REMARK VINA RESULT: -4.4 1.306 1.891 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 -2.276 13.098 -13.918 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 -3.124 13.706 -15.016 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 -2.555 14.078 -16.243 0.00 0.00 0.010 A ATOM 4 C UNL d 1 -3.329 14.687 -17.237 0.00 0.00 0.037 A ATOM 5 C UNL d 1 -4.677 14.932 -16.998 0.00 0.00 0.065 A ATOM 6 C UNL d 1 -5.264 14.563 -15.796 0.00 0.00 0.037 A ATOM 7 C UNL d 1 -4.492 13.948 -14.807 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 -5.467 15.542 -17.927 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 -6.371 15.599 -17.575 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 -1.955 11.638 -14.150 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 -2.915 10.775 -14.704 0.00 0.00 0.010 A ATOM 12 C UNL d 1 -2.657 9.407 -14.832 0.00 0.00 0.037 A ATOM 13 C UNL d 1 -1.431 8.899 -14.418 0.00 0.00 0.065 A ATOM 14 C UNL d 1 -0.451 9.741 -13.906 0.00 0.00 0.037 A ATOM 15 C UNL d 1 -0.714 11.106 -13.766 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 -1.151 7.567 -14.500 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 -1.982 7.074 -14.401 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4