REMARK VINA RESULT: -6.0 3.883 6.196 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 13.687 1.489 -8.201 0.00 0.00 -0.241 NA ATOM 2 N UNL d 1 15.371 2.227 -9.691 0.00 0.00 -0.224 NA ATOM 3 C UNL d 1 10.648 3.177 -10.567 0.00 0.00 0.103 C ATOM 4 C UNL d 1 13.045 2.667 -10.194 0.00 0.00 0.042 C ATOM 5 C UNL d 1 11.977 3.152 -11.014 0.00 0.00 0.057 C ATOM 6 C UNL d 1 10.428 2.787 -9.239 0.00 0.00 0.103 C ATOM 7 C UNL d 1 12.757 2.072 -8.968 0.00 0.00 0.075 C ATOM 8 C UNL d 1 11.463 2.176 -8.502 0.00 0.00 0.072 C ATOM 9 C UNL d 1 14.421 2.807 -10.451 0.00 0.00 0.142 C ATOM 10 C UNL d 1 14.956 1.556 -8.623 0.00 0.00 0.236 C ENDROOT BRANCH 3 11 ATOM 11 O UNL d 1 9.609 3.633 -11.364 0.00 0.00 -0.348 OA BRANCH 11 12 ATOM 12 C UNL d 1 9.993 4.061 -12.685 0.00 0.00 0.177 C BRANCH 12 13 ATOM 13 C UNL d 1 9.514 5.469 -13.091 0.00 0.00 0.057 C BRANCH 13 14 ATOM 14 C UNL d 1 10.346 6.744 -12.836 0.00 0.00 0.274 C BRANCH 14 15 ATOM 15 N UNL d 1 11.604 6.667 -12.059 0.00 0.00 0.092 N ATOM 16 C UNL d 1 11.446 7.085 -10.649 0.00 0.00 0.298 C ATOM 17 C UNL d 1 11.053 8.561 -10.491 0.00 0.00 0.198 C ATOM 18 O UNL d 1 12.019 9.432 -11.095 0.00 0.00 -0.388 OA ATOM 19 C UNL d 1 12.259 9.093 -12.468 0.00 0.00 0.198 C ATOM 20 C UNL d 1 12.627 7.604 -12.630 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 9.288 2.919 -8.492 0.00 0.00 -0.353 OA ATOM 22 C UNL d 1 9.223 2.201 -7.272 0.00 0.00 0.210 C ENDBRANCH 6 21 BRANCH 9 23 ATOM 23 N UNL d 1 14.835 3.729 -11.431 0.00 0.00 -0.340 N ATOM 24 H UNL d 1 15.152 3.290 -12.278 0.00 0.00 0.167 HD BRANCH 23 25 ATOM 25 C UNL d 1 15.217 5.064 -11.230 0.00 0.00 0.035 A ATOM 26 C UNL d 1 14.790 5.798 -10.111 0.00 0.00 0.056 A ATOM 27 C UNL d 1 15.164 7.133 -9.944 0.00 0.00 0.074 A ATOM 28 CL UNL d 1 14.635 7.991 -8.548 0.00 0.00 -0.081 Cl ATOM 29 C UNL d 1 15.949 7.751 -10.905 0.00 0.00 0.138 A ATOM 30 F UNL d 1 16.332 9.028 -10.762 0.00 0.00 -0.204 F ATOM 31 C UNL d 1 16.349 7.056 -12.042 0.00 0.00 0.046 A ATOM 32 C UNL d 1 15.976 5.721 -12.209 0.00 0.00 0.032 A ENDBRANCH 23 25 ENDBRANCH 9 23 TORSDOF 8