#
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
ASK      ASK 'DEHYDROXYMETHYLASPARTIC ACID        ' non-polymer        18   9 M
#
data_comp_ASK
#
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
 ASK           N      N    .         0.000
 ASK           CA     C    .         0.000
 ASK           CB     C    .         0.000
 ASK           CG     C    .         0.000
 ASK           OD1    O    .         0.000
 ASK           OD2    O    .         0.000
 ASK           C      C    .         0.000
 ASK           O      O    .         0.000
 ASK           CM     C    .         0.000
 ASK           HN1    H    .         0.000
 ASK           HN2    H    .         0.000
 ASK           HA     H    .         0.000
 ASK           HB1    H    .         0.000
 ASK           HB2    H    .         0.000
 ASK           HOD    H    .         0.000
 ASK           HM1    H    .         0.000
 ASK           HM2    H    .         0.000
 ASK           HM3    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
 ASK        N      CA        single
 ASK        N      HN1       single
 ASK        N      HN2       single
 ASK        CA     CB        single
 ASK        CA     C         single
 ASK        CA     HA        single
 ASK        CB     CG        single
 ASK        CB     HB1       single
 ASK        CB     HB2       single
 ASK        CG     OD1       double
 ASK        CG     OD2       single
 ASK        OD2    HOD       single
 ASK        C      O         double
 ASK        C      CM        single
 ASK        CM     HM1       single
 ASK        CM     HM2       single
 ASK        CM     HM3       single