REMARK Name = LIG000160 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 1.929 -0.091 0.396 0.00 0.00 +0.029 A ATOM 2 C LIG 1 1.166 0.958 -0.147 0.00 0.00 +0.053 A ATOM 3 C LIG 1 -0.230 0.886 -0.254 0.00 0.00 +0.102 A ATOM 4 C LIG 1 -0.865 -0.246 0.217 0.00 0.00 +0.068 A ATOM 5 C LIG 1 -2.318 -0.279 0.086 0.00 0.00 +0.278 A ATOM 6 N LIG 1 -2.882 0.823 -0.530 0.00 0.00 -0.198 N ATOM 7 N LIG 1 -2.164 1.910 -0.944 0.00 0.00 -0.061 NA ATOM 8 O LIG 1 -2.954 -1.241 0.507 0.00 0.00 -0.265 OA ATOM 9 C LIG 1 -0.149 -1.294 0.798 0.00 0.00 +0.017 A ATOM 10 N LIG 1 -0.922 1.963 -0.819 0.00 0.00 -0.131 NA ATOM 11 C LIG 1 1.242 -1.203 0.897 0.00 0.00 +0.024 A ENDROOT BRANCH 6 12 ATOM 12 C LIG 1 -4.329 0.910 -0.722 0.00 0.00 +0.199 C ATOM 13 C LIG 1 -4.814 -0.200 -1.661 0.00 0.00 +0.244 C ATOM 14 O LIG 1 -4.136 -0.670 -2.573 0.00 0.00 -0.273 OA ATOM 15 N LIG 1 -6.126 -0.588 -1.504 0.00 0.00 -0.255 N ATOM 16 H LIG 1 -6.449 -1.308 -2.136 0.00 0.00 +0.158 HD ATOM 17 C LIG 1 -7.062 -0.081 -0.638 0.00 0.00 +0.219 C ATOM 18 O LIG 1 -8.227 -0.468 -0.666 0.00 0.00 -0.275 OA ATOM 19 C LIG 1 -6.604 1.029 0.279 0.00 0.00 +0.099 C ATOM 20 C LIG 1 -5.119 0.918 0.586 0.00 0.00 +0.046 C ENDBRANCH 6 12 BRANCH 1 21 ATOM 21 N LIG 1 3.308 0.092 0.529 0.00 0.00 -0.344 N ATOM 22 H LIG 1 3.675 0.718 -0.184 0.00 0.00 +0.146 HD BRANCH 21 23 ATOM 23 C LIG 1 4.173 -1.053 0.797 0.00 0.00 +0.101 C BRANCH 23 24 ATOM 24 C LIG 1 5.644 -0.625 0.824 0.00 0.00 +0.018 C BRANCH 24 26 ATOM 25 C LIG 1 7.680 0.034 -0.508 0.00 0.00 +0.004 C ATOM 26 C LIG 1 6.202 -0.321 -0.569 0.00 0.00 -0.002 C ENDBRANCH 24 26 ENDBRANCH 23 24 ENDBRANCH 21 23 ENDBRANCH 1 21 TORSDOF 5