REMARK VINA RESULT: -3.4 2.635 5.175 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 34.956 7.107 31.869 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 34.216 5.953 32.512 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 33.706 6.062 33.815 0.00 0.00 0.010 A ATOM 4 C UNL d 1 33.068 4.977 34.427 0.00 0.00 0.037 A ATOM 5 C UNL d 1 32.947 3.777 33.736 0.00 0.00 0.065 A ATOM 6 C UNL d 1 33.434 3.650 32.443 0.00 0.00 0.037 A ATOM 7 C UNL d 1 34.064 4.735 31.829 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 32.353 2.687 34.299 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 31.467 2.942 34.607 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 34.052 8.036 31.087 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 34.273 9.422 31.097 0.00 0.00 0.010 A ATOM 12 C UNL d 1 33.386 10.292 30.454 0.00 0.00 0.037 A ATOM 13 C UNL d 1 32.281 9.774 29.788 0.00 0.00 0.065 A ATOM 14 C UNL d 1 32.066 8.403 29.730 0.00 0.00 0.037 A ATOM 15 C UNL d 1 32.946 7.535 30.383 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 31.377 10.590 29.173 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 31.035 11.216 29.831 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4