REMARK Name = BDB001110 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 0.916 2.874 0.535 0.00 0.00 +0.068 C ATOM 2 C LIG 1 1.283 1.477 0.202 0.00 0.00 +0.069 A ATOM 3 C LIG 1 0.447 0.362 0.021 0.00 0.00 +0.043 A ATOM 4 C LIG 1 1.279 -0.690 -0.278 0.00 0.00 +0.139 A ATOM 5 N LIG 1 0.859 -1.980 -0.542 0.00 0.00 -0.307 N ATOM 6 H LIG 1 1.494 -2.733 -0.763 0.00 0.00 +0.170 HD ATOM 7 C LIG 1 -0.498 -2.270 -0.515 0.00 0.00 +0.254 A ATOM 8 C LIG 1 -1.409 -1.141 -0.189 0.00 0.00 +0.021 A ATOM 9 C LIG 1 -2.886 -1.199 -0.104 0.00 0.00 +0.041 C ATOM 10 C LIG 1 -3.219 0.152 0.553 0.00 0.00 +0.009 C ATOM 11 C LIG 1 -1.996 1.068 0.360 0.00 0.00 +0.036 C ATOM 12 O LIG 1 -0.930 -3.395 -0.746 0.00 0.00 -0.268 OA ATOM 13 N LIG 1 2.545 -0.185 -0.255 0.00 0.00 -0.251 N ATOM 14 C LIG 1 3.788 -0.871 -0.503 0.00 0.00 +0.174 C ATOM 15 C LIG 1 -0.931 0.085 0.060 0.00 0.00 -0.027 A ATOM 16 N LIG 1 2.574 1.140 0.031 0.00 0.00 -0.174 NA ENDROOT TORSDOF 0