REMARK VINA RESULT: -4.7 3.641 4.761 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 -1.165 14.478 -14.358 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 -0.058 14.813 -15.336 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 -0.351 15.164 -16.663 0.00 0.00 0.010 A ATOM 4 C UNL d 1 0.675 15.422 -17.578 0.00 0.00 0.037 A ATOM 5 C UNL d 1 2.000 15.321 -17.167 0.00 0.00 0.065 A ATOM 6 C UNL d 1 2.312 14.986 -15.858 0.00 0.00 0.037 A ATOM 7 C UNL d 1 1.288 14.735 -14.941 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 3.033 15.542 -18.028 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 2.696 16.035 -18.796 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 -1.575 13.022 -14.396 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 -0.658 12.013 -14.063 0.00 0.00 0.010 A ATOM 12 C UNL d 1 -1.003 10.664 -14.187 0.00 0.00 0.037 A ATOM 13 C UNL d 1 -2.274 10.320 -14.632 0.00 0.00 0.065 A ATOM 14 C UNL d 1 -3.212 11.302 -14.926 0.00 0.00 0.037 A ATOM 15 C UNL d 1 -2.862 12.650 -14.814 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 -2.642 9.016 -14.793 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 -1.840 8.491 -14.951 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4