REMARK Name = BDB063151 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -1.937 -0.261 0.066 0.00 0.00 +0.130 A ATOM 2 C LIG 1 -0.565 -0.025 0.113 0.00 0.00 +0.077 A ATOM 3 N LIG 1 0.201 0.607 1.065 0.00 0.00 -0.352 N ATOM 4 H LIG 1 -0.181 1.008 1.914 0.00 0.00 +0.166 HD ATOM 5 C LIG 1 1.526 0.613 0.701 0.00 0.00 +0.048 A ATOM 6 C LIG 1 1.617 -0.039 -0.529 0.00 0.00 +0.008 A ATOM 7 C LIG 1 2.886 -0.170 -1.129 0.00 0.00 +0.010 A ATOM 8 C LIG 1 4.011 0.353 -0.481 0.00 0.00 +0.001 A ATOM 9 C LIG 1 3.887 0.999 0.747 0.00 0.00 +0.002 A ATOM 10 C LIG 1 2.640 1.142 1.363 0.00 0.00 +0.026 A ATOM 11 C LIG 1 0.294 -0.442 -0.900 0.00 0.00 +0.011 A ATOM 12 C LIG 1 -0.256 -1.121 -1.999 0.00 0.00 +0.030 A ATOM 13 C LIG 1 -1.629 -1.324 -1.986 0.00 0.00 +0.112 A ATOM 14 N LIG 1 -2.461 -0.918 -1.001 0.00 0.00 -0.250 NA ENDROOT BRANCH 1 16 ATOM 15 C LIG 1 -4.311 -0.124 0.991 0.00 0.00 +0.093 C ATOM 16 C LIG 1 -2.846 0.185 1.147 0.00 0.00 +0.180 C ATOM 17 O LIG 1 -2.401 0.783 2.127 0.00 0.00 -0.291 OA ENDBRANCH 1 16 TORSDOF 1