#
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
IIL      IIL 'ISO-ISOLEUCINE                      ' non-polymer        22   9 M
#
data_comp_IIL
#
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
 IIL           N      N    .         0.000
 IIL           CA     C    .         0.000
 IIL           C      C    .         0.000
 IIL           O      O    .         0.000
 IIL           CB     C    .         0.000
 IIL           CG2    C    .         0.000
 IIL           CG1    C    .         0.000
 IIL           CD1    C    .         0.000
 IIL           OXT    O    .         0.000
 IIL           H      H    .         0.000
 IIL           HN2    H    .         0.000
 IIL           HA     H    .         0.000
 IIL           HB     H    .         0.000
 IIL           HG21   H    .         0.000
 IIL           HG22   H    .         0.000
 IIL           HG23   H    .         0.000
 IIL           HG11   H    .         0.000
 IIL           HG12   H    .         0.000
 IIL           HD11   H    .         0.000
 IIL           HD12   H    .         0.000
 IIL           HD13   H    .         0.000
 IIL           HXT    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
 IIL        N      CA        single
 IIL        N      H         single
 IIL        N      HN2       single
 IIL        CA     CB        single
 IIL        CA     C         single
 IIL        CA     HA        single
 IIL        C      O         double
 IIL        C      OXT       single
 IIL        CB     CG2       single
 IIL        CB     CG1       single
 IIL        CB     HB        single
 IIL        CG2    HG21      single
 IIL        CG2    HG22      single
 IIL        CG2    HG23      single
 IIL        CG1    CD1       single
 IIL        CG1    HG11      single
 IIL        CG1    HG12      single
 IIL        CD1    HD11      single
 IIL        CD1    HD12      single
 IIL        CD1    HD13      single
 IIL        OXT    HXT       single