REMARK VINA RESULT: -3.7 1.183 5.848 REMARK 4 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_14 REMARK 2 A between atoms: O_2 and C_15 REMARK 3 A between atoms: C_3 and C_4 REMARK 4 A between atoms: C_3 and C_5 ROOT ATOM 1 C UNL d 1 34.256 6.192 30.711 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 35.036 6.523 31.967 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 34.443 6.410 33.233 0.00 0.00 0.010 A ATOM 4 C UNL d 1 35.148 6.766 34.388 0.00 0.00 0.037 A ATOM 5 C UNL d 1 36.448 7.246 34.275 0.00 0.00 0.065 A ATOM 6 C UNL d 1 37.058 7.356 33.034 0.00 0.00 0.037 A ATOM 7 C UNL d 1 36.357 6.993 31.881 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 37.166 7.625 35.370 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 38.017 7.987 35.071 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 33.388 7.333 30.228 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 33.866 8.653 30.250 0.00 0.00 0.010 A ATOM 12 C UNL d 1 33.036 9.720 29.894 0.00 0.00 0.037 A ATOM 13 C UNL d 1 31.726 9.468 29.501 0.00 0.00 0.065 A ATOM 14 C UNL d 1 31.245 8.166 29.431 0.00 0.00 0.037 A ATOM 15 C UNL d 1 32.071 7.101 29.799 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 30.875 10.482 29.173 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 30.574 10.343 28.260 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4