data_nef_c30356_6be9 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 6BE9 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 THR N 1 7 DPR C 1 1 THR C 1 2 DLY N 1 2 DLY C 1 3 ASN N 1 5 THR C 1 6 DSG N 1 6 DSG C 1 7 DPR 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 THR cyclic -H2,-OXT . 2 A 2 DLY middle -H2,-OXT . 3 A 3 ASN middle -H2 . 4 A 4 ASP middle . . 5 A 5 THR middle -OXT . 6 A 6 DSG middle -H2,-OXT . 7 A 7 DPR cyclic -OXT,-H . 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 THR H1 H 1 8.372 0.00 A 1 THR HA H 1 4.457 0.00 A 1 THR HB H 1 4.247 0.00 A 1 THR HG2% H 1 1.117 0.00 A 1 THR N N 15 115.100 0.00 A 2 DLY H H 1 8.258 0.00 A 2 DLY HA H 1 4.442 0.00 A 2 DLY HBx H 1 1.668 0.00 A 2 DLY HBy H 1 1.761 0.00 A 2 DLY HDy H 1 1.559 0.00 A 2 DLY HEy H 1 2.864 0.00 A 2 DLY HGx H 1 1.226 0.00 A 2 DLY HGy H 1 1.298 0.00 A 2 DLY N N 15 121.800 0.00 A 3 ASN H H 1 8.348 0.00 A 3 ASN HA H 1 4.242 0.01 A 3 ASN HBx H 1 2.796 0.00 A 3 ASN HBy H 1 3.043 0.00 A 3 ASN HD2x H 1 6.915 0.00 A 3 ASN HD2y H 1 7.702 0.00 A 3 ASN N N 15 118.100 0.00 A 3 ASN ND2 N 15 114.500 0.00 A 4 ASP H H 1 8.851 0.00 A 4 ASP HA H 1 4.386 0.00 A 4 ASP HBx H 1 2.872 0.00 A 4 ASP HBy H 1 2.946 0.00 A 4 ASP N N 15 118.100 0.00 A 5 THR H H 1 8.244 0.00 A 5 THR HA H 1 4.367 0.00 A 5 THR HB H 1 4.320 0.00 A 5 THR HG2% H 1 1.071 0.00 A 5 THR N N 15 109.800 0.00 A 6 DSG H H 1 7.684 0.00 A 6 DSG HA H 1 5.172 0.00 A 6 DSG HBx H 1 2.731 0.00 A 6 DSG HBy H 1 2.788 0.00 A 6 DSG HD2x H 1 7.021 0.00 A 6 DSG HD2y H 1 7.596 0.00 A 6 DSG N N 15 123.100 0.00 A 6 DSG ND2 N 15 113.700 0.00 A 7 DPR HA H 1 4.237 0.00 A 7 DPR HBy H 1 2.237 0.00 A 7 DPR HBx H 1 1.860 0.01 A 7 DPR HDx H 1 3.726 0.00 A 7 DPR HDy H 1 3.986 0.00 A 7 DPR HGy H 1 2.058 0.00 A 7 DPR HGx H 1 1.940 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 1 THR HB A 1 THR HA 1.0 2.0 4.4 2 2 A 3 ASN HA A 3 ASN H 1.0 2.0 4.4 3 3 A 3 ASN HBy A 4 ASP H 1.0 2.0 4.4 4 4 A 4 ASP H A 3 ASN HBx 1.0 2.0 4.4 5 5 A 4 ASP H A 4 ASP HA 1.0 2.0 4.4 6 6 A 4 ASP H A 4 ASP HBy 1.0 2.0 4.4 7 7 A 4 ASP H A 4 ASP HBx 1.0 2.0 4.4 8 8 A 5 THR HA A 5 THR H 1.0 2.0 4.4 9 9 A 4 ASP H A 5 THR H 1.0 2.0 4.4 10 10 A 7 DPR HA A 7 DPR HBx 1.0 2.0 4.4 11 11 A 3 ASN HBy A 3 ASN HD2x 1.0 2.9 6.1 12 12 A 3 ASN H A 3 ASN HBy 1.0 2.9 6.1 13 13 A 3 ASN HBx A 3 ASN HD2x 1.0 2.9 6.1 14 14 A 3 ASN HBx A 3 ASN HD2y 1.0 2.9 6.1 15 15 A 3 ASN H A 3 ASN HBx 1.0 2.9 6.1 16 16 A 3 ASN HBx A 5 THR H 1.0 2.9 6.1 17 17 A 3 ASN H A 3 ASN HD2x 1.0 2.9 6.1 18 18 A 3 ASN H A 4 ASP H 1.0 2.9 6.1 19 19 A 3 ASN H A 4 ASP HBx 1.0 2.9 6.1 20 20 A 4 ASP HBx A 5 THR H 1.0 2.9 6.1 21 21 A 5 THR H A 5 THR HB 1.0 2.9 6.1 22 22 A 7 DPR HA A 7 DPR HBy 1.0 2.9 6.1 23 23 A 7 DPR HA A 7 DPR HGx 1.0 2.9 6.1 24 24 A 7 DPR HDy A 7 DPR HBx 1.0 2.9 6.1 25 25 A 7 DPR HDy A 7 DPR HBy 1.0 2.9 6.1 26 26 A 7 DPR HDy A 7 DPR HGx 1.0 2.3 4.7 27 27 A 7 DPR HDy A 7 DPR HGy 1.0 2.9 6.1 28 28 A 7 DPR HDx A 7 DPR HBx 1.0 2.9 6.1 29 29 A 7 DPR HDx A 7 DPR HBy 1.0 2.9 6.1 30 30 A 7 DPR HDx A 7 DPR HGx 1.0 2.9 6.1 31 31 A 7 DPR HDx A 7 DPR HGy 1.0 2.3 4.7 stop_ save_