COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0       7.111  -0.113   0.799  1.00  0.00           C  
HETATM    2  O   UNK A   0       7.087   0.093   1.994  1.00  0.00           O  
HETATM    3  C   UNK A   0       8.356  -0.668   0.155  1.00  0.00           C  
ATOM      4  N   VAL A   1       6.023   0.149   0.048  1.00  0.00           N  
ATOM      5  CA  VAL A   1       4.812   0.683   0.675  1.00  0.00           C  
ATOM      6  C   VAL A   1       3.612   0.325  -0.164  1.00  0.00           C  
ATOM      7  O   VAL A   1       3.752   0.060  -1.339  1.00  0.00           O  
ATOM      8  CB  VAL A   1       4.922   2.205   0.785  1.00  0.00           C  
ATOM      9  CG1 VAL A   1       6.053   2.566   1.749  1.00  0.00           C  
ATOM     10  CG2 VAL A   1       5.220   2.795  -0.595  1.00  0.00           C  
ATOM     11  N   GLU A   2       2.385   0.300   0.391  1.00  0.00           N  
ATOM     12  CA  GLU A   2       1.233  -0.147  -0.397  1.00  0.00           C  
ATOM     13  C   GLU A   2      -0.026   0.463   0.163  1.00  0.00           C  
ATOM     14  O   GLU A   2       0.033   1.198   1.126  1.00  0.00           O  
ATOM     15  CB  GLU A   2       1.133  -1.672  -0.334  1.00  0.00           C  
ATOM     16  CG  GLU A   2       2.354  -2.292  -1.015  1.00  0.00           C  
ATOM     17  CD  GLU A   2       2.255  -3.795  -0.954  1.00  0.00           C  
ATOM     18  OE1 GLU A   2       1.305  -4.316  -0.420  1.00  0.00           O  
ATOM     19  OE2 GLU A   2       3.222  -4.554  -1.492  1.00  0.00           O  
ATOM     20  N   ILE A   3      -1.217   0.192  -0.406  1.00  0.00           N  
ATOM     21  CA  ILE A   3      -2.441   0.785   0.139  1.00  0.00           C  
ATOM     22  C   ILE A   3      -3.621  -0.085  -0.214  1.00  0.00           C  
ATOM     23  O   ILE A   3      -3.455  -1.099  -0.857  1.00  0.00           O  
ATOM     24  CB  ILE A   3      -2.640   2.180  -0.456  1.00  0.00           C  
ATOM     25  CG1 ILE A   3      -2.759   2.074  -1.977  1.00  0.00           C  
ATOM     26  CG2 ILE A   3      -1.443   3.063  -0.098  1.00  0.00           C  
ATOM     27  CD1 ILE A   3      -3.082   3.451  -2.561  1.00  0.00           C  
ATOM     28  N   ASP A   4      -4.859   0.266   0.185  1.00  0.00           N  
ATOM     29  CA  ASP A   4      -6.006  -0.579  -0.158  1.00  0.00           C  
ATOM     30  C   ASP A   4      -6.503  -0.217  -1.533  1.00  0.00           C  
ATOM     31  O   ASP A   4      -5.956   0.657  -2.162  1.00  0.00           O  
ATOM     32  CB  ASP A   4      -7.124  -0.360   0.863  1.00  0.00           C  
ATOM     33  CG  ASP A   4      -6.668  -0.837   2.218  1.00  0.00           C  
ATOM     34  OD1 ASP A   4      -5.562  -1.305   2.353  1.00  0.00           O  
ATOM     35  OD2 ASP A   4      -7.491  -0.743   3.274  1.00  0.00           O  
HETATM   36  H   UNK A   0       9.122  -0.819   0.916  1.00  0.00           H  
HETATM   37  H   UNK A   0       8.124  -1.621  -0.321  1.00  0.00           H  
HETATM   38  H   UNK A   0       8.721   0.034  -0.594  1.00  0.00           H  
ATOM     39  H   VAL A   1       6.043  -0.016  -0.907  1.00  0.00           H  
ATOM     40  HA  VAL A   1       4.699   0.254   1.671  1.00  0.00           H  
ATOM     41  HB  VAL A   1       3.982   2.611   1.158  1.00  0.00           H  
ATOM     42 HG11 VAL A   1       6.993   2.159   1.376  1.00  0.00           H  
ATOM     43 HG12 VAL A   1       6.132   3.651   1.827  1.00  0.00           H  
ATOM     44 HG13 VAL A   1       5.841   2.146   2.732  1.00  0.00           H  
ATOM     45 HG21 VAL A   1       5.377   3.870  -0.505  1.00  0.00           H  
ATOM     46 HG22 VAL A   1       6.119   2.330  -1.003  1.00  0.00           H  
ATOM     47 HG23 VAL A   1       4.379   2.604  -1.261  1.00  0.00           H  
ATOM     48  H   GLU A   2       2.263   0.577   1.313  1.00  0.00           H  
ATOM     49  HA  GLU A   2       1.359   0.167  -1.433  1.00  0.00           H  
ATOM     50  HB1 GLU A   2       1.096  -1.991   0.707  1.00  0.00           H  
ATOM     51  HB2 GLU A   2       0.227  -1.998  -0.846  1.00  0.00           H  
ATOM     52  HG1 GLU A   2       2.390  -1.973  -2.057  1.00  0.00           H  
ATOM     53  HG2 GLU A   2       3.260  -1.966  -0.504  1.00  0.00           H  
ATOM     54  HE2 GLU A   2       3.115  -5.512  -1.428  1.00  0.00           H  
ATOM     55  H   ILE A   3      -1.264  -0.396  -1.176  1.00  0.00           H  
ATOM     56  HA  ILE A   3      -2.357   0.860   1.223  1.00  0.00           H  
ATOM     57  HB  ILE A   3      -3.551   2.621  -0.051  1.00  0.00           H  
ATOM     58 HG11 ILE A   3      -1.816   1.716  -2.391  1.00  0.00           H  
ATOM     59 HG12 ILE A   3      -3.555   1.375  -2.232  1.00  0.00           H  
ATOM     60 HG21 ILE A   3      -0.532   2.622  -0.503  1.00  0.00           H  
ATOM     61 HG22 ILE A   3      -1.585   4.057  -0.521  1.00  0.00           H  
ATOM     62 HG23 ILE A   3      -1.359   3.139   0.987  1.00  0.00           H  
ATOM     63 HD11 ILE A   3      -3.166   3.375  -3.645  1.00  0.00           H  
ATOM     64 HD12 ILE A   3      -4.024   3.809  -2.148  1.00  0.00           H  
ATOM     65 HD13 ILE A   3      -2.285   4.150  -2.307  1.00  0.00           H  
ATOM     66  H   ASP A   4      -4.992   1.077   0.700  1.00  0.00           H  
ATOM     67  HA  ASP A   4      -5.702  -1.626  -0.145  1.00  0.00           H  
ATOM     68  H   ASP A   4      -7.349  -0.739  -1.957  1.00  0.00           H  
ATOM     69  HB1 ASP A   4      -7.367   0.701   0.914  1.00  0.00           H  
ATOM     70  HB2 ASP A   4      -8.008  -0.921   0.559  1.00  0.00           H  
ATOM     71  HD2 ASP A   4      -7.154  -1.062   4.123  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1                                                 
CONECT    3    1   36   37   38                                       
CONECT    4    5   39    1                                            
CONECT    5    4    6    8   40                                       
CONECT    6    5    7    7   11                                       
CONECT    7    6    6                                                 
CONECT    8    5    9   10   41                                       
CONECT    9    8   42   43   44                                       
CONECT   10    8   45   46   47                                       
CONECT   11   12   48    6                                            
CONECT   12   11   13   15   49                                       
CONECT   13   12   14   14   20                                       
CONECT   14   13   13                                                 
CONECT   15   12   16   50   51                                       
CONECT   16   15   17   52   53                                       
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   54                                                 
CONECT   20   21   55   13                                            
CONECT   21   20   22   24   56                                       
CONECT   22   21   23   23   28                                       
CONECT   23   22   22                                                 
CONECT   24   21   25   26   57                                       
CONECT   25   24   27   58   59                                       
CONECT   26   24   60   61   62                                       
CONECT   27   25   63   64   65                                       
CONECT   28   29   66   22                                            
CONECT   29   28   30   32   67                                       
CONECT   30   29   31   31   68                                       
CONECT   31   30   30                                                 
CONECT   32   29   33   69   70                                       
CONECT   33   32   34   34   35                                       
CONECT   34   33   33                                                 
CONECT   35   33   71                                                 
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   21                                                      
CONECT   57   24                                                      
CONECT   58   25                                                      
CONECT   59   25                                                      
CONECT   60   26                                                      
CONECT   61   26                                                      
CONECT   62   26                                                      
CONECT   63   27                                                      
CONECT   64   27                                                      
CONECT   65   27                                                      
CONECT   66   28                                                      
CONECT   67   29                                                      
CONECT   68   30                                                      
CONECT   69   32                                                      
CONECT   70   32                                                      
CONECT   71   35                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
