REMARK VINA RESULT: -4.9 2.012 5.495 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 -1.060 -0.705 7.917 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 -2.433 -0.806 8.549 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 -3.314 0.286 8.536 0.00 0.00 0.010 A ATOM 4 C UNL d 1 -4.561 0.207 9.165 0.00 0.00 0.037 A ATOM 5 C UNL d 1 -4.925 -0.966 9.816 0.00 0.00 0.065 A ATOM 6 C UNL d 1 -4.075 -2.062 9.832 0.00 0.00 0.037 A ATOM 7 C UNL d 1 -2.832 -1.987 9.197 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 -6.120 -1.083 10.461 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 -6.823 -0.761 9.871 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 0.045 -0.467 8.924 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 0.828 -1.535 9.390 0.00 0.00 0.010 A ATOM 12 C UNL d 1 1.786 -1.335 10.389 0.00 0.00 0.037 A ATOM 13 C UNL d 1 1.972 -0.063 10.915 0.00 0.00 0.065 A ATOM 14 C UNL d 1 1.238 1.017 10.439 0.00 0.00 0.037 A ATOM 15 C UNL d 1 0.272 0.815 9.450 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 2.877 0.169 11.910 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 3.744 0.326 11.503 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4