REMARK Name = BDB018286 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.913 -4.637 -0.217 0.00 0.00 +0.152 C ATOM 2 N LIG 1 -1.482 -3.300 -0.172 0.00 0.00 -0.318 N ATOM 3 C LIG 1 -2.856 -3.144 -0.255 0.00 0.00 +0.253 A ATOM 4 O LIG 1 -3.667 -4.062 -0.345 0.00 0.00 -0.268 OA ATOM 5 C LIG 1 -3.347 -1.747 -0.213 0.00 0.00 +0.094 A ATOM 6 C LIG 1 -2.519 -0.689 -0.128 0.00 0.00 +0.044 A ATOM 7 C LIG 1 -1.055 -0.935 -0.129 0.00 0.00 +0.022 A ATOM 8 C LIG 1 -0.626 -2.215 -0.137 0.00 0.00 +0.099 A ENDROOT BRANCH 6 9 ATOM 9 N LIG 1 -3.001 0.622 -0.011 0.00 0.00 -0.329 N ATOM 10 C LIG 1 -2.818 1.401 1.226 0.00 0.00 +0.105 C ATOM 11 C LIG 1 -3.600 2.683 0.978 0.00 0.00 +0.020 C ATOM 12 C LIG 1 -4.781 2.191 0.166 0.00 0.00 +0.020 C ATOM 13 C LIG 1 -4.156 1.149 -0.756 0.00 0.00 +0.105 C ENDBRANCH 6 9 BRANCH 7 14 ATOM 14 C LIG 1 -0.096 0.134 -0.194 0.00 0.00 +0.023 A ATOM 15 C LIG 1 1.086 0.229 0.510 0.00 0.00 +0.117 A ATOM 16 N LIG 1 1.680 1.393 0.104 0.00 0.00 -0.267 N ATOM 17 N LIG 1 0.949 2.077 -0.803 0.00 0.00 -0.179 NA ATOM 18 C LIG 1 -0.123 1.300 -0.990 0.00 0.00 +0.143 A BRANCH 16 19 ATOM 19 C LIG 1 2.942 1.940 0.584 0.00 0.00 +0.178 C BRANCH 19 20 ATOM 20 C LIG 1 4.123 1.127 0.112 0.00 0.00 -0.026 A ATOM 21 C LIG 1 4.921 0.426 1.028 0.00 0.00 +0.005 A ATOM 22 C LIG 1 6.014 -0.322 0.586 0.00 0.00 +0.000 A ATOM 23 C LIG 1 6.321 -0.375 -0.772 0.00 0.00 +0.000 A ATOM 24 C LIG 1 5.538 0.319 -1.692 0.00 0.00 +0.000 A ATOM 25 C LIG 1 4.445 1.068 -1.253 0.00 0.00 +0.005 A ENDBRANCH 19 20 ENDBRANCH 16 19 ENDBRANCH 7 14 TORSDOF 4