REMARK VINA RESULT: -5.5 1.585 6.038 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 29.616 3.915 -43.369 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 29.424 5.398 -43.126 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 28.175 6.004 -43.327 0.00 0.00 0.010 A ATOM 4 C UNL d 1 28.012 7.382 -43.152 0.00 0.00 0.037 A ATOM 5 C UNL d 1 29.105 8.159 -42.784 0.00 0.00 0.065 A ATOM 6 C UNL d 1 30.347 7.579 -42.569 0.00 0.00 0.037 A ATOM 7 C UNL d 1 30.508 6.201 -42.736 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 29.000 9.508 -42.622 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 29.482 9.945 -43.345 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 30.874 3.363 -42.734 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 31.499 4.045 -41.677 0.00 0.00 0.010 A ATOM 12 C UNL d 1 32.711 3.590 -41.150 0.00 0.00 0.037 A ATOM 13 C UNL d 1 33.296 2.441 -41.671 0.00 0.00 0.065 A ATOM 14 C UNL d 1 32.674 1.727 -42.687 0.00 0.00 0.037 A ATOM 15 C UNL d 1 31.469 2.189 -43.222 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 34.492 1.979 -41.204 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 34.346 1.106 -40.805 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4