REMARK Name = BDB020184 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 0.510 0.588 -0.192 0.00 0.00 +0.033 A ATOM 2 C LIG 1 -0.392 1.115 0.737 0.00 0.00 +0.023 A ATOM 3 C LIG 1 -1.760 0.826 0.651 0.00 0.00 +0.006 A ATOM 4 C LIG 1 -2.272 0.002 -0.363 0.00 0.00 -0.032 A ATOM 5 C LIG 1 -1.352 -0.507 -1.294 0.00 0.00 +0.006 A ATOM 6 C LIG 1 0.018 -0.223 -1.210 0.00 0.00 +0.023 A ENDROOT BRANCH 4 7 ATOM 7 C LIG 1 -3.746 -0.318 -0.474 0.00 0.00 +0.084 C ATOM 8 C LIG 1 -4.670 0.692 -1.100 0.00 0.00 +0.230 C ATOM 9 O LIG 1 -4.500 1.201 -2.194 0.00 0.00 -0.274 OA ATOM 10 N LIG 1 -5.733 0.874 -0.269 0.00 0.00 -0.255 N ATOM 11 H LIG 1 -6.524 1.441 -0.524 0.00 0.00 +0.158 HD ATOM 12 C LIG 1 -5.772 -0.010 0.762 0.00 0.00 +0.224 C ATOM 13 O LIG 1 -6.672 -0.173 1.565 0.00 0.00 -0.275 OA ATOM 14 C LIG 1 -4.522 -0.811 0.755 0.00 0.00 +0.096 C ATOM 15 C LIG 1 -4.200 -1.764 -0.362 0.00 0.00 +0.035 C ENDBRANCH 4 7 BRANCH 1 17 ATOM 16 C LIG 1 2.944 0.492 -0.798 0.00 0.00 +0.231 C ATOM 17 N LIG 1 1.869 0.925 -0.034 0.00 0.00 -0.284 N ATOM 18 H LIG 1 2.087 1.533 0.746 0.00 0.00 +0.155 HD ATOM 19 O LIG 1 2.893 -0.287 -1.746 0.00 0.00 -0.274 OA BRANCH 16 20 ATOM 20 C LIG 1 4.281 1.087 -0.326 0.00 0.00 +0.180 C BRANCH 20 22 ATOM 21 C LIG 1 5.516 -1.008 -0.165 0.00 0.00 +0.105 C ATOM 22 N LIG 1 5.067 0.190 0.546 0.00 0.00 -0.300 NA ATOM 23 C LIG 1 4.377 -0.166 1.781 0.00 0.00 +0.105 C ENDBRANCH 20 22 ENDBRANCH 16 20 ENDBRANCH 1 17 TORSDOF 4