REMARK VINA RESULT: -3.8 0.308 1.789 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 42.092 63.483 57.654 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 41.570 63.237 59.054 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 42.384 63.458 60.176 0.00 0.00 0.010 A ATOM 4 C UNL d 1 41.917 63.181 61.465 0.00 0.00 0.037 A ATOM 5 C UNL d 1 40.634 62.672 61.633 0.00 0.00 0.065 A ATOM 6 C UNL d 1 39.808 62.456 60.539 0.00 0.00 0.037 A ATOM 7 C UNL d 1 40.271 62.740 59.252 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 40.143 62.367 62.867 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 39.311 61.877 62.757 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 41.699 64.834 57.098 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 40.493 64.995 56.397 0.00 0.00 0.010 A ATOM 12 C UNL d 1 40.170 66.217 55.801 0.00 0.00 0.037 A ATOM 13 C UNL d 1 41.048 67.289 55.916 0.00 0.00 0.065 A ATOM 14 C UNL d 1 42.226 67.165 56.641 0.00 0.00 0.037 A ATOM 15 C UNL d 1 42.555 65.940 57.226 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 40.783 68.490 55.326 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 39.864 68.480 55.013 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4