COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNK A   0      -3.702   0.446  -0.286  1.00  0.00           C  
HETATM    2  C   UNK A   0      -4.988   1.245  -0.509  1.00  0.00           C  
HETATM    3  C   UNK A   0      -4.648   2.730  -0.648  1.00  0.00           C  
HETATM    4  C   UNK A   0      -5.675   0.758  -1.786  1.00  0.00           C  
ATOM      5  CB  VAL A   1       0.504  -1.653  -0.725  1.00  0.00           C  
ATOM      6  CG1 VAL A   1       0.440  -0.943  -2.079  1.00  0.00           C  
ATOM      7  CA  VAL A   2       4.130   0.490   0.414  1.00  0.00           C  
ATOM      8  CB  VAL A   2       5.261  -0.209   1.171  1.00  0.00           C  
ATOM      9  CG1 VAL A   2       5.627  -1.510   0.453  1.00  0.00           C  
HETATM   10  C   UNK A   0      -4.045  -1.002  -0.050  1.00  0.00           C  
HETATM   11  O   UNK A   0      -3.731  -1.536   0.987  1.00  0.00           O  
HETATM   12  C   UNK A   0      -2.963   1.000   0.934  1.00  0.00           C  
HETATM   13  O   UNK A   0      -3.801   0.894   2.087  1.00  0.00           O  
HETATM   14  C   UNK A   0      -1.699   0.211   1.157  1.00  0.00           C  
HETATM   15  O   UNK A   0      -1.566  -0.448   2.166  1.00  0.00           O  
ATOM     16  N   VAL A   1      -0.717   0.237   0.234  1.00  0.00           N  
ATOM     17  CA  VAL A   1       0.465  -0.614   0.398  1.00  0.00           C  
ATOM     18  CG2 VAL A   1      -0.690  -2.599  -0.587  1.00  0.00           C  
ATOM     19  C   VAL A   1       1.708   0.236   0.341  1.00  0.00           C  
ATOM     20  O   VAL A   1       1.616   1.434   0.179  1.00  0.00           O  
ATOM     21  N   VAL A   2       2.921  -0.336   0.469  1.00  0.00           N  
ATOM     22  C   VAL A   2       4.536   0.690  -1.024  1.00  0.00           C  
ATOM     23  O   VAL A   2       3.883   0.193  -1.911  1.00  0.00           O  
ATOM     24  OXT VAL A   2       5.623   1.420  -1.319  1.00  0.00           O  
ATOM     25  CG2 VAL A   2       6.485   0.708   1.219  1.00  0.00           C  
HETATM   26  H   UNK A   0      -3.065   0.530  -1.166  1.00  0.00           H  
HETATM   27  H   UNK A   0      -5.656   1.103   0.340  1.00  0.00           H  
HETATM   28  H   UNK A   0      -3.936   2.866  -1.462  1.00  0.00           H  
HETATM   29  H   UNK A   0      -5.557   3.293  -0.863  1.00  0.00           H  
HETATM   30  H   UNK A   0      -4.209   3.091   0.282  1.00  0.00           H  
HETATM   31  H   UNK A   0      -5.918  -0.300  -1.687  1.00  0.00           H  
HETATM   32  H   UNK A   0      -6.591   1.327  -1.945  1.00  0.00           H  
HETATM   33  H   UNK A   0      -5.007   0.900  -2.635  1.00  0.00           H  
ATOM     34  HB  VAL A   1       1.430  -2.224  -0.658  1.00  0.00           H  
ATOM     35 HG11 VAL A   1      -0.520  -0.434  -2.177  1.00  0.00           H  
ATOM     36 HG12 VAL A   1       1.246  -0.213  -2.145  1.00  0.00           H  
ATOM     37 HG13 VAL A   1       0.546  -1.675  -2.879  1.00  0.00           H  
ATOM     38  HA  VAL A   2       3.930   1.458   0.873  1.00  0.00           H  
ATOM     39  HB  VAL A   2       4.934  -0.433   2.186  1.00  0.00           H  
ATOM     40 HG11 VAL A   2       5.953  -1.286  -0.562  1.00  0.00           H  
ATOM     41 HG12 VAL A   2       6.432  -2.008   0.992  1.00  0.00           H  
ATOM     42 HG13 VAL A   2       4.755  -2.163   0.418  1.00  0.00           H  
HETATM   43  H   UNK A   0      -2.712   2.047   0.762  1.00  0.00           H  
HETATM   44  H   UNK A   0      -4.064  -0.012   2.300  1.00  0.00           H  
ATOM     45  H   VAL A   1      -0.792   0.819  -0.538  1.00  0.00           H  
ATOM     46  HA  VAL A   1       0.416  -1.122   1.361  1.00  0.00           H  
ATOM     47 HG21 VAL A   1      -1.616  -2.027  -0.654  1.00  0.00           H  
ATOM     48 HG22 VAL A   1      -0.662  -3.339  -1.387  1.00  0.00           H  
ATOM     49 HG23 VAL A   1      -0.644  -3.105   0.377  1.00  0.00           H  
ATOM     50  H   VAL A   2       2.995  -1.295   0.598  1.00  0.00           H  
ATOM     51  HXT VAL A   2       5.844   1.520  -2.255  1.00  0.00           H  
ATOM     52 HG21 VAL A   2       6.224   1.635   1.730  1.00  0.00           H  
ATOM     53 HG22 VAL A   2       7.291   0.210   1.759  1.00  0.00           H  
ATOM     54 HG23 VAL A   2       6.812   0.932   0.204  1.00  0.00           H  
HETATM   55  O   UNK A   0      -4.700  -1.699  -0.993  1.00  0.00           O  
HETATM   56  H   UNK A   0      -4.898  -2.624  -0.796  1.00  0.00           H  
CONECT    1   10   12    2   26                                       
CONECT    2    3    1    4   27                                       
CONECT    3    2   28   29   30                                       
CONECT    4    2   31   32   33                                       
CONECT    5    6   17   18   34                                       
CONECT    6    5   35   36   37                                       
CONECT    7   21    8   22   38                                       
CONECT    8    9    7   25   39                                       
CONECT    9    8   40   41   42                                       
CONECT   10   11   11    1   55                                       
CONECT   11   10   10                                                 
CONECT   12   13    1   14   43                                       
CONECT   13   12   44                                                 
CONECT   14   12   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   17   45                                            
CONECT   17   16    5   19   46                                       
CONECT   18    5   47   48   49                                       
CONECT   19   17   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   19    7   50                                            
CONECT   22    7   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   51                                                 
CONECT   25    8   52   53   54                                       
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   21                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   25                                                      
CONECT   54   25                                                      
CONECT   55   10   56                                                 
CONECT   56   55                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
