REMARK VINA RESULT: -3.0 1.810 4.450 REMARK 7 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: P_1 and O_2 REMARK 2 A between atoms: P_1 and O_3 REMARK 3 A between atoms: P_1 and C_8 REMARK 4 A between atoms: O_5 and C_10 REMARK 5 A between atoms: N_7 and C_8 REMARK 6 A between atoms: N_7 and C_9 REMARK 7 A between atoms: C_9 and C_10 ROOT ATOM 1 N UNL d 1 38.718 -37.669 -44.996 0.00 0.00 0.104 N ATOM 2 H UNL d 1 39.589 -37.319 -45.422 0.00 0.00 0.317 HD ENDROOT BRANCH 1 3 ATOM 3 C UNL d 1 37.701 -37.638 -46.085 0.00 0.00 0.394 C BRANCH 3 4 ATOM 4 P UNL d 1 36.256 -36.712 -45.549 0.00 0.00 0.264 P ATOM 5 O UNL d 1 36.442 -35.243 -45.350 0.00 0.00 -0.652 OA BRANCH 4 6 ATOM 6 O UNL d 1 35.144 -37.098 -46.634 0.00 0.00 -0.328 OA ATOM 7 H UNL d 1 34.911 -36.347 -47.212 0.00 0.00 0.220 HD ENDBRANCH 4 6 BRANCH 4 8 ATOM 8 O UNL d 1 35.721 -37.484 -44.247 0.00 0.00 -0.328 OA ATOM 9 H UNL d 1 36.420 -37.983 -43.785 0.00 0.00 0.220 HD ENDBRANCH 4 8 ENDBRANCH 3 4 ENDBRANCH 1 3 BRANCH 1 10 ATOM 10 C UNL d 1 38.917 -39.118 -44.667 0.00 0.00 0.379 C BRANCH 10 11 ATOM 11 C UNL d 1 38.568 -39.431 -43.219 0.00 0.00 0.168 C ATOM 12 O UNL d 1 37.433 -39.444 -42.771 0.00 0.00 -0.649 OA BRANCH 11 13 ATOM 13 O UNL d 1 39.665 -39.652 -42.456 0.00 0.00 -0.775 OA ATOM 14 H UNL d 1 39.779 -38.889 -41.849 0.00 0.00 0.167 HD ENDBRANCH 11 13 ENDBRANCH 10 11 ENDBRANCH 1 10 TORSDOF 7