data_nef_c34198_6ey3 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 6EY3 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 CYS SG 1 8 CYS SG 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 CYS start -HG . 2 A 2 ARG middle . . 3 A 3 PRO middle . false 4 A 4 LEU middle . . 5 A 5 TRP middle . . 6 A 6 THR middle . . 7 A 7 ALA middle . . 8 A 8 CYS middle -HG . 9 A 9 GLY end . false 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 CYS HA H 1 4.458 0.020 A 1 CYS HB2 H 1 3.194 0.020 A 1 CYS HB3 H 1 3.194 0.020 A 2 ARG H H 1 8.408 0.020 A 2 ARG HA H 1 4.885 0.020 A 2 ARG HB2 H 1 1.910 0.020 A 2 ARG HB3 H 1 1.910 0.020 A 2 ARG HD2 H 1 2.945 0.020 A 2 ARG HD3 H 1 2.945 0.020 A 2 ARG HG2 H 1 1.620 0.020 A 2 ARG HG3 H 1 1.620 0.020 A 2 ARG HH11 H 1 6.971 0.020 A 2 ARG HH12 H 1 6.971 0.020 A 3 PRO HA H 1 4.286 0.020 A 3 PRO HBx H 1 2.140 0.020 A 3 PRO HBy H 1 2.344 0.020 A 3 PRO HDx H 1 3.619 0.020 A 3 PRO HDy H 1 3.825 0.020 A 3 PRO HG2 H 1 1.902 0.020 A 3 PRO HG3 H 1 1.902 0.020 A 4 LEU H H 1 8.523 0.020 A 4 LEU HA H 1 4.074 0.020 A 4 LEU HBx H 1 1.554 0.020 A 4 LEU HBy H 1 2.002 0.020 A 4 LEU HDx% H 1 0.867 0.020 A 4 LEU HDy% H 1 0.917 0.020 A 4 LEU HG H 1 1.764 0.020 A 5 TRP H H 1 8.187 0.020 A 5 TRP HA H 1 4.967 0.020 A 5 TRP HBx H 1 3.058 0.020 A 5 TRP HBy H 1 3.296 0.020 A 5 TRP HD1 H 1 7.309 0.020 A 5 TRP HE1 H 1 10.181 0.020 A 5 TRP HE3 H 1 7.730 0.020 A 5 TRP HH2 H 1 7.203 0.020 A 5 TRP HZ2 H 1 7.470 0.020 A 6 THR H H 1 8.179 0.020 A 6 THR HA H 1 4.242 0.020 A 6 THR HG2% H 1 1.157 0.020 A 7 ALA H H 1 7.889 0.020 A 7 ALA HA H 1 4.283 0.020 A 7 ALA HB% H 1 1.314 0.020 A 8 CYS H H 1 7.497 0.020 A 8 CYS HA H 1 4.647 0.020 A 8 CYS HBy H 1 3.225 0.020 A 8 CYS HBx H 1 2.948 0.020 A 9 GLY H H 1 8.558 0.020 A 9 GLY HA2 H 1 3.930 0.020 A 9 GLY HA3 H 1 3.930 0.020 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _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 CYS HA A 1 CYS HB2 1.0 . 4.25 2 1 A 1 CYS HA A 1 CYS HB3 1.0 . 4.25 3 2 A 1 CYS HA A 2 ARG H 1.0 . 2.76 4 3 A 2 ARG H A 1 CYS HB2 1.0 . 5.03 5 3 A 1 CYS HB3 A 2 ARG H 1.0 . 5.03 6 4 A 2 ARG H A 2 ARG HA 1.0 . 3.73 7 5 A 2 ARG H A 2 ARG HB2 1.0 . 5.65 8 5 A 2 ARG H A 2 ARG HB3 1.0 . 5.65 9 6 A 2 ARG H A 2 ARG HD2 1.0 . 6.38 10 6 A 2 ARG H A 2 ARG HD3 1.0 . 6.38 11 7 A 2 ARG H A 2 ARG HG2 1.0 . 5.75 12 7 A 2 ARG H A 2 ARG HG3 1.0 . 5.75 13 8 A 2 ARG H A 2 ARG HH1% 1.0 . 6.37 14 9 A 3 PRO HA A 4 LEU H 1.0 . 2.79 15 10 A 2 ARG HA A 2 ARG HB2 1.0 . 4.75 16 10 A 2 ARG HA A 2 ARG HB3 1.0 . 4.75 17 11 A 2 ARG HA A 2 ARG HD2 1.0 . 5.95 18 11 A 2 ARG HA A 2 ARG HD3 1.0 . 5.95 19 12 A 2 ARG HA A 2 ARG HG2 1.0 . 5.78 20 12 A 2 ARG HA A 2 ARG HG3 1.0 . 5.78 21 13 A 2 ARG HA A 2 ARG HH1% 1.0 . 6.37 22 14 A 2 ARG HA A 3 PRO HDx 1.0 . 3.86 23 15 A 2 ARG HA A 3 PRO HDy 1.0 . 4.49 24 16 A 2 ARG HB2 A 2 ARG HD2 1.0 . 6.01 25 16 A 2 ARG HB3 A 2 ARG HD2 1.0 . 6.01 26 16 A 2 ARG HD3 A 2 ARG HB2 1.0 . 6.01 27 16 A 2 ARG HB3 A 2 ARG HD3 1.0 . 6.01 28 17 A 2 ARG HB2 A 2 ARG HG2 1.0 . 4.89 29 17 A 2 ARG HB3 A 2 ARG HG2 1.0 . 4.89 30 17 A 2 ARG HG3 A 2 ARG HB2 1.0 . 4.89 31 17 A 2 ARG HB3 A 2 ARG HG3 1.0 . 4.89 32 18 A 2 ARG HH1% A 2 ARG HB2 1.0 . 7.25 33 18 A 2 ARG HB3 A 2 ARG HH1% 1.0 . 7.25 34 19 A 2 ARG HH1% A 2 ARG HD2 1.0 . 5.73 35 19 A 2 ARG HD3 A 2 ARG HH1% 1.0 . 5.73 36 20 A 2 ARG HD2 A 2 ARG HG2 1.0 . 6.01 37 20 A 2 ARG HG3 A 2 ARG HD2 1.0 . 6.01 38 20 A 2 ARG HD3 A 2 ARG HG3 1.0 . 6.01 39 20 A 2 ARG HD3 A 2 ARG HG2 1.0 . 6.01 40 21 A 2 ARG HH1% A 2 ARG HG2 1.0 . 7.25 41 21 A 2 ARG HG3 A 2 ARG HH1% 1.0 . 7.25 42 22 A 3 PRO HA A 3 PRO HBy 1.0 . 3.59 43 23 A 3 PRO HA A 3 PRO HDy 1.0 . 4.30 44 24 A 3 PRO HA A 3 PRO HG2 1.0 . 5.30 45 24 A 3 PRO HA A 3 PRO HG3 1.0 . 5.30 46 25 A 3 PRO HBy A 3 PRO HBx 1.0 . 3.06 47 26 A 3 PRO HDx A 3 PRO HBx 1.0 . 4.81 48 27 A 3 PRO HDy A 3 PRO HBx 1.0 . 5.50 49 28 A 3 PRO HBx A 3 PRO HG2 1.0 . 4.28 50 28 A 3 PRO HG3 A 3 PRO HBx 1.0 . 4.28 51 29 A 3 PRO HDy A 3 PRO HBy 1.0 . 3.92 52 30 A 3 PRO HBy A 3 PRO HG2 1.0 . 3.85 53 30 A 3 PRO HBy A 3 PRO HG3 1.0 . 3.85 54 31 A 3 PRO HDx A 3 PRO HDy 1.0 . 2.20 55 32 A 3 PRO HDx A 3 PRO HG2 1.0 . 5.27 56 32 A 3 PRO HDx A 3 PRO HG3 1.0 . 5.27 57 33 A 3 PRO HDy A 3 PRO HG2 1.0 . 6.22 58 33 A 3 PRO HDy A 3 PRO HG3 1.0 . 6.22 59 34 A 4 LEU H A 5 TRP H 1.0 . 3.65 60 35 A 4 LEU H A 4 LEU HA 1.0 . 3.09 61 36 A 4 LEU H A 4 LEU HBx 1.0 . 4.08 62 37 A 4 LEU H A 4 LEU HBy 1.0 . 3.82 63 38 A 4 LEU H A 4 LEU HG 1.0 . 5.50 64 39 A 4 LEU H A 4 LEU HDx% 1.0 . 5.17 65 40 A 4 LEU H A 4 LEU HDy% 1.0 . 4.90 66 41 A 4 LEU HA A 4 LEU HBx 1.0 . 3.32 67 42 A 4 LEU HA A 4 LEU HBy 1.0 . 2.70 68 43 A 4 LEU HA A 4 LEU HG 1.0 . 5.04 69 44 A 4 LEU HA A 4 LEU HDx% 1.0 . 4.28 70 45 A 4 LEU HA A 4 LEU HDy% 1.0 . 3.42 71 46 A 5 TRP H A 4 LEU HA 1.0 . 3.39 72 47 A 5 TRP H A 4 LEU HBx 1.0 . 3.29 73 48 A 4 LEU HBx A 4 LEU HBy 1.0 . 2.23 74 49 A 4 LEU HBx A 4 LEU HDx% 1.0 . 3.85 75 50 A 4 LEU HBx A 4 LEU HDy% 1.0 . 4.14 76 51 A 4 LEU HBy A 4 LEU HG 1.0 . 2.96 77 52 A 4 LEU HBy A 4 LEU HDx% 1.0 . 3.22 78 53 A 4 LEU HBy A 4 LEU HDy% 1.0 . 3.22 79 54 A 4 LEU HBy A 6 THR H 1.0 . 3.29 80 55 A 4 LEU HG A 6 THR H 1.0 . 4.44 81 56 A 4 LEU HG A 4 LEU HDx% 1.0 . 4.90 82 57 A 4 LEU HG A 4 LEU HDy% 1.0 . 4.55 83 58 A 4 LEU HDx% A 4 LEU HDy% 1.0 . 4.57 84 59 A 5 TRP H A 5 TRP HA 1.0 . 3.19 85 60 A 5 TRP H A 5 TRP HBx 1.0 . 3.55 86 61 A 5 TRP H A 5 TRP HBy 1.0 . 3.53 87 62 A 6 THR H A 5 TRP HA 1.0 . 3.45 88 63 A 5 TRP HA A 5 TRP HBx 1.0 . 3.42 89 64 A 5 TRP HA A 5 TRP HBy 1.0 . 3.69 90 65 A 5 TRP HBx A 5 TRP HBy 1.0 . 2.20 91 66 A 5 TRP HD1 A 6 THR HG2% 1.0 . 4.04 92 67 A 6 THR H A 6 THR HA 1.0 . 3.49 93 68 A 6 THR H A 6 THR HG2% 1.0 . 4.34 94 69 A 6 THR H A 7 ALA H 1.0 . 2.86 95 70 A 6 THR HG2% A 6 THR HA 1.0 . 3.22 96 71 A 7 ALA H A 7 ALA HA 1.0 . 2.93 97 72 A 7 ALA H A 7 ALA HB% 1.0 . 4.36 98 73 A 7 ALA HA A 7 ALA HB% 1.0 . 4.27 99 74 A 7 ALA HA A 8 CYS H 1.0 . 2.99 100 75 A 7 ALA HB% A 8 CYS H 1.0 . 4.77 101 76 A 8 CYS H A 8 CYS HA 1.0 . 3.78 102 77 A 8 CYS H A 8 CYS HBy 1.0 . 3.65 103 78 A 8 CYS H A 8 CYS HBx 1.0 . 3.26 104 79 A 8 CYS HA A 8 CYS HBy 1.0 . 4.08 105 80 A 8 CYS HA A 8 CYS HBx 1.0 . 3.49 106 81 A 8 CYS HA A 9 GLY H 1.0 . 3.52 107 82 A 8 CYS HBy A 8 CYS HBx 1.0 . 2.20 108 83 A 8 CYS HBy A 9 GLY H 1.0 . 4.36 109 84 A 8 CYS HBx A 9 GLY H 1.0 . 3.55 110 85 A 9 GLY H A 9 GLY HA2 1.0 . 3.48 111 85 A 9 GLY H A 9 GLY HA3 1.0 . 3.48 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 1 _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 Hz . . 6000 . folded . . stop_ save_