG  LEU A   1       7.675   3.204  -2.241  1.00  0.00           C  
ATOM     10  CD1 LEU A   1       7.173   2.855  -3.644  1.00  0.00           C  
ATOM     11  CD2 LEU A   1       7.135   2.184  -1.237  1.00  0.00           C  
ATOM     12  N   ASP A   2       9.798   1.497   0.214  1.00  0.00           N  
ATOM     13  CA  ASP A   2       9.346   0.542   1.229  1.00  0.00           C  
ATOM     14  C   ASP A   2       8.713  -0.647   0.554  1.00  0.00           C  
ATOM     15  O   ASP A   2       8.646  -0.693  -0.656  1.00  0.00           O  
ATOM     16  CB  ASP A   2      10.543   0.078   2.062  1.00  0.00           C  
ATOM     17  CG  ASP A   2      11.118   1.252   2.812  1.00  0.00           C  
ATOM     18  OD1 ASP A   2      10.557   2.322   2.782  1.00  0.00           O  
ATOM     19  OD2 ASP A   2      12.254   1.109   3.513  1.00  0.00           O  
ATOM     20  N   PRO A   3       8.221  -1.660   1.294  1.00  0.00           N  
ATOM     21  CA  PRO A   3       7.581  -2.874   0.768  1.00  0.00           C  
ATOM     22  C   PRO A   3       6.369  -2.502  -0.046  1.00  0.00           C  
ATOM     23  O   PRO A   3       6.062  -1.337  -0.179  1.00  0.00           O  
ATOM     24  CB  PRO A   3       7.157  -3.731   1.980  1.00  0.00           C  
ATOM     25  CG  PRO A   3       7.074  -2.691   3.128  1.00  0.00           C  
ATOM     26  CD  PRO A   3       8.242  -1.737   2.767  1.00  0.00           C  
ATOM     27  N   PRO A   4       5.626  -3.465  -0.627  1.00  0.00           N  
ATOM     28  CA  PRO A   4       4.424  -3.244  -1.444  1.00  0.00           C  
ATOM     29  C   PRO A   4       3.376  -2.527  -0.632  1.00  0.00           C  
ATOM     30  O   PRO A   4       3.604  -2.225   0.520  1.00  0.00           O  
ATOM     31  CB  PRO A   4       3.898  -4.631  -1.871  1.00  0.00           C  
ATOM     32  CG  PRO A   4       4.507  -5.577  -0.802  1.00  0.00           C  
ATOM     33  CD  PRO A   4       5.887  -4.914  -0.553  1.00  0.00           C  
ATOM     34  N   LEU A   5       2.187  -2.220  -1.187  1.00  0.00           N  
ATOM     35  CA  LEU A   5       1.169  -1.523  -0.397  1.00  0.00           C  
ATOM     36  C   LEU A   5      -0.197  -1.828  -0.957  1.00  0.00           C  
ATOM     37  O   LEU A   5      -0.309  -2.556  -1.921  1.00  0.00           O  
ATOM     38  CB  LEU A   5       1.420  -0.015  -0.458  1.00  0.00           C  
ATOM     39  CG  LEU A   5       2.752   0.308   0.222  1.00  0.00           C  
ATOM     40  CD1 LEU A   5       3.063   1.796   0.053  1.00  0.00           C  
ATOM     41  CD2 LEU A   5       2.657  -0.026   1.712  1.00  0.00           C  
ATOM     42  N   HIS A   6      -1.294  -1.291  -0.387  1.00  0.00           N  
ATOM     43  CA  HIS A   6      -2.622  -1.587  -0.931  1.00  0.00           C  
ATOM     44  C   HIS A   6      -3.570  -0.471  -0.577  1.00  0.00           C  
ATOM     45  O   HIS A   6      -3.176   0.478   0.067  1.00  0.00           O  
ATOM     46  CB  HIS A   6      -3.135  -2.901  -0.338  1.00  0.00           C  
ATOM     47  CG  HIS A   6      -2.255  -4.036  -0.794  1.00  0.00           C  
ATOM     48  ND1 HIS A   6      -1.214  -4.547  -0.118  1.00  0.00           N1+
ATOM     49  CD2 HIS A   6      -2.378  -4.719  -1.948  1.00  0.00           C  
ATOM     50  CE1 HIS A   6      -0.686  -5.517  -0.812  1.00  0.00           C  
ATOM     51  NE2 HIS A   6      -1.382  -5.657  -1.961  1.00  0.00           N  
HETATM   52  N   UNK A   7      -4.857  -0.528  -0.975  1.00  0.00           N  
HETATM   53  C   UNK A   7      -5.779   0.557  -0.631  1.00  0.00           C  
HETATM   54  C   UNK A   7      -7.191   0.031  -0.619  1.00  0.00           C  
HETATM   55  O   UNK A   7      -7.406  -1.135  -0.873  1.00  0.00           O  
HETATM   56  C   UNK A   7      -5.660   1.676  -1.668  1.00  0.00           C  
HETATM   57  O   UNK A   7      -6.100   1.195  -2.940  1.00  0.00           O  
HETATM   58  N   UNK A   7      -8.215   0.856  -0.326  1.00  0.00           N  
HETATM   59  C   UNK A   7      -9.588   0.345  -0.314  1.00  0.00           C  
HETATM   60  C   UNK A   7      -9.889  -0.275   1.052  1.00  0.00           C  
HETATM   61  C   UNK A   7      -8.945  -1.454   1.296  1.00  0.00           C  
HETATM   62  O   UNK A   7      -9.700   0.706   2.073  1.00  0.00           O  
HETATM   63  P   UNK A   7     -10.876   1.175   3.067  1.00  0.00           P  
HETATM   64  O   UNK A   7     -11.449  -0.008   3.747  1.00  0.00           O  
HETATM   65  O   UNK A   7     -10.278   2.188   4.166  1.00  0.00           O  
HETATM   66  O   UNK A   7     -12.028   1.919   2.223  1.00  0.00           O  
HETATM   67  C   UNK A   7     -10.548   1.477  -0.574  1.00  0.00           C  
HETATM   68  O   UNK A   7     -10.164   2.626  -0.504  1.00  0.00           O  
HETATM   69  N   UNK A   7     -11.833   1.214  -0.885  1.00  0.00           N  
HETATM   70  C   UNK A   7     -12.794   2.311  -1.016  1.00  0.00           C  
HETATM   71  C   UNK A   7     -14.185   1.794  -0.753  1.00  0.00           C  
HETATM   72  O   UNK A   7     -14.356   0.624  -0.482  1.00  0.00           O  
HETATM   73  C   UNK A   7     -12.723   2.885  -2.432  1.00  0.00           C  
HETATM   74  N   UNK A   7     -15.239   2.631  -0.818  1.00  0.00           N  
HETATM   75  H   UNK A   0       8.261   7.613  -1.831  1.00  0.00           H  
HETATM   76  H   UNK A   0       8.437   7.483  -0.065  1.00  0.00           H  
HETATM   77  H   UNK A   0       9.715   8.257  -1.032  1.00  0.00           H  
ATOM     78  H   LEU A   1       8.333   5.098  -0.056  1.00  0.00           H  
ATOM     79  HA  LEU A   1      10.796   3.805  -0.918  1.00  0.00           H  
ATOM     80  HB1 LEU A   1       9.588   3.798  -3.034  1.00  0.00           H  
ATOM     81  HB2 LEU A   1       9.550   2.150  -2.361  1.00  0.00           H  
ATOM     82  HG  LEU A   1       7.327   4.201  -1.969  1.00  0.00           H  
ATOM     83 HD11 LEU A   1       7.520   1.858  -3.916  1.00  0.00           H  
ATOM     84 HD12 LEU A   1       6.083   2.875  -3.655  1.00  0.00           H  
ATOM     85 HD13 LEU A   1       7.557   3.582  -4.359  1.00  0.00           H  
ATOM     86 HD21 LEU A   1       7.260   2.569  -0.225  1.00  0.00           H  
ATOM     87 HD22 LEU A   1       6.077   2.009  -1.431  1.00  0.00           H  
ATOM     88 HD23 LEU A   1       7.683   1.247  -1.341  1.00  0.00           H  
ATOM     89  H   ASP A   2      10.440   1.221  -0.459  1.00  0.00           H  
ATOM     90  HA  ASP A   2       8.615   1.022   1.880  1.00  0.00           H  
ATOM     91  HB1 ASP A   2      10.219  -0.683   2.772  1.00  0.00           H  
ATOM     92  HB2 ASP A   2      11.304  -0.340   1.403  1.00  0.00           H  
ATOM     93  HD2 ASP A   2      12.584   1.890   3.978  1.00  0.00           H  
ATOM     94  HA  PRO A   3       8.288  -3.428   0.149  1.00  0.00           H  
ATOM     95  HB1 PRO A   3       6.184  -4.191   1.805  1.00  0.00           H  
ATOM     96  HB2 PRO A   3       7.909  -4.488   2.199  1.00  0.00           H  
ATOM     97  HG1 PRO A   3       6.118  -2.167   3.112  1.00  0.00           H  
ATOM     98  HG2 PRO A   3       7.242  -3.163   4.096  1.00  0.00           H  
ATOM     99  HD1 PRO A   3       9.191  -2.148   3.112  1.00  0.00           H  
ATOM    100  HD2 PRO A   3       8.075  -0.751   3.200  1.00  0.00           H  
ATOM    101  HA  PRO A   4       4.678  -2.654  -2.325  1.00  0.00           H  
ATOM    102  HB1 PRO A   4       2.809  -4.659  -1.835  1.00  0.00           H  
ATOM    103  HB2 PRO A   4       4.259  -4.891  -2.866  1.00  0.00           H  
ATOM    104  HG1 PRO A   4       3.902  -5.582   0.105  1.00  0.00           H  
ATOM    105  HG2 PRO A   4       4.625  -6.586  -1.196  1.00  0.00           H  
ATOM    106  HD1 PRO A   4       6.598  -5.212  -1.324  1.00  0.00           H  
ATOM    107  HD2 PRO A   4       6.263  -5.182   0.435  1.00  0.00           H  
ATOM    108  H   LEU A   5       2.005  -2.461  -2.109  1.00  0.00           H  
ATOM    109  HA  LEU A   5       1.220  -1.858   0.639  1.00  0.00           H  
ATOM    110  HB1 LEU A   5       1.457   0.305  -1.500  1.00  0.00           H  
ATOM    111  HB2 LEU A   5       0.613   0.509   0.054  1.00  0.00           H  
ATOM    112  HG  LEU A   5       3.546  -0.284  -0.233  1.00  0.00           H  
ATOM    113 HD11 LEU A   5       2.270   2.388   0.508  1.00  0.00           H  
ATOM    114 HD12 LEU A   5       4.012   2.026   0.538  1.00  0.00           H  
ATOM    115 HD13 LEU A   5       3.131   2.034  -1.009  1.00  0.00           H  
ATOM    116 HD21 LEU A   5       3.605   0.204   2.197  1.00  0.00           H  
ATOM    117 HD22 LEU A   5       1.863   0.565   2.168  1.00  0.00           H  
ATOM    118 HD23 LEU A   5       2.435  -1.087   1.833  1.00  0.00           H  
ATOM    119  H   HIS A   6      -1.205  -0.709   0.384  1.00  0.00           H  
ATOM    120  HA  HIS A   6      -2.557  -1.679  -2.016  1.00  0.00           H  
ATOM    121  HB1 HIS A   6      -3.115  -2.840   0.750  1.00  0.00           H  
ATOM    122  HB2 HIS A   6      -4.157  -3.076  -0.673  1.00  0.00           H  
ATOM    123  HD1 HIS A   6      -0.904  -4.243   0.749  1.00  0.00           H  
ATOM    124  HD2 HIS A   6      -3.121  -4.557  -2.715  1.00  0.00           H  
ATOM    125  HE1 HIS A   6       0.166  -6.112  -0.516  1.00  0.00           H  
ATOM    126  HE2 HIS A   6      -1.210  -6.304  -2.663  1.00  0.00           H  
HETATM  127  H   UNK A   7      -5.172  -1.288  -1.490  1.00  0.00           H  
HETATM  128  H   UNK A   7      -5.528   0.947   0.355  1.00  0.00           H  
HETATM  129  H   UNK A   7      -6.279   2.519  -1.364  1.00  0.00           H  
HETATM  130  H   UNK A   7      -4.620   1.995  -1.740  1.00  0.00           H  
HETATM  131  H   UNK A   7      -6.052   1.853  -3.647  1.00  0.00           H  
HETATM  132  H   UNK A   7      -8.043   1.789  -0.123  1.00  0.00           H  
HETATM  133  H   UNK A   7      -9.700  -0.412  -1.090  1.00  0.00           H  
HETATM  134  H   UNK A   7     -10.921  -0.626   1.072  1.00  0.00           H  
HETATM  135  H   UNK A   7      -7.922  -1.089   1.379  1.00  0.00           H  
HETATM  136  H   UNK A   7      -9.227  -1.960   2.220  1.00  0.00           H  
HETATM  137  H   UNK A   7      -9.015  -2.154   0.463  1.00  0.00           H  
HETATM  138  H   UNK A   7     -10.932   2.513   4.800  1.00  0.00           H  
HETATM  139  H   UNK A   7     -11.723   2.705   1.750  1.00  0.00           H  
HETATM  140  H   UNK A   7     -12.120   0.297  -1.021  1.00  0.00           H  
HETATM  141  H   UNK A   7     -12.555   3.092  -0.295  1.00  0.00           H  
HETATM  142  H   UNK A   7     -13.439   3.701  -2.530  1.00  0.00           H  
HETATM  143  H   UNK A   7     -11.717   3.259  -2.623  1.00  0.00           H  
HETATM  144  H   UNK A   7     -12.963   2.103  -3.154  1.00  0.00           H  
HETATM  145  H   UNK A   7     -15.102   3.567  -1.035  1.00  0.00           H  
HETATM  146  H   UNK A   7     -16.134   2.298  -0.649  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1                                                 
CONECT    3    1   75   76   77                                       
CONECT    4    5   78    1                                            
CONECT    5    4    6    8   79                                       
CONECT    6    5    7    7   12                                       
CONECT    7    6    6                                                 
CONECT    8    5    9   80   81                                       
CONECT    9    8   10   11   82                                       
CONECT   10    9   83   84   85                                       
CONECT   11    9   86   87   88                                       
CONECT   12   13   89    6                                            
CONECT   13   12   14   16   90                                       
CONECT   14   13   15   15   20                                       
CONECT   15   14   14                                                 
CONECT   16   13   17   91   92                                       
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   93                                                 
CONECT   20   21   26   14                                            
CONECT   21   20   22   24   94                                       
CONECT   22   21   23   23   27                                       
CONECT   23   22   22                                                 
CONECT   24   21   25   95   96                                       
CONECT   25   24   26   97   98                                       
CONECT   26   20   25   99  100                                       
CONECT   27   28   33   22                                            
CONECT   28   27   29   31  101                                       
CONECT   29   28   30   30   34                                       
CONECT   30   29   29                                                 
CONECT   31   28   32  102  103                                       
CONECT   32   31   33  104  105                                       
CONECT   33   27   32  106  107                                       
CONECT   34   35  108   29                                            
CONECT   35   34   36   38  109                                       
CONECT   36   35   37   37   42                                       
CONECT   37   36   36                                                 
CONECT   38   35   39  110  111                                       
CONECT   39   38   40   41  112                                       
CONECT   40   39  113  114  115                                       
CONECT   41   39  116  117  118                                       
CONECT   42   43  119   36                                            
CONECT   43   42   44   46  120                                       
CONECT   44   43   45   45   52                                       
CONECT   45   44   44                                                 
CONECT   46   43   47  121  122                                       
CONECT   47   46   48   49   49                                       
CONECT   48   47   50   50  123                                       
CONECT   49   47   47   51  124                                       
CONECT   50   48   48   51  125                                       
CONECT   51   49   50  126                                            
CONECT   52   53  127   44                                            
CONECT   53   52   54   56  128                                       
CONECT   54   53   55   55   58                                       
CONECT   55   54   54                                                 
CONECT   56   53   57  129  130                                       
CONECT   57   56  131                                                 
CONECT   58   59  132   54                                            
CONECT   59   58   60   67  133                                       
CONECT   60   59   61   62  134                                       
CONECT   61   60  135  136  137                                       
CONECT   62   60   63                                                 
CONECT   63   62   64   64   65                                       
CONECT   63   66                                                      
CONECT   64   63   63                                                 
CONECT   65   63  138                                                 
CONECT   66   63  139                                                 
CONECT   67   59   68   68   69                                       
CONECT   68   67   67                                                 
CONECT   69   70  140   67                                            
CONECT   70   69   71   73  141                                       
CONECT   71   70   72   72   74                                       
CONECT   72   71   71                                                 
CONECT   73   70  142  143  144                                       
CONECT   74  145  146   71                                            
CONECT   75    3                                                      
CONECT   76    3                                                      
CONECT   77    3                                                      
CONECT   78    4                                                      
CONECT   79    5                                                      
CONECT   80    8                                                      
CONECT   81    8                                                      
CONECT   82    9                                                      
CONECT   83   10                                                      
CONECT   84   10                                                      
CONECT   85   10                                                      
CONECT   86   11                                                      
CONECT   87   11                                                      
CONECT   88   11                                                      
CONECT   89   12                                                      
CONECT   90   13                                                      
CONECT   91   16                                                      
CONECT   92   16                                                      
CONECT   93   19                                                      
CONECT   94   21                                                      
CONECT   95   24                                                      
CONECT   96   24                                                      
CONECT   97   25                                                      
CONECT   98   25                                                      
CONECT   99   26                                                      
CONECT  100   26                                                      
CONECT  101   28                                                      
CONECT  102   31                                                      
CONECT  103   31                                                      
CONECT  104   32                                                      
CONECT  105   32                                                      
CONECT  106   33                                                      
CONECT  107   33                                                      
CONECT  108   34                                                      
CONECT  109   35                                                      
CONECT  110   38                                                      
CONECT  111   38                                                      
CONECT  112   39                                                      
CONECT  113   40                                                      
CONECT  114   40                                                      
CONECT  115   40                                                      
CONECT  116   41                                                      
CONECT  117   41                                                      
CONECT  118   41                                                      
CONECT  119   42                                                      
CONECT  120   43                                                      
CONECT  121   46                                                      
CONECT  122   46                                                      
CONECT  123   48                                                      
CONECT  124   49                                                      
CONECT  125   50                                                      
CONECT  126   51                                                      
CONECT  127   52                                                      
CONECT  128   53                                                      
CONECT  129   56                                                      
CONECT  130   56                                                      
CONECT  131   57                                                      
CONECT  132   58                                                      
CONECT  133   59                                                      
CONECT  134   60                                                      
CONECT  135   61                                                      
CONECT  136   61                                                      
CONECT  137   61                                                      
CONECT  138   65                                                      
CONECT  139   66                                                      
CONECT  140   69                                                      
CONECT  141   70                                                      
CONECT  142   73                                                      
CONECT  143   73                                                      
CONECT  144   73                                                      
CONECT  145   74                                                      
CONECT  146   74                                                      
MASTER        0    0    0    0    0    0    0    0  146    0  146    0
END
