REMARK VINA RESULT: -4.8 2.303 3.584 REMARK 2 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_2 and C_12 REMARK 2 A between atoms: O_2 and C_15 REMARK I between atoms: N_4 and C_15 ROOT ATOM 1 O UNL d 1 -2.697 13.120 -13.645 0.00 0.00 -0.337 OA ATOM 2 C UNL d 1 -3.646 14.195 -13.901 0.00 0.00 0.065 C ATOM 3 C UNL d 1 -3.050 15.163 -14.948 0.00 0.00 0.079 C ATOM 4 C UNL d 1 -1.661 14.658 -15.016 0.00 0.00 -0.019 A ATOM 5 C UNL d 1 -1.536 13.498 -14.267 0.00 0.00 0.110 A ATOM 6 C UNL d 1 -3.909 14.905 -12.569 0.00 0.00 0.046 C ATOM 7 C UNL d 1 -4.937 13.553 -14.416 0.00 0.00 0.046 C ATOM 8 C UNL d 1 -0.588 15.167 -15.729 0.00 0.00 0.010 A ATOM 9 C UNL d 1 -0.336 12.812 -14.197 0.00 0.00 0.114 A ATOM 10 C UNL d 1 0.625 14.477 -15.681 0.00 0.00 0.003 A ATOM 11 C UNL d 1 0.751 13.298 -14.928 0.00 0.00 0.040 A ENDROOT BRANCH 9 12 ATOM 12 O UNL d 1 -0.304 11.618 -13.450 0.00 0.00 -0.259 OA BRANCH 12 13 ATOM 13 C UNL d 1 -0.569 10.386 -14.035 0.00 0.00 0.365 C ATOM 14 O UNL d 1 -1.557 10.095 -14.700 0.00 0.00 -0.238 OA ATOM 15 N UNL d 1 0.402 9.448 -13.808 0.00 0.00 -0.341 N ATOM 16 C UNL d 1 1.644 9.631 -13.102 0.00 0.00 0.151 C ATOM 17 H UNL d 1 0.199 8.549 -14.223 0.00 0.00 0.164 HD ENDBRANCH 12 13 ENDBRANCH 9 12 TORSDOF 2