# 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 PP8 PP8 '2-[(1R)-1-(N-(3-METHYLBUTANOYL)-L-VA' non-polymer 90 43 M # data_comp_PP8 # 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 PP8 NV2 N . 0.000 PP8 CV1 C . 0.000 PP8 CV6 C . 0.000 PP8 CV2 C . 0.000 PP8 CV7 C . 0.000 PP8 CV3 C . 0.000 PP8 CV8 C . 0.000 PP8 CV4 C . 0.000 PP8 CV9 C . 0.000 PP8 CV5 C . 0.000 PP8 CR C . 0.000 PP8 OV1 O . 0.000 PP8 OV2 O . 0.000 PP8 N1 N . 0.000 PP8 C1 C . 0.000 PP8 C2 C . 0.000 PP8 C4 C . 0.000 PP8 O2 O . 0.000 PP8 N2 N . 0.000 PP8 C3 C . 0.000 PP8 O1 O . 0.000 PP8 NL N . 0.000 PP8 CAL C . 0.000 PP8 CBL C . 0.000 PP8 CGL C . 0.000 PP8 CL1 C . 0.000 PP8 CL2 C . 0.000 PP8 P P . 0.000 PP8 O3 O . 0.000 PP8 O4 O . 0.000 PP8 O5 O . 0.000 PP8 C5 C . 0.000 PP8 C6 C . 0.000 PP8 C7 C . 0.000 PP8 CE2 C . 0.000 PP8 CZ C . 0.000 PP8 CD2 C . 0.000 PP8 CE1 C . 0.000 PP8 CD1 C . 0.000 PP8 CG C . 0.000 PP8 CT C . 0.000 PP8 OT1 O . 0.000 PP8 OT2 O . 0.000 PP8 HNV2 H . 0.000 PP8 HV11 H . 0.000 PP8 HV12 H . 0.000 PP8 HV6 H . 0.000 PP8 HV2 H . 0.000 PP8 HV7 H . 0.000 PP8 HV31 H . 0.000 PP8 HV32 H . 0.000 PP8 HV33 H . 0.000 PP8 HV81 H . 0.000 PP8 HV82 H . 0.000 PP8 HV83 H . 0.000 PP8 HV41 H . 0.000 PP8 HV42 H . 0.000 PP8 HV43 H . 0.000 PP8 HV91 H . 0.000 PP8 HV92 H . 0.000 PP8 HV93 H . 0.000 PP8 HN1 H . 0.000 PP8 H1 H . 0.000 PP8 H21 H . 0.000 PP8 H22 H . 0.000 PP8 HN21 H . 0.000 PP8 HN22 H . 0.000 PP8 HNL H . 0.000 PP8 HAL H . 0.000 PP8 HBL1 H . 0.000 PP8 HBL2 H . 0.000 PP8 HGL H . 0.000 PP8 HL11 H . 0.000 PP8 HL12 H . 0.000 PP8 HL13 H . 0.000 PP8 HL21 H . 0.000 PP8 HL22 H . 0.000 PP8 HL23 H . 0.000 PP8 HO4 H . 0.000 PP8 H5 H . 0.000 PP8 H61 H . 0.000 PP8 H62 H . 0.000 PP8 H71 H . 0.000 PP8 H72 H . 0.000 PP8 H73 H . 0.000 PP8 HZ H . 0.000 PP8 HD2 H . 0.000 PP8 HE1 H . 0.000 PP8 HD1 H . 0.000 PP8 HG 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 PP8 NV2 CV6 single PP8 NV2 CV5 single PP8 NV2 HNV2 single PP8 CV1 CV2 single PP8 CV1 CV5 single PP8 CV1 HV11 single PP8 CV1 HV12 single PP8 CV6 CV7 single PP8 CV6 CR single PP8 CV6 HV6 single PP8 CV2 CV3 single PP8 CV2 CV4 single PP8 CV2 HV2 single PP8 CV7 CV8 single PP8 CV7 CV9 single PP8 CV7 HV7 single PP8 CV3 HV31 single PP8 CV3 HV32 single PP8 CV3 HV33 single PP8 CV8 HV81 single PP8 CV8 HV82 single PP8 CV8 HV83 single PP8 CV4 HV41 single PP8 CV4 HV42 single PP8 CV4 HV43 single PP8 CV9 HV91 single PP8 CV9 HV92 single PP8 CV9 HV93 single PP8 CV5 OV1 double PP8 CR OV2 double PP8 CR N1 single PP8 N1 C1 single PP8 N1 HN1 single PP8 C1 C2 single PP8 C1 C3 single PP8 C1 H1 single PP8 C2 C4 single PP8 C2 H21 single PP8 C2 H22 single PP8 C4 O2 double PP8 C4 N2 single PP8 N2 HN21 single PP8 N2 HN22 single PP8 C3 O1 double PP8 C3 NL single PP8 NL CAL single PP8 NL HNL single PP8 CAL CBL single PP8 CAL P single PP8 CAL HAL single PP8 CBL CGL single PP8 CBL HBL1 single PP8 CBL HBL2 single PP8 CGL CL1 single PP8 CGL CL2 single PP8 CGL HGL single PP8 CL1 HL11 single PP8 CL1 HL12 single PP8 CL1 HL13 single PP8 CL2 HL21 single PP8 CL2 HL22 single PP8 CL2 HL23 single PP8 P O3 double PP8 P O4 single PP8 P O5 single PP8 O4 HO4 single PP8 O5 C5 single PP8 C5 C6 single PP8 C5 CT single PP8 C5 H5 single PP8 C6 CE2 single PP8 C6 H61 single PP8 C6 H62 single PP8 C7 OT1 single PP8 C7 H71 single PP8 C7 H72 single PP8 C7 H73 single PP8 CE2 CZ double PP8 CE2 CD2 single PP8 CZ CE1 single PP8 CZ HZ single PP8 CD2 CG double PP8 CD2 HD2 single PP8 CE1 CD1 double PP8 CE1 HE1 single PP8 CD1 CG single PP8 CD1 HD1 single PP8 CG HG single PP8 CT OT1 single PP8 CT OT2 double