data_nef_c30448_6cxq 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 6CXQ stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly 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 ARG middle . . 3 A 3 PHE middle . . 4 A 4 LEU middle . . 5 A 5 ARG middle . . 6 A 6 HIS middle . . 7 A 7 NH2 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 1 HIS HA H 1 4.192 . A 1 HIS HBx H 1 3.183 . A 1 HIS HBy H 1 3.183 . A 1 HIS HD2 H 1 7.043 . A 1 HIS HE1 H 1 8.296 . A 1 HIS CA C 13 55.493 . A 1 HIS CB C 13 29.866 . A 1 HIS CD2 C 13 120.605 . A 1 HIS CE1 C 13 137.871 . A 2 ARG HA H 1 4.305 . A 2 ARG HBx H 1 1.679 . A 2 ARG HBy H 1 1.679 . A 2 ARG HDx H 1 3.118 . A 2 ARG HDy H 1 3.118 . A 2 ARG HE H 1 7.125 . A 2 ARG HGy H 1 1.526 . A 2 ARG HGx H 1 1.466 . A 2 ARG CA C 13 56.114 . A 2 ARG CB C 13 31.116 . A 2 ARG CD C 13 43.563 . A 2 ARG CG C 13 27.026 . A 3 PHE H H 1 8.594 . A 3 PHE HA H 1 4.602 . A 3 PHE HBy H 1 3.053 . A 3 PHE HBx H 1 2.970 . A 3 PHE HDx H 1 7.221 . A 3 PHE HDy H 1 7.221 . A 3 PHE HEx H 1 7.221 . A 3 PHE HEy H 1 7.221 . A 3 PHE HZ H 1 7.291 . A 3 PHE CA C 13 57.369 . A 3 PHE CB C 13 39.827 . A 3 PHE CDx C 13 131.792 . A 3 PHE CDy C 13 131.792 . A 3 PHE CEx C 13 129.894 . A 3 PHE CEy C 13 129.894 . A 3 PHE CZ C 13 131.323 . A 4 LEU H H 1 8.247 . A 4 LEU HA H 1 4.301 . A 4 LEU HBx H 1 1.446 . A 4 LEU HBy H 1 1.446 . A 4 LEU HDx% H 1 0.778 . A 4 LEU HDy% H 1 0.842 . A 4 LEU HG H 1 1.494 . A 4 LEU CA C 13 54.855 . A 4 LEU CB C 13 42.916 . A 4 LEU CDx C 13 23.615 . A 4 LEU CDy C 13 24.865 . A 4 LEU CG C 13 26.740 . A 5 ARG H H 1 8.044 . A 5 ARG HA H 1 4.193 . A 5 ARG HBy H 1 1.745 . A 5 ARG HBx H 1 1.701 . A 5 ARG HDx H 1 3.161 . A 5 ARG HDy H 1 3.161 . A 5 ARG HE H 1 7.179 . A 5 ARG HGy H 1 1.572 . A 5 ARG HGx H 1 1.551 . A 5 ARG CA C 13 55.493 . A 5 ARG CB C 13 30.989 . A 5 ARG CD C 13 43.221 . A 5 ARG CG C 13 27.366 . A 6 HIS H H 1 8.546 . A 6 HIS HA H 1 4.622 . A 6 HIS HBy H 1 3.206 . A 6 HIS HBx H 1 3.121 . A 6 HIS HD2 H 1 7.255 . A 6 HIS HE1 H 1 8.531 . A 6 HIS CA C 13 54.890 . A 6 HIS CB C 13 29.241 . A 6 HIS CD2 C 13 120.058 . A 6 HIS CE1 C 13 136.473 . 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 HD2 A 1 HIS HBx 1.0 1.8 3.4 2 1 A 1 HIS HD2 A 1 HIS HBy 1.0 1.8 3.4 3 2 A 3 PHE H A 2 ARG HBx 1.0 1.8 5.0 4 2 A 3 PHE H A 2 ARG HBy 1.0 1.8 5.0 5 3 A 4 LEU H A 2 ARG HBx 1.0 1.8 3.4 6 3 A 2 ARG HBy A 4 LEU H 1.0 1.8 3.4 7 4 A 4 LEU H A 4 LEU HBx 1.0 1.8 5.0 8 4 A 4 LEU H A 4 LEU HBy 1.0 1.8 5.0 9 5 A 4 LEU HA A 2 ARG HBx 1.0 1.8 3.4 10 5 A 2 ARG HBy A 4 LEU HA 1.0 1.8 3.4 11 6 A 4 LEU HDy% A 4 LEU HBx 1.0 1.8 2.8 12 6 A 4 LEU HBy A 4 LEU HDy% 1.0 1.8 2.8 13 7 A 4 LEU H A 5 ARG HDx 1.0 1.8 5.0 14 7 A 4 LEU H A 5 ARG HDy 1.0 1.8 5.0 15 8 A 3 PHE HA A 3 PHE HDx 1.0 1.8 2.8 16 8 A 3 PHE HA A 3 PHE HDy 1.0 1.8 2.8 17 9 A 5 ARG HE A 5 ARG HDx 1.0 1.8 3.4 18 9 A 5 ARG HDy A 5 ARG HE 1.0 1.8 3.4 19 10 A 2 ARG HE A 2 ARG HDx 1.0 1.8 5.0 20 10 A 2 ARG HE A 2 ARG HDy 1.0 1.8 5.0 21 11 A 5 ARG HA A 5 ARG HDx 1.0 1.8 3.4 22 11 A 5 ARG HDy A 5 ARG HA 1.0 1.8 3.4 23 12 A 4 LEU H A 2 ARG HBx 1.0 1.8 5.0 24 12 A 2 ARG HBy A 4 LEU H 1.0 1.8 5.0 25 13 A 4 LEU H A 4 LEU HBx 1.0 1.8 5.0 26 13 A 4 LEU H A 4 LEU HBy 1.0 1.8 5.0 27 14 A 3 PHE HBx A 3 PHE HDx 1.0 1.8 3.4 28 14 A 3 PHE HBx A 3 PHE HDy 1.0 1.8 3.4 29 15 A 3 PHE HBy A 3 PHE HDx 1.0 1.8 2.8 30 15 A 3 PHE HBy A 3 PHE HDy 1.0 1.8 2.8 31 16 A 5 ARG HE A 5 ARG HDx 1.0 1.8 5.0 32 16 A 5 ARG HDy A 5 ARG HE 1.0 1.8 5.0 33 17 A 2 ARG HE A 2 ARG HDx 1.0 1.8 5.0 34 17 A 2 ARG HE A 2 ARG HDy 1.0 1.8 5.0 35 18 A 1 HIS HD2 A 1 HIS HBx 1.0 1.8 5.0 36 18 A 1 HIS HD2 A 1 HIS HBy 1.0 1.8 5.0 37 19 A 4 LEU HA A 4 LEU HBx 1.0 1.8 3.4 38 19 A 4 LEU HBy A 4 LEU HA 1.0 1.8 3.4 39 20 A 2 ARG HBx A 2 ARG HDx 1.0 1.8 3.4 40 20 A 2 ARG HBy A 2 ARG HDx 1.0 1.8 3.4 41 20 A 2 ARG HDy A 2 ARG HBx 1.0 1.8 3.4 42 20 A 2 ARG HBy A 2 ARG HDy 1.0 1.8 3.4 43 21 A 6 HIS HBx A 4 LEU HBx 1.0 1.8 3.4 44 21 A 4 LEU HBy A 6 HIS HBx 1.0 1.8 3.4 45 22 A 1 HIS HA A 1 HIS HBx 1.0 1.8 2.8 46 22 A 1 HIS HBy A 1 HIS HA 1.0 1.8 2.8 47 23 A 2 ARG HA A 1 HIS HBx 1.0 1.8 5.0 48 23 A 1 HIS HBy A 2 ARG HA 1.0 1.8 5.0 49 24 A 5 ARG HA A 4 LEU HBx 1.0 1.8 5.0 50 24 A 4 LEU HBy A 5 ARG HA 1.0 1.8 5.0 51 25 A 2 ARG HGx A 2 ARG HDx 1.0 1.8 3.4 52 25 A 2 ARG HDy A 2 ARG HGx 1.0 1.8 3.4 53 26 A 2 ARG HBy A 2 ARG HDx 1.0 1.8 3.4 54 26 A 2 ARG HBx A 2 ARG HDx 1.0 1.8 3.4 55 26 A 2 ARG HDy A 2 ARG HBx 1.0 1.8 3.4 56 26 A 2 ARG HBy A 2 ARG HDy 1.0 1.8 3.4 57 27 A 3 PHE HZ A 3 PHE HE% 1.0 1.8 2.8 58 28 A 3 PHE HZ A 3 PHE HE% 1.0 1.8 2.8 59 29 A 4 LEU HA A 2 ARG HDx 1.0 1.8 3.4 60 29 A 4 LEU HA A 2 ARG HDy 1.0 1.8 3.4 61 30 A 4 LEU HDy% A 4 LEU HBx 1.0 1.8 2.8 62 30 A 4 LEU HBy A 4 LEU HDy% 1.0 1.8 2.8 63 31 A 4 LEU HDx% A 4 LEU HBx 1.0 1.8 2.8 64 31 A 4 LEU HBy A 4 LEU HDx% 1.0 1.8 2.8 65 32 A 5 ARG HBx A 5 ARG HDx 1.0 1.8 3.4 66 32 A 5 ARG HDy A 5 ARG HBx 1.0 1.8 3.4 67 33 A 5 ARG HBy A 5 ARG HDx 1.0 1.8 3.4 68 33 A 5 ARG HDy A 5 ARG HBy 1.0 1.8 3.4 69 34 A 2 ARG HGy A 2 ARG HDx 1.0 1.8 3.4 70 34 A 2 ARG HDy A 2 ARG HGy 1.0 1.8 3.4 71 35 A 1 HIS HA A 1 HIS HE1 1.0 1.8 5.0 72 36 A 1 HIS HA A 2 ARG HGy 1.0 1.8 5.0 73 37 A 1 HIS HA A 2 ARG HGy 1.0 1.8 3.4 74 38 A 2 ARG HDy A 2 ARG HGx 1.0 1.8 5.0 75 39 A 2 ARG HGy A 2 ARG HDx 1.0 1.8 2.8 76 40 A 3 PHE H A 2 ARG HA 1.0 1.8 2.8 77 41 A 3 PHE H A 2 ARG HA 1.0 1.8 3.4 78 42 A 3 PHE HA A 3 PHE HBx 1.0 1.8 2.8 79 43 A 3 PHE HA A 3 PHE HBx 1.0 1.8 5.0 80 44 A 3 PHE HA A 3 PHE HBy 1.0 1.8 2.8 81 45 A 3 PHE HBx A 3 PHE HBy 1.0 1.8 2.8 82 46 A 3 PHE HBx A 3 PHE HBy 1.0 1.8 2.8 83 47 A 3 PHE HBx A 3 PHE HDx 1.0 1.8 2.8 84 48 A 3 PHE HBy A 3 PHE HDx 1.0 1.8 2.8 85 49 A 3 PHE H A 3 PHE HA 1.0 1.8 5.0 86 50 A 3 PHE H A 3 PHE HBx 1.0 1.8 3.4 87 51 A 3 PHE H A 3 PHE HBx 1.0 1.8 5.0 88 52 A 3 PHE H A 3 PHE HBy 1.0 1.8 5.0 89 53 A 3 PHE H A 3 PHE HBy 1.0 1.8 5.0 90 54 A 4 LEU HA A 2 ARG HBx 1.0 1.8 2.8 91 55 A 4 LEU H A 2 ARG HGy 1.0 1.8 5.0 92 56 A 4 LEU HA A 3 PHE HA 1.0 1.8 5.0 93 57 A 3 PHE HDy A 4 LEU HBx 1.0 1.8 5.0 94 58 A 4 LEU H A 3 PHE HA 1.0 1.8 2.8 95 59 A 4 LEU H A 3 PHE HBx 1.0 1.8 5.0 96 60 A 4 LEU H A 3 PHE HBx 1.0 1.8 5.0 97 61 A 4 LEU H A 3 PHE HBy 1.0 1.8 5.0 98 62 A 4 LEU H A 3 PHE HBy 1.0 1.8 5.0 99 63 A 4 LEU HA A 4 LEU HDx% 1.0 1.8 5.0 100 64 A 4 LEU HA A 4 LEU HDx% 1.0 1.8 3.4 101 65 A 4 LEU HA A 4 LEU HDy% 1.0 1.8 5.0 102 66 A 4 LEU HA A 4 LEU HDy% 1.0 1.8 5.0 103 67 A 4 LEU HA A 4 LEU HG 1.0 1.8 2.8 104 68 A 4 LEU HDx% A 4 LEU HG 1.0 1.8 3.4 105 69 A 4 LEU HDx% A 4 LEU HG 1.0 1.8 2.8 106 70 A 4 LEU HDy% A 4 LEU HG 1.0 1.8 3.4 107 71 A 4 LEU H A 4 LEU HA 1.0 1.8 3.4 108 72 A 4 LEU H A 4 LEU HA 1.0 1.8 3.4 109 73 A 4 LEU H A 4 LEU HG 1.0 1.8 2.8 110 74 A 4 LEU H A 4 LEU HG 1.0 1.8 3.4 111 75 A 4 LEU HA A 5 ARG H 1.0 1.8 2.8 112 76 A 5 ARG HA A 5 ARG HBx 1.0 1.8 5.0 113 77 A 5 ARG HA A 5 ARG HBx 1.0 1.8 3.4 114 78 A 5 ARG HA A 5 ARG HBy 1.0 1.8 3.4 115 79 A 5 ARG HA A 5 ARG HBy 1.0 1.8 3.4 116 80 A 5 ARG HBx A 5 ARG HBy 1.0 1.8 2.8 117 81 A 5 ARG HBx A 5 ARG HBy 1.0 1.8 2.8 118 82 A 5 ARG HBx A 5 ARG HBy 1.0 1.8 3.4 119 83 A 5 ARG HBx A 5 ARG HBy 1.0 1.8 3.4 120 84 A 5 ARG HDy A 5 ARG HBx 1.0 1.8 2.8 121 85 A 5 ARG HBy A 5 ARG HDx 1.0 1.8 3.4 122 86 A 5 ARG HE A 5 ARG HBx 1.0 1.8 5.0 123 87 A 5 ARG HBy A 5 ARG HGx 1.0 1.8 3.4 124 88 A 5 ARG HDy A 5 ARG HGx 1.0 1.8 5.0 125 89 A 5 ARG HA A 5 ARG HGy 1.0 1.8 5.0 126 90 A 5 ARG HA A 5 ARG HGy 1.0 1.8 5.0 127 91 A 5 ARG HBy A 5 ARG HGy 1.0 1.8 2.8 128 92 A 5 ARG HBy A 5 ARG HGy 1.0 1.8 2.8 129 93 A 5 ARG HGy A 5 ARG HDx 1.0 1.8 2.8 130 94 A 5 ARG HA A 5 ARG H 1.0 1.8 3.4 131 95 A 5 ARG HA A 6 HIS HA 1.0 1.8 5.0 132 96 A 5 ARG HE A 6 HIS HA 1.0 1.8 5.0 133 97 A 5 ARG HA A 6 HIS H 1.0 1.8 3.4 134 98 A 5 ARG HA A 6 HIS H 1.0 1.8 5.0 135 99 A 6 HIS HBx A 6 HIS HA 1.0 1.8 2.8 136 100 A 6 HIS HBx A 6 HIS HA 1.0 1.8 5.0 137 101 A 6 HIS HA A 6 HIS HBy 1.0 1.8 3.4 138 102 A 6 HIS HA A 6 HIS HBy 1.0 1.8 5.0 139 103 A 6 HIS HBx A 6 HIS HBy 1.0 1.8 2.8 140 104 A 6 HIS HBx A 6 HIS HBy 1.0 1.8 2.8 141 105 A 6 HIS HBx A 6 HIS HD2 1.0 1.8 5.0 142 106 A 6 HIS HBx A 6 HIS HD2 1.0 1.8 5.0 143 107 A 6 HIS HBy A 6 HIS HD2 1.0 1.8 5.0 144 108 A 6 HIS HBy A 6 HIS HD2 1.0 1.8 5.0 145 109 A 6 HIS HA A 6 HIS H 1.0 1.8 5.0 146 110 A 6 HIS HBx A 6 HIS H 1.0 1.8 5.0 147 111 A 6 HIS HBx A 6 HIS H 1.0 1.8 5.0 148 112 A 6 HIS H A 6 HIS HBy 1.0 1.8 5.0 149 113 A 6 HIS H A 6 HIS HBy 1.0 1.8 5.0 stop_ save_