REMARK VINA RESULT: -4.8 2.581 4.134 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 6.182 4.437 4.945 0.00 0.00 -0.266 OA ATOM 2 N UNL d 1 4.893 2.568 5.363 0.00 0.00 -0.290 N ATOM 3 C UNL d 1 5.090 3.875 4.937 0.00 0.00 0.265 C ATOM 4 H UNL d 1 3.955 2.243 5.587 0.00 0.00 0.183 HD ENDROOT BRANCH 3 5 ATOM 5 C UNL d 1 3.876 4.591 4.461 0.00 0.00 0.036 A ATOM 6 C UNL d 1 3.152 5.422 5.317 0.00 0.00 0.036 A ATOM 7 C UNL d 1 2.020 6.033 4.815 0.00 0.00 0.117 A ATOM 8 N UNL d 1 1.583 5.874 3.548 0.00 0.00 -0.273 NA ATOM 9 C UNL d 1 2.298 5.051 2.748 0.00 0.00 0.117 A ATOM 10 C UNL d 1 3.440 4.388 3.154 0.00 0.00 0.036 A ENDBRANCH 3 5 BRANCH 2 11 ATOM 11 N UNL d 1 5.989 1.831 5.857 0.00 0.00 -0.247 NA ATOM 12 H UNL d 1 5.716 1.426 6.757 0.00 0.00 0.143 HD ATOM 13 H UNL d 1 6.100 1.012 5.240 0.00 0.00 0.143 HD ENDBRANCH 2 11 TORSDOF 2