global_
_lib_name         ?
_lib_version      ?
_lib_update       ?
# ------------------------------------------------
#
# ---   LIST OF MONOMERS ---
#
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
0AZ      0AZ '(4R)-4-hydroxy-L-proline            ' P-peptide          17   9 .
# ------------------------------------------------------
# ------------------------------------------------------
#
# --- DESCRIPTION OF MONOMERS ---
#
data_comp_0AZ
#
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
_chem_comp_atom.x
_chem_comp_atom.y
_chem_comp_atom.z
 0AZ           OXT    O    OC       -0.500      0.000    0.000    0.000
 0AZ           C      C    C         0.000     -1.198    0.325    0.153
 0AZ           O      O    OC       -0.500     -1.521    1.109    1.074
 0AZ           CA     C    CH1       0.000     -2.253   -0.226   -0.772
 0AZ           HA     H    H         0.000     -1.874   -0.246   -1.803
 0AZ           CB     C    CH2       0.000     -2.646   -1.650   -0.328
 0AZ           HB2    H    H         0.000     -2.442   -1.832    0.729
 0AZ           HB3    H    H         0.000     -2.164   -2.424   -0.929
 0AZ           CG     C    CH1       0.000     -4.179   -1.683   -0.574
 0AZ           HG     H    H         0.000     -4.404   -1.901   -1.627
 0AZ           OD1    O    OH1       0.000     -4.816   -2.624    0.291
 0AZ           HD1    H    H         0.000     -5.767   -2.626    0.119
 0AZ           CD     C    CH2       0.000     -4.584   -0.232   -0.210
 0AZ           HD22   H    H         0.000     -4.693   -0.101    0.869
 0AZ           HD23   H    H         0.000     -5.509    0.066   -0.707
 0AZ           N      N    NH1       0.000     -3.468    0.606   -0.699
 0AZ           H      H    H         0.000     -3.528    1.585   -0.942
loop_
_chem_comp_tree.comp_id
_chem_comp_tree.atom_id
_chem_comp_tree.atom_back
_chem_comp_tree.atom_forward
_chem_comp_tree.connect_type
 0AZ      OXT    n/a    C      START
 0AZ      C      OXT    CA     .
 0AZ      O      C      .      .
 0AZ      CA     C      CB     .
 0AZ      HA     CA     .      .
 0AZ      CB     CA     CG     .
 0AZ      HB2    CB     .      .
 0AZ      HB3    CB     .      .
 0AZ      CG     CB     CD     .
 0AZ      HG     CG     .      .
 0AZ      OD1    CG     HD1    .
 0AZ      HD1    OD1    .      .
 0AZ      CD     CG     N      .
 0AZ      HD22   CD     .      .
 0AZ      HD23   CD     .      .
 0AZ      N      CD     H      .
 0AZ      H      N      .      END
 0AZ      N      CA     .    ADD
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
 0AZ      N      CA        single      1.450    0.020
 0AZ      N      CD        single      1.450    0.020
 0AZ      H      N         single      1.010    0.020
 0AZ      CA     C         single      1.500    0.020
 0AZ      CB     CA        single      1.524    0.020
 0AZ      HA     CA        single      1.099    0.020
 0AZ      O      C         deloc       1.250    0.020
 0AZ      C      OXT       deloc       1.250    0.020
 0AZ      CG     CB        single      1.524    0.020
 0AZ      HB2    CB        single      1.092    0.020
 0AZ      HB3    CB        single      1.092    0.020
 0AZ      CD     CG        single      1.524    0.020
 0AZ      OD1    CG        single      1.432    0.020
 0AZ      HG     CG        single      1.099    0.020
 0AZ      HD22   CD        single      1.092    0.020
 0AZ      HD23   CD        single      1.092    0.020
 0AZ      HD1    OD1       single      0.967    0.020
loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
 0AZ      OXT    C      O       123.000    3.000
 0AZ      OXT    C      CA      118.500    3.000
 0AZ      O      C      CA      118.500    3.000
 0AZ      C      CA     HA      108.810    3.000
 0AZ      C      CA     CB      109.470    3.000
 0AZ      C      CA     N       111.600    3.000
 0AZ      HA     CA     CB      108.340    3.000
 0AZ      HA     CA     N       108.550    3.000
 0AZ      CB     CA     N       110.000    3.000
 0AZ      CA     CB     HB2     109.470    3.000
 0AZ      CA     CB     HB3     109.470    3.000
 0AZ      CA     CB     CG      111.000    3.000
 0AZ      HB2    CB     HB3     107.900    3.000
 0AZ      HB2    CB     CG      109.470    3.000
 0AZ      HB3    CB     CG      109.470    3.000
 0AZ      CB     CG     HG      108.340    3.000
 0AZ      CB     CG     OD1     109.470    3.000
 0AZ      CB     CG     CD      109.470    3.000
 0AZ      HG     CG     OD1     109.470    3.000
 0AZ      HG     CG     CD      108.340    3.000
 0AZ      OD1    CG     CD      109.470    3.000
 0AZ      CG     OD1    HD1     109.470    3.000
 0AZ      CG     CD     HD22    109.470    3.000
 0AZ      CG     CD     HD23    109.470    3.000
 0AZ      CG     CD     N       110.000    3.000
 0AZ      HD22   CD     HD23    107.900    3.000
 0AZ      HD22   CD     N       109.470    3.000
 0AZ      HD23   CD     N       109.470    3.000
 0AZ      CD     N      H       118.500    3.000
 0AZ      CD     N      CA      120.000    3.000
 0AZ      H      N      CA      118.500    3.000
loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
 0AZ      var_1    OXT    C      CA     CB        80.777   20.000   3
 0AZ      var_2    C      CA     CB     CG       150.000   20.000   3
 0AZ      var_3    CA     CB     CG     CD       -30.000   20.000   3
 0AZ      var_4    CB     CG     OD1    HD1     -179.976   20.000   1
 0AZ      var_5    CB     CG     CD     N         30.000   20.000   3
 0AZ      var_6    CG     CD     N      CA       -30.000   20.000   3
 0AZ      var_7    CD     N      CA     C       -120.000   20.000   3
loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
 0AZ      chir_01  CA     N      C      CB        negativ
 0AZ      chir_02  CG     CB     CD     OD1       positiv
loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
 0AZ      plan-1    N         0.020
 0AZ      plan-1    CA        0.020
 0AZ      plan-1    CD        0.020
 0AZ      plan-1    H         0.020
 0AZ      plan-2    C         0.020
 0AZ      plan-2    CA        0.020
 0AZ      plan-2    O         0.020
 0AZ      plan-2    OXT       0.020
# ------------------------------------------------------
