REMARK  Name = BDB048037
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   UNK A  0       -2.924   1.170   1.619  0.00  0.00    +0.108 A 
ATOM      2  C   UNK A  0       -3.669   1.579   2.832  0.00  0.00    +0.268 A 
ATOM      3  O   UNK A  0       -4.881   1.541   2.973  0.00  0.00    -0.267 OA
ATOM      4  N   UNK A  0       -2.800   2.078   3.765  0.00  0.00    -0.291 N 
ATOM      5  H   UNK A  0       -3.151   2.482   4.624  0.00  0.00    +0.177 HD
ATOM      6  S   UNK A  0       -1.209   2.203   3.244  0.00  0.00    +0.005 S 
ATOM      7  C   UNK A  0       -1.596   1.418   1.701  0.00  0.00    +0.102 A 
ENDROOT
BRANCH   1   9
ATOM      8  N   ALA A  1       -4.269  -0.504   0.656  0.00  0.00    -0.263 NA
ATOM      9  C   UNK A  0       -3.560   0.543   0.427  0.00  0.00    +0.126 C 
BRANCH   9  10
ATOM     10  N   UNK A  0       -3.314   1.087  -0.814  0.00  0.00    -0.343 N 
ATOM     11  H   UNK A  0       -3.122   2.087  -0.811  0.00  0.00    +0.144 HD
ATOM     12  H   UNK A  0       -3.996   0.861  -1.525  0.00  0.00    +0.144 HD
ENDBRANCH   9  10
BRANCH   8  14
ATOM     13  CB  ALA A  1       -6.171  -0.614  -0.937  0.00  0.00    +0.035 C 
ATOM     14  CA  ALA A  1       -4.979  -1.334  -0.324  0.00  0.00    +0.130 C 
BRANCH  14  15
ATOM     15  C   ALA A  1       -4.030  -1.961  -1.353  0.00  0.00    +0.182 C 
BRANCH  15  16
ATOM     16  O   ALA A  1       -2.955  -2.626  -0.690  0.00  0.00    -0.393 OA
ATOM     17  H   ALA A  1       -2.852  -2.167   0.167  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       -0.703   1.151   0.671  0.00  0.00    -0.307 N 
ATOM     19  H   UNK A  0       -1.141   0.795  -0.178  0.00  0.00    +0.153 HD
BRANCH  18  20
ATOM     20  C   UNK A  0        0.692   0.968   0.673  0.00  0.00    +0.032 A 
ATOM     21  C   UNK A  0        1.373   1.124  -0.546  0.00  0.00    +0.027 A 
ATOM     22  C   UNK A  0        2.764   0.998  -0.627  0.00  0.00    +0.048 A 
ATOM     23  C   UNK A  0        3.496   0.701   0.520  0.00  0.00    +0.129 A 
ATOM     24  C   UNK A  0        2.845   0.570   1.743  0.00  0.00    +0.048 A 
ATOM     25  C   UNK A  0        1.453   0.700   1.815  0.00  0.00    +0.027 A 
BRANCH  23  26
ATOM     26  O   UNK A  0        4.868   0.594   0.524  0.00  0.00    -0.456 OA
BRANCH  26  27
ATOM     27  C   UNK A  0        5.445  -0.173  -0.462  0.00  0.00    +0.128 A 
ATOM     28  C   UNK A  0        5.000  -1.461  -0.773  0.00  0.00    +0.046 A 
ATOM     29  C   UNK A  0        5.654  -2.199  -1.761  0.00  0.00    +0.004 A 
ATOM     30  C   UNK A  0        6.756  -1.658  -2.423  0.00  0.00    +0.000 A 
ATOM     31  C   UNK A  0        7.213  -0.381  -2.094  0.00  0.00    +0.004 A 
ATOM     32  C   UNK A  0        6.561   0.359  -1.107  0.00  0.00    +0.046 A 
ENDBRANCH  26  27
ENDBRANCH  23  26
ENDBRANCH  18  20
ENDBRANCH   7  18
TORSDOF 9