data_nef_c26538_2n0i 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 25517 BMRB 26536 BMRB 26537 PDB 2N0I 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 HIS C 1 2 KCY N 1 2 KCY C 1 3 GLU N 1 4 GLY C 1 5 HCS N 1 5 HCS C 1 6 PHE N 1 10 PHE C 1 11 PH8 N 1 11 PH8 C 1 12 NH2 N 1 2 KCY SD 1 5 HCS SD 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 HIS start . . 2 A 2 KCY middle . . 3 A 3 GLU middle . . 4 A 4 GLY middle . false 5 A 5 HCS middle . . 6 A 6 PHE middle . . 7 A 7 THR middle . . 8 A 8 SER middle . . 9 A 9 ASP middle . . 10 A 10 PHE middle . . 11 A 11 PH8 middle . . 12 A 12 NH2 end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_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 HIS HA H 1 4.050 0.013 A 2 KCY H H 1 8.660 0.013 A 2 KCY HA H 1 4.270 0.013 A 3 GLU H H 1 8.140 0.013 A 3 GLU HA H 1 4.060 0.013 A 4 GLY H H 1 8.620 0.013 A 4 GLY HA2 H 1 3.810 0.013 A 4 GLY HA3 H 1 3.810 0.013 A 5 HCS H H 1 7.610 0.013 A 5 HCS HCA H 1 4.400 0.013 A 6 PHE H H 1 8.380 0.013 A 7 THR H H 1 7.430 0.013 A 7 THR HA H 1 4.040 0.013 A 8 SER H H 1 7.810 0.013 A 8 SER HA H 1 4.190 0.013 A 9 ASP H H 1 7.960 0.013 A 9 ASP HA H 1 4.390 0.013 A 10 PHE H H 1 7.730 0.013 A 10 PHE HA H 1 4.410 0.013 A 11 PH8 H H 1 7.680 0.013 A 11 PH8 HA H 1 4.150 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 HIS HA A 3 GLU H 1.0 0.0 5.0 2 2 A 4 GLY H A 3 GLU HA 1.0 0.0 2.7 3 3 A 3 GLU H A 4 GLY H 1.0 0.0 5.0 4 4 A 4 GLY H A 3 GLU HBy 1.0 0.0 5.0 5 5 A 4 GLY H A 3 GLU HBx 1.0 0.0 5.0 6 6 A 4 GLY HA3 A 6 PHE H 1.0 0.0 5.0 7 7 A 4 GLY H A 6 PHE H 1.0 0.0 6.0 8 8 A 6 PHE H A 7 THR H 1.0 0.0 3.5 9 9 A 7 THR H A 6 PHE HBy 1.0 0.0 6.0 10 10 A 7 THR H A 6 PHE HBx 1.0 0.0 6.0 11 11 A 6 PHE H A 8 SER H 1.0 0.0 6.0 12 12 A 8 SER H A 7 THR HA 1.0 0.0 3.5 13 13 A 7 THR HA A 9 ASP H 1.0 0.0 6.0 14 14 A 7 THR HA A 10 PHE H 1.0 0.0 5.0 15 15 A 7 THR H A 8 SER H 1.0 0.0 3.5 16 16 A 8 SER H A 7 THR HB 1.0 0.0 6.0 17 17 A 7 THR HA A 10 PHE HBy 1.0 0.0 6.0 18 17 A 7 THR HA A 10 PHE HBx 1.0 0.0 6.0 19 18 A 9 ASP H A 8 SER HA 1.0 0.0 3.5 20 19 A 10 PHE H A 8 SER HA 1.0 0.0 5.0 21 20 A 8 SER H A 9 ASP H 1.0 0.0 3.5 22 21 A 9 ASP H A 8 SER HBx 1.0 0.0 6.0 23 21 A 9 ASP H A 8 SER HBy 1.0 0.0 6.0 24 22 A 7 THR H A 8 SER HBx 1.0 0.0 6.0 25 22 A 7 THR H A 8 SER HBy 1.0 0.0 6.0 26 23 A 10 PHE H A 9 ASP HA 1.0 0.0 3.5 27 24 A 9 ASP H A 10 PHE H 1.0 0.0 3.5 28 25 A 10 PHE H A 9 ASP HBy 1.0 0.0 6.0 29 26 A 10 PHE H A 9 ASP HBx 1.0 0.0 6.0 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 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 10 PHE H A 7 THR O 1.0 1.58 2.3 2 2 A 7 THR O A 10 PHE N 1.0 2.58 3.3 stop_ save_