REMARK VINA RESULT: -4.4 1.664 2.170 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 -0.558 10.495 -14.110 0.00 0.00 -0.266 OA ATOM 2 N UNL d 1 -2.392 9.288 -14.825 0.00 0.00 -0.290 N ATOM 3 C UNL d 1 -1.716 10.462 -14.520 0.00 0.00 0.265 C ATOM 4 H UNL d 1 -3.407 9.291 -14.900 0.00 0.00 0.183 HD ENDROOT BRANCH 3 5 ATOM 5 C UNL d 1 -2.485 11.720 -14.712 0.00 0.00 0.036 A ATOM 6 C UNL d 1 -2.859 12.505 -13.621 0.00 0.00 0.036 A ATOM 7 C UNL d 1 -3.596 13.647 -13.871 0.00 0.00 0.117 A ATOM 8 N UNL d 1 -3.967 14.042 -15.107 0.00 0.00 -0.273 NA ATOM 9 C UNL d 1 -3.601 13.252 -16.142 0.00 0.00 0.117 A ATOM 10 C UNL d 1 -2.870 12.089 -15.999 0.00 0.00 0.036 A ENDBRANCH 3 5 BRANCH 2 11 ATOM 11 N UNL d 1 -1.741 8.050 -14.642 0.00 0.00 -0.247 NA ATOM 12 H UNL d 1 -0.740 8.195 -14.800 0.00 0.00 0.143 HD ATOM 13 H UNL d 1 -1.803 7.827 -13.636 0.00 0.00 0.143 HD ENDBRANCH 2 11 TORSDOF 2