REMARK  Name = BDB044570
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   UNK A  0       -0.043   0.276   0.354  0.00  0.00    +0.155 C 
ENDROOT
BRANCH   1   4
ATOM      2  N   ALA A  1       -2.094  -0.806  -0.551  0.00  0.00    -0.301 N 
ATOM      3  H   ALA A  1       -2.582  -0.235   0.132  0.00  0.00    +0.150 HD
ATOM      4  C   UNK A  0       -0.729  -0.887  -0.411  0.00  0.00    +0.232 C 
ATOM      5  O   UNK A  0       -0.087  -1.870  -0.789  0.00  0.00    -0.274 OA
BRANCH   2   7
ATOM      6  CB  ALA A  1       -4.147  -1.446  -1.716  0.00  0.00    +0.040 C 
ATOM      7  CA  ALA A  1       -2.853  -1.935  -1.084  0.00  0.00    +0.179 C 
BRANCH   7   8
ATOM      8  C   ALA A  1       -3.167  -2.904   0.056  0.00  0.00    +0.325 C 
ATOM      9  O   ALA A  1       -3.163  -2.645   1.251  0.00  0.00    -0.249 OA
BRANCH   8  10
ATOM     10  OXT ALA A  1       -3.513  -4.134  -0.374  0.00  0.00    -0.479 OA
ATOM     11  HXT ALA A  1       -3.660  -4.643   0.451  0.00  0.00    +0.295 HD
ENDBRANCH   8  10
ENDBRANCH   7   8
ENDBRANCH   2   7
ENDBRANCH   1   4
BRANCH   1  12
ATOM     12  N   UNK A  0        1.423   0.101   0.216  0.00  0.00    -0.200 NA
ATOM     13  H   UNK A  0        1.600  -0.879   0.437  0.00  0.00    +0.135 HD
BRANCH  12  14
ATOM     14  P   UNK A  0        2.101   0.391  -1.245  0.00  0.00    +0.460 P 
ATOM     15  O   UNK A  0        1.216   0.387  -2.451  0.00  0.00    -0.228 OA
BRANCH  14  16
ATOM     16  O   UNK A  0        2.749   1.857  -1.111  0.00  0.00    -0.303 OA
ATOM     17  H   UNK A  0        3.049   2.162  -1.987  0.00  0.00    +0.222 HD
ENDBRANCH  14  16
BRANCH  14  18
ATOM     18  O   UNK A  0        3.398  -0.541  -1.418  0.00  0.00    -0.413 OA
BRANCH  18  19
ATOM     19  C   UNK A  0        4.446  -0.686  -0.554  0.00  0.00    +0.131 A 
ATOM     20  C   UNK A  0        4.652   0.090   0.584  0.00  0.00    +0.046 A 
ATOM     21  C   UNK A  0        5.763  -0.147   1.399  0.00  0.00    +0.004 A 
ATOM     22  C   UNK A  0        6.668  -1.156   1.076  0.00  0.00    +0.000 A 
ATOM     23  C   UNK A  0        6.466  -1.931  -0.064  0.00  0.00    +0.004 A 
ATOM     24  C   UNK A  0        5.357  -1.694  -0.877  0.00  0.00    +0.046 A 
ENDBRANCH  18  19
ENDBRANCH  14  18
ENDBRANCH  12  14
ENDBRANCH   1  12
BRANCH   1  25
ATOM     25  C   UNK A  0       -0.484   1.693  -0.070  0.00  0.00    +0.063 C 
BRANCH  25  26
ATOM     26  C   UNK A  0       -1.819   2.136   0.492  0.00  0.00    -0.045 A 
ATOM     27  C   UNK A  0       -2.886   2.430  -0.370  0.00  0.00    +0.004 A 
ATOM     28  C   UNK A  0       -4.124   2.819   0.142  0.00  0.00    +0.000 A 
ATOM     29  C   UNK A  0       -4.306   2.929   1.519  0.00  0.00    +0.000 A 
ATOM     30  C   UNK A  0       -3.248   2.657   2.384  0.00  0.00    +0.000 A 
ATOM     31  C   UNK A  0       -2.009   2.268   1.874  0.00  0.00    +0.004 A 
ENDBRANCH  25  26
ENDBRANCH   1  25
TORSDOF 11