REMARK  Name = BDB049501
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   UNK A  0        0.904   0.202  -0.623  0.00  0.00    -0.276 OA
ATOM      2  C   UNK A  0        0.219  -0.784  -0.859  0.00  0.00    +0.215 C 
ATOM      3  N   TYR A  1        0.752  -2.053  -0.948  0.00  0.00    -0.302 N 
ATOM      4  H   TYR A  1        0.176  -2.820  -1.280  0.00  0.00    +0.150 HD
ENDROOT
BRANCH   3   5
ATOM      5  CA  TYR A  1        2.187  -2.307  -0.791  0.00  0.00    +0.186 C 
BRANCH   5   6
ATOM      6  C   TYR A  1        2.614  -3.239  -1.919  0.00  0.00    +0.326 C 
ATOM      7  O   TYR A  1        1.882  -3.987  -2.551  0.00  0.00    -0.249 OA
BRANCH   6   8
ATOM      8  OXT TYR A  1        3.938  -3.209  -2.165  0.00  0.00    -0.479 OA
ATOM      9  HXT TYR A  1        4.064  -3.833  -2.911  0.00  0.00    +0.295 HD
ENDBRANCH   6   8
ENDBRANCH   5   6
BRANCH   5  10
ATOM     10  CB  TYR A  1        2.510  -2.979   0.552  0.00  0.00    +0.069 C 
BRANCH  10  11
ATOM     11  CG  TYR A  1        2.137  -2.168   1.773  0.00  0.00    -0.045 A 
ATOM     12  CD2 TYR A  1        1.229  -2.676   2.713  0.00  0.00    +0.007 A 
ATOM     13  CE2 TYR A  1        0.883  -1.929   3.840  0.00  0.00    +0.045 A 
ATOM     14  CZ  TYR A  1        1.445  -0.674   4.034  0.00  0.00    +0.117 A 
ATOM     15  CE1 TYR A  1        2.352  -0.152   3.119  0.00  0.00    +0.045 A 
ATOM     16  CD1 TYR A  1        2.701  -0.902   1.993  0.00  0.00    +0.007 A 
BRANCH  14  17
ATOM     17  OH  TYR A  1        1.073   0.028   5.142  0.00  0.00    -0.507 OA
ATOM     18  HH  TYR A  1        1.547   0.876   5.137  0.00  0.00    +0.292 HD
ENDBRANCH  14  17
ENDBRANCH  10  11
ENDBRANCH   5  10
ENDBRANCH   3   5
BRANCH   2  19
ATOM     19  C   UNK A  0       -1.289  -0.782  -1.045  0.00  0.00    +0.108 C 
BRANCH  19  20
ATOM     20  C   UNK A  0       -2.007   0.582  -1.004  0.00  0.00    +0.058 C 
BRANCH  20  21
ATOM     21  C   UNK A  0       -2.114   1.299   0.345  0.00  0.00    -0.040 A 
ATOM     22  C   UNK A  0       -2.958   2.423   0.449  0.00  0.00    +0.004 A 
ATOM     23  C   UNK A  0       -3.127   3.096   1.661  0.00  0.00    +0.000 A 
ATOM     24  C   UNK A  0       -2.463   2.652   2.800  0.00  0.00    +0.000 A 
ATOM     25  C   UNK A  0       -1.630   1.540   2.722  0.00  0.00    +0.000 A 
ATOM     26  C   UNK A  0       -1.456   0.869   1.507  0.00  0.00    +0.004 A 
ENDBRANCH  20  21
BRANCH  20  27
ATOM     27  C   UNK A  0       -1.604   1.468  -2.183  0.00  0.00    -0.040 A 
ATOM     28  C   UNK A  0       -2.253   1.318  -3.421  0.00  0.00    +0.004 A 
ATOM     29  C   UNK A  0       -1.898   2.108  -4.516  0.00  0.00    +0.000 A 
ATOM     30  C   UNK A  0       -0.887   3.058  -4.392  0.00  0.00    +0.000 A 
ATOM     31  C   UNK A  0       -0.230   3.216  -3.174  0.00  0.00    +0.000 A 
ATOM     32  C   UNK A  0       -0.585   2.427  -2.078  0.00  0.00    +0.004 A 
ENDBRANCH  20  27
ENDBRANCH  19  20
ENDBRANCH   2  19
TORSDOF 10