data_nef_c34016_5lff 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 PDB 5LFF 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 3 CYS SG 1 7 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 ARG start . . 2 A 2 ALA middle . . 3 A 3 CYS middle -HG . 4 A 4 ARG middle . . 5 A 5 PHE middle . . 6 A 6 PHE middle . . 7 A 7 CYS end -HG . 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 ARG HBx H 1 1.984 0.006 A 1 ARG HBy H 1 2.032 0.000 A 1 ARG HDx H 1 3.210 0.000 A 1 ARG HDy H 1 3.210 0.000 A 1 ARG HE H 1 7.232 0.000 A 1 ARG HGx H 1 1.574 0.000 A 1 ARG HGy H 1 1.688 0.000 A 2 ALA H H 1 8.614 0.000 A 2 ALA HA H 1 4.287 0.000 A 2 ALA HB% H 1 1.377 0.000 A 3 CYS H H 1 8.308 0.000 A 3 CYS HA H 1 4.494 0.000 A 3 CYS HBx H 1 3.026 0.000 A 3 CYS HBy H 1 3.287 0.000 A 4 ARG H H 1 8.270 0.000 A 4 ARG HA H 1 4.049 0.000 A 4 ARG HBx H 1 1.198 0.002 A 4 ARG HBy H 1 1.403 0.002 A 4 ARG HDx H 1 2.887 0.000 A 4 ARG HDy H 1 2.887 0.000 A 4 ARG HE H 1 6.976 0.000 A 4 ARG HGx H 1 0.989 0.002 A 4 ARG HGy H 1 1.113 0.000 A 5 PHE H H 1 7.898 0.000 A 5 PHE HA H 1 4.549 0.000 A 5 PHE HBx H 1 2.551 0.000 A 5 PHE HBy H 1 2.551 0.000 A 5 PHE HDx H 1 7.077 0.000 A 5 PHE HDy H 1 7.077 0.000 A 5 PHE HEx H 1 7.170 0.000 A 5 PHE HEy H 1 7.170 0.000 A 6 PHE H H 1 8.016 0.000 A 6 PHE HA H 1 4.634 0.000 A 6 PHE HBx H 1 3.030 0.000 A 6 PHE HBy H 1 3.332 0.003 A 6 PHE HDx H 1 7.335 0.000 A 6 PHE HDy H 1 7.335 0.000 A 6 PHE HEx H 1 7.235 0.000 A 6 PHE HEy H 1 7.235 0.000 A 7 CYS H H 1 7.982 0.000 A 7 CYS HA H 1 4.716 0.000 A 7 CYS HBx H 1 3.084 0.000 A 7 CYS HBy H 1 3.276 0.000 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 ARG HA A 1 ARG HBx 1.0 . 2.92 2 2 A 1 ARG HA A 1 ARG HBy 1.0 . 2.92 3 3 A 1 ARG HA A 2 ALA H 1.0 . 2.56 4 4 A 1 ARG HA A 2 ALA HB% 1.0 . 6.03 5 5 A 1 ARG HA A 3 CYS H 1.0 . 4.60 6 6 A 1 ARG HE A 1 ARG HBx 1.0 . 5.00 7 7 A 2 ALA H A 1 ARG HBx 1.0 . 3.48 8 8 A 3 CYS H A 1 ARG HBx 1.0 . 4.36 9 9 A 1 ARG HE A 1 ARG HBy 1.0 . 5.00 10 10 A 2 ALA H A 1 ARG HBy 1.0 . 3.48 11 11 A 3 CYS H A 1 ARG HBy 1.0 . 4.36 12 12 A 2 ALA H A 1 ARG HBy 1.0 . 2.91 13 12 A 2 ALA H A 1 ARG HBx 1.0 . 2.91 14 13 A 3 CYS H A 1 ARG HBy 1.0 . 3.83 15 13 A 3 CYS H A 1 ARG HBx 1.0 . 3.83 16 14 A 2 ALA H A 1 ARG HGx 1.0 . 5.00 17 15 A 3 CYS H A 1 ARG HGx 1.0 . 5.00 18 16 A 2 ALA H A 1 ARG HGy 1.0 . 5.00 19 17 A 3 CYS H A 1 ARG HGy 1.0 . 5.00 20 18 A 3 CYS HA A 1 ARG HGy 1.0 . 4.87 21 18 A 1 ARG HGx A 3 CYS HA 1.0 . 4.87 22 19 A 2 ALA H A 1 ARG HDx 1.0 . 5.88 23 19 A 2 ALA H A 1 ARG HDy 1.0 . 5.88 24 20 A 2 ALA H A 3 CYS H 1.0 . 3.32 25 21 A 3 CYS H A 2 ALA HA 1.0 . 2.60 26 22 A 2 ALA HA A 3 CYS HBx 1.0 . 4.52 27 23 A 2 ALA HA A 3 CYS HBy 1.0 . 4.52 28 24 A 2 ALA HB% A 3 CYS H 1.0 . 6.03 29 25 A 3 CYS H A 3 CYS HA 1.0 . 2.68 30 26 A 3 CYS H A 3 CYS HBx 1.0 . 3.16 31 27 A 3 CYS H A 3 CYS HBy 1.0 . 3.16 32 28 A 3 CYS HA A 3 CYS HBx 1.0 . 3.00 33 29 A 3 CYS HA A 3 CYS HBy 1.0 . 3.00 34 30 A 3 CYS HA A 4 ARG H 1.0 . 2.64 35 31 A 4 ARG H A 3 CYS HBx 1.0 . 3.72 36 32 A 5 PHE H A 3 CYS HBx 1.0 . 4.36 37 33 A 4 ARG H A 3 CYS HBy 1.0 . 3.72 38 34 A 5 PHE H A 3 CYS HBy 1.0 . 4.36 39 35 A 4 ARG H A 3 CYS HBy 1.0 . 3.24 40 35 A 4 ARG H A 3 CYS HBx 1.0 . 3.24 41 36 A 5 PHE H A 3 CYS HBy 1.0 . 3.77 42 36 A 5 PHE H A 3 CYS HBx 1.0 . 3.77 43 37 A 4 ARG H A 4 ARG HBx 1.0 . 3.20 44 38 A 4 ARG H A 4 ARG HBy 1.0 . 3.20 45 39 A 4 ARG H A 4 ARG HBx 1.0 . 2.73 46 39 A 4 ARG H A 4 ARG HBy 1.0 . 2.73 47 40 A 4 ARG H A 4 ARG HGx 1.0 . 5.00 48 41 A 4 ARG H A 4 ARG HGy 1.0 . 5.00 49 42 A 4 ARG H A 4 ARG HDx 1.0 . 5.88 50 42 A 4 ARG H A 4 ARG HDy 1.0 . 5.88 51 43 A 4 ARG H A 5 PHE H 1.0 . 2.76 52 44 A 4 ARG H A 5 PHE HBx 1.0 . 5.88 53 44 A 4 ARG H A 5 PHE HBy 1.0 . 5.88 54 45 A 4 ARG H A 5 PHE HD% 1.0 . 7.12 55 46 A 4 ARG H A 6 PHE H 1.0 . 3.92 56 47 A 4 ARG HA A 4 ARG HBx 1.0 . 3.00 57 48 A 4 ARG HBy A 4 ARG HA 1.0 . 3.00 58 49 A 5 PHE H A 4 ARG HA 1.0 . 3.36 59 50 A 5 PHE HD% A 4 ARG HA 1.0 . 7.12 60 51 A 6 PHE H A 4 ARG HA 1.0 . 4.96 61 52 A 4 ARG HE A 4 ARG HBx 1.0 . 5.00 62 53 A 5 PHE H A 4 ARG HBx 1.0 . 3.20 63 54 A 5 PHE HBy A 4 ARG HBx 1.0 . 5.88 64 54 A 4 ARG HBx A 5 PHE HBx 1.0 . 5.88 65 55 A 5 PHE HD% A 4 ARG HBx 1.0 . 7.12 66 56 A 5 PHE HE% A 4 ARG HBx 1.0 . 7.12 67 57 A 6 PHE H A 4 ARG HBx 1.0 . 4.92 68 58 A 4 ARG HBy A 4 ARG HE 1.0 . 5.00 69 59 A 5 PHE H A 4 ARG HBy 1.0 . 3.20 70 60 A 4 ARG HBy A 5 PHE HBy 1.0 . 5.88 71 60 A 4 ARG HBy A 5 PHE HBx 1.0 . 5.88 72 61 A 4 ARG HBy A 5 PHE HD% 1.0 . 7.12 73 62 A 4 ARG HBy A 5 PHE HE% 1.0 . 7.12 74 63 A 4 ARG HBy A 6 PHE H 1.0 . 4.92 75 64 A 6 PHE H A 4 ARG HBx 1.0 . 4.29 76 64 A 4 ARG HBy A 6 PHE H 1.0 . 4.29 77 65 A 5 PHE H A 4 ARG HGx 1.0 . 5.00 78 66 A 4 ARG HGx A 5 PHE HD% 1.0 . 7.12 79 67 A 4 ARG HGx A 5 PHE HE% 1.0 . 7.12 80 68 A 5 PHE H A 4 ARG HGy 1.0 . 5.00 81 69 A 4 ARG HGy A 5 PHE HD% 1.0 . 7.12 82 70 A 4 ARG HGy A 5 PHE HE% 1.0 . 7.12 83 71 A 5 PHE H A 4 ARG HDx 1.0 . 5.88 84 71 A 5 PHE H A 4 ARG HDy 1.0 . 5.88 85 72 A 5 PHE HE% A 4 ARG HDx 1.0 . 8.00 86 72 A 4 ARG HDy A 5 PHE HE% 1.0 . 8.00 87 73 A 5 PHE H A 4 ARG HE 1.0 . 5.00 88 74 A 5 PHE H A 5 PHE HBx 1.0 . 4.16 89 74 A 5 PHE H A 5 PHE HBy 1.0 . 4.16 90 75 A 5 PHE H A 5 PHE HD% 1.0 . 7.12 91 76 A 5 PHE H A 6 PHE H 1.0 . 2.92 92 77 A 5 PHE H A 6 PHE HD% 1.0 . 7.12 93 78 A 5 PHE HD% A 5 PHE HA 1.0 . 7.12 94 79 A 6 PHE H A 5 PHE HA 1.0 . 3.00 95 80 A 6 PHE H A 5 PHE HBx 1.0 . 4.16 96 80 A 5 PHE HBy A 6 PHE H 1.0 . 4.16 97 81 A 5 PHE HBy A 6 PHE HBy 1.0 . 5.70 98 81 A 5 PHE HBx A 6 PHE HBy 1.0 . 5.70 99 81 A 6 PHE HBx A 5 PHE HBx 1.0 . 5.70 100 81 A 5 PHE HBy A 6 PHE HBx 1.0 . 5.70 101 82 A 6 PHE HD% A 5 PHE HBx 1.0 . 8.00 102 82 A 5 PHE HBy A 6 PHE HD% 1.0 . 8.00 103 83 A 5 PHE HD% A 6 PHE H 1.0 . 7.12 104 84 A 6 PHE H A 6 PHE HA 1.0 . 2.88 105 85 A 6 PHE H A 6 PHE HBx 1.0 . 3.44 106 86 A 6 PHE H A 6 PHE HBy 1.0 . 3.44 107 87 A 6 PHE H A 6 PHE HBy 1.0 . 2.85 108 87 A 6 PHE H A 6 PHE HBx 1.0 . 2.85 109 88 A 6 PHE H A 6 PHE HD% 1.0 . 7.12 110 89 A 6 PHE HD% A 6 PHE HA 1.0 . 7.12 111 90 A 6 PHE HA A 7 CYS H 1.0 . 2.80 112 91 A 7 CYS H A 7 CYS HA 1.0 . 2.88 113 92 A 7 CYS H A 7 CYS HBx 1.0 . 3.12 114 93 A 7 CYS H A 7 CYS HBy 1.0 . 3.12 115 94 A 7 CYS H A 7 CYS HBx 1.0 . 2.68 116 94 A 7 CYS H A 7 CYS HBy 1.0 . 2.68 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.num_dimensions 2 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.folding 1 Hz 1H 12000 folded 2 Hz 1H 12000 folded stop_ save_