REMARK VINA RESULT: -4.7 1.844 2.144 REMARK 2 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: N_2 and N_4 REMARK I between atoms: N_2 and C_8 REMARK 2 A between atoms: C_5 and C_8 ROOT ATOM 1 O UNL d 1 -17.817 19.430 -24.349 0.00 0.00 -0.266 OA ATOM 2 N UNL d 1 -18.529 19.463 -26.545 0.00 0.00 -0.290 N ATOM 3 C UNL d 1 -17.723 19.874 -25.491 0.00 0.00 0.265 C ATOM 4 H UNL d 1 -18.598 20.034 -27.384 0.00 0.00 0.183 HD ENDROOT BRANCH 3 5 ATOM 5 C UNL d 1 -16.714 20.917 -25.815 0.00 0.00 0.036 A ATOM 6 C UNL d 1 -15.819 20.743 -26.872 0.00 0.00 0.036 A ATOM 7 C UNL d 1 -14.890 21.740 -27.099 0.00 0.00 0.117 A ATOM 8 N UNL d 1 -14.807 22.867 -26.361 0.00 0.00 -0.273 NA ATOM 9 C UNL d 1 -15.679 22.999 -25.336 0.00 0.00 0.117 A ATOM 10 C UNL d 1 -16.641 22.059 -25.022 0.00 0.00 0.036 A ENDBRANCH 3 5 BRANCH 2 11 ATOM 11 N UNL d 1 -19.531 18.499 -26.311 0.00 0.00 -0.247 NA ATOM 12 H UNL d 1 -19.734 18.034 -27.201 0.00 0.00 0.143 HD ATOM 13 H UNL d 1 -19.103 17.757 -25.737 0.00 0.00 0.143 HD ENDBRANCH 2 11 TORSDOF 2