data_nef_c34319_6hvc 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 6HVB PDB 6HVC 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 2 CYS SG 1 7 CYS SG 1 4 TRP C 1 5 NMK N 1 5 NMK C 1 6 TYR 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 4 ASP start . . 2 A 5 CYS middle -HG . 3 A 6 PHE middle . . 4 A 7 TRP middle -OXT . 5 A 8 NMK middle -OXT . 6 A 9 TYR middle -H2 . 7 A 10 CYS middle -HG . 8 A 11 VAL end . . 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 4 ASP HA H 1 4.466 0.002 A 4 ASP HBx H 1 2.833 0.006 A 4 ASP HBy H 1 2.833 0.006 A 5 CYS H H 1 8.561 0.001 A 5 CYS HA H 1 5.581 0.005 A 5 CYS HBx H 1 2.896 0.004 A 5 CYS HBy H 1 2.983 0.005 A 6 PHE H H 1 9.172 0.000 A 6 PHE HA H 1 5.114 0.000 A 6 PHE HBx H 1 3.056 0.000 A 6 PHE HBy H 1 3.149 0.002 A 6 PHE HDx H 1 7.263 0.002 A 6 PHE HDy H 1 7.263 0.002 A 6 PHE HEx H 1 7.193 0.000 A 6 PHE HEy H 1 7.193 0.000 A 9 TYR H H 1 8.182 0.000 A 9 TYR HA H 1 4.788 0.000 A 9 TYR HBx H 1 2.919 0.002 A 9 TYR HBy H 1 3.071 0.002 A 9 TYR HDx H 1 7.135 0.002 A 9 TYR HDy H 1 7.135 0.002 A 9 TYR HEx H 1 6.685 0.001 A 9 TYR HEy H 1 6.685 0.001 A 10 E9M HN% H 1 2.914 0.000 A 10 E9M HA H 1 4.181 0.001 A 10 E9M HBx H 1 3.748 0.002 A 10 E9M HBy H 1 3.070 0.004 A 10 E9M HD1 H 1 7.337 0.000 A 10 E9M HE1 H 1 10.248 0.001 A 10 E9M HE3 H 1 7.603 0.001 A 10 E9M HZ2 H 1 7.570 0.003 A 10 E9M HZ3 H 1 7.192 0.001 A 10 CYS H H 1 8.411 0.000 A 11 LYS H H 1 6.274 0.003 A 11 LYS HA H 1 4.046 0.002 A 11 LYS HBx H 1 0.965 0.001 A 11 LYS HBy H 1 1.161 0.001 A 11 LYS HGx H 1 -0.249 0.000 A 11 LYS HGy H 1 0.039 0.002 A 11 LYS HDx H 1 1.029 0.000 A 11 LYS HDy H 1 1.029 0.000 A 11 LYS HEx H 1 2.419 0.004 A 11 LYS HEy H 1 2.511 0.004 A 11 LYS HZ1 H 1 7.249 0.005 A 11 LYS HZ2 H 1 7.249 0.005 A 11 LYS HZ3 H 1 7.249 0.005 A 11 VAL HB% H 1 2.273 0.000 A 11 VAL HG11 H 1 1.011 0.004 A 11 VAL HG12 H 1 1.011 0.004 A 11 VAL HG13 H 1 1.011 0.004 A 11 VAL HG21 H 1 1.011 0.004 A 11 VAL HG22 H 1 1.011 0.004 A 11 VAL HG23 H 1 1.011 0.004 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 4 ASP HA A 5 CYS H 1.0 . 2.71 2 2 A 5 CYS H A 5 CYS HBx 1.0 . 2.83 3 3 A 5 CYS H A 5 CYS HBy 1.0 . 2.83 4 4 A 5 CYS HA A 5 CYS HBx 1.0 . 2.83 5 5 A 5 CYS HA A 5 CYS HBy 1.0 . 2.83 6 6 A 5 CYS HA A 6 PHE H 1.0 . 2.68 7 7 A 5 CYS HA A 6 PHE HD% 1.0 . 7.62 8 8 A 5 CYS HA A 10 CYS HA 1.0 . 2.59 9 9 A 5 CYS HA A 11 VAL H 1.0 . 3.73 10 10 A 10 CYS HA A 5 CYS HBy 1.0 . 5.39 11 10 A 10 CYS HA A 5 CYS HBx 1.0 . 5.39 12 11 A 11 VAL H A 5 CYS HBy 1.0 . 6.38 13 11 A 11 VAL H A 5 CYS HBx 1.0 . 6.38 14 12 A 6 PHE H A 6 PHE HBx 1.0 . 4.14 15 13 A 6 PHE H A 6 PHE HBy 1.0 . 4.14 16 14 A 6 PHE H A 6 PHE HBx 1.0 . 3.60 17 14 A 6 PHE H A 6 PHE HBy 1.0 . 3.60 18 15 A 6 PHE H A 7 TRP HBx 1.0 . 6.38 19 15 A 6 PHE H A 7 TRP HBy 1.0 . 6.38 20 16 A 6 PHE H A 9 TYR H 1.0 . 3.30 21 17 A 6 PHE H A 10 CYS HA 1.0 . 3.67 22 18 A 6 PHE HA A 6 PHE HBx 1.0 . 2.96 23 19 A 6 PHE HBy A 6 PHE HA 1.0 . 2.96 24 20 A 6 PHE HA A 6 PHE HBx 1.0 . 2.73 25 20 A 6 PHE HBy A 6 PHE HA 1.0 . 2.73 26 21 A 6 PHE HA A 7 TRP H 1.0 . 2.90 27 22 A 6 PHE HD% A 7 TRP H 1.0 . 7.00 28 23 A 6 PHE HD% A 11 VAL HG11 1.0 . 9.74 29 23 A 6 PHE HD% A 11 VAL HG21 1.0 . 9.74 30 24 A 6 PHE HE% A 11 VAL HG11 1.0 . 9.71 31 24 A 11 VAL HG21 A 6 PHE HE% 1.0 . 9.71 32 25 A 7 TRP H A 7 TRP HBx 1.0 . 2.96 33 26 A 7 TRP HBy A 7 TRP H 1.0 . 2.96 34 27 A 7 TRP H A 7 TRP HBx 1.0 . 2.70 35 27 A 7 TRP HBy A 7 TRP H 1.0 . 2.70 36 28 A 7 TRP H A 7 TRP HD1 1.0 . 4.97 37 29 A 7 TRP HD1 A 7 TRP HA 1.0 . 4.85 38 30 A 7 TRP HA A 7 TRP HE3 1.0 . 3.55 39 31 A 9 TYR H A 7 TRP HA 1.0 . 3.39 40 32 A 7 TRP HD1 A 7 TRP HBx 1.0 . 3.83 41 33 A 7 TRP HE3 A 7 TRP HBx 1.0 . 3.79 42 34 A 7 TRP HBy A 7 TRP HD1 1.0 . 3.83 43 35 A 7 TRP HBy A 7 TRP HE3 1.0 . 3.79 44 36 A 9 TYR H A 9 TYR HBx 1.0 . 3.73 45 37 A 9 TYR H A 9 TYR HBy 1.0 . 3.73 46 38 A 9 TYR H A 9 TYR HBy 1.0 . 3.40 47 38 A 9 TYR H A 9 TYR HBx 1.0 . 3.40 48 39 A 9 TYR H A 9 TYR HE% 1.0 . 7.63 49 40 A 9 TYR H A 10 CYS H 1.0 . 4.01 50 41 A 9 TYR HBx A 9 TYR HA 1.0 . 3.08 51 42 A 9 TYR HA A 9 TYR HBy 1.0 . 3.08 52 43 A 10 CYS H A 9 TYR HA 1.0 . 2.96 53 44 A 9 TYR HD% A 11 VAL HG11 1.0 . 9.76 54 44 A 11 VAL HG21 A 9 TYR HD% 1.0 . 9.76 55 45 A 9 TYR HE% A 11 VAL HA 1.0 . 7.63 56 46 A 9 TYR HE% A 11 VAL HG11 1.0 . 9.75 57 46 A 11 VAL HG21 A 9 TYR HE% 1.0 . 9.75 58 47 A 10 CYS HA A 11 VAL H 1.0 . 2.77 59 48 A 10 CYS HA A 11 VAL HG11 1.0 . 7.62 60 48 A 10 CYS HA A 11 VAL HG21 1.0 . 7.62 61 49 A 11 VAL H A 11 VAL HB 1.0 . 3.86 62 50 A 11 VAL HA A 11 VAL HB 1.0 . 2.96 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 . . 14 . . . . 2 ppm . . 14 . . . . stop_ save_