REMARK  Name = BDB023104
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  CA  LIG    1        0.834   1.684  -1.583  0.00  0.00    +0.166 A 
ATOM      2  N   LIG    1        1.993   1.103  -1.094  0.00  0.00    -0.221 NA
ATOM      3  C   LIG    1        1.592   0.272  -0.149  0.00  0.00    +0.146 A 
ATOM      4  N   LIG    1        0.216   0.265  -0.032  0.00  0.00    -0.271 N 
ATOM      5  C   LIG    1       -0.462  -0.545   0.893  0.00  0.00    +0.202 A 
ATOM      6  N   LIG    1        0.215  -1.296   1.717  0.00  0.00    -0.224 NA
ATOM      7  C   LIG    1        1.589  -1.290   1.613  0.00  0.00    +0.122 A 
ATOM      8  C   LIG    1        2.326  -0.572   0.738  0.00  0.00    +0.017 A 
ATOM      9  C   LIG    1       -0.270   1.187  -0.926  0.00  0.00    +0.131 A 
ENDROOT
BRANCH   8  10
ATOM     10  C   LIG    1        3.847  -0.694   0.752  0.00  0.00    +0.026 C 
ATOM     11  C   LIG    1        4.535   0.623   1.171  0.00  0.00    +0.023 C 
ATOM     12  C   LIG    1        5.886   0.829   0.483  0.00  0.00    +0.081 C 
ATOM     13  N   LIG    1        6.605  -0.433   0.371  0.00  0.00    -0.316 NA
ATOM     14  H   LIG    1        7.553  -0.274   0.032  0.00  0.00    +0.122 HD
ATOM     15  C   LIG    1        5.924  -1.387  -0.507  0.00  0.00    +0.081 C 
ATOM     16  C   LIG    1        4.405  -1.194  -0.588  0.00  0.00    +0.023 C 
ENDBRANCH   8  10
BRANCH   1  18
ATOM     17  O   LIG    1       -0.112   3.233  -3.115  0.00  0.00    -0.243 OA
ATOM     18  C   LIG    1        0.871   2.686  -2.639  0.00  0.00    +0.357 C 
BRANCH  18  19
ATOM     19  OXT LIG    1        2.143   2.944  -3.044  0.00  0.00    -0.476 OA
ATOM     20  HXT LIG    1        2.739   2.375  -2.504  0.00  0.00    +0.295 HD
ENDBRANCH  18  19
ENDBRANCH   1  18
BRANCH   5  21
ATOM     21  N   LIG    1       -1.839  -0.540   0.963  0.00  0.00    -0.310 N 
ATOM     22  H   LIG    1       -2.092  -1.024   1.826  0.00  0.00    +0.149 HD
BRANCH  21  23
ATOM     23  C   LIG    1       -2.607  -1.148  -0.121  0.00  0.00    +0.143 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -4.071  -1.114   0.211  0.00  0.00    +0.012 A 
ATOM     25  C   LIG    1       -4.799   0.070   0.280  0.00  0.00    +0.005 A 
ATOM     26  C   LIG    1       -4.358   1.477   0.116  0.00  0.00    +0.080 C 
ATOM     27  C   LIG    1       -5.723   2.161   0.040  0.00  0.00    +0.234 C 
ATOM     28  O   LIG    1       -6.713   1.311   0.663  0.00  0.00    -0.491 OA
ATOM     29  C   LIG    1       -6.147   0.064   0.616  0.00  0.00    +0.124 A 
ATOM     30  C   LIG    1       -6.832  -1.101   0.896  0.00  0.00    +0.049 A 
ATOM     31  C   LIG    1       -6.128  -2.301   0.821  0.00  0.00    +0.042 A 
ATOM     32  C   LIG    1       -4.768  -2.299   0.482  0.00  0.00    +0.129 A 
ATOM     33  F   LIG    1       -4.124  -3.474   0.429  0.00  0.00    -0.205 F 
ENDBRANCH  23  24
ENDBRANCH  21  23
ENDBRANCH   5  21
TORSDOF 6