REMARK VINA RESULT: -5.5 2.865 4.974 REMARK 3 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: N_6 and C_13 REMARK 2 A between atoms: N_8 and N_10 REMARK 3 A between atoms: C_13 and C_15 ROOT ATOM 1 O UNL d 1 34.042 77.557 101.348 0.00 0.00 -0.352 OA ATOM 2 N UNL d 1 32.999 76.622 103.259 0.00 0.00 -0.188 N ATOM 3 N UNL d 1 31.754 77.681 101.707 0.00 0.00 -0.198 N ATOM 4 N UNL d 1 30.728 77.347 103.745 0.00 0.00 0.083 NA ATOM 5 C UNL d 1 34.203 77.221 102.715 0.00 0.00 0.314 C ATOM 6 C UNL d 1 31.777 77.204 102.997 0.00 0.00 0.725 C ATOM 7 C UNL d 1 32.903 78.383 101.206 0.00 0.00 0.313 C ATOM 8 C UNL d 1 30.630 77.495 100.813 0.00 0.00 0.171 C ENDROOT BRANCH 2 9 ATOM 9 C UNL d 1 33.083 75.192 103.594 0.00 0.00 0.191 C BRANCH 9 10 ATOM 10 C UNL d 1 33.638 74.847 104.949 0.00 0.00 0.021 A ATOM 11 S UNL d 1 33.539 73.234 105.554 0.00 0.00 -0.060 SA ATOM 12 C UNL d 1 34.345 73.734 106.962 0.00 0.00 0.167 A ATOM 13 CL UNL d 1 34.713 72.596 108.193 0.00 0.00 -0.054 Cl ATOM 14 N UNL d 1 34.665 74.999 107.056 0.00 0.00 -0.240 NA ATOM 15 C UNL d 1 34.255 75.640 105.900 0.00 0.00 0.135 A ENDBRANCH 9 10 ENDBRANCH 2 9 BRANCH 4 16 ATOM 16 N UNL d 1 30.827 77.083 105.057 0.00 0.00 0.001 N ATOM 17 O UNL d 1 30.283 76.082 105.555 0.00 0.00 -0.515 OA ATOM 18 O UNL d 1 31.542 77.841 105.734 0.00 0.00 -0.515 OA ENDBRANCH 4 16 TORSDOF 3