REMARK VINA RESULT: -5.8 0.215 1.263 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 -4.237 12.686 -13.885 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 -4.509 13.483 -15.145 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 -5.133 14.738 -15.083 0.00 0.00 0.010 A ATOM 4 C UNL d 1 -5.430 15.448 -16.251 0.00 0.00 0.037 A ATOM 5 C UNL d 1 -5.109 14.897 -17.486 0.00 0.00 0.065 A ATOM 6 C UNL d 1 -4.482 13.662 -17.571 0.00 0.00 0.037 A ATOM 7 C UNL d 1 -4.178 12.956 -16.405 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 -5.398 15.542 -18.652 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 -5.804 16.399 -18.439 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 -2.878 12.020 -13.881 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 -1.772 12.658 -13.296 0.00 0.00 0.010 A ATOM 12 C UNL d 1 -0.497 12.090 -13.372 0.00 0.00 0.037 A ATOM 13 C UNL d 1 -0.327 10.874 -14.023 0.00 0.00 0.065 A ATOM 14 C UNL d 1 -1.414 10.204 -14.572 0.00 0.00 0.037 A ATOM 15 C UNL d 1 -2.686 10.779 -14.507 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 0.905 10.299 -14.144 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 0.783 9.369 -14.395 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4