REMARK Name = BDB011154 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N LIG 1 -1.811 2.474 -0.819 0.00 0.00 -0.261 N ATOM 2 C LIG 1 -2.023 1.209 -1.345 0.00 0.00 +0.332 A ATOM 3 O LIG 1 -3.095 0.915 -1.880 0.00 0.00 -0.246 OA ATOM 4 N LIG 1 -0.986 0.275 -1.203 0.00 0.00 -0.292 N ATOM 5 C LIG 1 0.269 0.624 -0.580 0.00 0.00 +0.069 A ATOM 6 C LIG 1 0.284 1.794 0.169 0.00 0.00 +0.082 A ATOM 7 C LIG 1 1.352 2.053 1.000 0.00 0.00 +0.127 A ATOM 8 N LIG 1 2.414 1.235 1.110 0.00 0.00 -0.250 NA ATOM 9 C LIG 1 2.505 0.161 0.302 0.00 0.00 +0.114 A ATOM 10 C LIG 1 3.668 -0.634 0.359 0.00 0.00 +0.146 A ATOM 11 C LIG 1 3.859 -1.699 -0.524 0.00 0.00 +0.048 A ATOM 12 C LIG 1 2.912 -1.958 -1.499 0.00 0.00 +0.004 A ATOM 13 C LIG 1 1.751 -1.190 -1.554 0.00 0.00 +0.012 A ATOM 14 C LIG 1 1.470 -0.162 -0.619 0.00 0.00 +0.028 A ATOM 15 C LIG 1 -0.809 2.758 0.089 0.00 0.00 +0.266 A ATOM 16 O LIG 1 -0.786 3.756 0.805 0.00 0.00 -0.267 OA ENDROOT BRANCH 1 18 ATOM 17 C LIG 1 -3.956 3.316 0.100 0.00 0.00 +0.027 C ATOM 18 C LIG 1 -2.878 3.459 -0.968 0.00 0.00 +0.126 C ENDBRANCH 1 18 BRANCH 10 19 ATOM 19 O LIG 1 4.589 -0.276 1.321 0.00 0.00 -0.493 OA ATOM 20 C LIG 1 5.784 -1.035 1.423 0.00 0.00 +0.277 C ENDBRANCH 10 19 BRANCH 4 21 ATOM 21 C LIG 1 -1.384 -1.135 -1.371 0.00 0.00 +0.130 C BRANCH 21 22 ATOM 22 C LIG 1 -1.468 -1.930 -0.050 0.00 0.00 +0.003 C ATOM 23 C LIG 1 -2.550 -1.376 0.880 0.00 0.00 +0.009 C ATOM 24 C LIG 1 -1.746 -3.405 -0.350 0.00 0.00 +0.009 C ENDBRANCH 21 22 ENDBRANCH 4 21 TORSDOF 4