REMARK VINA RESULT: -5.1 3.453 7.222 REMARK 8 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_4 and C_16 REMARK 2 A between atoms: O_4 and C_17 REMARK 3 A between atoms: O_5 and C_20 REMARK 4 A between atoms: N_6 and C_10 REMARK 5 A between atoms: N_7 and C_23 REMARK 6 A between atoms: N_7 and C_24 REMARK 7 A between atoms: C_10 and C_13 REMARK 8 A between atoms: C_13 and C_16 ROOT ATOM 1 N UNL d 1 33.627 5.790 34.147 0.00 0.00 -0.241 NA ATOM 2 N UNL d 1 32.376 5.951 32.145 0.00 0.00 -0.224 NA ATOM 3 C UNL d 1 36.910 7.778 32.430 0.00 0.00 0.103 C ATOM 4 C UNL d 1 34.590 6.920 32.260 0.00 0.00 0.042 C ATOM 5 C UNL d 1 35.695 7.668 31.740 0.00 0.00 0.057 C ATOM 6 C UNL d 1 37.023 7.042 33.616 0.00 0.00 0.103 C ATOM 7 C UNL d 1 34.660 6.396 33.549 0.00 0.00 0.075 C ATOM 8 C UNL d 1 35.883 6.437 34.184 0.00 0.00 0.072 C ATOM 9 C UNL d 1 33.425 6.560 31.559 0.00 0.00 0.142 C ATOM 10 C UNL d 1 32.509 5.633 33.428 0.00 0.00 0.236 C ENDROOT BRANCH 3 11 ATOM 11 O UNL d 1 37.976 8.514 31.935 0.00 0.00 -0.348 OA BRANCH 11 12 ATOM 12 C UNL d 1 39.009 7.741 31.294 0.00 0.00 0.177 C BRANCH 12 13 ATOM 13 C UNL d 1 38.863 7.576 29.768 0.00 0.00 0.057 C BRANCH 13 14 ATOM 14 C UNL d 1 38.444 6.246 29.105 0.00 0.00 0.274 C BRANCH 14 15 ATOM 15 N UNL d 1 38.157 6.197 27.654 0.00 0.00 0.092 N ATOM 16 C UNL d 1 37.341 7.337 27.182 0.00 0.00 0.298 C ATOM 17 C UNL d 1 35.932 7.372 27.793 0.00 0.00 0.198 C ATOM 18 O UNL d 1 35.204 6.171 27.508 0.00 0.00 -0.388 OA ATOM 19 C UNL d 1 35.926 5.000 27.914 0.00 0.00 0.198 C ATOM 20 C UNL d 1 37.351 4.977 27.323 0.00 0.00 0.298 C ENDBRANCH 14 15 ENDBRANCH 13 14 ENDBRANCH 12 13 ENDBRANCH 11 12 ENDBRANCH 3 11 BRANCH 6 21 ATOM 21 O UNL d 1 38.146 6.798 34.361 0.00 0.00 -0.353 OA ATOM 22 C UNL d 1 38.132 7.215 35.716 0.00 0.00 0.210 C ENDBRANCH 6 21 BRANCH 9 23 ATOM 23 N UNL d 1 33.418 6.677 30.155 0.00 0.00 -0.340 N ATOM 24 H UNL d 1 34.299 6.437 29.734 0.00 0.00 0.167 HD BRANCH 23 25 ATOM 25 C UNL d 1 32.526 7.426 29.374 0.00 0.00 0.035 A ATOM 26 C UNL d 1 32.687 8.809 29.183 0.00 0.00 0.056 A ATOM 27 C UNL d 1 31.774 9.539 28.419 0.00 0.00 0.074 A ATOM 28 CL UNL d 1 32.017 11.228 28.196 0.00 0.00 -0.081 Cl ATOM 29 C UNL d 1 30.680 8.896 27.859 0.00 0.00 0.138 A ATOM 30 F UNL d 1 29.796 9.572 27.111 0.00 0.00 -0.204 F ATOM 31 C UNL d 1 30.479 7.535 28.068 0.00 0.00 0.046 A ATOM 32 C UNL d 1 31.393 6.805 28.830 0.00 0.00 0.032 A ENDBRANCH 23 25 ENDBRANCH 9 23 TORSDOF 8