REMARK Name = BDB014209 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 1.714 0.119 0.622 0.00 0.00 +0.086 A ATOM 2 C LIG 1 0.434 0.157 0.063 0.00 0.00 +0.079 A ATOM 3 C LIG 1 -0.137 1.363 -0.326 0.00 0.00 +0.090 A ATOM 4 C LIG 1 -1.419 1.082 -0.850 0.00 0.00 +0.053 A ATOM 5 CA LIG 1 -1.620 -0.286 -0.771 0.00 0.00 +0.044 A ATOM 6 N LIG 1 0.489 2.556 -0.193 0.00 0.00 -0.253 NA ATOM 7 C LIG 1 1.724 2.498 0.348 0.00 0.00 +0.112 A ATOM 8 N LIG 1 -0.482 -0.829 -0.221 0.00 0.00 -0.354 N ATOM 9 H LIG 1 -0.314 -1.812 -0.038 0.00 0.00 +0.166 HD ATOM 10 C LIG 1 2.368 1.344 0.762 0.00 0.00 +0.037 A ENDROOT BRANCH 1 12 ATOM 11 O LIG 1 3.497 -1.188 1.545 0.00 0.00 -0.245 OA ATOM 12 C LIG 1 2.385 -1.119 1.056 0.00 0.00 +0.339 C BRANCH 12 13 ATOM 13 O LIG 1 1.639 -2.225 0.864 0.00 0.00 -0.477 OA ATOM 14 H LIG 1 2.222 -2.942 1.199 0.00 0.00 +0.295 HD ENDBRANCH 12 13 ENDBRANCH 1 12 BRANCH 5 15 ATOM 15 C LIG 1 -2.775 -1.122 -1.177 0.00 0.00 +0.208 C BRANCH 15 16 ATOM 16 O LIG 1 -3.923 -0.600 -0.530 0.00 0.00 -0.389 OA ATOM 17 H LIG 1 -3.678 -0.418 0.393 0.00 0.00 +0.210 HD ENDBRANCH 15 16 ENDBRANCH 5 15 TORSDOF 4