REMARK Name = BDB000284 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 2.049 0.071 -1.083 0.00 0.00 -0.011 A ATOM 2 C LIG 1 0.740 -0.434 -0.963 0.00 0.00 +0.036 A ATOM 3 C LIG 1 -0.378 0.289 -1.408 0.00 0.00 +0.079 A ATOM 4 N LIG 1 -1.702 -0.221 -1.302 0.00 0.00 -0.265 N ATOM 5 C LIG 1 -2.792 0.579 -1.638 0.00 0.00 +0.265 C ATOM 6 C LIG 1 -2.459 2.020 -2.065 0.00 0.00 +0.289 C ATOM 7 O LIG 1 -1.143 2.358 -2.467 0.00 0.00 -0.473 OA ATOM 8 O LIG 1 -3.959 0.181 -1.572 0.00 0.00 -0.271 OA ATOM 9 C LIG 1 -0.159 1.545 -1.985 0.00 0.00 +0.143 A ATOM 10 C LIG 1 1.135 2.051 -2.131 0.00 0.00 +0.048 A ATOM 11 C LIG 1 2.233 1.321 -1.682 0.00 0.00 +0.012 A ENDROOT BRANCH 1 13 ATOM 12 C LIG 1 3.837 -0.468 0.611 0.00 0.00 +0.056 A ATOM 13 C LIG 1 3.197 -0.711 -0.602 0.00 0.00 +0.043 A ATOM 14 C LIG 1 3.728 -1.773 -1.335 0.00 0.00 +0.129 A ATOM 15 N LIG 1 4.763 -2.519 -0.922 0.00 0.00 -0.199 NA ATOM 16 C LIG 1 5.292 -2.212 0.260 0.00 0.00 +0.214 A ATOM 17 N LIG 1 4.888 -1.208 1.038 0.00 0.00 -0.219 NA BRANCH 14 18 ATOM 18 N LIG 1 3.171 -2.173 -2.556 0.00 0.00 -0.343 N ATOM 19 H LIG 1 3.754 -2.917 -2.930 0.00 0.00 +0.144 HD ATOM 20 H LIG 1 3.070 -1.396 -3.200 0.00 0.00 +0.144 HD ENDBRANCH 14 18 BRANCH 16 21 ATOM 21 N LIG 1 6.368 -2.956 0.695 0.00 0.00 -0.327 N ATOM 22 H LIG 1 6.843 -3.372 -0.093 0.00 0.00 +0.145 HD ATOM 23 H LIG 1 6.919 -2.415 1.345 0.00 0.00 +0.145 HD ENDBRANCH 16 21 BRANCH 12 25 ATOM 24 C LIG 1 2.326 0.083 2.539 0.00 0.00 +0.010 C ATOM 25 C LIG 1 3.385 0.601 1.577 0.00 0.00 +0.053 C ENDBRANCH 12 25 ENDBRANCH 1 13 BRANCH 6 26 ATOM 26 C LIG 1 -2.918 3.040 -1.028 0.00 0.00 +0.002 A ATOM 27 C LIG 1 -2.461 2.987 0.299 0.00 0.00 +0.008 A ATOM 28 C LIG 1 -2.880 3.934 1.234 0.00 0.00 +0.000 A ATOM 29 C LIG 1 -3.755 4.950 0.856 0.00 0.00 +0.000 A ATOM 30 C LIG 1 -4.210 5.021 -0.459 0.00 0.00 +0.000 A ATOM 31 C LIG 1 -3.793 4.075 -1.396 0.00 0.00 +0.008 A ENDBRANCH 6 26 BRANCH 4 32 ATOM 32 C LIG 1 -1.972 -1.560 -0.780 0.00 0.00 +0.116 C BRANCH 32 33 ATOM 33 C LIG 1 -2.088 -1.566 0.743 0.00 0.00 +0.047 C BRANCH 33 34 ATOM 34 C LIG 1 -2.395 -2.961 1.268 0.00 0.00 +0.161 C BRANCH 34 35 ATOM 35 O LIG 1 -2.427 -2.904 2.693 0.00 0.00 -0.383 OA ATOM 36 C LIG 1 -2.728 -4.170 3.263 0.00 0.00 +0.193 C ENDBRANCH 34 35 ENDBRANCH 33 34 ENDBRANCH 32 33 ENDBRANCH 4 32 TORSDOF 9