REMARK Name = BDB056459 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.638 -1.424 0.490 0.00 0.00 +0.083 C ENDROOT BRANCH 1 2 ATOM 2 C LIG 1 -2.083 -1.115 0.201 0.00 0.00 +0.111 A ATOM 3 N LIG 1 -2.574 -1.593 -0.984 0.00 0.00 -0.310 N ATOM 4 H LIG 1 -2.003 -2.157 -1.598 0.00 0.00 +0.170 HD ATOM 5 C LIG 1 -3.863 -1.383 -1.403 0.00 0.00 +0.259 A ATOM 6 O LIG 1 -4.283 -1.828 -2.465 0.00 0.00 -0.267 OA ATOM 7 C LIG 1 -4.704 -0.586 -0.495 0.00 0.00 +0.065 A ATOM 8 C LIG 1 -4.117 -0.129 0.689 0.00 0.00 +0.078 A ATOM 9 C LIG 1 -4.893 0.628 1.568 0.00 0.00 +0.028 A ATOM 10 C LIG 1 -6.228 0.920 1.269 0.00 0.00 +0.002 A ATOM 11 C LIG 1 -6.799 0.457 0.082 0.00 0.00 +0.001 A ATOM 12 C LIG 1 -6.037 -0.300 -0.806 0.00 0.00 +0.015 A ATOM 13 N LIG 1 -2.779 -0.401 1.024 0.00 0.00 -0.234 NA ENDBRANCH 1 2 BRANCH 1 14 ATOM 14 C LIG 1 0.232 -0.263 0.025 0.00 0.00 +0.103 C BRANCH 14 17 ATOM 15 N LIG 1 2.526 0.465 -0.193 0.00 0.00 -0.310 N ATOM 16 H LIG 1 2.120 1.392 -0.155 0.00 0.00 +0.149 HD ATOM 17 C LIG 1 1.703 -0.602 0.099 0.00 0.00 +0.214 C ATOM 18 O LIG 1 2.138 -1.716 0.374 0.00 0.00 -0.276 OA BRANCH 15 19 ATOM 19 CA LIG 1 3.987 0.356 -0.103 0.00 0.00 +0.098 C BRANCH 19 21 ATOM 20 C LIG 1 6.128 1.284 -1.157 0.00 0.00 +0.006 C ATOM 21 C LIG 1 4.622 1.430 -1.000 0.00 0.00 +0.021 C ENDBRANCH 19 21 BRANCH 19 22 ATOM 22 C LIG 1 4.465 0.454 1.363 0.00 0.00 +0.178 C BRANCH 22 23 ATOM 23 O LIG 1 3.917 -0.561 2.201 0.00 0.00 -0.393 OA ATOM 24 H LIG 1 3.490 -1.236 1.633 0.00 0.00 +0.209 HD ENDBRANCH 22 23 ENDBRANCH 19 22 ENDBRANCH 15 19 ENDBRANCH 14 17 ENDBRANCH 1 14 TORSDOF 7