REMARK Name = BDB051907 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -2.206 -1.491 -0.721 0.00 0.00 +0.113 C ATOM 2 C LIG 1 -2.178 -0.015 -0.504 0.00 0.00 +0.231 C ATOM 3 N LIG 1 -0.953 0.574 -0.137 0.00 0.00 -0.254 N ATOM 4 C LIG 1 0.304 -0.012 0.068 0.00 0.00 +0.077 A ATOM 5 C LIG 1 1.138 1.054 0.413 0.00 0.00 +0.091 A ATOM 6 C LIG 1 2.496 0.837 0.695 0.00 0.00 +0.030 A ATOM 7 C LIG 1 3.006 -0.460 0.627 0.00 0.00 +0.002 A ATOM 8 C LIG 1 2.176 -1.521 0.284 0.00 0.00 +0.002 A ATOM 9 N LIG 1 0.460 2.233 0.425 0.00 0.00 -0.218 NA ATOM 10 C LIG 1 0.818 -1.321 -0.001 0.00 0.00 +0.028 A ATOM 11 C LIG 1 -0.781 1.938 0.097 0.00 0.00 +0.220 A ATOM 12 O LIG 1 -3.170 0.692 -0.631 0.00 0.00 -0.273 OA ENDROOT BRANCH 11 13 ATOM 13 C LIG 1 -1.792 2.949 0.009 0.00 0.00 +0.139 C ATOM 14 N LIG 1 -2.584 3.796 -0.052 0.00 0.00 -0.188 NA ENDBRANCH 11 13 TORSDOF 1