HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: 89I                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0       0.879   5.262   0.000  0.00  0.00           C+0
HETATM    2  N   UNK     0       2.213   4.492   0.000  0.00  0.00           N+0
HETATM    3  C   UNK     0       2.213   2.952   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       0.879   2.182   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -0.454   2.952   0.000  0.00  0.00           C+0
HETATM    6  N   UNK     0      -0.454   4.492   0.000  0.00  0.00           N+0
HETATM    7  C   UNK     0       0.879   0.642   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -0.454  -0.128   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -0.454  -1.668   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       0.879  -2.438   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       2.213  -1.668   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       2.213  -0.128   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       7.548   1.412   0.000  0.00  0.00           C+0
HETATM   14  N   UNK     0       8.881   0.642   0.000  0.00  0.00           N+0
HETATM   15  C   UNK     0       8.881  -0.898   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       7.548  -1.668   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       6.214  -0.898   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       6.214   0.642   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      11.549  -0.898   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      12.882  -1.668   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0      12.882  -3.208   0.000  0.00  0.00           O+0
HETATM   22  C   UNK     0      11.549  -3.978   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      10.215  -3.208   0.000  0.00  0.00           C+0
HETATM   24  N   UNK     0      10.215  -1.668   0.000  0.00  0.00           N+0
HETATM   25  C   UNK     0       3.547   2.182   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       4.880   1.412   0.000  0.00  0.00           C+0
HETATM   27  N   UNK     0       0.879  -3.978   0.000  0.00  0.00           N+0
HETATM   28  C   UNK     0       2.213  -4.748   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      -0.454  -4.748   0.000  0.00  0.00           C+0
HETATM   30  N   UNK     0      -1.788   2.182   0.000  0.00  0.00           N+0
CONECT    1    2    6                                                       
CONECT    2    1    3                                                       
CONECT    3    2   25    4                                                  
CONECT    4    3    7    5                                                  
CONECT    5    4   30    6                                                  
CONECT    6    1    5                                                       
CONECT    7    4   12    8                                                  
CONECT    8    7    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   27   11                                                  
CONECT   11   10   12                                                       
CONECT   12    7   11                                                       
CONECT   13   14   18                                                       
CONECT   14   13   15                                                       
CONECT   15   14   24   16                                                  
CONECT   16   15   17                                                       
CONECT   17   16   18                                                       
CONECT   18   13   17   26                                                  
CONECT   19   20   24                                                       
CONECT   20   19   21                                                       
CONECT   21   20   22                                                       
CONECT   22   21   23                                                       
CONECT   23   22   24                                                       
CONECT   24   15   19   23                                                  
CONECT   25    3   26                                                       
CONECT   26   18   25                                                       
CONECT   27   10   28   29                                                  
CONECT   28   27                                                            
CONECT   29   27                                                            
CONECT   30    5                                                            
MASTER        0    0    0    0    0    0    0    0   30    0   66    0
END