HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 1595                                              
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  O   UNK     0       4.369   4.840   0.000  0.00  0.00           O+0
HETATM    2  O   UNK     0       3.485  -4.840   0.000  0.00  0.00           O-1
HETATM    3  O   UNK     0       6.144  -4.630   0.000  0.00  0.00           O+0
HETATM    4  N   UNK     0       4.077   2.249   0.000  0.00  0.00           N+0
HETATM    5  N   UNK     0       7.537   2.249   0.000  0.00  0.00           N+0
HETATM    6  N   UNK     0       4.754  -3.968   0.000  0.00  0.00           N+1
HETATM    7  C   UNK     0       5.807   0.079   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       4.419   0.747   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       7.194   0.747   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       8.398  -0.213   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       5.951  -1.519   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       3.080  -0.136   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       6.577   3.453   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       4.633  -2.432   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       5.037   3.453   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       3.188  -1.736   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       9.832   0.350   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       8.169  -1.736   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      11.036  -0.611   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       9.373  -2.696   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      10.806  -2.133   0.000  0.00  0.00           C+0
CONECT    1   15                                                            
CONECT    2    6                                                            
CONECT    3    6                                                            
CONECT    4    8   15                                                       
CONECT    5    9   13                                                       
CONECT    6    2    3   14                                                  
CONECT    7    8    9   11                                                  
CONECT    8    4    7   12                                                  
CONECT    9    5    7   10                                                  
CONECT   10    9   17   18                                                  
CONECT   11    7   14                                                       
CONECT   12    8   16                                                       
CONECT   13    5   15                                                       
CONECT   14    6   11   16                                                  
CONECT   15    1    4   13                                                  
CONECT   16   12   14                                                       
CONECT   17   10   19                                                       
CONECT   18   10   20                                                       
CONECT   19   17   21                                                       
CONECT   20   18   21                                                       
CONECT   21   19   20                                                       
MASTER        0    0    0    0    0    0    0    0   21    0   46    0
END