REMARK VINA RESULT: -3.8 2.216 2.656 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 31.605 8.390 31.972 0.00 0.00 -0.266 OA ATOM 2 N UNL d 1 33.837 8.551 31.405 0.00 0.00 -0.290 N ATOM 3 C UNL d 1 32.725 7.891 31.913 0.00 0.00 0.265 C ATOM 4 H UNL d 1 34.771 8.210 31.618 0.00 0.00 0.183 HD ENDROOT BRANCH 3 5 ATOM 5 C UNL d 1 32.963 6.508 32.406 0.00 0.00 0.036 A ATOM 6 C UNL d 1 33.461 5.520 31.556 0.00 0.00 0.036 A ATOM 7 C UNL d 1 33.631 4.250 32.074 0.00 0.00 0.117 A ATOM 8 N UNL d 1 33.348 3.920 33.351 0.00 0.00 -0.273 NA ATOM 9 C UNL d 1 32.854 4.896 34.146 0.00 0.00 0.117 A ATOM 10 C UNL d 1 32.641 6.194 33.724 0.00 0.00 0.036 A ENDBRANCH 3 5 BRANCH 2 11 ATOM 11 N UNL d 1 33.700 9.877 30.944 0.00 0.00 -0.247 NA ATOM 12 H UNL d 1 34.457 10.432 31.354 0.00 0.00 0.143 HD ATOM 13 H UNL d 1 33.919 9.867 29.937 0.00 0.00 0.143 HD ENDBRANCH 2 11 TORSDOF 2