REMARK VINA RESULT: -4.6 1.586 6.194 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 20.948 -31.126 -1.126 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 19.622 -30.602 -1.638 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 19.222 -30.827 -2.964 0.00 0.00 0.010 A ATOM 4 C UNL d 1 18.022 -30.297 -3.449 0.00 0.00 0.037 A ATOM 5 C UNL d 1 17.222 -29.532 -2.607 0.00 0.00 0.065 A ATOM 6 C UNL d 1 17.592 -29.306 -1.290 0.00 0.00 0.037 A ATOM 7 C UNL d 1 18.788 -29.841 -0.802 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 16.055 -28.978 -3.041 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 15.496 -28.789 -2.269 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 20.845 -31.788 0.231 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 21.028 -31.041 1.406 0.00 0.00 0.010 A ATOM 12 C UNL d 1 21.028 -31.664 2.657 0.00 0.00 0.037 A ATOM 13 C UNL d 1 20.831 -33.038 2.738 0.00 0.00 0.065 A ATOM 14 C UNL d 1 20.606 -33.791 1.592 0.00 0.00 0.037 A ATOM 15 C UNL d 1 20.619 -33.169 0.341 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 20.852 -33.689 3.936 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 19.969 -34.060 4.096 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4