REMARK VINA RESULT: -4.5 0.095 1.495 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 33.254 9.224 33.359 0.00 0.00 -0.266 OA ATOM 2 N UNL d 1 31.363 8.309 34.316 0.00 0.00 -0.290 N ATOM 3 C UNL d 1 32.531 8.253 33.566 0.00 0.00 0.265 C ATOM 4 H UNL d 1 30.674 7.564 34.239 0.00 0.00 0.183 HD ENDROOT BRANCH 3 5 ATOM 5 C UNL d 1 32.874 6.921 33.000 0.00 0.00 0.036 A ATOM 6 C UNL d 1 33.292 6.791 31.675 0.00 0.00 0.036 A ATOM 7 C UNL d 1 33.568 5.521 31.209 0.00 0.00 0.117 A ATOM 8 N UNL d 1 33.459 4.407 31.963 0.00 0.00 -0.273 NA ATOM 9 C UNL d 1 33.038 4.564 33.238 0.00 0.00 0.117 A ATOM 10 C UNL d 1 32.731 5.789 33.799 0.00 0.00 0.036 A ENDBRANCH 3 5 BRANCH 2 11 ATOM 11 N UNL d 1 30.953 9.542 34.863 0.00 0.00 -0.247 NA ATOM 12 H UNL d 1 29.933 9.525 34.948 0.00 0.00 0.143 HD ATOM 13 H UNL d 1 31.282 9.559 35.840 0.00 0.00 0.143 HD ENDBRANCH 2 11 TORSDOF 2