HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: AUP                                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0       1.817  -0.917   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       1.817   0.623   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       3.150   1.393   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       4.484   0.623   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       4.484  -0.917   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       3.150  -1.687   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       0.352  -1.393   0.000  0.00  0.00           C+0
HETATM    8  P   UNK     0      -0.553  -0.147   0.000  0.00  0.00           P+0
HETATM    9  C   UNK     0       0.352   1.099   0.000  0.00  0.00           C+0
HETATM   10  N   UNK     0      -1.630   2.883   0.000  0.00  0.00           N+0
HETATM   11  C   UNK     0      -2.106   4.348   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -1.076   5.492   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       0.431   5.172   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       0.907   3.708   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -0.124   2.563   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -5.173  -0.147   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -4.403   1.186   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      -2.863   1.186   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -2.093  -0.147   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -2.863  -1.481   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -4.403  -1.481   0.000  0.00  0.00           C+0
HETATM   22  N   UNK     0      -1.630  -3.178   0.000  0.00  0.00           N+0
HETATM   23  C   UNK     0      -0.124  -2.858   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       0.907  -4.002   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       0.431  -5.467   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      -1.076  -5.787   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      -2.106  -4.643   0.000  0.00  0.00           C+0
CONECT    1    2    6    7                                                  
CONECT    2    1    3    9                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    1    5                                                       
CONECT    7    1    8   23                                                  
CONECT    8    7    9   19                                                  
CONECT    9    2    8   15                                                  
CONECT   10   11   15                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15                                                       
CONECT   15    9   10   14                                                  
CONECT   16   17   21                                                       
CONECT   17   16   18                                                       
CONECT   18   17   19                                                       
CONECT   19    8   18   20                                                  
CONECT   20   19   21                                                       
CONECT   21   16   20                                                       
CONECT   22   23   27                                                       
CONECT   23    7   22   24                                                  
CONECT   24   23   25                                                       
CONECT   25   24   26                                                       
CONECT   26   25   27                                                       
CONECT   27   22   26                                                       
MASTER        0    0    0    0    0    0    0    0   27    0   62    0
END