REMARK VINA RESULT: -5.7 0.174 5.946 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 31.135 5.406 -41.581 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 30.204 6.407 -42.234 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 30.650 7.695 -42.566 0.00 0.00 0.010 A ATOM 4 C UNL d 1 29.775 8.635 -43.122 0.00 0.00 0.037 A ATOM 5 C UNL d 1 28.446 8.287 -43.339 0.00 0.00 0.065 A ATOM 6 C UNL d 1 27.986 7.015 -43.029 0.00 0.00 0.037 A ATOM 7 C UNL d 1 28.862 6.074 -42.481 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 27.552 9.175 -43.858 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 27.492 9.029 -44.817 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 31.174 4.072 -42.294 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 32.111 3.093 -41.926 0.00 0.00 0.010 A ATOM 12 C UNL d 1 32.213 1.897 -42.642 0.00 0.00 0.037 A ATOM 13 C UNL d 1 31.369 1.671 -43.722 0.00 0.00 0.065 A ATOM 14 C UNL d 1 30.405 2.607 -44.078 0.00 0.00 0.037 A ATOM 15 C UNL d 1 30.312 3.808 -43.370 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 31.455 0.529 -44.465 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 32.178 0.636 -45.104 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4