REMARK VINA RESULT: -4.3 3.667 5.979 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 -5.452 -15.559 3.530 0.00 0.00 -0.241 NA ATOM 2 N UNL d 1 -3.354 -16.113 2.586 0.00 0.00 -0.224 NA ATOM 3 C UNL d 1 -3.760 -15.019 7.342 0.00 0.00 0.103 C ATOM 4 C UNL d 1 -3.499 -15.521 4.928 0.00 0.00 0.042 C ATOM 5 C UNL d 1 -2.949 -15.244 6.220 0.00 0.00 0.057 C ATOM 6 C UNL d 1 -5.140 -15.169 7.154 0.00 0.00 0.103 C ATOM 7 C UNL d 1 -4.875 -15.432 4.732 0.00 0.00 0.075 C ATOM 8 C UNL d 1 -5.667 -15.293 5.852 0.00 0.00 0.072 C ATOM 9 C UNL d 1 -2.791 -15.981 3.803 0.00 0.00 0.142 C ATOM 10 C UNL d 1 -4.654 -15.853 2.497 0.00 0.00 0.236 C ENDROOT BRANCH 3 11 ATOM 11 O UNL d 1 -3.230 -14.736 8.591 0.00 0.00 -0.348 OA BRANCH 11 12 ATOM 12 C UNL d 1 -2.983 -13.341 8.850 0.00 0.00 0.177 C BRANCH 12 13 ATOM 13 C UNL d 1 -1.502 -12.954 9.036 0.00 0.00 0.057 C BRANCH 13 14 ATOM 14 C UNL d 1 -0.592 -12.531 7.862 0.00 0.00 0.274 C BRANCH 14 15 ATOM 15 N UNL d 1 -0.846 -11.260 7.146 0.00 0.00 0.092 N ATOM 16 C UNL d 1 -1.753 -11.414 5.989 0.00 0.00 0.298 C ATOM 17 C UNL d 1 -1.179 -12.307 4.878 0.00 0.00 0.198 C ATOM 18 O UNL d 1 0.069 -11.800 4.386 0.00 0.00 -0.388 OA ATOM 19 C UNL d 1 1.017 -11.596 5.443 0.00 0.00 0.198 C ATOM 20 C UNL d 1 0.431 -10.722 6.572 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 -6.126 -15.221 8.103 0.00 0.00 -0.353 OA ATOM 22 C UNL d 1 -6.829 -14.021 8.378 0.00 0.00 0.210 C ENDBRANCH 6 21 BRANCH 9 23 ATOM 23 N UNL d 1 -1.490 -16.490 3.984 0.00 0.00 -0.340 N ATOM 24 H UNL d 1 -0.771 -15.810 3.807 0.00 0.00 0.167 HD BRANCH 23 25 ATOM 25 C UNL d 1 -1.101 -17.837 3.980 0.00 0.00 0.035 A ATOM 26 C UNL d 1 -0.961 -18.574 5.169 0.00 0.00 0.056 A ATOM 27 C UNL d 1 -0.550 -19.908 5.142 0.00 0.00 0.074 A ATOM 28 CL UNL d 1 -0.409 -20.780 6.620 0.00 0.00 -0.081 Cl ATOM 29 C UNL d 1 -0.253 -20.510 3.928 0.00 0.00 0.138 A ATOM 30 F UNL d 1 0.132 -21.793 3.874 0.00 0.00 -0.204 F ATOM 31 C UNL d 1 -0.345 -19.788 2.742 0.00 0.00 0.046 A ATOM 32 C UNL d 1 -0.758 -18.454 2.769 0.00 0.00 0.032 A ENDBRANCH 23 25 ENDBRANCH 9 23 TORSDOF 8