COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0      10.462  -0.692  -1.449  1.00  0.00           C  
HETATM    2  O   UNK A   0      10.755  -0.558  -2.619  1.00  0.00           O  
HETATM    3  C   UNK A   0      11.416  -1.382  -0.508  1.00  0.00           C  
HETATM    4  C   UNK A   0      12.667  -1.812  -1.275  1.00  0.00           C  
HETATM    5  C   UNK A   0      13.621  -2.503  -0.334  1.00  0.00           C  
HETATM    6  C   UNK A   0      13.622  -3.799  -0.097  1.00  0.00           C  
HETATM    7  S   UNK A   0      14.873  -1.684   0.579  1.00  0.00           S  
HETATM    8  C   UNK A   0      14.632  -4.247   0.849  1.00  0.00           C  
HETATM    9  C   UNK A   0      15.411  -3.186   1.319  1.00  0.00           C  
HETATM   10  C   UNK A   0      16.436  -3.432   2.238  1.00  0.00           C  
HETATM   11  C   UNK A   0      16.675  -4.711   2.681  1.00  0.00           C  
HETATM   12  C   UNK A   0      15.900  -5.766   2.219  1.00  0.00           C  
HETATM   13  C   UNK A   0      14.903  -5.551   1.318  1.00  0.00           C  
ATOM     14  N   ASP A   1       9.287  -0.219  -0.991  1.00  0.00           N  
ATOM     15  CA  ASP A   1       8.412   0.553  -1.877  1.00  0.00           C  
ATOM     16  C   ASP A   1       7.587   1.512  -1.058  1.00  0.00           C  
ATOM     17  O   ASP A   1       7.507   1.370   0.144  1.00  0.00           O  
ATOM     18  CB  ASP A   1       7.484  -0.400  -2.634  1.00  0.00           C  
ATOM     19  CG  ASP A   1       6.735  -1.260  -1.648  1.00  0.00           C  
ATOM     20  OD1 ASP A   1       6.882  -1.087  -0.461  1.00  0.00           O  
ATOM     21  OD2 ASP A   1       5.905  -2.218  -2.089  1.00  0.00           O  
ATOM     22  N   PRO A   2       6.938   2.528  -1.661  1.00  0.00           N  
ATOM     23  CA  PRO A   2       6.126   3.549  -0.983  1.00  0.00           C  
ATOM     24  C   PRO A   2       4.994   2.891  -0.237  1.00  0.00           C  
ATOM     25  O   PRO A   2       4.716   1.731  -0.458  1.00  0.00           O  
ATOM     26  CB  PRO A   2       5.563   4.485  -2.073  1.00  0.00           C  
ATOM     27  CG  PRO A   2       5.627   3.608  -3.351  1.00  0.00           C  
ATOM     28  CD  PRO A   2       6.931   2.803  -3.109  1.00  0.00           C  
ATOM     29  N   PRO A   3       4.290   3.592   0.674  1.00  0.00           N  
ATOM     30  CA  PRO A   3       3.223   3.054   1.531  1.00  0.00           C  
ATOM     31  C   PRO A   3       2.112   2.499   0.677  1.00  0.00           C  
ATOM     32  O   PRO A   3       2.167   2.598  -0.530  1.00  0.00           O  
ATOM     33  CB  PRO A   3       2.693   4.221   2.390  1.00  0.00           C  
ATOM     34  CG  PRO A   3       3.103   5.471   1.567  1.00  0.00           C  
ATOM     35  CD  PRO A   3       4.467   5.022   0.982  1.00  0.00           C  
ATOM     36  N   LEU A   4       1.056   1.893   1.256  1.00  0.00           N  
ATOM     37  CA  LEU A   4       0.013   1.287   0.425  1.00  0.00           C  
ATOM     38  C   LEU A   4      -1.327   1.467   1.091  1.00  0.00           C  
ATOM     39  O   LEU A   4      -1.403   2.045   2.155  1.00  0.00           O  
ATOM     40  CB  LEU A   4       0.300  -0.206   0.253  1.00  0.00           C  
ATOM     41  CG  LEU A   4       1.602  -0.387  -0.530  1.00  0.00           C  
ATOM     42  CD1 LEU A   4       1.987  -1.868  -0.543  1.00  0.00           C  
ATOM     43  CD2 LEU A   4       1.405   0.101  -1.967  1.00  0.00           C  
ATOM     44  N   HIS A   5      -2.441   0.987   0.504  1.00  0.00           N  
ATOM     45  CA  HIS A   5      -3.744   1.162   1.151  1.00  0.00           C  
ATOM     46  C   HIS A   5      -4.686   0.081   0.685  1.00  0.00           C  
ATOM     47  O   HIS A   5      -4.306  -0.753  -0.109  1.00  0.00           O  
ATOM     48  CB  HIS A   5      -4.317   2.532   0.782  1.00  0.00           C  
ATOM     49  CG  HIS A   5      -3.439   3.615   1.354  1.00  0.00           C  
ATOM     50  ND1 HIS A   5      -2.448   4.248   0.710  1.00  0.00           N1+
ATOM     51  CD2 HIS A   5      -3.515   4.119   2.600  1.00  0.00           C  
ATOM     52  CE1 HIS A   5      -1.904   5.123   1.511  1.00  0.00           C  
ATOM     53  NE2 HIS A   5      -2.540   5.075   2.701  1.00  0.00           N  
HETATM   54  N   UNK A   6      -5.950   0.042   1.151  1.00  0.00           N  
HETATM   55  C   UNK A   6      -6.865  -1.008   0.699  1.00  0.00           C  
HETATM   56  C   UNK A   6      -8.287  -0.528   0.834  1.00  0.00           C  
HETATM   57  O   UNK A   6      -8.513   0.582   1.266  1.00  0.00           O  
HETATM   58  C   UNK A   6      -6.666  -2.261   1.554  1.00  0.00           C  
HETATM   59  O   UNK A   6      -7.048  -1.983   2.903  1.00  0.00           O  
HETATM   60  N   UNK A   6      -9.307  -1.333   0.475  1.00  0.00           N  
HETATM   61  C   UNK A   6     -10.689  -0.866   0.606  1.00  0.00           C  
HETATM   62  C   UNK A   6     -11.077  -0.064  -0.638  1.00  0.00           C  
HETATM   63  C   UNK A   6     -10.168   1.161  -0.758  1.00  0.00           C  
HETATM   64  O   UNK A   6     -10.928  -0.883  -1.799  1.00  0.00           O  
HETATM   65  P   UNK A   6     -12.150  -1.234  -2.787  1.00  0.00           P  
HETATM   66  O   UNK A   6     -13.257  -1.835  -2.009  1.00  0.00           O  
HETATM   67  O   UNK A   6     -12.666   0.113  -3.501  1.00  0.00           O  
HETATM   68  O   UNK A   6     -11.652  -2.279  -3.906  1.00  0.00           O  
HETATM   69  C   UNK A   6     -11.609  -2.052   0.746  1.00  0.00           C  
HETATM   70  O   UNK A   6     -11.169  -3.176   0.636  1.00  0.00           O  
HETATM   71  N   UNK A   6     -12.920  -1.862   0.993  1.00  0.00           N  
HETATM   72  C   UNK A   6     -13.833  -3.007   1.019  1.00  0.00           C  
HETATM   73  C   UNK A   6     -15.231  -2.542   0.699  1.00  0.00           C  
HETATM   74  O   UNK A   6     -15.443  -1.370   0.471  1.00  0.00           O  
HETATM   75  C   UNK A   6     -13.814  -3.644   2.410  1.00  0.00           C  
HETATM   76  N   UNK A   6     -16.245  -3.429   0.665  1.00  0.00           N  
HETATM   77  H   UNK A   0      11.697  -0.696   0.291  1.00  0.00           H  
HETATM   78  H   UNK A   0      10.932  -2.259  -0.080  1.00  0.00           H  
HETATM   79  H   UNK A   0      12.386  -2.498  -2.074  1.00  0.00           H  
HETATM   80  H   UNK A   0      13.151  -0.935  -1.704  1.00  0.00           H  
HETATM   81  H   UNK A   0      12.927  -4.477  -0.568  1.00  0.00           H  
HETATM   82  H   UNK A   0      17.042  -2.614   2.600  1.00  0.00           H  
HETATM   83  H   UNK A   0      17.469  -4.896   3.390  1.00  0.00           H  
HETATM   84  H   UNK A   0      16.095  -6.768   2.572  1.00  0.00           H  
HETATM   85  H   UNK A   0      14.312  -6.382   0.963  1.00  0.00           H  
ATOM     86  H   ASP A   1       9.020  -0.389  -0.074  1.00  0.00           H  
ATOM     87  HA  ASP A   1       9.018   1.112  -2.590  1.00  0.00           H  
ATOM     88  HB1 ASP A   1       6.773   0.178  -3.225  1.00  0.00           H  
ATOM     89  HB2 ASP A   1       8.075  -1.034  -3.294  1.00  0.00           H  
ATOM     90  HD2 ASP A   1       5.394  -2.697  -1.422  1.00  0.00           H  
ATOM     91  HA  PRO A   2       6.747   4.116  -0.289  1.00  0.00           H  
ATOM     92  HB1 PRO A   2       4.534   4.764  -1.848  1.00  0.00           H  
ATOM     93  HB2 PRO A   2       6.189   5.371  -2.182  1.00  0.00           H  
ATOM     94  HG1 PRO A   2       4.762   2.947  -3.415  1.00  0.00           H  
ATOM     95  HG2 PRO A   2       5.710   4.225  -4.246  1.00  0.00           H  
ATOM     96  HD1 PRO A   2       7.802   3.397  -3.387  1.00  0.00           H  
ATOM     97  HD2 PRO A   2       6.911   1.871  -3.673  1.00  0.00           H  
ATOM     98  HA  PRO A   3       3.624   2.270   2.173  1.00  0.00           H  
ATOM     99  HB1 PRO A   3       1.609   4.164   2.491  1.00  0.00           H  
ATOM    100  HB2 PRO A   3       3.173   4.228   3.368  1.00  0.00           H  
ATOM    101  HG1 PRO A   3       2.381   5.672   0.776  1.00  0.00           H  
ATOM    102  HG2 PRO A   3       3.224   6.341   2.213  1.00  0.00           H  
ATOM    103  HD1 PRO A   3       5.261   5.157   1.716  1.00  0.00           H  
ATOM    104  HD2 PRO A   3       4.692   5.581   0.073  1.00  0.00           H  
ATOM    105  H   LEU A   4       0.987   1.858   2.223  1.00  0.00           H  
ATOM    106  HA  LEU A   4       0.001   1.770  -0.552  1.00  0.00           H  
ATOM    107  HB1 LEU A   4       0.398  -0.672   1.233  1.00  0.00           H  
ATOM    108  HB2 LEU A   4      -0.520  -0.673  -0.292  1.00  0.00           H  
ATOM    109  HG  LEU A   4       2.395   0.190  -0.056  1.00  0.00           H  
ATOM    110 HD11 LEU A   4       1.159  -2.455  -0.941  1.00  0.00           H  
ATOM    111 HD12 LEU A   4       2.867  -2.009  -1.170  1.00  0.00           H  
ATOM    112 HD13 LEU A   4       2.208  -2.195   0.473  1.00  0.00           H  
ATOM    113 HD21 LEU A   4       1.131   1.156  -1.957  1.00  0.00           H  
ATOM    114 HD22 LEU A   4       2.332  -0.028  -2.525  1.00  0.00           H  
ATOM    115 HD23 LEU A   4       0.612  -0.476  -2.441  1.00  0.00           H  
ATOM    116  H   HIS A   5      -2.381   0.525  -0.347  1.00  0.00           H  
ATOM    117  HA  HIS A   5      -3.624   1.098   2.233  1.00  0.00           H  
ATOM    118  HB1 HIS A   5      -4.354   2.629  -0.303  1.00  0.00           H  
ATOM    119  HB2 HIS A   5      -5.323   2.627   1.190  1.00  0.00           H  
ATOM    120  HD1 HIS A   5      -2.178   4.082  -0.207  1.00  0.00           H  
ATOM    121  HD2 HIS A   5      -4.212   3.827   3.372  1.00  0.00           H  
ATOM    122  HE1 HIS A   5      -1.083   5.779   1.262  1.00  0.00           H  
ATOM    123  HE2 HIS A   5      -2.345   5.618   3.480  1.00  0.00           H  
HETATM  124  H   UNK A   6      -6.253   0.709   1.787  1.00  0.00           H  
HETATM  125  H   UNK A   6      -6.659  -1.245  -0.345  1.00  0.00           H  
HETATM  126  H   UNK A   6      -7.282  -3.070   1.162  1.00  0.00           H  
HETATM  127  H   UNK A   6      -5.617  -2.557   1.527  1.00  0.00           H  
HETATM  128  H   UNK A   6      -6.948  -2.734   3.503  1.00  0.00           H  
HETATM  129  H   UNK A   6      -9.125  -2.221   0.129  1.00  0.00           H  
HETATM  130  H   UNK A   6     -10.776  -0.232   1.489  1.00  0.00           H  
HETATM  131  H   UNK A   6     -12.114   0.261  -0.552  1.00  0.00           H  
HETATM  132  H   UNK A   6      -9.145   0.837  -0.951  1.00  0.00           H  
HETATM  133  H   UNK A   6     -10.512   1.789  -1.581  1.00  0.00           H  
HETATM  134  H   UNK A   6     -10.200   1.730   0.171  1.00  0.00           H  
HETATM  135  H   UNK A   6     -11.992   0.561  -4.030  1.00  0.00           H  
HETATM  136  H   UNK A   6     -12.338  -2.536  -4.537  1.00  0.00           H  
HETATM  137  H   UNK A   6     -13.259  -0.967   1.153  1.00  0.00           H  
HETATM  138  H   UNK A   6     -13.516  -3.741   0.278  1.00  0.00           H  
HETATM  139  H   UNK A   6     -14.131  -2.909   3.150  1.00  0.00           H  
HETATM  140  H   UNK A   6     -14.493  -4.496   2.429  1.00  0.00           H  
HETATM  141  H   UNK A   6     -12.803  -3.980   2.641  1.00  0.00           H  
HETATM  142  H   UNK A   6     -16.075  -4.367   0.847  1.00  0.00           H  
HETATM  143  H   UNK A   6     -17.144  -3.130   0.459  1.00  0.00           H  
CONECT    1    3    2    2   14                                       
CONECT    2    1    1                                                 
CONECT    3    4    1   77   78                                       
CONECT    4    3    5   79   80                                       
CONECT    5    4    6    6    7                                       
CONECT    6    5    5    8   81                                       
CONECT    7    5    9                                                 
CONECT    8    6    9    9   13                                       
CONECT    9    7    8    8   10                                       
CONECT   10    9   11   11   82                                       
CONECT   11   10   10   12   83                                       
CONECT   12   13   13   11   84                                       
CONECT   13    8   12   12   85                                       
CONECT   14   15   86    1                                            
CONECT   15   14   16   18   87                                       
CONECT   16   15   17   17   22                                       
CONECT   17   16   16                                                 
CONECT   18   15   19   88   89                                       
CONECT   19   18   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   90                                                 
CONECT   22   23   28   16                                            
CONECT   23   22   24   26   91                                       
CONECT   24   23   25   25   29                                       
CONECT   25   24   24                                                 
CONECT   26   23   27   92   93                                       
CONECT   27   26   28   94   95                                       
CONECT   28   22   27   96   97                                       
CONECT   29   30   35   24                                            
CONECT   30   29   31   33   98                                       
CONECT   31   30   32   32   36                                       
CONECT   32   31   31                                                 
CONECT   33   30   34   99  100                                       
CONECT   34   33   35  101  102                                       
CONECT   35   29   34  103  104                                       
CONECT   36   37  105   31                                            
CONECT   37   36   38   40  106                                       
CONECT   38   37   39   39   44                                       
CONECT   39   38   38                                                 
CONECT   40   37   41  107  108                                       
CONECT   41   40   42   43  109                                       
CONECT   42   41  110  111  112                                       
CONECT   43   41  113  114  115                                       
CONECT   44   45  116   38                                            
CONECT   45   44   46   48  117                                       
CONECT   46   45   47   47   54                                       
CONECT   47   46   46                                                 
CONECT   48   45   49  118  119                                       
CONECT   49   48   50   51   51                                       
CONECT   50   49   52   52  120                                       
CONECT   51   49   49   53  121                                       
CONECT   52   50   50   53  122                                       
CONECT   53   51   52  123                                            
CONECT   54   55  124   46                                            
CONECT   55   54   56   58  125                                       
CONECT   56   55   57   57   60                                       
CONECT   57   56   56                                                 
CONECT   58   55   59  126  127                                       
CONECT   59   58  128                                                 
CONECT   60   61  129   56                                            
CONECT   61   60   62   69  130                                       
CONECT   62   61   63   64  131                                       
CONECT   63   62  132  133  134                                       
CONECT   64   62   65                                                 
CONECT   65   64   66   66   67                                       
CONECT   65   68                                                      
CONECT   66   65   65                                                 
CONECT   67   65  135                                                 
CONECT   68   65  136                                                 
CONECT   69   61   70   70   71                                       
CONECT   70   69   69                                                 
CONECT   71   72  137   69                                            
CONECT   72   71   73   75  138                                       
CONECT   73   72   74   74   76                                       
CONECT   74   73   73                                                 
CONECT   75   72  139  140  141                                       
CONECT   76  142  143   73                                            
CONECT   77    3                                                      
CONECT   78    3                                                      
CONECT   79    4                                                      
CONECT   80    4                                                      
CONECT   81    6                                                      
CONECT   82   10                                                      
CONECT   83   11                                                      
CONECT   84   12                                                      
CONECT   85   13                                                      
CONECT   86   14                                                      
CONECT   87   15                                                      
CONECT   88   18                                                      
CONECT   89   18                                                      
CONECT   90   21                                                      
CONECT   91   23                                                      
CONECT   92   26                                                      
CONECT   93   26                                                      
CONECT   94   27                                                      
CONECT   95   27                                                      
CONECT   96   28                                                      
CONECT   97   28                                                      
CONECT   98   30                                                      
CONECT   99   33                                                      
CONECT  100   33                                                      
CONECT  101   34                                                      
CONECT  102   34                                                      
CONECT  103   35                                                      
CONECT  104   35                                                      
CONECT  105   36                                                      
CONECT  106   37                                                      
CONECT  107   40                                                      
CONECT  108   40                                                      
CONECT  109   41                                                      
CONECT  110   42                                                      
CONECT  111   42                                                      
CONECT  112   42                                                      
CONECT  113   43                                                      
CONECT  114   43                                                      
CONECT  115   43                                                      
CONECT  116   44                                                      
CONECT  117   45                                                      
CONECT  118   48                                                      
CONECT  119   48                                                      
CONECT  120   50                                                      
CONECT  121   51                                                      
CONECT  122   52                                                      
CONECT  123   53                                                      
CONECT  124   54                                                      
CONECT  125   55                                                      
CONECT  126   58                                                      
CONECT  127   58                                                      
CONECT  128   59                                                      
CONECT  129   60                                                      
CONECT  130   61                                                      
CONECT  131   62                                                      
CONECT  132   63                                                      
CONECT  133   63                                                      
CONECT  134   63                                                      
CONECT  135   67                                                      
CONECT  136   68                                                      
CONECT  137   71                                                      
CONECT  138   72                                                      
CONECT  139   75                                                      
CONECT  140   75                                                      
CONECT  141   75                                                      
CONECT  142   76                                                      
CONECT  143   76                                                      
MASTER        0    0    0    0    0    0    0    0  143    0  143    0
END
