REMARK Name = LIG000364 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.017 0.215 -0.447 0.00 0.00 +0.210 A ATOM 2 C LIG 1 -0.012 -1.245 -0.154 0.00 0.00 +0.288 A ATOM 3 O LIG 1 1.067 -1.818 -0.064 0.00 0.00 -0.265 OA ATOM 4 N LIG 1 -1.251 -1.813 0.029 0.00 0.00 -0.253 N ATOM 5 C LIG 1 -2.430 -1.075 0.122 0.00 0.00 +0.353 A ATOM 6 O LIG 1 -3.488 -1.653 0.381 0.00 0.00 -0.244 OA ATOM 7 N LIG 1 -2.300 0.319 -0.075 0.00 0.00 -0.181 N ATOM 8 N LIG 1 -1.101 0.925 -0.394 0.00 0.00 -0.152 NA ENDROOT BRANCH 1 12 ATOM 9 C LIG 1 4.188 2.083 1.072 0.00 0.00 +0.115 C ATOM 10 C LIG 1 3.231 2.210 -0.112 0.00 0.00 +0.122 C ATOM 11 N LIG 1 1.910 1.652 0.178 0.00 0.00 -0.295 N ATOM 12 C LIG 1 1.259 0.929 -0.821 0.00 0.00 +0.272 C ATOM 13 O LIG 1 1.645 0.822 -1.979 0.00 0.00 -0.268 OA ATOM 14 C LIG 1 1.390 1.795 1.538 0.00 0.00 +0.108 C ATOM 15 C LIG 1 2.094 2.904 2.309 0.00 0.00 +0.020 C ATOM 16 C LIG 1 3.613 2.719 2.350 0.00 0.00 +0.018 C BRANCH 9 17 ATOM 17 C LIG 1 4.531 0.616 1.273 0.00 0.00 +0.312 C ATOM 18 O LIG 1 4.097 -0.089 2.173 0.00 0.00 -0.250 OA BRANCH 17 19 ATOM 19 O LIG 1 5.387 0.200 0.297 0.00 0.00 -0.465 OA BRANCH 19 21 ATOM 20 C LIG 1 6.713 -1.490 -0.745 0.00 0.00 +0.048 C ATOM 21 C LIG 1 5.715 -1.194 0.357 0.00 0.00 +0.229 C ENDBRANCH 19 21 ENDBRANCH 17 19 ENDBRANCH 9 17 ENDBRANCH 1 12 BRANCH 7 22 ATOM 22 C LIG 1 -3.396 1.262 0.006 0.00 0.00 +0.071 A ATOM 23 C LIG 1 -3.171 2.628 -0.267 0.00 0.00 +0.028 A ATOM 24 C LIG 1 -4.196 3.580 -0.194 0.00 0.00 +0.005 A ATOM 25 C LIG 1 -5.490 3.199 0.158 0.00 0.00 -0.050 A ATOM 26 C LIG 1 -6.587 4.219 0.219 0.00 0.00 +0.044 C ATOM 27 C LIG 1 -5.737 1.853 0.427 0.00 0.00 +0.005 A ATOM 28 C LIG 1 -4.705 0.903 0.355 0.00 0.00 +0.028 A ENDBRANCH 7 22 BRANCH 4 29 ATOM 29 C LIG 1 -1.312 -3.256 0.211 0.00 0.00 +0.165 C BRANCH 29 30 ATOM 30 C LIG 1 -1.454 -3.977 -1.113 0.00 0.00 -0.028 A ATOM 31 C LIG 1 -0.320 -4.378 -1.833 0.00 0.00 +0.005 A ATOM 32 C LIG 1 -0.454 -5.020 -3.065 0.00 0.00 +0.000 A ATOM 33 C LIG 1 -1.721 -5.263 -3.592 0.00 0.00 +0.000 A ATOM 34 C LIG 1 -2.855 -4.862 -2.889 0.00 0.00 +0.000 A ATOM 35 C LIG 1 -2.724 -4.219 -1.657 0.00 0.00 +0.005 A ENDBRANCH 29 30 ENDBRANCH 4 29 TORSDOF 7