data_nef_c30476_6dny 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 6DNY 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 PRO N 1 4 VAL C 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 PRO cyclic -H false 2 A 2 TYR middle . . 3 A 3 PRO middle . true 4 A 4 VAL cyclic -OXT . 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 PRO HA H 1 4.047 0.020 A 1 PRO HBy H 1 1.803 0.020 A 1 PRO HBx H 1 1.632 0.020 A 1 PRO HDy H 1 3.429 0.020 A 1 PRO HDx H 1 3.103 0.020 A 1 PRO HGy H 1 1.637 0.020 A 1 PRO HGx H 1 1.248 0.020 A 1 PRO CA C 13 61.379 0.3 A 1 PRO CB C 13 31.287 0.3 A 1 PRO CD C 13 46.669 0.3 A 1 PRO CG C 13 21.210 0.3 A 2 TYR H H 1 7.988 0.020 A 2 TYR HA H 1 4.863 0.020 A 2 TYR HBy H 1 3.009 0.020 A 2 TYR HBx H 1 2.537 0.020 A 2 TYR HD1 H 1 6.950 0.020 A 2 TYR HD2 H 1 6.950 0.020 A 2 TYR HE1 H 1 6.584 0.020 A 2 TYR HE2 H 1 6.584 0.020 A 2 TYR CA C 13 51.743 0.3 A 2 TYR CB C 13 37.108 0.3 A 2 TYR CD1 C 13 130.500 0.3 A 2 TYR CD2 C 13 130.500 0.3 A 2 TYR CE1 C 13 114.600 0.3 A 2 TYR CE2 C 13 114.600 0.3 A 3 PRO HA H 1 4.243 0.020 A 3 PRO HBy H 1 2.045 0.020 A 3 PRO HBx H 1 1.960 0.020 A 3 PRO HDy H 1 3.558 0.020 A 3 PRO HDx H 1 3.205 0.020 A 3 PRO HGy H 1 1.889 0.020 A 3 PRO HGx H 1 1.523 0.020 A 3 PRO CA C 13 61.565 0.3 A 3 PRO CB C 13 31.808 0.3 A 3 PRO CD C 13 47.025 0.3 A 3 PRO CG C 13 21.934 0.3 A 4 VAL H H 1 7.841 0.020 A 4 VAL HA H 1 4.407 0.020 A 4 VAL HGx% H 1 0.787 0.020 A 4 VAL HGy% H 1 0.817 0.020 A 4 VAL CA C 13 55.120 0.3 A 4 VAL CB C 13 29.073 0.3 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-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 PRO HDx A 4 VAL H 1.0 . 5.50 2 2 A 4 VAL H A 2 TYR H 1.0 . 2.70 3 3 A 2 TYR H A 4 VAL HA 1.0 . 4.09 4 4 A 4 VAL HA A 1 PRO HA 1.0 . 2.40 5 5 A 1 PRO HDx A 2 TYR H 1.0 . 3.42 6 6 A 2 TYR H A 1 PRO HA 1.0 . 3.28 7 7 A 2 TYR H A 1 PRO HGx 1.0 . 4.00 8 8 A 2 TYR H A 3 PRO HA 1.0 . 3.89 9 9 A 3 PRO HA A 2 TYR HA 1.0 . 2.40 10 10 A 1 PRO HA A 4 VAL HGx% 1.0 . 3.71 11 10 A 1 PRO HA A 4 VAL HGy% 1.0 . 3.71 12 11 A 1 PRO HDx A 4 VAL HGx% 1.0 . 5.19 13 11 A 1 PRO HDx A 4 VAL HGy% 1.0 . 5.19 14 12 A 2 TYR H A 3 PRO HGy 1.0 . 5.35 15 12 A 2 TYR H A 3 PRO HGx 1.0 . 5.35 16 13 A 2 TYR HA A 3 PRO HBy 1.0 . 4.30 17 13 A 2 TYR HA A 3 PRO HBx 1.0 . 4.30 18 14 A 2 TYR HD% A 3 PRO HDy 1.0 . 5.35 19 14 A 2 TYR HD% A 3 PRO HDx 1.0 . 5.35 20 15 A 4 VAL H A 3 PRO HBy 1.0 . 3.90 21 15 A 4 VAL H A 3 PRO HBx 1.0 . 3.90 22 16 A 1 PRO N A 4 VAL C 1.0 . 1.30 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 3 PRO C A 4 VAL N A 4 VAL CA A 4 VAL C 1.0 -175.0 75.0 PHI 2 2 A 3 PRO C A 4 VAL N A 4 VAL CA A 4 VAL C 1.0 -255.0 -25.0 PHI 3 3 A 3 PRO C A 4 VAL N A 4 VAL CA A 4 VAL C 1.0 -135.0 75.0 PHI 4 4 A 2 TYR N A 2 TYR CA A 2 TYR CB A 2 TYR CG 1.0 -90.0 210.0 CHI1 5 5 A 2 TYR N A 2 TYR CA A 2 TYR CB A 2 TYR CG 1.0 -330.0 -30.0 CHI1 6 6 A 2 TYR N A 2 TYR CA A 2 TYR CB A 2 TYR CG 1.0 -210.0 90.0 CHI1 7 7 A 4 VAL N A 4 VAL CA A 4 VAL CB A 4 VAL CG1 1.0 -90.0 210.0 CHI1 8 8 A 4 VAL N A 4 VAL CA A 4 VAL CB A 4 VAL CG1 1.0 -330.0 -30.0 CHI1 9 9 A 4 VAL N A 4 VAL CA A 4 VAL CB A 4 VAL CG1 1.0 -210.0 90.0 CHI1 stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 2 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 12 . . . . 2 ppm . . 12 . . . . stop_ save_