REMARK VINA RESULT: -4.2 2.711 3.841 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 31.922 6.126 33.693 0.00 0.00 -0.266 OA ATOM 2 N UNL d 1 33.948 5.019 33.715 0.00 0.00 -0.290 N ATOM 3 C UNL d 1 33.120 6.096 33.423 0.00 0.00 0.265 C ATOM 4 H UNL d 1 34.846 4.927 33.245 0.00 0.00 0.183 HD ENDROOT BRANCH 3 5 ATOM 5 C UNL d 1 33.769 7.245 32.738 0.00 0.00 0.036 A ATOM 6 C UNL d 1 35.126 7.515 32.921 0.00 0.00 0.036 A ATOM 7 C UNL d 1 35.656 8.615 32.275 0.00 0.00 0.117 A ATOM 8 N UNL d 1 34.938 9.434 31.479 0.00 0.00 -0.273 NA ATOM 9 C UNL d 1 33.623 9.154 31.334 0.00 0.00 0.117 A ATOM 10 C UNL d 1 32.995 8.083 31.939 0.00 0.00 0.036 A ENDBRANCH 3 5 BRANCH 2 11 ATOM 11 N UNL d 1 33.402 3.878 34.338 0.00 0.00 -0.247 NA ATOM 12 H UNL d 1 33.196 4.119 35.311 0.00 0.00 0.143 HD ATOM 13 H UNL d 1 32.471 3.727 33.919 0.00 0.00 0.143 HD ENDBRANCH 2 11 TORSDOF 2