HEADER TITLE MDANALYSIS FRAME 0: Created by PDBWriter ATOM 1 CG LIG B 0 17.714 15.291 24.807 1.00 0.00 B C ATOM 2 CB LIG B 0 19.252 15.345 24.560 1.00 0.00 B C ATOM 3 CA LIG B 0 19.686 15.008 23.101 1.00 0.00 B C ATOM 4 N LIG B 0 18.518 14.563 22.191 1.00 0.00 B N ATOM 5 C LIG B 0 20.790 13.929 23.035 1.00 0.00 B C ATOM 6 O LIG B 0 21.080 13.613 21.889 1.00 0.00 B O ATOM 7 OXT LIG B 0 21.447 13.730 24.029 1.00 0.00 B O ATOM 8 CD LIG B 0 17.336 15.447 26.301 1.00 0.00 B C ATOM 9 NE LIG B 0 18.532 15.667 27.145 1.00 0.00 B N ATOM 10 CZ LIG B 0 18.585 16.287 28.330 1.00 0.00 B C ATOM 11 NH1 LIG B 0 19.754 16.495 28.923 1.00 0.00 B N ATOM 12 NH2 LIG B 0 17.485 16.690 28.955 1.00 0.00 B N END