REMARK  Name = BDB038854
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.433  -0.662   0.418  0.00  0.00    +0.098 A 
ATOM      2  C   LIG    1       -0.699   0.152   0.356  0.00  0.00    +0.074 A 
ATOM      3  N   LIG    1       -0.836   1.516   0.207  0.00  0.00    -0.352 N 
ATOM      4  H   LIG    1       -0.069   2.165   0.095  0.00  0.00    +0.166 HD
ATOM      5  C   LIG    1       -2.160   1.885   0.212  0.00  0.00    +0.048 A 
ATOM      6  C   LIG    1       -2.910   0.718   0.339  0.00  0.00    +0.008 A 
ATOM      7  C   LIG    1       -4.316   0.820   0.360  0.00  0.00    +0.010 A 
ATOM      8  C   LIG    1       -4.916   2.080   0.258  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1       -4.137   3.228   0.133  0.00  0.00    +0.002 A 
ATOM     10  C   LIG    1       -2.742   3.153   0.106  0.00  0.00    +0.026 A 
ATOM     11  C   LIG    1       -1.990  -0.375   0.413  0.00  0.00    +0.012 A 
ATOM     12  C   LIG    1       -2.142  -1.766   0.523  0.00  0.00    +0.045 A 
ATOM     13  CA  LIG    1       -0.979  -2.528   0.548  0.00  0.00    +0.149 A 
ATOM     14  N   LIG    1        0.272  -2.004   0.492  0.00  0.00    -0.238 NA
ENDROOT
BRANCH   1  20
ATOM     15  C   LIG    1        5.039  -0.608  -1.353  0.00  0.00    +0.130 C 
ATOM     16  N   LIG    1        3.982   0.008  -0.562  0.00  0.00    -0.319 N 
ATOM     17  C   LIG    1        4.421   0.980   0.436  0.00  0.00    +0.247 C 
ATOM     18  N   LIG    1        3.400   1.531   1.333  0.00  0.00    -0.272 NA
ATOM     19  C   LIG    1        2.238   0.978   1.270  0.00  0.00    +0.118 C 
ATOM     20  C   LIG    1        1.779  -0.109   0.375  0.00  0.00    +0.034 C 
ATOM     21  C   LIG    1        2.720  -0.541  -0.472  0.00  0.00    +0.083 C 
ENDBRANCH   1  20
BRANCH  13  22
ATOM     22  C   LIG    1       -1.040  -4.022   0.639  0.00  0.00    +0.355 C 
ATOM     23  O   LIG    1       -0.100  -4.797   0.647  0.00  0.00    -0.243 OA
BRANCH  22  24
ATOM     24  OXT LIG    1       -2.303  -4.494   0.718  0.00  0.00    -0.476 OA
ATOM     25  HXT LIG    1       -2.171  -5.465   0.773  0.00  0.00    +0.295 HD
ENDBRANCH  22  24
ENDBRANCH  13  22
TORSDOF 3