REMARK Name = BDB001011 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 O LIG 1 -2.071 1.993 -0.126 0.00 0.00 -0.267 OA ATOM 2 C LIG 1 -1.653 0.843 -0.064 0.00 0.00 +0.259 A ATOM 3 C LIG 1 -0.214 0.527 -0.029 0.00 0.00 +0.065 A ATOM 4 C LIG 1 0.147 -0.823 0.042 0.00 0.00 +0.078 A ATOM 5 C LIG 1 1.504 -1.148 0.077 0.00 0.00 +0.028 A ATOM 6 C LIG 1 2.477 -0.145 0.041 0.00 0.00 +0.002 A ATOM 7 C LIG 1 2.101 1.197 -0.029 0.00 0.00 +0.001 A ATOM 8 N LIG 1 -0.804 -1.859 0.079 0.00 0.00 -0.237 NA ATOM 9 C LIG 1 -2.048 -1.525 0.046 0.00 0.00 +0.199 A ATOM 10 C LIG 1 0.750 1.539 -0.065 0.00 0.00 +0.015 A ATOM 11 N LIG 1 -2.496 -0.238 -0.023 0.00 0.00 -0.313 N ATOM 12 H LIG 1 -3.485 -0.035 -0.046 0.00 0.00 +0.170 HD ENDROOT TORSDOF 0