data_nef_c30365_6bf3 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 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6BF3 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 GLN N 1 7 DAS C 1 3 PRO C 1 4 DPR N 1 4 DPR C 1 5 LYS N 1 5 LYS C 1 6 DTH N 1 6 DTH C 1 7 DAS 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 GLN cyclic -H2 . 2 A 2 ASP middle . . 3 A 3 PRO middle -OXT false 4 A 4 DPR middle -H,-OXT . 5 A 5 LYS middle -H2,-OXT . 6 A 6 DTH middle -HN2,-OXT . 7 A 7 DAS cyclic -OXT,-H2 . 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 GLN H1 H 1 9.157 0.00 A 1 GLN HA H 1 4.317 0.00 A 1 GLN HBx H 1 1.815 0.00 A 1 GLN HBy H 1 1.815 0.00 A 1 GLN HGx H 1 2.305 0.00 A 1 GLN HGy H 1 2.305 0.00 A 2 ASP H H 1 8.171 0.02 A 2 ASP HA H 1 5.227 0.00 A 2 ASP HBx H 1 2.824 0.00 A 2 ASP HBy H 1 2.979 0.00 A 3 PRO HA H 1 4.530 0.00 A 3 PRO HBy H 1 2.096 0.01 A 3 PRO HBx H 1 1.934 0.00 A 3 PRO HDx H 1 3.747 0.00 A 3 PRO HDy H 1 4.119 0.00 A 3 PRO HGy H 1 2.280 0.00 A 3 PRO HGx H 1 1.802 0.00 A 4 DPR HA H 1 4.651 0.00 A 4 DPR HBy H 1 2.009 0.01 A 4 DPR HDy H 1 3.826 0.00 A 4 DPR HDx H 1 3.559 0.00 A 4 DPR HGy H 1 2.209 0.00 A 4 DPR HGx H 1 1.736 0.00 A 5 LYS H H 1 8.042 0.00 A 5 LYS HA H 1 4.432 0.00 A 5 LYS HBx H 1 1.662 0.00 A 5 LYS HBy H 1 1.662 0.00 A 5 LYS HDx H 1 1.306 0.00 A 5 LYS HDy H 1 1.389 0.00 A 5 LYS HEx H 1 2.930 0.00 A 5 LYS HEy H 1 2.930 0.00 A 5 LYS HGx H 1 1.822 0.00 A 5 LYS HGy H 1 1.822 0.00 A 5 LYS HZ1 H 1 7.548 0.01 A 5 LYS HZ2 H 1 7.548 0.01 A 5 LYS HZ3 H 1 7.548 0.01 A 6 DTH H H 1 8.242 0.02 A 6 DTH HA H 1 4.632 0.00 A 6 DTH HB H 1 4.162 0.00 A 6 DTH HG2% H 1 1.018 0.00 A 7 DAS H H 1 8.566 0.00 A 7 DAS HA H 1 4.481 0.00 A 7 DAS HBy H 1 2.830 0.00 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 6 DTH H A 4 DPR HA 1.0 2.9 6.1 2 2 A 4 DPR HA A 4 DPR HDx 1.0 2.9 6.1 3 3 A 4 DPR HBy A 4 DPR HDx 1.0 2.9 6.1 4 4 A 4 DPR HDx A 4 DPR HBx 1.0 2.9 6.1 5 5 A 4 DPR HDx A 4 DPR HGx 1.0 2.3 4.7 6 6 A 4 DPR HDx A 4 DPR HGy 1.0 2.3 4.7 7 7 A 4 DPR HBy A 4 DPR HDy 1.0 2.9 6.1 8 8 A 4 DPR HBx A 4 DPR HDy 1.0 2.9 6.1 9 9 A 4 DPR HGx A 4 DPR HDy 1.0 2.9 6.1 10 10 A 4 DPR HGy A 4 DPR HDy 1.0 2.9 6.1 11 11 A 5 LYS HA A 5 LYS HGy 1.0 2.9 6.1 12 12 A 5 LYS HA A 5 LYS HGx 1.0 2.9 6.1 13 13 A 6 DTH H A 5 LYS HA 1.0 2.9 6.1 14 14 A 4 DPR HA A 5 LYS HDy 1.0 2.9 6.1 15 15 A 4 DPR HGx A 5 LYS HDy 1.0 2.9 6.1 16 16 A 5 LYS HGy A 5 LYS HDy 1.0 2.9 6.1 17 17 A 5 LYS HGx A 5 LYS HDy 1.0 2.9 6.1 18 18 A 6 DTH H A 5 LYS HDy 1.0 2.9 6.1 19 19 A 4 DPR HA A 5 LYS HDx 1.0 2.9 6.1 20 20 A 5 LYS HGy A 5 LYS HDx 1.0 2.9 6.1 21 21 A 5 LYS HGx A 5 LYS HDx 1.0 2.3 4.7 22 22 A 6 DTH H A 6 DTH HA 1.0 2.9 6.1 23 23 A 6 DTH H A 6 DTH HB 1.0 2.9 6.1 stop_ save_