REMARK  Name = BDB048214
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   UNK A  0       -2.734  -2.147  -1.237  0.00  0.00    +0.108 A 
ATOM      2  C   UNK A  0       -3.924  -3.026  -1.087  0.00  0.00    +0.268 A 
ATOM      3  O   UNK A  0       -5.046  -2.671  -0.758  0.00  0.00    -0.267 OA
ATOM      4  N   UNK A  0       -3.601  -4.317  -1.418  0.00  0.00    -0.291 N 
ATOM      5  H   UNK A  0       -4.321  -5.028  -1.440  0.00  0.00    +0.177 HD
ATOM      6  S   UNK A  0       -2.036  -4.531  -1.982  0.00  0.00    +0.005 S 
ATOM      7  C   UNK A  0       -1.653  -2.830  -1.677  0.00  0.00    +0.102 A 
ENDROOT
BRANCH   1   9
ATOM      8  N   ALA A  1       -3.448  -0.321   0.073  0.00  0.00    -0.263 NA
ATOM      9  C   UNK A  0       -2.770  -0.680  -0.966  0.00  0.00    +0.126 C 
BRANCH   9  10
ATOM     10  N   UNK A  0       -2.099   0.193  -1.792  0.00  0.00    -0.343 N 
ATOM     11  H   UNK A  0       -1.827   1.066  -1.359  0.00  0.00    +0.144 HD
ATOM     12  H   UNK A  0       -1.316  -0.223  -2.293  0.00  0.00    +0.144 HD
ENDBRANCH   9  10
BRANCH   8  14
ATOM     13  CB  ALA A  1       -2.554   1.549   1.367  0.00  0.00    +0.035 C 
ATOM     14  CA  ALA A  1       -3.655   1.088   0.419  0.00  0.00    +0.130 C 
BRANCH  14  15
ATOM     15  C   ALA A  1       -5.031   1.184   1.098  0.00  0.00    +0.182 C 
BRANCH  15  16
ATOM     16  O   ALA A  1       -6.036   0.683   0.218  0.00  0.00    -0.393 OA
ATOM     17  H   ALA A  1       -5.688  -0.185  -0.082  0.00  0.00    +0.209 HD
ENDBRANCH  15  16
ENDBRANCH  14  15
ENDBRANCH   8  14
ENDBRANCH   1   9
BRANCH   7  18
ATOM     18  N   UNK A  0       -0.381  -2.340  -1.944  0.00  0.00    -0.307 N 
ATOM     19  H   UNK A  0        0.149  -3.030  -2.477  0.00  0.00    +0.153 HD
BRANCH  18  20
ATOM     20  C   UNK A  0        0.487  -1.725  -1.006  0.00  0.00    +0.032 A 
ATOM     21  C   UNK A  0        0.172  -1.524   0.340  0.00  0.00    +0.025 A 
ATOM     22  C   UNK A  0        1.063  -0.860   1.194  0.00  0.00    +0.025 A 
ATOM     23  C   UNK A  0        2.293  -0.377   0.732  0.00  0.00    +0.031 A 
ATOM     24  C   UNK A  0        2.600  -0.568  -0.617  0.00  0.00    +0.025 A 
ATOM     25  C   UNK A  0        1.712  -1.232  -1.473  0.00  0.00    +0.025 A 
BRANCH  23  26
ATOM     26  N   UNK A  0        3.130   0.317   1.619  0.00  0.00    -0.314 N 
ATOM     27  H   UNK A  0        3.011   0.054   2.591  0.00  0.00    +0.152 HD
BRANCH  26  28
ATOM     28  C   UNK A  0        4.125   1.288   1.412  0.00  0.00    +0.031 A 
ATOM     29  C   UNK A  0        5.184   1.380   2.326  0.00  0.00    +0.023 A 
ATOM     30  C   UNK A  0        6.218   2.303   2.143  0.00  0.00    +0.002 A 
ATOM     31  C   UNK A  0        6.209   3.148   1.038  0.00  0.00    +0.000 A 
ATOM     32  C   UNK A  0        5.168   3.069   0.117  0.00  0.00    +0.002 A 
ATOM     33  C   UNK A  0        4.137   2.142   0.303  0.00  0.00    +0.023 A 
ENDBRANCH  26  28
ENDBRANCH  23  26
ENDBRANCH  18  20
ENDBRANCH   7  18
TORSDOF 9