REMARK Name = LIG000488 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N LIG 1 3.620 0.393 0.183 0.00 0.00 -0.282 N ATOM 2 C LIG 1 3.197 -0.607 1.048 0.00 0.00 +0.248 C ATOM 3 O LIG 1 3.871 -1.346 1.738 0.00 0.00 -0.270 OA ATOM 4 C LIG 1 1.733 -0.640 0.973 0.00 0.00 +0.042 A ATOM 5 C LIG 1 1.327 0.278 0.009 0.00 0.00 -0.016 A ATOM 6 C LIG 1 -0.019 0.454 -0.273 0.00 0.00 +0.029 A ATOM 7 C LIG 1 -0.959 -0.309 0.434 0.00 0.00 +0.034 A ATOM 8 C LIG 1 -0.520 -1.239 1.406 0.00 0.00 +0.024 A ATOM 9 C LIG 1 0.839 -1.413 1.684 0.00 0.00 +0.015 A ATOM 10 C LIG 1 2.518 0.933 -0.603 0.00 0.00 +0.144 C ENDROOT BRANCH 1 17 ATOM 11 O LIG 1 9.011 -0.284 -0.729 0.00 0.00 -0.275 OA ATOM 12 C LIG 1 7.824 -0.057 -0.513 0.00 0.00 +0.219 C ATOM 13 N LIG 1 6.841 -0.715 -1.210 0.00 0.00 -0.255 N ATOM 14 H LIG 1 7.156 -1.408 -1.874 0.00 0.00 +0.158 HD ATOM 15 C LIG 1 5.485 -0.481 -1.184 0.00 0.00 +0.240 C ATOM 16 O LIG 1 4.742 -1.053 -1.982 0.00 0.00 -0.273 OA ATOM 17 C LIG 1 5.008 0.608 -0.210 0.00 0.00 +0.163 C ATOM 18 C LIG 1 5.970 0.730 0.971 0.00 0.00 +0.041 C ATOM 19 C LIG 1 7.371 1.012 0.453 0.00 0.00 +0.098 C ENDBRANCH 1 17 BRANCH 7 20 ATOM 20 N LIG 1 -2.348 -0.214 0.234 0.00 0.00 -0.279 N ATOM 21 H LIG 1 -2.938 -0.824 0.791 0.00 0.00 +0.155 HD ATOM 22 C LIG 1 -3.039 0.613 -0.634 0.00 0.00 +0.284 C ATOM 23 O LIG 1 -2.532 1.433 -1.392 0.00 0.00 -0.266 OA BRANCH 22 24 ATOM 24 C LIG 1 -4.476 0.419 -0.561 0.00 0.00 +0.191 A ATOM 25 O LIG 1 -4.986 -0.509 0.312 0.00 0.00 -0.450 OA ATOM 26 C LIG 1 -6.340 -0.486 0.177 0.00 0.00 +0.136 A ATOM 27 C LIG 1 -6.717 0.452 -0.777 0.00 0.00 +0.021 A ATOM 28 C LIG 1 -8.086 0.617 -1.053 0.00 0.00 +0.011 A ATOM 29 C LIG 1 -9.013 -0.170 -0.354 0.00 0.00 +0.001 A ATOM 30 C LIG 1 -8.593 -1.102 0.599 0.00 0.00 +0.004 A ATOM 31 C LIG 1 -7.236 -1.281 0.887 0.00 0.00 +0.047 A ATOM 32 C LIG 1 -5.511 1.030 -1.247 0.00 0.00 +0.063 A ENDBRANCH 22 24 ENDBRANCH 7 20 TORSDOF 3