REMARK  Name = BDB021370
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.588  -0.636   2.965  0.00  0.00    +0.159 A 
ATOM      2  N   LIG    1        2.560  -0.550   2.000  0.00  0.00    -0.217 NA
ATOM      3  C   LIG    1        1.942  -0.112   0.920  0.00  0.00    +0.151 A 
ATOM      4  N   LIG    1        0.600   0.111   1.164  0.00  0.00    -0.270 N 
ATOM      5  C   LIG    1       -0.289   0.596   0.183  0.00  0.00    +0.202 A 
ATOM      6  N   LIG    1        0.160   0.837  -1.018  0.00  0.00    -0.223 NA
ATOM      7  C   LIG    1        1.497   0.619  -1.275  0.00  0.00    +0.126 A 
ATOM      8  C   LIG    1        2.413   0.153  -0.399  0.00  0.00    +0.045 A 
ATOM      9  C   LIG    1        0.365  -0.238   2.475  0.00  0.00    +0.134 A 
ENDROOT
BRANCH   8  10
ATOM     10  C   LIG    1        3.818  -0.016  -0.834  0.00  0.00    +0.005 A 
ATOM     11  C   LIG    1        4.876   0.407  -0.029  0.00  0.00    +0.120 A 
ATOM     12  N   LIG    1        6.187   0.295  -0.358  0.00  0.00    -0.248 NA
ATOM     13  CA  LIG    1        6.480  -0.294  -1.544  0.00  0.00    +0.147 A 
ATOM     14  C   LIG    1        5.500  -0.770  -2.409  0.00  0.00    +0.035 A 
ATOM     15  C   LIG    1        4.159  -0.629  -2.046  0.00  0.00    +0.012 A 
BRANCH  13  16
ATOM     16  C   LIG    1        7.937  -0.407  -1.874  0.00  0.00    +0.355 C 
ATOM     17  O   LIG    1        8.879  -0.016  -1.208  0.00  0.00    -0.243 OA
BRANCH  16  18
ATOM     18  OXT LIG    1        8.159  -1.019  -3.058  0.00  0.00    -0.476 OA
ATOM     19  HXT LIG    1        9.138  -1.017  -3.122  0.00  0.00    +0.295 HD
ENDBRANCH  16  18
ENDBRANCH  13  16
ENDBRANCH   8  10
BRANCH   1  21
ATOM     20  N   LIG    1        2.070  -1.465   5.374  0.00  0.00    -0.189 NA
ATOM     21  C   LIG    1        1.878  -1.097   4.289  0.00  0.00    +0.121 C 
ENDBRANCH   1  21
BRANCH   5  22
ATOM     22  N   LIG    1       -1.609   0.795   0.526  0.00  0.00    -0.310 N 
ATOM     23  H   LIG    1       -1.815   0.947   1.507  0.00  0.00    +0.149 HD
BRANCH  22  24
ATOM     24  C   LIG    1       -2.510   1.518  -0.356  0.00  0.00    +0.143 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -3.917   1.377   0.147  0.00  0.00    +0.012 A 
ATOM     26  C   LIG    1       -4.630   0.187   0.037  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1       -4.213  -1.130  -0.503  0.00  0.00    +0.080 C 
ATOM     28  C   LIG    1       -5.578  -1.816  -0.563  0.00  0.00    +0.234 C 
ATOM     29  O   LIG    1       -6.472  -1.168   0.371  0.00  0.00    -0.491 OA
ATOM     30  C   LIG    1       -5.919   0.074   0.541  0.00  0.00    +0.124 A 
ATOM     31  C   LIG    1       -6.557   1.122   1.174  0.00  0.00    +0.049 A 
ATOM     32  C   LIG    1       -5.865   2.328   1.290  0.00  0.00    +0.042 A 
ATOM     33  C   LIG    1       -4.564   2.445   0.782  0.00  0.00    +0.129 A 
ATOM     34  F   LIG    1       -3.924   3.613   0.931  0.00  0.00    -0.205 F 
ENDBRANCH  24  25
ENDBRANCH  22  24
ENDBRANCH   5  22
TORSDOF 7