REMARK VINA RESULT: -5.8 0.071 6.006 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 30.988 5.492 -41.595 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 30.108 6.526 -42.266 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 30.622 7.779 -42.632 0.00 0.00 0.010 A ATOM 4 C UNL d 1 29.796 8.752 -43.205 0.00 0.00 0.037 A ATOM 5 C UNL d 1 28.448 8.473 -43.404 0.00 0.00 0.065 A ATOM 6 C UNL d 1 27.921 7.237 -43.059 0.00 0.00 0.037 A ATOM 7 C UNL d 1 28.747 6.263 -42.495 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 27.600 9.397 -43.938 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 26.686 9.099 -43.792 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 31.109 4.207 -42.385 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 30.268 3.961 -43.483 0.00 0.00 0.010 A ATOM 12 C UNL d 1 30.312 2.737 -44.157 0.00 0.00 0.037 A ATOM 13 C UNL d 1 31.207 1.758 -43.742 0.00 0.00 0.065 A ATOM 14 C UNL d 1 32.078 1.995 -42.685 0.00 0.00 0.037 A ATOM 15 C UNL d 1 32.025 3.214 -42.004 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 31.262 0.540 -44.355 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 30.698 0.572 -45.145 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4