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
FGP      FGP '2-AMINO-3-HYDROXY-3-PHOSPHONOOXY-PRO' non-polymer        17  12 .
# ------------------------------------------------------
# ------------------------------------------------------
#
# --- DESCRIPTION OF MONOMERS ---
#
data_comp_FGP
#
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
 FGP           O2     O    OC       -0.500      0.000    0.000    0.000
 FGP           C      C    C         0.000     -1.243   -0.143    0.012
 FGP           O      O    OC       -0.500     -2.018    0.642   -0.578
 FGP           CA     C    CH1       0.000     -1.722   -1.382    0.747
 FGP           HA     H    H         0.000     -1.019   -1.593    1.565
 FGP           N      N    NH2       0.000     -3.037   -1.111    1.328
 FGP           HN2    H    H         0.000     -3.115   -0.580    2.187
 FGP           HN1    H    H         0.000     -3.875   -1.453    0.875
 FGP           CB     C    CH1       0.000     -1.772   -2.608   -0.175
 FGP           HB     H    H         0.000     -2.092   -3.472    0.424
 FGP           OG1    O    OH1       0.000     -2.725   -2.414   -1.219
 FGP           HOG    H    H         0.000     -2.704   -1.492   -1.506
 FGP           OG2    O    O2        0.000     -0.480   -2.891   -0.704
 FGP           P      P    P         0.000     -0.253   -4.137   -1.708
 FGP           O1P    O    OP       -0.666      1.175   -4.304   -2.182
 FGP           O2P    O    OP       -0.666     -0.813   -5.332   -0.968
 FGP           O3P    O    OP       -0.666     -1.250   -3.912   -2.823
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
 FGP      O2     n/a    C      START
 FGP      C      O2     CA     .
 FGP      O      C      .      .
 FGP      CA     C      CB     .
 FGP      HA     CA     .      .
 FGP      N      CA     HN1    .
 FGP      HN2    N      .      .
 FGP      HN1    N      .      .
 FGP      CB     CA     OG2    .
 FGP      HB     CB     .      .
 FGP      OG1    CB     HOG    .
 FGP      HOG    OG1    .      .
 FGP      OG2    CB     P      .
 FGP      P      OG2    O3P    .
 FGP      O1P    P      .      .
 FGP      O2P    P      .      .
 FGP      O3P    P      .      END
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
 FGP      N      CA        single      1.450    0.020
 FGP      HN1    N         single      1.010    0.020
 FGP      HN2    N         single      1.010    0.020
 FGP      CB     CA        single      1.524    0.020
 FGP      CA     C         single      1.500    0.020
 FGP      HA     CA        single      1.099    0.020
 FGP      OG1    CB        single      1.432    0.020
 FGP      OG2    CB        single      1.426    0.020
 FGP      HB     CB        single      1.099    0.020
 FGP      HOG    OG1       single      0.967    0.020
 FGP      P      OG2       single      1.610    0.020
 FGP      O      C         deloc       1.250    0.020
 FGP      C      O2        deloc       1.250    0.020
 FGP      O1P    P         deloc       1.510    0.020
 FGP      O2P    P         deloc       1.510    0.020
 FGP      O3P    P         deloc       1.510    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
 FGP      O2     C      O       123.000    3.000
 FGP      O2     C      CA      118.500    3.000
 FGP      O      C      CA      118.500    3.000
 FGP      C      CA     HA      108.810    3.000
 FGP      C      CA     N       109.470    3.000
 FGP      C      CA     CB      109.470    3.000
 FGP      HA     CA     N       109.470    3.000
 FGP      HA     CA     CB      108.340    3.000
 FGP      N      CA     CB      109.470    3.000
 FGP      CA     N      HN2     120.000    3.000
 FGP      CA     N      HN1     120.000    3.000
 FGP      HN2    N      HN1     120.000    3.000
 FGP      CA     CB     HB      108.340    3.000
 FGP      CA     CB     OG1     109.470    3.000
 FGP      CA     CB     OG2     109.470    3.000
 FGP      HB     CB     OG1     109.470    3.000
 FGP      HB     CB     OG2     109.470    3.000
 FGP      OG1    CB     OG2     109.470    3.000
 FGP      CB     OG1    HOG     109.470    3.000
 FGP      CB     OG2    P       120.500    3.000
 FGP      OG2    P      O1P     108.200    3.000
 FGP      OG2    P      O2P     108.200    3.000
 FGP      OG2    P      O3P     108.200    3.000
 FGP      O1P    P      O2P     119.900    3.000
 FGP      O1P    P      O3P     119.900    3.000
 FGP      O2P    P      O3P     119.900    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
 FGP      var_1    O2     C      CA     CB       -87.615   20.000   3
 FGP      var_2    C      CA     N      HN1      101.102   20.000   1
 FGP      var_3    C      CA     CB     OG2       59.987   20.000   3
 FGP      var_4    CA     CB     OG1    HOG       37.259   20.000   1
 FGP      var_5    CA     CB     OG2    P        179.954   20.000   1
 FGP      var_6    CB     OG2    P      O3P       54.611   20.000   1
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
 FGP      chir_01  CA     N      CB     C         negativ
 FGP      chir_02  CB     CA     OG1    OG2       negativ
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
 FGP      plan-1    N         0.020
 FGP      plan-1    CA        0.020
 FGP      plan-1    HN1       0.020
 FGP      plan-1    HN2       0.020
 FGP      plan-2    C         0.020
 FGP      plan-2    CA        0.020
 FGP      plan-2    O         0.020
 FGP      plan-2    O2        0.020
# ------------------------------------------------------
