data_nef_c30202_5twi save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 30203 PDB 5TWI stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 1 ALA N 1 4 UN1 C1' 1 3 ALA C 1 4 UN1 N4 1 4 UN1 C3 1 5 NH2 N stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 ALA start -H2 . 2 A 2 ARG middle . . 3 A 3 ALA middle -OXT . 4 A 4 UN1 middle -O5' . 5 A 5 NH2 end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 ALA H H 1 8.600 0.013 A 1 ALA HA H 1 4.100 0.013 A 2 ARG H H 1 7.880 0.013 A 2 ARG HA H 1 4.210 0.013 A 3 ALA H H 1 8.510 0.013 A 3 ALA HA H 1 4.220 0.013 A 4 UN1 H4 H 1 4.100 0.013 A 5 NH2 HN1 H 1 7.580 0.013 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 1 ALA HA A 2 ARG H 1.0 0.0 3.5 2 2 A 1 ALA HA A 3 ALA H 1.0 0.0 6.0 3 3 A 2 ARG H A 1 ALA HB1 1.0 0.0 4.2 4 4 A 3 ALA H A 1 ALA HB1 1.0 0.0 6.0 5 5 A 2 ARG H A 2 ARG HA 1.0 0.0 3.5 6 6 A 3 ALA H A 2 ARG HA 1.0 0.0 6.0 7 7 A 3 ALA H A 2 ARG HBx 1.0 0.0 6.0 8 7 A 3 ALA H A 2 ARG HBy 1.0 0.0 6.0 9 8 A 2 ARG H A 3 ALA H 1.0 0.0 3.5 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type . save_