REMARK VINA RESULT: -4.6 0.227 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 36.890 -38.713 -43.979 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 36.523 -37.369 -44.574 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 37.474 -36.608 -45.270 0.00 0.00 0.010 A ATOM 4 C UNL d 1 37.147 -35.344 -45.774 0.00 0.00 0.037 A ATOM 5 C UNL d 1 35.869 -34.837 -45.573 0.00 0.00 0.065 A ATOM 6 C UNL d 1 34.910 -35.577 -44.896 0.00 0.00 0.037 A ATOM 7 C UNL d 1 35.233 -36.843 -44.400 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 35.511 -33.602 -46.026 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 34.568 -33.463 -45.835 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 37.944 -39.452 -44.774 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 37.589 -40.202 -45.907 0.00 0.00 0.010 A ATOM 12 C UNL d 1 38.544 -40.962 -46.589 0.00 0.00 0.037 A ATOM 13 C UNL d 1 39.862 -40.962 -46.147 0.00 0.00 0.065 A ATOM 14 C UNL d 1 40.244 -40.194 -45.055 0.00 0.00 0.037 A ATOM 15 C UNL d 1 39.287 -39.445 -44.365 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 40.819 -41.712 -46.768 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 41.578 -41.793 -46.168 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4