REMARK Name = BDB025267 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -3.027 -0.655 0.107 0.00 0.00 +0.030 A ATOM 2 C LIG 1 -2.317 0.512 -0.239 0.00 0.00 +0.033 A ATOM 3 C LIG 1 -0.911 0.614 -0.095 0.00 0.00 +0.011 A ATOM 4 C LIG 1 0.032 1.648 -0.366 0.00 0.00 +0.027 A ATOM 5 C LIG 1 1.289 1.157 -0.033 0.00 0.00 +0.142 A ATOM 6 N LIG 1 1.134 -0.123 0.443 0.00 0.00 -0.313 N ATOM 7 N LIG 1 2.465 1.805 -0.157 0.00 0.00 -0.237 NA ATOM 8 C LIG 1 2.341 3.059 -0.644 0.00 0.00 +0.113 A ATOM 9 C LIG 1 1.152 3.671 -1.007 0.00 0.00 +0.020 A ATOM 10 C LIG 1 -0.039 2.958 -0.872 0.00 0.00 +0.013 A ATOM 11 C LIG 1 -0.204 -0.484 0.396 0.00 0.00 +0.052 A ATOM 12 C LIG 1 -0.859 -1.673 0.732 0.00 0.00 +0.028 A ATOM 13 C LIG 1 -2.255 -1.730 0.574 0.00 0.00 +0.025 A ENDROOT BRANCH 6 14 ATOM 14 C LIG 1 2.216 -0.999 0.891 0.00 0.00 +0.176 C ATOM 15 C LIG 1 3.277 -0.281 1.709 0.00 0.00 +0.242 C ATOM 16 O LIG 1 3.075 0.112 2.858 0.00 0.00 -0.273 OA ATOM 17 N LIG 1 4.505 -0.096 1.118 0.00 0.00 -0.255 N ATOM 18 H LIG 1 5.178 0.422 1.665 0.00 0.00 +0.158 HD ATOM 19 C LIG 1 4.859 -0.335 -0.185 0.00 0.00 +0.219 C ATOM 20 O LIG 1 5.955 0.014 -0.617 0.00 0.00 -0.275 OA ATOM 21 C LIG 1 3.829 -1.009 -1.060 0.00 0.00 +0.099 C ATOM 22 C LIG 1 2.839 -1.821 -0.239 0.00 0.00 +0.044 C ENDBRANCH 6 14 BRANCH 1 24 ATOM 23 C LIG 1 -5.191 0.464 -0.294 0.00 0.00 +0.129 C ATOM 24 N LIG 1 -4.418 -0.753 -0.051 0.00 0.00 -0.336 N ATOM 25 C LIG 1 -5.131 -1.818 0.654 0.00 0.00 +0.129 C ENDBRANCH 1 24 TORSDOF 2