REMARK 5 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_4 REMARK 2 A between atoms: O_2 and C_4 REMARK 3 A between atoms: C_4 and C_5 REMARK 4 A between atoms: C_4 and C_6 REMARK 5 A between atoms: C_6 and C_7 ROOT HETATM 1 C UNL 1 -0.825 -1.084 -0.060 1.00 0.00 0.260 C ENDROOT BRANCH 1 2 HETATM 2 O UNL 1 -0.626 -1.537 -1.402 1.00 0.00 -0.350 OA HETATM 3 C UNL 1 -0.106 -2.854 -1.538 1.00 0.00 0.206 C ENDBRANCH 1 2 BRANCH 1 4 HETATM 4 O UNL 1 -1.712 -1.949 0.682 1.00 0.00 -0.350 OA HETATM 5 C UNL 1 -3.047 -2.020 0.194 1.00 0.00 0.206 C ENDBRANCH 1 4 BRANCH 1 6 HETATM 6 C UNL 1 -1.387 0.343 -0.026 1.00 0.00 0.012 A HETATM 7 C UNL 1 -1.676 0.904 1.195 1.00 0.00 0.013 A HETATM 8 C UNL 1 -2.187 2.201 1.226 1.00 0.00 0.001 A HETATM 9 C UNL 1 -2.394 2.898 0.036 1.00 0.00 0.000 A HETATM 10 C UNL 1 -2.089 2.298 -1.186 1.00 0.00 0.001 A HETATM 11 C UNL 1 -1.578 1.000 -1.217 1.00 0.00 0.013 A ENDBRANCH 1 6 BRANCH 1 12 HETATM 12 C UNL 1 0.514 -1.137 0.724 1.00 0.00 0.226 C HETATM 13 O UNL 1 0.646 -1.858 1.714 1.00 0.00 -0.286 OA BRANCH 12 14 HETATM 14 C UNL 1 1.682 -0.297 0.315 1.00 0.00 0.016 A HETATM 15 C UNL 1 1.827 0.022 -1.014 1.00 0.00 0.015 A HETATM 16 C UNL 1 2.917 0.804 -1.396 1.00 0.00 0.001 A HETATM 17 C UNL 1 3.829 1.245 -0.437 1.00 0.00 0.000 A HETATM 18 C UNL 1 3.651 0.902 0.904 1.00 0.00 0.001 A HETATM 19 C UNL 1 2.562 0.120 1.285 1.00 0.00 0.015 A ENDBRANCH 12 14 ENDBRANCH 1 12 TORSDOF 5