REMARK VINA RESULT: -4.0 2.278 6.453 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 42.534 64.132 56.465 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 42.790 65.534 55.949 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 43.629 65.752 54.846 0.00 0.00 0.010 A ATOM 4 C UNL d 1 43.905 67.051 54.403 0.00 0.00 0.037 A ATOM 5 C UNL d 1 43.346 68.134 55.072 0.00 0.00 0.065 A ATOM 6 C UNL d 1 42.505 67.941 56.158 0.00 0.00 0.037 A ATOM 7 C UNL d 1 42.223 66.644 56.596 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 43.603 69.417 54.691 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 43.660 69.971 55.487 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 42.970 63.935 57.900 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 42.027 63.640 58.898 0.00 0.00 0.010 A ATOM 12 C UNL d 1 42.411 63.550 60.240 0.00 0.00 0.037 A ATOM 13 C UNL d 1 43.743 63.742 60.585 0.00 0.00 0.065 A ATOM 14 C UNL d 1 44.700 63.994 59.609 0.00 0.00 0.037 A ATOM 15 C UNL d 1 44.314 64.096 58.271 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 44.155 63.691 61.885 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 44.658 62.870 62.013 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4