# data_comp_list loop_ _chem_comp.id _chem_comp.three_letter_code _chem_comp.name _chem_comp.group _chem_comp.number_atoms_all _chem_comp.number_atoms_nh _chem_comp.desc_level TCK TCK 'N-TOSYL-L-LYSINYL METHYL KETONE ' non-polymer 42 20 M # data_comp_TCK # loop_ _chem_comp_atom.comp_id _chem_comp_atom.atom_id _chem_comp_atom.type_symbol _chem_comp_atom.type_energy _chem_comp_atom.partial_charge TCK C1 C . 0.000 TCK C2 C . 0.000 TCK C3 C . 0.000 TCK C4 C . 0.000 TCK C5 C . 0.000 TCK C6 C . 0.000 TCK C7 C . 0.000 TCK S S . 0.000 TCK OS1 O . 0.000 TCK OS2 O . 0.000 TCK N N . 0.000 TCK CA C . 0.000 TCK C C . 0.000 TCK O O . 0.000 TCK C8 C . 0.000 TCK CB C . 0.000 TCK CG C . 0.000 TCK CD C . 0.000 TCK CE C . 0.000 TCK NZ N . 0.000 TCK H11 H . 0.000 TCK H12 H . 0.000 TCK H13 H . 0.000 TCK H3 H . 0.000 TCK H4 H . 0.000 TCK H5 H . 0.000 TCK H6 H . 0.000 TCK HN H . 0.000 TCK HA H . 0.000 TCK H81 H . 0.000 TCK H82 H . 0.000 TCK H83 H . 0.000 TCK HB1 H . 0.000 TCK HB2 H . 0.000 TCK HG1 H . 0.000 TCK HG2 H . 0.000 TCK HD1 H . 0.000 TCK HD2 H . 0.000 TCK HE1 H . 0.000 TCK HE2 H . 0.000 TCK HNZ1 H . 0.000 TCK HNZ2 H . 0.000 loop_ _chem_comp_bond.comp_id _chem_comp_bond.atom_id_1 _chem_comp_bond.atom_id_2 _chem_comp_bond.type TCK C1 C2 single TCK C1 H11 single TCK C1 H12 single TCK C1 H13 single TCK C2 C3 double TCK C2 C4 single TCK C3 C5 single TCK C3 H3 single TCK C4 C6 double TCK C4 H4 single TCK C5 C7 double TCK C5 H5 single TCK C6 C7 single TCK C6 H6 single TCK C7 S single TCK S N single TCK S OS1 double TCK S OS2 double TCK N CA single TCK N HN single TCK CA C single TCK CA CB single TCK CA HA single TCK C O double TCK C C8 single TCK C8 H81 single TCK C8 H82 single TCK C8 H83 single TCK CB CG single TCK CB HB1 single TCK CB HB2 single TCK CG CD single TCK CG HG1 single TCK CG HG2 single TCK CD CE single TCK CD HD1 single TCK CD HD2 single TCK CE NZ single TCK CE HE1 single TCK CE HE2 single TCK NZ HNZ1 single TCK NZ HNZ2 single