REMARK VINA RESULT: -4.5 1.743 6.023 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 38.661 -37.048 -45.306 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 37.409 -36.225 -45.530 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 37.428 -35.099 -46.366 0.00 0.00 0.010 A ATOM 4 C UNL d 1 36.283 -34.310 -46.530 0.00 0.00 0.037 A ATOM 5 C UNL d 1 35.118 -34.646 -45.850 0.00 0.00 0.065 A ATOM 6 C UNL d 1 35.074 -35.762 -45.027 0.00 0.00 0.037 A ATOM 7 C UNL d 1 36.214 -36.554 -44.868 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 33.986 -33.897 -45.962 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 34.154 -33.174 -46.590 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 38.375 -38.500 -44.994 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 37.811 -39.342 -45.967 0.00 0.00 0.010 A ATOM 12 C UNL d 1 37.457 -40.658 -45.655 0.00 0.00 0.037 A ATOM 13 C UNL d 1 37.679 -41.141 -44.371 0.00 0.00 0.065 A ATOM 14 C UNL d 1 38.275 -40.340 -43.405 0.00 0.00 0.037 A ATOM 15 C UNL d 1 38.616 -39.021 -43.713 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 37.323 -42.410 -44.018 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 38.099 -42.848 -43.633 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4