REMARK Name = BDB013675 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.451 0.175 0.265 0.00 0.00 +0.166 A ATOM 2 C LIG 1 -1.665 1.025 0.375 0.00 0.00 +0.117 A ATOM 3 C LIG 1 -2.891 0.469 0.105 0.00 0.00 +0.070 A ATOM 4 C LIG 1 -4.018 1.282 0.218 0.00 0.00 +0.017 A ATOM 5 C LIG 1 -3.858 2.616 0.592 0.00 0.00 +0.020 A ATOM 6 C LIG 1 -2.575 3.089 0.834 0.00 0.00 +0.111 A ATOM 7 C LIG 1 -2.967 -0.936 -0.298 0.00 0.00 +0.276 A ATOM 8 O LIG 1 -4.070 -1.432 -0.511 0.00 0.00 -0.266 OA ATOM 9 N LIG 1 -1.756 -1.610 -0.423 0.00 0.00 -0.230 N ATOM 10 C LIG 1 -1.741 -3.014 -0.793 0.00 0.00 +0.176 C ATOM 11 N LIG 1 -1.462 2.329 0.732 0.00 0.00 -0.251 NA ATOM 12 N LIG 1 -0.528 -1.068 -0.121 0.00 0.00 -0.151 NA ENDROOT BRANCH 1 13 ATOM 13 N LIG 1 0.752 0.777 0.598 0.00 0.00 -0.321 N ATOM 14 H LIG 1 0.688 1.793 0.659 0.00 0.00 +0.148 HD BRANCH 13 18 ATOM 15 C LIG 1 4.619 -0.796 -0.508 0.00 0.00 +0.105 C ATOM 16 N LIG 1 3.841 -0.417 0.672 0.00 0.00 -0.302 NA ATOM 17 C LIG 1 3.233 0.921 0.492 0.00 0.00 +0.107 C ATOM 18 C LIG 1 1.935 0.262 -0.028 0.00 0.00 +0.100 C ATOM 19 C LIG 1 2.489 -1.028 0.619 0.00 0.00 +0.107 C ENDBRANCH 13 18 ENDBRANCH 1 13 TORSDOF 2