REMARK  Name = BDB056536
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.397  -0.706   0.733  0.00  0.00    +0.124 A 
ATOM      2  N   LIG    1        1.261   0.083   0.059  0.00  0.00    -0.214 NA
ATOM      3  C   LIG    1        2.530  -0.378  -0.041  0.00  0.00    +0.151 A 
ATOM      4  C   LIG    1        3.015  -1.568   0.494  0.00  0.00    +0.019 A 
ATOM      5  C   LIG    1        4.385  -1.661   0.159  0.00  0.00    +0.030 A 
ATOM      6  C   LIG    1        4.705  -0.539  -0.569  0.00  0.00    +0.098 A 
ATOM      7  C   LIG    1        2.116  -2.365   1.210  0.00  0.00    +0.015 A 
ATOM      8  N   LIG    1        3.576   0.263  -0.701  0.00  0.00    -0.255 N 
ATOM      9  C   LIG    1        3.555   1.494  -1.391  0.00  0.00    +0.317 C 
ATOM     10  O   LIG    1        4.564   1.930  -1.925  0.00  0.00    -0.249 OA
ATOM     11  N   LIG    1        2.339   2.105  -1.391  0.00  0.00    -0.311 N 
ATOM     12  H   LIG    1        1.541   1.683  -0.917  0.00  0.00    +0.147 HD
ATOM     13  H   LIG    1        2.231   2.995  -1.854  0.00  0.00    +0.147 HD
ATOM     14  C   LIG    1        0.800  -1.909   1.322  0.00  0.00    +0.044 A 
ENDROOT
BRANCH   1  19
ATOM     15  C   LIG    1       -4.466   1.157  -0.859  0.00  0.00    +0.105 C 
ATOM     16  N   LIG    1       -3.719   0.549   0.238  0.00  0.00    -0.302 NA
ATOM     17  C   LIG    1       -2.685   1.461   0.774  0.00  0.00    +0.103 C 
ATOM     18  C   LIG    1       -1.227   1.090   0.417  0.00  0.00    +0.122 C 
ATOM     19  N   LIG    1       -0.920  -0.273   0.873  0.00  0.00    -0.313 N 
ATOM     20  C   LIG    1       -2.011  -1.256   0.748  0.00  0.00    +0.122 C 
ATOM     21  C   LIG    1       -3.138  -0.743  -0.180  0.00  0.00    +0.103 C 
ENDBRANCH   1  19
TORSDOF 1