# 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 HMF HMF '2-AMINO-4-PHENYL-BUTYRIC ACID ' non-polymer 26 13 M # data_comp_HMF # 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 HMF N N . 0.000 HMF CA C . 0.000 HMF C C . 0.000 HMF O O . 0.000 HMF OXT O . 0.000 HMF CB C . 0.000 HMF CG C . 0.000 HMF C1 C . 0.000 HMF C2 C . 0.000 HMF C6 C . 0.000 HMF C3 C . 0.000 HMF C5 C . 0.000 HMF C4 C . 0.000 HMF HN1 H . 0.000 HMF HN2 H . 0.000 HMF HA H . 0.000 HMF HXT H . 0.000 HMF HB1 H . 0.000 HMF HB2 H . 0.000 HMF HG1 H . 0.000 HMF HG2 H . 0.000 HMF H2 H . 0.000 HMF H6 H . 0.000 HMF H3 H . 0.000 HMF H5 H . 0.000 HMF H4 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 HMF N CA single HMF N HN1 single HMF N HN2 single HMF CA CB single HMF CA C single HMF CA HA single HMF C O double HMF C OXT single HMF OXT HXT single HMF CB CG single HMF CB HB1 single HMF CB HB2 single HMF CG C1 single HMF CG HG1 single HMF CG HG2 single HMF C1 C2 double HMF C1 C6 single HMF C2 C3 single HMF C2 H2 single HMF C6 C5 double HMF C6 H6 single HMF C3 C4 double HMF C3 H3 single HMF C5 C4 single HMF C5 H5 single HMF C4 H4 single