REMARK VINA RESULT: -4.0 1.751 4.469 REMARK 10 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_9 REMARK 2 A between atoms: O_1 and C_15 REMARK 3 A between atoms: O_2 and C_10 REMARK 4 A between atoms: O_2 and C_16 REMARK 5 A between atoms: C_5 and C_7 REMARK 6 A between atoms: C_5 and C_9 REMARK 7 A between atoms: C_6 and C_8 REMARK 8 A between atoms: C_6 and C_10 REMARK 9 A between atoms: C_11 and C_15 REMARK 10 A between atoms: C_12 and C_16 ROOT ATOM 1 C UNL d 1 42.364 63.752 58.508 0.00 0.00 0.055 C ATOM 2 C UNL d 1 42.764 62.942 59.579 0.00 0.00 0.055 C ATOM 3 C UNL d 1 41.104 63.543 57.916 0.00 0.00 0.018 C ATOM 4 C UNL d 1 41.990 61.821 59.917 0.00 0.00 0.018 C ATOM 5 C UNL d 1 40.311 62.462 58.301 0.00 0.00 0.001 C ATOM 6 C UNL d 1 40.777 61.574 59.266 0.00 0.00 0.001 C ENDROOT BRANCH 1 7 ATOM 7 C UNL d 1 43.258 64.704 57.802 0.00 0.00 0.294 C ATOM 8 O UNL d 1 43.300 65.891 58.079 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 43.764 64.112 56.693 0.00 0.00 -0.317 OA BRANCH 9 10 ATOM 10 C UNL d 1 45.186 63.875 56.630 0.00 0.00 0.179 C BRANCH 10 11 ATOM 11 C UNL d 1 45.873 64.510 55.424 0.00 0.00 0.026 C BRANCH 11 12 ATOM 12 C UNL d 1 47.140 63.789 54.970 0.00 0.00 -0.002 C ATOM 13 C UNL d 1 48.379 64.678 54.900 0.00 0.00 0.005 C ENDBRANCH 11 12 ENDBRANCH 10 11 ENDBRANCH 9 10 ENDBRANCH 7 9 ENDBRANCH 1 7 BRANCH 2 14 ATOM 14 C UNL d 1 43.971 63.209 60.383 0.00 0.00 0.294 C ATOM 15 O UNL d 1 43.973 63.885 61.397 0.00 0.00 -0.259 OA BRANCH 14 16 ATOM 16 O UNL d 1 45.058 62.689 59.756 0.00 0.00 -0.317 OA BRANCH 16 17 ATOM 17 C UNL d 1 45.791 61.673 60.465 0.00 0.00 0.179 C BRANCH 17 18 ATOM 18 C UNL d 1 47.302 61.798 60.267 0.00 0.00 0.026 C BRANCH 18 19 ATOM 19 C UNL d 1 48.051 62.156 61.550 0.00 0.00 -0.002 C ATOM 20 C UNL d 1 47.411 61.512 62.774 0.00 0.00 0.005 C ENDBRANCH 18 19 ENDBRANCH 17 18 ENDBRANCH 16 17 ENDBRANCH 14 16 ENDBRANCH 2 14 TORSDOF 10