REMARK VINA RESULT: -3.7 1.755 2.188 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 20.872 4.252 -12.939 0.00 0.00 0.104 N ATOM 2 H UNL d 1 21.858 4.475 -13.144 0.00 0.00 0.317 HD ENDROOT BRANCH 1 3 ATOM 3 C UNL d 1 20.444 5.246 -11.913 0.00 0.00 0.394 C BRANCH 3 4 ATOM 4 P UNL d 1 21.872 6.155 -11.309 0.00 0.00 0.264 P ATOM 5 O UNL d 1 21.594 7.294 -10.383 0.00 0.00 -0.652 OA BRANCH 4 6 ATOM 6 O UNL d 1 22.807 5.012 -10.692 0.00 0.00 -0.328 OA ATOM 7 H UNL d 1 23.169 5.257 -9.819 0.00 0.00 0.220 HD ENDBRANCH 4 6 BRANCH 4 8 ATOM 8 O UNL d 1 22.693 6.571 -12.625 0.00 0.00 -0.328 OA ATOM 9 H UNL d 1 23.466 5.998 -12.789 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 20.066 4.560 -14.164 0.00 0.00 0.379 C BRANCH 10 11 ATOM 11 C UNL d 1 20.262 3.520 -15.258 0.00 0.00 0.168 C ATOM 12 O UNL d 1 19.370 3.103 -15.980 0.00 0.00 -0.649 OA BRANCH 11 13 ATOM 13 O UNL d 1 21.534 3.063 -15.319 0.00 0.00 -0.775 OA ATOM 14 H UNL d 1 22.141 3.807 -15.114 0.00 0.00 0.167 HD ENDBRANCH 11 13 ENDBRANCH 10 11 ENDBRANCH 1 10 TORSDOF 7