data_nef_c30433_6cou 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 BMRB 30432 BMRB 30434 PDB 6COU 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 9 LEU C 1 10 DAS N 1 10 DAS C 1 11 PHE 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 1 ALA start . . 2 A 2 MET middle . . 3 A 3 ARG middle . . 4 A 4 ILE middle . . 5 A 5 SER middle . . 6 A 6 ARG middle . . 7 A 7 ILE middle . . 8 A 8 ILE middle . . 9 A 9 LEU middle -OXT . 10 A 10 DAS middle -H2,-OXT . 11 A 11 PHE middle -H2 . 12 A 12 LEU middle . . 13 A 13 PHE middle . . 14 A 14 LEU middle . . 15 A 15 ARG middle . . 16 A 16 LYS middle . . 17 A 17 LYS 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 2 MET HA H 1 4.410 0.00 A 2 MET HBx H 1 2.007 0.00 A 2 MET HGy H 1 2.561 0.00 A 2 MET HGx H 1 2.501 0.00 A 2 MET CA C 13 53.206 0.00 A 3 ARG H H 1 8.607 0.00 A 3 ARG HA H 1 4.388 0.01 A 3 ARG HBy H 1 1.954 0.00 A 3 ARG HBx H 1 1.790 0.00 A 3 ARG HDx H 1 3.191 0.00 A 3 ARG HGy H 1 1.696 0.00 A 3 ARG HGx H 1 1.597 0.00 A 3 ARG CA C 13 53.868 0.00 A 3 ARG CB C 13 27.742 0.00 A 3 ARG N N 15 123.389 0.00 A 4 ILE H H 1 8.876 0.00 A 4 ILE HA H 1 3.782 0.00 A 4 ILE HB H 1 1.945 0.00 A 4 ILE HG1y H 1 1.569 0.00 A 4 ILE HG1x H 1 1.251 0.00 A 4 ILE HG2% H 1 0.887 0.00 A 4 ILE CA C 13 61.105 0.00 A 4 ILE CB C 13 34.873 0.00 A 4 ILE N N 15 122.279 0.00 A 5 SER H H 1 8.535 0.00 A 5 SER HA H 1 3.879 0.00 A 5 SER HBx H 1 3.822 0.00 A 5 SER CA C 13 59.205 0.00 A 5 SER CB C 13 59.602 0.00 A 5 SER N N 15 115.515 0.00 A 6 ARG H H 1 7.260 0.00 A 6 ARG HA H 1 4.062 0.00 A 6 ARG HBy H 1 2.002 0.00 A 6 ARG HBx H 1 1.921 0.00 A 6 ARG HDx H 1 3.196 0.00 A 6 ARG HE H 1 7.651 0.00 A 6 ARG HGx H 1 1.699 0.00 A 6 ARG CA C 13 55.091 0.00 A 6 ARG CB C 13 27.105 0.00 A 7 ILE H H 1 7.716 0.00 A 7 ILE HA H 1 3.802 0.00 A 7 ILE HB H 1 1.989 0.00 A 7 ILE HD1% H 1 0.826 0.00 A 7 ILE HG1y H 1 1.674 0.00 A 7 ILE HG1x H 1 1.161 0.00 A 7 ILE HG2% H 1 0.865 0.00 A 7 ILE CA C 13 61.629 0.00 A 7 ILE CB C 13 35.362 0.00 A 7 ILE N N 15 120.159 0.00 A 8 ILE H H 1 7.832 0.00 A 8 ILE HA H 1 3.674 0.00 A 8 ILE HB H 1 1.853 0.00 A 8 ILE HD1% H 1 0.770 0.00 A 8 ILE HG1y H 1 1.751 0.00 A 8 ILE HG1x H 1 1.033 0.00 A 8 ILE HG2% H 1 0.864 0.00 A 8 ILE CA C 13 61.654 0.00 A 8 ILE CB C 13 35.383 0.00 A 8 ILE N N 15 118.339 0.00 A 9 LEU H H 1 8.076 0.00 A 9 LEU HA H 1 3.885 0.00 A 9 LEU HBy H 1 1.782 0.00 A 9 LEU HBx H 1 1.507 0.00 A 9 LEU HDx% H 1 0.862 0.00 A 9 LEU CA C 13 55.936 0.00 A 9 LEU CB C 13 38.830 0.00 A 9 LEU N N 15 118.855 0.00 A 10 ASP H H 1 8.417 0.00 A 10 ASP HA H 1 4.247 0.00 A 10 ASP HBy H 1 3.001 0.00 A 10 ASP HBx H 1 2.614 0.00 A 10 ASP CA C 13 51.979 0.00 A 10 ASP CB C 13 37.272 0.00 A 10 ASP N N 15 114.940 0.00 A 11 PHE H H 1 7.683 0.00 A 11 PHE HA H 1 4.269 0.01 A 11 PHE HBx H 1 3.198 0.00 A 11 PHE HEy H 1 7.187 0.00 A 11 PHE CA C 13 58.279 0.00 A 11 PHE CB C 13 40.765 0.00 A 11 PHE N N 15 118.807 0.00 A 12 LEU H H 1 8.077 0.00 A 12 LEU HA H 1 3.794 0.00 A 12 LEU HBy H 1 1.866 0.00 A 12 LEU HBx H 1 1.681 0.00 A 12 LEU HDx% H 1 0.860 0.00 A 12 LEU HDy% H 1 0.781 0.00 A 12 LEU HG H 1 1.103 0.00 A 12 LEU CA C 13 54.518 0.00 A 12 LEU N N 15 117.199 0.00 A 13 PHE H H 1 8.147 0.00 A 13 PHE HA H 1 4.488 0.00 A 13 PHE HBy H 1 3.238 0.00 A 13 PHE HBx H 1 3.018 0.00 A 13 PHE HEy H 1 7.342 0.00 A 13 PHE HZ H 1 7.244 0.00 A 13 PHE CA C 13 55.910 0.00 A 13 PHE CB C 13 36.464 0.00 A 13 PHE N N 15 115.161 0.00 A 14 LEU H H 1 7.805 0.00 A 14 LEU HA H 1 4.250 0.00 A 14 LEU HBy H 1 1.738 0.00 A 14 LEU HBx H 1 1.546 0.00 A 14 LEU HG H 1 1.638 0.00 A 14 LEU CA C 13 53.219 0.00 A 14 LEU CB C 13 39.444 0.00 A 14 LEU N N 15 120.454 0.00 A 15 ARG H H 1 7.874 0.00 A 15 ARG HA H 1 4.161 0.00 A 15 ARG HBy H 1 1.736 0.00 A 15 ARG HBx H 1 1.671 0.00 A 15 ARG HDx H 1 2.989 0.00 A 15 ARG HE H 1 7.419 0.00 A 15 ARG HGx H 1 1.494 0.00 A 15 ARG CA C 13 53.422 0.00 A 15 ARG CB C 13 27.679 0.00 A 15 ARG N N 15 120.733 0.00 A 16 LYS H H 1 8.048 0.00 A 16 LYS HA H 1 4.220 0.00 A 16 LYS HBy H 1 1.790 0.00 A 16 LYS HBx H 1 1.667 0.00 A 16 LYS HDx H 1 1.612 0.00 A 16 LYS HGx H 1 1.380 0.00 A 16 LYS CA C 13 53.612 0.00 A 16 LYS CB C 13 30.267 0.00 A 16 LYS N N 15 122.203 0.00 A 17 LYS H H 1 7.845 0.00 A 17 LYS HA H 1 4.055 0.00 A 17 LYS HBy H 1 1.737 0.00 A 17 LYS HBx H 1 1.645 0.00 A 17 LYS HDx H 1 1.601 0.00 A 17 LYS HGx H 1 1.334 0.00 A 17 LYS CA C 13 54.019 0.00 A 17 LYS CB C 13 30.924 0.00 A 17 LYS N N 15 128.004 0.00 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 2 MET HA A 2 MET HBx 1.0 1.6 3.4 2 1 A 2 MET HA A 2 MET HBy 1.0 1.6 3.4 3 2 A 2 MET HA A 2 MET HGy 1.0 1.9 3.9 4 2 A 2 MET HA A 2 MET HGx 1.0 1.9 3.9 5 3 A 2 MET HA A 2 MET HGy 1.0 1.8 3.8 6 3 A 2 MET HA A 2 MET HGx 1.0 1.8 3.8 7 4 A 2 MET HGx A 2 MET HBx 1.0 1.6 3.4 8 4 A 2 MET HGy A 2 MET HBx 1.0 1.6 3.4 9 4 A 2 MET HBy A 2 MET HGy 1.0 1.6 3.4 10 4 A 2 MET HBy A 2 MET HGx 1.0 1.6 3.4 11 5 A 2 MET HGx A 2 MET HBx 1.0 1.6 3.4 12 5 A 2 MET HGy A 2 MET HBx 1.0 1.6 3.4 13 5 A 2 MET HBy A 2 MET HGy 1.0 1.6 3.4 14 5 A 2 MET HBy A 2 MET HGx 1.0 1.6 3.4 15 6 A 2 MET HA A 3 ARG H 1.0 1.7 3.5 16 7 A 3 ARG H A 2 MET HBx 1.0 1.9 3.9 17 7 A 2 MET HBy A 3 ARG H 1.0 1.9 3.9 18 8 A 2 MET HGy A 3 ARG H 1.0 2.1 4.5 19 8 A 2 MET HGx A 3 ARG H 1.0 2.1 4.5 20 9 A 2 MET HGy A 3 ARG H 1.0 2.1 4.3 21 9 A 2 MET HGx A 3 ARG H 1.0 2.1 4.3 22 10 A 4 ILE H A 2 MET HBx 1.0 1.9 3.9 23 10 A 2 MET HBy A 4 ILE H 1.0 1.9 3.9 24 11 A 5 SER H A 2 MET HBx 1.0 1.9 3.9 25 11 A 2 MET HBy A 5 SER H 1.0 1.9 3.9 26 12 A 3 ARG HA A 3 ARG HBy 1.0 1.6 3.4 27 12 A 3 ARG HA A 3 ARG HBx 1.0 1.6 3.4 28 13 A 3 ARG HA A 3 ARG HBy 1.0 1.7 3.5 29 13 A 3 ARG HA A 3 ARG HBx 1.0 1.7 3.5 30 14 A 3 ARG HA A 3 ARG HDx 1.0 1.8 3.8 31 14 A 3 ARG HA A 3 ARG HDy 1.0 1.8 3.8 32 15 A 3 ARG HA A 3 ARG HGy 1.0 1.7 3.5 33 15 A 3 ARG HA A 3 ARG HGx 1.0 1.7 3.5 34 16 A 3 ARG HA A 3 ARG HGy 1.0 1.7 3.5 35 16 A 3 ARG HA A 3 ARG HGx 1.0 1.7 3.5 36 17 A 3 ARG H A 3 ARG HA 1.0 1.6 3.4 37 18 A 3 ARG HBy A 3 ARG HDx 1.0 1.6 3.2 38 18 A 3 ARG HBx A 3 ARG HDx 1.0 1.6 3.2 39 18 A 3 ARG HBy A 3 ARG HDy 1.0 1.6 3.2 40 18 A 3 ARG HBx A 3 ARG HDy 1.0 1.6 3.2 41 19 A 3 ARG H A 3 ARG HBy 1.0 1.7 3.5 42 19 A 3 ARG H A 3 ARG HBx 1.0 1.7 3.5 43 20 A 3 ARG HBy A 3 ARG HDx 1.0 1.6 3.4 44 20 A 3 ARG HBx A 3 ARG HDx 1.0 1.6 3.4 45 20 A 3 ARG HBy A 3 ARG HDy 1.0 1.6 3.4 46 20 A 3 ARG HBx A 3 ARG HDy 1.0 1.6 3.4 47 21 A 3 ARG HBy A 3 ARG HGy 1.0 1.8 3.8 48 21 A 3 ARG HBy A 3 ARG HGx 1.0 1.8 3.8 49 21 A 3 ARG HBx A 3 ARG HGy 1.0 1.8 3.8 50 21 A 3 ARG HBx A 3 ARG HGx 1.0 1.8 3.8 51 22 A 3 ARG H A 3 ARG HBy 1.0 1.9 3.9 52 22 A 3 ARG H A 3 ARG HBx 1.0 1.9 3.9 53 23 A 3 ARG HGy A 3 ARG HDx 1.0 1.6 3.4 54 23 A 3 ARG HGx A 3 ARG HDx 1.0 1.6 3.4 55 23 A 3 ARG HDy A 3 ARG HGy 1.0 1.6 3.4 56 23 A 3 ARG HDy A 3 ARG HGx 1.0 1.6 3.4 57 24 A 3 ARG H A 3 ARG HDx 1.0 2.1 4.5 58 24 A 3 ARG H A 3 ARG HDy 1.0 2.1 4.5 59 25 A 3 ARG H A 3 ARG HGy 1.0 1.9 3.9 60 25 A 3 ARG H A 3 ARG HGx 1.0 1.9 3.9 61 26 A 3 ARG H A 3 ARG HGy 1.0 2.0 4.0 62 26 A 3 ARG H A 3 ARG HGx 1.0 2.0 4.0 63 27 A 3 ARG HA A 4 ILE HA 1.0 1.9 4.1 64 28 A 3 ARG HA A 4 ILE HG1y 1.0 1.8 3.8 65 28 A 3 ARG HA A 4 ILE HG1x 1.0 1.8 3.8 66 29 A 3 ARG HA A 4 ILE HG2% 1.0 1.8 3.8 67 29 A 3 ARG HA A 4 ILE HD11 1.0 1.8 3.8 68 30 A 4 ILE H A 3 ARG HA 1.0 1.8 3.8 69 31 A 4 ILE H A 3 ARG HBy 1.0 1.9 3.9 70 31 A 4 ILE H A 3 ARG HBx 1.0 1.9 3.9 71 32 A 4 ILE H A 3 ARG HGy 1.0 1.9 3.9 72 32 A 4 ILE H A 3 ARG HGx 1.0 1.9 3.9 73 33 A 3 ARG H A 4 ILE HG2% 1.0 1.9 3.9 74 33 A 3 ARG H A 4 ILE HD11 1.0 1.9 3.9 75 34 A 3 ARG H A 4 ILE H 1.0 2.0 4.2 76 35 A 5 SER H A 3 ARG HA 1.0 2.0 4.0 77 36 A 5 SER H A 3 ARG HBy 1.0 1.9 4.6 78 36 A 5 SER H A 3 ARG HBx 1.0 1.9 4.6 79 37 A 5 SER H A 3 ARG HGy 1.0 1.9 4.1 80 37 A 5 SER H A 3 ARG HGx 1.0 1.9 4.1 81 38 A 3 ARG HA A 7 ILE HD1% 1.0 1.9 3.9 82 39 A 7 ILE HD1% A 3 ARG HDx 1.0 1.6 3.2 83 39 A 3 ARG HDy A 7 ILE HD1% 1.0 1.6 3.2 84 40 A 4 ILE HA A 4 ILE HB 1.0 1.6 3.2 85 41 A 4 ILE HA A 4 ILE HG1y 1.0 1.8 3.8 86 41 A 4 ILE HA A 4 ILE HG1x 1.0 1.8 3.8 87 42 A 4 ILE HA A 4 ILE HG1y 1.0 1.7 3.5 88 42 A 4 ILE HA A 4 ILE HG1x 1.0 1.7 3.5 89 43 A 4 ILE HA A 4 ILE HG2% 1.0 1.6 3.4 90 43 A 4 ILE HA A 4 ILE HD11 1.0 1.6 3.4 91 44 A 4 ILE H A 4 ILE HA 1.0 1.8 3.6 92 45 A 4 ILE HG1y A 4 ILE HB 1.0 1.6 3.4 93 45 A 4 ILE HG1x A 4 ILE HB 1.0 1.6 3.4 94 46 A 4 ILE HG1y A 4 ILE HB 1.0 1.7 3.5 95 46 A 4 ILE HG1x A 4 ILE HB 1.0 1.7 3.5 96 47 A 4 ILE HG2% A 4 ILE HB 1.0 1.6 3.2 97 47 A 4 ILE HD11 A 4 ILE HB 1.0 1.6 3.2 98 48 A 4 ILE H A 4 ILE HB 1.0 1.8 3.6 99 49 A 4 ILE H A 4 ILE HG1y 1.0 1.9 3.9 100 49 A 4 ILE H A 4 ILE HG1x 1.0 1.9 3.9 101 50 A 4 ILE HG1y A 4 ILE HD11 1.0 1.6 3.4 102 50 A 4 ILE HG1y A 4 ILE HG2% 1.0 1.6 3.4 103 50 A 4 ILE HG1x A 4 ILE HG2% 1.0 1.6 3.4 104 50 A 4 ILE HG1x A 4 ILE HD11 1.0 1.6 3.4 105 51 A 4 ILE H A 4 ILE HG1y 1.0 1.9 3.9 106 51 A 4 ILE H A 4 ILE HG1x 1.0 1.9 3.9 107 52 A 4 ILE H A 4 ILE HG2% 1.0 1.8 3.8 108 52 A 4 ILE H A 4 ILE HD11 1.0 1.8 3.8 109 53 A 5 SER H A 4 ILE HA 1.0 1.8 3.8 110 54 A 4 ILE HB A 5 SER HA 1.0 1.8 4.1 111 55 A 5 SER H A 4 ILE HB 1.0 1.7 3.5 112 56 A 5 SER H A 4 ILE HG1y 1.0 1.9 3.9 113 56 A 5 SER H A 4 ILE HG1x 1.0 1.9 3.9 114 57 A 5 SER H A 4 ILE HG1y 1.0 2.0 4.2 115 57 A 5 SER H A 4 ILE HG1x 1.0 2.0 4.2 116 58 A 5 SER H A 4 ILE HG2% 1.0 1.7 3.5 117 58 A 5 SER H A 4 ILE HD11 1.0 1.7 3.5 118 59 A 4 ILE H A 5 SER HA 1.0 2.1 4.5 119 60 A 4 ILE H A 5 SER H 1.0 1.8 3.8 120 61 A 4 ILE HA A 7 ILE HD1% 1.0 1.6 3.2 121 62 A 4 ILE HG1y A 7 ILE HD1% 1.0 1.8 3.6 122 62 A 4 ILE HG1x A 7 ILE HD1% 1.0 1.8 3.6 123 63 A 4 ILE H A 7 ILE HD1% 1.0 1.6 3.2 124 64 A 4 ILE HB A 8 ILE HD1% 1.0 1.9 3.9 125 65 A 4 ILE HG1y A 8 ILE HD1% 1.0 1.8 3.8 126 65 A 4 ILE HG1x A 8 ILE HD1% 1.0 1.8 3.8 127 66 A 5 SER HA A 5 SER HBx 1.0 1.6 3.2 128 66 A 5 SER HA A 5 SER HBy 1.0 1.6 3.2 129 67 A 5 SER H A 5 SER HA 1.0 1.8 3.6 130 68 A 5 SER H A 5 SER HBx 1.0 1.7 3.5 131 68 A 5 SER H A 5 SER HBy 1.0 1.7 3.5 132 69 A 5 SER HA A 6 ARG HBy 1.0 2.0 4.4 133 69 A 5 SER HA A 6 ARG HBx 1.0 2.0 4.4 134 70 A 5 SER HA A 6 ARG H 1.0 1.8 3.8 135 71 A 5 SER H A 6 ARG H 1.0 2.0 4.0 136 72 A 5 SER HA A 7 ILE HB 1.0 2.0 5.1 137 73 A 5 SER HA A 7 ILE H 1.0 2.1 4.3 138 74 A 5 SER H A 7 ILE HD1% 1.0 2.0 4.2 139 75 A 5 SER HA A 8 ILE HB 1.0 1.7 3.5 140 76 A 5 SER HA A 8 ILE HG1y 1.0 1.9 4.1 141 76 A 5 SER HA A 8 ILE HG1x 1.0 1.9 4.1 142 77 A 5 SER HA A 8 ILE H 1.0 1.9 3.9 143 78 A 5 SER H A 8 ILE HD1% 1.0 2.1 4.3 144 79 A 6 ARG HBy A 6 ARG HA 1.0 1.6 3.4 145 79 A 6 ARG HBx A 6 ARG HA 1.0 1.6 3.4 146 80 A 6 ARG HBy A 6 ARG HA 1.0 1.6 3.4 147 80 A 6 ARG HBx A 6 ARG HA 1.0 1.6 3.4 148 81 A 6 ARG HA A 6 ARG HDx 1.0 1.7 3.5 149 81 A 6 ARG HA A 6 ARG HDy 1.0 1.7 3.5 150 82 A 6 ARG HA A 6 ARG HGx 1.0 1.6 3.4 151 82 A 6 ARG HA A 6 ARG HGy 1.0 1.6 3.4 152 83 A 6 ARG H A 6 ARG HA 1.0 1.8 3.8 153 84 A 6 ARG HBy A 6 ARG HDx 1.0 2.0 4.0 154 84 A 6 ARG HBx A 6 ARG HDx 1.0 2.0 4.0 155 84 A 6 ARG HBy A 6 ARG HDy 1.0 2.0 4.0 156 84 A 6 ARG HBx A 6 ARG HDy 1.0 2.0 4.0 157 85 A 6 ARG HBy A 6 ARG HE 1.0 1.5 3.1 158 85 A 6 ARG HBx A 6 ARG HE 1.0 1.5 3.1 159 86 A 6 ARG HBx A 6 ARG HGx 1.0 1.6 3.4 160 86 A 6 ARG HBy A 6 ARG HGx 1.0 1.6 3.4 161 86 A 6 ARG HBy A 6 ARG HGy 1.0 1.6 3.4 162 86 A 6 ARG HBx A 6 ARG HGy 1.0 1.6 3.4 163 87 A 6 ARG HBy A 6 ARG H 1.0 1.7 3.5 164 87 A 6 ARG HBx A 6 ARG H 1.0 1.7 3.5 165 88 A 6 ARG HBy A 6 ARG HDx 1.0 2.0 4.2 166 88 A 6 ARG HBx A 6 ARG HDx 1.0 2.0 4.2 167 88 A 6 ARG HBy A 6 ARG HDy 1.0 2.0 4.2 168 88 A 6 ARG HBx A 6 ARG HDy 1.0 2.0 4.2 169 89 A 6 ARG HBx A 6 ARG HGx 1.0 1.6 3.4 170 89 A 6 ARG HBy A 6 ARG HGx 1.0 1.6 3.4 171 89 A 6 ARG HBy A 6 ARG HGy 1.0 1.6 3.4 172 89 A 6 ARG HBx A 6 ARG HGy 1.0 1.6 3.4 173 90 A 6 ARG HBy A 6 ARG H 1.0 1.7 3.5 174 90 A 6 ARG HBx A 6 ARG H 1.0 1.7 3.5 175 91 A 6 ARG HE A 6 ARG HDx 1.0 1.8 3.8 176 91 A 6 ARG HDy A 6 ARG HE 1.0 1.8 3.8 177 92 A 6 ARG HDy A 6 ARG HGx 1.0 1.6 3.2 178 92 A 6 ARG HDx A 6 ARG HGx 1.0 1.6 3.2 179 92 A 6 ARG HGy A 6 ARG HDx 1.0 1.6 3.2 180 92 A 6 ARG HDy A 6 ARG HGy 1.0 1.6 3.2 181 93 A 6 ARG H A 6 ARG HDx 1.0 2.0 4.0 182 93 A 6 ARG H A 6 ARG HDy 1.0 2.0 4.0 183 94 A 6 ARG HE A 6 ARG HGx 1.0 1.9 3.9 184 94 A 6 ARG HGy A 6 ARG HE 1.0 1.9 3.9 185 95 A 6 ARG H A 6 ARG HGx 1.0 1.7 3.7 186 95 A 6 ARG H A 6 ARG HGy 1.0 1.7 3.7 187 96 A 6 ARG HA A 7 ILE HA 1.0 2.1 4.3 188 97 A 7 ILE HD1% A 6 ARG HA 1.0 1.8 3.6 189 98 A 7 ILE H A 6 ARG HA 1.0 1.9 3.9 190 99 A 6 ARG HBy A 7 ILE H 1.0 1.9 3.9 191 99 A 6 ARG HBx A 7 ILE H 1.0 1.9 3.9 192 100 A 7 ILE HA A 6 ARG HDx 1.0 1.7 3.5 193 100 A 6 ARG HDy A 7 ILE HA 1.0 1.7 3.5 194 101 A 6 ARG H A 7 ILE HA 1.0 1.7 4.0 195 102 A 6 ARG H A 7 ILE H 1.0 1.9 3.9 196 103 A 8 ILE HD1% A 6 ARG HA 1.0 1.7 3.5 197 103 A 6 ARG HA A 8 ILE HG2% 1.0 1.7 3.5 198 104 A 8 ILE HA A 6 ARG HDx 1.0 1.8 6.0 199 104 A 6 ARG HDy A 8 ILE HA 1.0 1.8 6.0 200 105 A 6 ARG HDy A 8 ILE HG2% 1.0 1.6 4.7 201 105 A 8 ILE HG2% A 6 ARG HDx 1.0 1.6 4.7 202 105 A 8 ILE HD1% A 6 ARG HDx 1.0 1.6 4.7 203 105 A 8 ILE HD1% A 6 ARG HDy 1.0 1.6 4.7 204 106 A 6 ARG HA A 9 LEU HBy 1.0 1.6 3.4 205 106 A 6 ARG HA A 9 LEU HBx 1.0 1.6 3.4 206 107 A 6 ARG HA A 9 LEU HBy 1.0 1.4 3.0 207 107 A 6 ARG HA A 9 LEU HBx 1.0 1.4 3.0 208 108 A 6 ARG HA A 9 LEU H 1.0 1.9 3.9 209 109 A 9 LEU HA A 6 ARG HDx 1.0 2.1 4.7 210 109 A 6 ARG HDy A 9 LEU HA 1.0 2.1 4.7 211 110 A 9 LEU HBy A 6 ARG HDx 1.0 1.9 3.9 212 110 A 9 LEU HBx A 6 ARG HDx 1.0 1.9 3.9 213 110 A 6 ARG HDy A 9 LEU HBy 1.0 1.9 3.9 214 110 A 6 ARG HDy A 9 LEU HBx 1.0 1.9 3.9 215 111 A 7 ILE HB A 7 ILE HA 1.0 1.6 3.2 216 112 A 7 ILE HA A 7 ILE HG1y 1.0 1.6 3.2 217 112 A 7 ILE HA A 7 ILE HG1x 1.0 1.6 3.2 218 113 A 7 ILE HA A 7 ILE HG1y 1.0 1.6 3.4 219 113 A 7 ILE HA A 7 ILE HG1x 1.0 1.6 3.4 220 114 A 7 ILE H A 7 ILE HA 1.0 1.7 3.5 221 115 A 7 ILE HD1% A 7 ILE HB 1.0 1.6 3.4 222 116 A 7 ILE HD1% A 7 ILE HB 1.0 1.6 3.2 223 116 A 7 ILE HB A 7 ILE HG2% 1.0 1.6 3.2 224 117 A 7 ILE HB A 7 ILE H 1.0 1.6 3.4 225 118 A 7 ILE HD1% A 7 ILE H 1.0 1.8 3.6 226 119 A 7 ILE H A 7 ILE HG1y 1.0 1.6 3.4 227 119 A 7 ILE H A 7 ILE HG1x 1.0 1.6 3.4 228 120 A 7 ILE H A 7 ILE HG1y 1.0 1.7 3.5 229 120 A 7 ILE H A 7 ILE HG1x 1.0 1.7 3.5 230 121 A 7 ILE HD1% A 7 ILE H 1.0 1.7 3.5 231 121 A 7 ILE H A 7 ILE HG2% 1.0 1.7 3.5 232 122 A 8 ILE HD1% A 7 ILE HA 1.0 1.6 3.8 233 122 A 7 ILE HA A 8 ILE HG2% 1.0 1.6 3.8 234 123 A 8 ILE H A 7 ILE HA 1.0 1.8 3.8 235 124 A 7 ILE HB A 8 ILE HA 1.0 1.9 4.1 236 125 A 8 ILE HD1% A 7 ILE HB 1.0 1.8 3.8 237 126 A 7 ILE HB A 8 ILE H 1.0 1.8 3.6 238 127 A 7 ILE HD1% A 8 ILE HA 1.0 1.8 5.4 239 128 A 8 ILE H A 7 ILE HG1y 1.0 1.9 3.9 240 128 A 8 ILE H A 7 ILE HG1x 1.0 1.9 3.9 241 129 A 7 ILE H A 8 ILE HA 1.0 2.0 4.2 242 130 A 7 ILE H A 8 ILE HB 1.0 2.0 4.0 243 131 A 8 ILE HD1% A 7 ILE H 1.0 1.9 4.1 244 132 A 8 ILE HD1% A 7 ILE H 1.0 1.7 3.5 245 132 A 7 ILE H A 8 ILE HG2% 1.0 1.7 3.5 246 133 A 7 ILE H A 8 ILE H 1.0 1.8 3.6 247 134 A 7 ILE HA A 9 LEU HBy 1.0 2.4 5.0 248 134 A 7 ILE HA A 9 LEU HBx 1.0 2.4 5.0 249 135 A 9 LEU HBx A 7 ILE HG1y 1.0 1.6 4.9 250 135 A 9 LEU HBy A 7 ILE HG1y 1.0 1.6 4.9 251 135 A 9 LEU HBy A 7 ILE HG1x 1.0 1.6 4.9 252 135 A 9 LEU HBx A 7 ILE HG1x 1.0 1.6 4.9 253 136 A 7 ILE HG1y A 9 LEU HDx% 1.0 1.6 5.1 254 136 A 7 ILE HG1y A 9 LEU HD21 1.0 1.6 5.1 255 136 A 7 ILE HG1x A 9 LEU HD21 1.0 1.6 5.1 256 136 A 7 ILE HG1x A 9 LEU HDx% 1.0 1.6 5.1 257 137 A 7 ILE H A 9 LEU H 1.0 2.1 4.3 258 138 A 7 ILE HA A 11 PHE H 1.0 1.8 4.0 259 139 A 8 ILE HB A 8 ILE HA 1.0 1.7 3.5 260 140 A 8 ILE HD1% A 8 ILE HA 1.0 1.6 3.4 261 141 A 8 ILE HG1y A 8 ILE HA 1.0 1.6 3.4 262 141 A 8 ILE HG1x A 8 ILE HA 1.0 1.6 3.4 263 142 A 8 ILE HG1y A 8 ILE HA 1.0 1.6 3.4 264 142 A 8 ILE HG1x A 8 ILE HA 1.0 1.6 3.4 265 143 A 8 ILE HD1% A 8 ILE HA 1.0 1.6 3.4 266 143 A 8 ILE HG2% A 8 ILE HA 1.0 1.6 3.4 267 144 A 8 ILE H A 8 ILE HA 1.0 1.8 3.6 268 145 A 8 ILE HB A 8 ILE HG1y 1.0 1.7 3.5 269 145 A 8 ILE HB A 8 ILE HG1x 1.0 1.7 3.5 270 146 A 8 ILE HD1% A 8 ILE HB 1.0 1.6 3.2 271 146 A 8 ILE HB A 8 ILE HG2% 1.0 1.6 3.2 272 147 A 8 ILE HB A 8 ILE H 1.0 1.7 3.5 273 148 A 8 ILE HD1% A 8 ILE HG1y 1.0 1.6 3.4 274 148 A 8 ILE HD1% A 8 ILE HG1x 1.0 1.6 3.4 275 149 A 8 ILE HD1% A 8 ILE HG1y 1.0 1.6 3.4 276 149 A 8 ILE HD1% A 8 ILE HG1x 1.0 1.6 3.4 277 150 A 8 ILE HD1% A 8 ILE H 1.0 1.7 3.5 278 151 A 8 ILE HG1y A 8 ILE H 1.0 1.8 3.6 279 151 A 8 ILE HG1x A 8 ILE H 1.0 1.8 3.6 280 152 A 8 ILE HD1% A 8 ILE H 1.0 1.6 3.2 281 152 A 8 ILE H A 8 ILE HG2% 1.0 1.6 3.2 282 153 A 8 ILE HA A 9 LEU H 1.0 1.8 3.8 283 154 A 8 ILE HB A 9 LEU HD21 1.0 1.6 3.2 284 154 A 8 ILE HB A 9 LEU HDx% 1.0 1.6 3.2 285 155 A 8 ILE HG1y A 9 LEU H 1.0 2.0 4.0 286 155 A 8 ILE HG1x A 9 LEU H 1.0 2.0 4.0 287 156 A 8 ILE H A 9 LEU H 1.0 1.8 3.6 288 157 A 8 ILE HA A 11 PHE HA 1.0 2.0 4.7 289 158 A 8 ILE HA A 11 PHE HE% 1.0 1.9 3.9 290 159 A 8 ILE HA A 11 PHE H 1.0 1.9 3.9 291 160 A 8 ILE HD1% A 11 PHE HBy 1.0 1.7 3.5 292 160 A 8 ILE HD1% A 11 PHE HBx 1.0 1.7 3.5 293 160 A 8 ILE HG2% A 11 PHE HBy 1.0 1.7 3.5 294 160 A 8 ILE HG2% A 11 PHE HBx 1.0 1.7 3.5 295 161 A 8 ILE HA A 12 LEU HBy 1.0 1.9 4.9 296 161 A 8 ILE HA A 12 LEU HBx 1.0 1.9 4.9 297 162 A 8 ILE HA A 12 LEU H 1.0 1.8 3.8 298 163 A 8 ILE HG1y A 12 LEU H 1.0 2.0 5.6 299 163 A 8 ILE HG1x A 12 LEU H 1.0 2.0 5.6 300 164 A 9 LEU HBy A 9 LEU HA 1.0 1.6 3.4 301 164 A 9 LEU HBx A 9 LEU HA 1.0 1.6 3.4 302 165 A 9 LEU HBy A 9 LEU HA 1.0 1.6 3.4 303 165 A 9 LEU HBx A 9 LEU HA 1.0 1.6 3.4 304 166 A 9 LEU H A 9 LEU HA 1.0 1.7 3.5 305 167 A 9 LEU HBy A 9 LEU HD21 1.0 1.5 3.1 306 167 A 9 LEU HBy A 9 LEU HDx% 1.0 1.5 3.1 307 167 A 9 LEU HBx A 9 LEU HD21 1.0 1.5 3.1 308 167 A 9 LEU HBx A 9 LEU HDx% 1.0 1.5 3.1 309 168 A 9 LEU HBy A 9 LEU H 1.0 1.6 3.4 310 168 A 9 LEU HBx A 9 LEU H 1.0 1.6 3.4 311 169 A 9 LEU HBy A 9 LEU HD21 1.0 1.4 3.0 312 169 A 9 LEU HBy A 9 LEU HDx% 1.0 1.4 3.0 313 169 A 9 LEU HBx A 9 LEU HD21 1.0 1.4 3.0 314 169 A 9 LEU HBx A 9 LEU HDx% 1.0 1.4 3.0 315 170 A 9 LEU HBy A 9 LEU H 1.0 1.7 3.5 316 170 A 9 LEU HBx A 9 LEU H 1.0 1.7 3.5 317 171 A 9 LEU HA A 11 PHE HBx 1.0 1.8 4.3 318 171 A 9 LEU HA A 11 PHE HBy 1.0 1.8 4.3 319 172 A 9 LEU HA A 11 PHE HE% 1.0 2.1 4.3 320 173 A 9 LEU HA A 11 PHE H 1.0 2.0 4.2 321 174 A 9 LEU HBy A 11 PHE H 1.0 1.8 3.6 322 174 A 9 LEU HBx A 11 PHE H 1.0 1.8 3.6 323 175 A 9 LEU HD21 A 11 PHE HE% 1.0 1.8 3.9 324 175 A 9 LEU HDx% A 11 PHE HE% 1.0 1.8 3.9 325 176 A 9 LEU HD21 A 11 PHE H 1.0 1.8 3.8 326 176 A 9 LEU HDx% A 11 PHE H 1.0 1.8 3.8 327 177 A 9 LEU HA A 12 LEU HBy 1.0 1.6 3.4 328 177 A 9 LEU HA A 12 LEU HBx 1.0 1.6 3.4 329 178 A 9 LEU HA A 12 LEU HDy% 1.0 1.6 3.2 330 178 A 9 LEU HA A 12 LEU HDx% 1.0 1.6 3.2 331 179 A 9 LEU HA A 12 LEU HDy% 1.0 1.6 3.4 332 179 A 9 LEU HA A 12 LEU HDx% 1.0 1.6 3.4 333 180 A 9 LEU HA A 12 LEU HG 1.0 1.8 3.8 334 181 A 9 LEU HA A 12 LEU H 1.0 1.7 3.5 335 182 A 9 LEU HBy A 12 LEU HDx% 1.0 1.5 3.1 336 182 A 9 LEU HBy A 12 LEU HDy% 1.0 1.5 3.1 337 182 A 9 LEU HBx A 12 LEU HDy% 1.0 1.5 3.1 338 182 A 9 LEU HBx A 12 LEU HDx% 1.0 1.5 3.1 339 183 A 9 LEU HBy A 12 LEU H 1.0 1.6 3.7 340 183 A 9 LEU HBx A 12 LEU H 1.0 1.6 3.7 341 184 A 9 LEU HBy A 12 LEU HDx% 1.0 1.6 3.2 342 184 A 9 LEU HBy A 12 LEU HDy% 1.0 1.6 3.2 343 184 A 9 LEU HBx A 12 LEU HDy% 1.0 1.6 3.2 344 184 A 9 LEU HBx A 12 LEU HDx% 1.0 1.6 3.2 345 185 A 9 LEU HBy A 12 LEU HDx% 1.0 1.8 3.6 346 185 A 9 LEU HBy A 12 LEU HDy% 1.0 1.8 3.6 347 185 A 9 LEU HBx A 12 LEU HDy% 1.0 1.8 3.6 348 185 A 9 LEU HBx A 12 LEU HDx% 1.0 1.8 3.6 349 186 A 9 LEU HD21 A 12 LEU H 1.0 1.6 3.4 350 186 A 9 LEU HDx% A 12 LEU H 1.0 1.6 3.4 351 187 A 9 LEU HA A 13 PHE HE% 1.0 1.9 3.9 352 188 A 9 LEU HA A 13 PHE H 1.0 1.9 4.1 353 189 A 9 LEU HBy A 13 PHE HE% 1.0 1.9 3.9 354 189 A 9 LEU HBx A 13 PHE HE% 1.0 1.9 3.9 355 190 A 9 LEU HBy A 13 PHE HZ 1.0 1.8 3.8 356 190 A 9 LEU HBx A 13 PHE HZ 1.0 1.8 3.8 357 191 A 9 LEU HBy A 13 PHE HE% 1.0 2.0 4.0 358 191 A 9 LEU HBx A 13 PHE HE% 1.0 2.0 4.0 359 192 A 9 LEU HBy A 13 PHE HZ 1.0 1.9 4.1 360 192 A 9 LEU HBx A 13 PHE HZ 1.0 1.9 4.1 361 193 A 9 LEU HD21 A 13 PHE HA 1.0 2.1 5.4 362 193 A 9 LEU HDx% A 13 PHE HA 1.0 2.1 5.4 363 194 A 9 LEU H A 13 PHE HZ 1.0 2.1 5.0 364 195 A 11 PHE HA A 11 PHE HBx 1.0 1.6 3.2 365 195 A 11 PHE HA A 11 PHE HBy 1.0 1.6 3.2 366 196 A 11 PHE HA A 11 PHE HE% 1.0 1.7 4.6 367 197 A 11 PHE H A 11 PHE HA 1.0 1.7 3.5 368 198 A 11 PHE HE% A 11 PHE HBx 1.0 1.6 3.4 369 198 A 11 PHE HE% A 11 PHE HBy 1.0 1.6 3.4 370 199 A 11 PHE H A 11 PHE HBx 1.0 1.6 3.4 371 199 A 11 PHE H A 11 PHE HBy 1.0 1.6 3.4 372 200 A 11 PHE H A 11 PHE HE% 1.0 1.8 4.3 373 201 A 11 PHE HA A 12 LEU HDy% 1.0 2.0 4.7 374 201 A 11 PHE HA A 12 LEU HDx% 1.0 2.0 4.7 375 202 A 11 PHE HA A 12 LEU H 1.0 1.8 3.6 376 203 A 12 LEU HBx A 11 PHE HBx 1.0 1.8 4.3 377 203 A 12 LEU HBy A 11 PHE HBx 1.0 1.8 4.3 378 203 A 11 PHE HBy A 12 LEU HBy 1.0 1.8 4.3 379 203 A 11 PHE HBy A 12 LEU HBx 1.0 1.8 4.3 380 204 A 12 LEU HDy% A 11 PHE HBx 1.0 1.6 4.5 381 204 A 12 LEU HDx% A 11 PHE HBx 1.0 1.6 4.5 382 204 A 11 PHE HBy A 12 LEU HDy% 1.0 1.6 4.5 383 204 A 11 PHE HBy A 12 LEU HDx% 1.0 1.6 4.5 384 205 A 12 LEU H A 11 PHE HBx 1.0 1.6 3.4 385 205 A 11 PHE HBy A 12 LEU H 1.0 1.6 3.4 386 206 A 11 PHE HE% A 12 LEU HA 1.0 1.8 3.8 387 207 A 11 PHE HE% A 12 LEU HBy 1.0 1.8 3.8 388 207 A 11 PHE HE% A 12 LEU HBx 1.0 1.8 3.8 389 208 A 11 PHE HE% A 12 LEU HBy 1.0 1.8 3.8 390 208 A 11 PHE HE% A 12 LEU HBx 1.0 1.8 3.8 391 209 A 11 PHE HE% A 12 LEU HDy% 1.0 1.7 3.5 392 209 A 11 PHE HE% A 12 LEU HDx% 1.0 1.7 3.5 393 210 A 11 PHE HE% A 12 LEU HDy% 1.0 1.6 3.4 394 210 A 11 PHE HE% A 12 LEU HDx% 1.0 1.6 3.4 395 211 A 11 PHE HE% A 12 LEU HG 1.0 2.1 4.3 396 212 A 11 PHE HE% A 12 LEU H 1.0 1.8 3.8 397 213 A 11 PHE H A 12 LEU HBy 1.0 2.0 4.0 398 213 A 11 PHE H A 12 LEU HBx 1.0 2.0 4.0 399 214 A 11 PHE H A 12 LEU HBy 1.0 1.6 3.2 400 214 A 11 PHE H A 12 LEU HBx 1.0 1.6 3.2 401 215 A 11 PHE H A 12 LEU HDy% 1.0 1.8 3.6 402 215 A 11 PHE H A 12 LEU HDx% 1.0 1.8 3.6 403 216 A 11 PHE H A 12 LEU HDy% 1.0 2.0 4.0 404 216 A 11 PHE H A 12 LEU HDx% 1.0 2.0 4.0 405 217 A 11 PHE H A 12 LEU H 1.0 1.8 3.6 406 218 A 11 PHE H A 13 PHE H 1.0 1.9 4.1 407 219 A 11 PHE HE% A 14 LEU HBy 1.0 2.0 4.8 408 219 A 11 PHE HE% A 14 LEU HBx 1.0 2.0 4.8 409 220 A 11 PHE HE% A 15 ARG HA 1.0 1.6 3.4 410 221 A 11 PHE HE% A 15 ARG HDx 1.0 1.8 3.8 411 221 A 11 PHE HE% A 15 ARG HDy 1.0 1.8 3.8 412 222 A 11 PHE HE% A 15 ARG HGx 1.0 2.0 4.0 413 222 A 11 PHE HE% A 15 ARG HGy 1.0 2.0 4.0 414 223 A 12 LEU HBy A 12 LEU HA 1.0 1.8 3.8 415 223 A 12 LEU HBx A 12 LEU HA 1.0 1.8 3.8 416 224 A 12 LEU HBy A 12 LEU HA 1.0 1.6 3.2 417 224 A 12 LEU HBx A 12 LEU HA 1.0 1.6 3.2 418 225 A 12 LEU HDy% A 12 LEU HA 1.0 1.6 3.2 419 225 A 12 LEU HDx% A 12 LEU HA 1.0 1.6 3.2 420 226 A 12 LEU HG A 12 LEU HA 1.0 1.6 3.6 421 227 A 12 LEU H A 12 LEU HA 1.0 1.7 3.5 422 228 A 12 LEU HBy A 12 LEU HDx% 1.0 1.6 3.2 423 228 A 12 LEU HBy A 12 LEU HDy% 1.0 1.6 3.2 424 228 A 12 LEU HBx A 12 LEU HDy% 1.0 1.6 3.2 425 228 A 12 LEU HBx A 12 LEU HDx% 1.0 1.6 3.2 426 229 A 12 LEU HBy A 12 LEU HG 1.0 1.7 3.5 427 229 A 12 LEU HBx A 12 LEU HG 1.0 1.7 3.5 428 230 A 12 LEU HBy A 12 LEU H 1.0 1.6 3.4 429 230 A 12 LEU HBx A 12 LEU H 1.0 1.6 3.4 430 231 A 12 LEU HBy A 12 LEU HDx% 1.0 1.5 3.1 431 231 A 12 LEU HBy A 12 LEU HDy% 1.0 1.5 3.1 432 231 A 12 LEU HBx A 12 LEU HDy% 1.0 1.5 3.1 433 231 A 12 LEU HBx A 12 LEU HDx% 1.0 1.5 3.1 434 232 A 12 LEU HBy A 12 LEU HG 1.0 1.6 3.2 435 232 A 12 LEU HBx A 12 LEU HG 1.0 1.6 3.2 436 233 A 12 LEU HBy A 12 LEU H 1.0 1.6 3.4 437 233 A 12 LEU HBx A 12 LEU H 1.0 1.6 3.4 438 234 A 12 LEU H A 12 LEU HDy% 1.0 1.6 3.2 439 234 A 12 LEU H A 12 LEU HDx% 1.0 1.6 3.2 440 235 A 12 LEU HDy% A 12 LEU HG 1.0 1.6 3.2 441 235 A 12 LEU HDx% A 12 LEU HG 1.0 1.6 3.2 442 236 A 12 LEU H A 12 LEU HDy% 1.0 1.6 3.4 443 236 A 12 LEU H A 12 LEU HDx% 1.0 1.6 3.4 444 237 A 12 LEU H A 12 LEU HG 1.0 1.7 3.8 445 238 A 13 PHE HE% A 12 LEU HA 1.0 2.1 5.5 446 239 A 13 PHE H A 12 LEU HA 1.0 1.8 3.8 447 240 A 12 LEU HBy A 13 PHE HE% 1.0 2.1 4.3 448 240 A 12 LEU HBx A 13 PHE HE% 1.0 2.1 4.3 449 241 A 12 LEU HBy A 13 PHE H 1.0 2.0 4.0 450 241 A 12 LEU HBx A 13 PHE H 1.0 2.0 4.0 451 242 A 12 LEU HBy A 13 PHE HZ 1.0 2.1 4.6 452 242 A 12 LEU HBx A 13 PHE HZ 1.0 2.1 4.6 453 243 A 12 LEU HBy A 13 PHE HE% 1.0 2.0 4.2 454 243 A 12 LEU HBx A 13 PHE HE% 1.0 2.0 4.2 455 244 A 12 LEU HBy A 13 PHE H 1.0 1.7 3.5 456 244 A 12 LEU HBx A 13 PHE H 1.0 1.7 3.5 457 245 A 12 LEU HDy% A 13 PHE HE% 1.0 1.7 3.5 458 245 A 12 LEU HDx% A 13 PHE HE% 1.0 1.7 3.5 459 246 A 12 LEU HDy% A 13 PHE H 1.0 1.8 3.6 460 246 A 12 LEU HDx% A 13 PHE H 1.0 1.8 3.6 461 247 A 12 LEU HDy% A 13 PHE HZ 1.0 1.7 3.5 462 247 A 12 LEU HDx% A 13 PHE HZ 1.0 1.7 3.5 463 248 A 12 LEU HDy% A 13 PHE HA 1.0 2.1 4.5 464 248 A 12 LEU HDx% A 13 PHE HA 1.0 2.1 4.5 465 249 A 12 LEU HDy% A 13 PHE HE% 1.0 1.9 3.9 466 249 A 12 LEU HDx% A 13 PHE HE% 1.0 1.9 3.9 467 250 A 12 LEU HDy% A 13 PHE H 1.0 1.8 3.8 468 250 A 12 LEU HDx% A 13 PHE H 1.0 1.8 3.8 469 251 A 12 LEU HDy% A 13 PHE HZ 1.0 1.9 3.9 470 251 A 12 LEU HDx% A 13 PHE HZ 1.0 1.9 3.9 471 252 A 12 LEU HG A 13 PHE HE% 1.0 2.0 4.0 472 253 A 12 LEU HG A 13 PHE H 1.0 1.8 4.3 473 254 A 12 LEU HG A 13 PHE HZ 1.0 2.1 4.3 474 255 A 12 LEU H A 13 PHE HA 1.0 2.1 4.9 475 256 A 12 LEU H A 13 PHE HE% 1.0 2.0 4.2 476 257 A 12 LEU H A 13 PHE H 1.0 1.8 3.6 477 258 A 14 LEU HBy A 12 LEU HA 1.0 1.6 4.3 478 258 A 14 LEU HBx A 12 LEU HA 1.0 1.6 4.3 479 259 A 14 LEU H A 12 LEU HA 1.0 2.1 4.5 480 260 A 12 LEU HDy% A 14 LEU HA 1.0 1.5 6.1 481 260 A 12 LEU HDx% A 14 LEU HA 1.0 1.5 6.1 482 261 A 12 LEU HDy% A 14 LEU HG 1.0 1.6 5.5 483 261 A 12 LEU HDx% A 14 LEU HG 1.0 1.6 5.5 484 262 A 12 LEU HA A 15 ARG HDx 1.0 1.9 3.9 485 262 A 12 LEU HA A 15 ARG HDy 1.0 1.9 3.9 486 263 A 12 LEU HA A 15 ARG HGx 1.0 1.7 3.5 487 263 A 12 LEU HA A 15 ARG HGy 1.0 1.7 3.5 488 264 A 12 LEU HA A 15 ARG H 1.0 1.9 3.9 489 265 A 12 LEU HDy% A 15 ARG H 1.0 3.2 6.8 490 265 A 12 LEU HDx% A 15 ARG H 1.0 3.2 6.8 491 266 A 12 LEU HDx% A 15 ARG HDx 1.0 1.8 3.8 492 266 A 12 LEU HDy% A 15 ARG HDx 1.0 1.8 3.8 493 266 A 12 LEU HDy% A 15 ARG HDy 1.0 1.8 3.8 494 266 A 12 LEU HDx% A 15 ARG HDy 1.0 1.8 3.8 495 267 A 13 PHE HA A 13 PHE HBy 1.0 1.7 3.5 496 267 A 13 PHE HA A 13 PHE HBx 1.0 1.7 3.5 497 268 A 13 PHE HA A 13 PHE HBy 1.0 1.6 3.4 498 268 A 13 PHE HA A 13 PHE HBx 1.0 1.6 3.4 499 269 A 13 PHE HE% A 13 PHE HA 1.0 1.7 4.0 500 270 A 13 PHE H A 13 PHE HA 1.0 1.7 3.5 501 271 A 13 PHE HZ A 13 PHE HA 1.0 2.0 5.4 502 272 A 13 PHE HE% A 13 PHE HBy 1.0 1.7 3.5 503 272 A 13 PHE HE% A 13 PHE HBx 1.0 1.7 3.5 504 273 A 13 PHE H A 13 PHE HBy 1.0 1.7 3.5 505 273 A 13 PHE H A 13 PHE HBx 1.0 1.7 3.5 506 274 A 13 PHE HZ A 13 PHE HBy 1.0 1.9 4.6 507 274 A 13 PHE HZ A 13 PHE HBx 1.0 1.9 4.6 508 275 A 13 PHE HE% A 13 PHE HBy 1.0 1.7 3.5 509 275 A 13 PHE HE% A 13 PHE HBx 1.0 1.7 3.5 510 276 A 13 PHE H A 13 PHE HBy 1.0 1.7 3.5 511 276 A 13 PHE H A 13 PHE HBx 1.0 1.7 3.5 512 277 A 13 PHE HZ A 13 PHE HBy 1.0 2.0 4.6 513 277 A 13 PHE HZ A 13 PHE HBx 1.0 2.0 4.6 514 278 A 13 PHE HE% A 13 PHE H 1.0 1.8 3.8 515 279 A 13 PHE H A 13 PHE HZ 1.0 2.2 4.6 516 280 A 13 PHE HA A 14 LEU H 1.0 1.8 3.6 517 281 A 13 PHE HBy A 14 LEU HG 1.0 1.8 3.8 518 281 A 13 PHE HBx A 14 LEU HG 1.0 1.8 3.8 519 282 A 13 PHE HBy A 14 LEU H 1.0 1.8 3.8 520 282 A 13 PHE HBx A 14 LEU H 1.0 1.8 3.8 521 283 A 13 PHE HBy A 14 LEU H 1.0 1.8 3.6 522 283 A 13 PHE HBx A 14 LEU H 1.0 1.8 3.6 523 284 A 13 PHE HE% A 14 LEU HA 1.0 2.0 7.0 524 285 A 13 PHE HE% A 14 LEU HG 1.0 1.8 4.9 525 286 A 13 PHE HE% A 14 LEU H 1.0 2.1 5.1 526 287 A 13 PHE H A 14 LEU HA 1.0 1.8 4.5 527 288 A 13 PHE H A 14 LEU HBy 1.0 2.2 4.6 528 288 A 13 PHE H A 14 LEU HBx 1.0 2.2 4.6 529 289 A 13 PHE H A 14 LEU H 1.0 1.7 3.5 530 290 A 13 PHE H A 15 ARG H 1.0 2.1 4.3 531 291 A 13 PHE HA A 16 LYS H 1.0 2.1 4.5 532 292 A 14 LEU HBy A 14 LEU HA 1.0 1.6 3.4 533 292 A 14 LEU HBx A 14 LEU HA 1.0 1.6 3.4 534 293 A 14 LEU HBy A 14 LEU HA 1.0 1.6 3.4 535 293 A 14 LEU HBx A 14 LEU HA 1.0 1.6 3.4 536 294 A 14 LEU HG A 14 LEU HA 1.0 1.6 3.4 537 295 A 14 LEU H A 14 LEU HA 1.0 1.6 3.4 538 296 A 14 LEU HBy A 14 LEU H 1.0 1.7 3.5 539 296 A 14 LEU HBx A 14 LEU H 1.0 1.7 3.5 540 297 A 14 LEU HBy A 14 LEU HG 1.0 1.7 3.5 541 297 A 14 LEU HBx A 14 LEU HG 1.0 1.7 3.5 542 298 A 14 LEU HBy A 14 LEU H 1.0 1.7 3.5 543 298 A 14 LEU HBx A 14 LEU H 1.0 1.7 3.5 544 299 A 14 LEU HG A 14 LEU H 1.0 1.7 3.5 545 300 A 14 LEU HA A 15 ARG H 1.0 1.7 3.5 546 301 A 14 LEU HBy A 15 ARG HBy 1.0 1.6 3.9 547 301 A 14 LEU HBy A 15 ARG HBx 1.0 1.6 3.9 548 301 A 14 LEU HBx A 15 ARG HBy 1.0 1.6 3.9 549 301 A 14 LEU HBx A 15 ARG HBx 1.0 1.6 3.9 550 302 A 14 LEU HBy A 15 ARG H 1.0 1.9 4.1 551 302 A 14 LEU HBx A 15 ARG H 1.0 1.9 4.1 552 303 A 14 LEU H A 15 ARG HA 1.0 1.8 4.4 553 304 A 14 LEU H A 15 ARG HGx 1.0 1.8 3.6 554 304 A 14 LEU H A 15 ARG HGy 1.0 1.8 3.6 555 305 A 14 LEU H A 15 ARG H 1.0 1.8 3.6 556 306 A 14 LEU H A 17 LYS HBy 1.0 1.6 3.6 557 306 A 14 LEU H A 17 LYS HBx 1.0 1.6 3.6 558 307 A 15 ARG HA A 15 ARG HBy 1.0 1.6 3.4 559 307 A 15 ARG HA A 15 ARG HBx 1.0 1.6 3.4 560 308 A 15 ARG HA A 15 ARG HBy 1.0 1.6 3.4 561 308 A 15 ARG HA A 15 ARG HBx 1.0 1.6 3.4 562 309 A 15 ARG HA A 15 ARG HDx 1.0 1.7 3.7 563 309 A 15 ARG HA A 15 ARG HDy 1.0 1.7 3.7 564 310 A 15 ARG HA A 15 ARG HGx 1.0 1.7 3.5 565 310 A 15 ARG HA A 15 ARG HGy 1.0 1.7 3.5 566 311 A 15 ARG HA A 15 ARG H 1.0 1.7 3.5 567 312 A 15 ARG HBy A 15 ARG HDx 1.0 1.7 3.5 568 312 A 15 ARG HBx A 15 ARG HDx 1.0 1.7 3.5 569 312 A 15 ARG HDy A 15 ARG HBy 1.0 1.7 3.5 570 312 A 15 ARG HDy A 15 ARG HBx 1.0 1.7 3.5 571 313 A 15 ARG H A 15 ARG HBy 1.0 1.5 3.1 572 313 A 15 ARG H A 15 ARG HBx 1.0 1.5 3.1 573 314 A 15 ARG HBy A 15 ARG HDx 1.0 1.6 3.4 574 314 A 15 ARG HBx A 15 ARG HDx 1.0 1.6 3.4 575 314 A 15 ARG HDy A 15 ARG HBy 1.0 1.6 3.4 576 314 A 15 ARG HDy A 15 ARG HBx 1.0 1.6 3.4 577 315 A 15 ARG H A 15 ARG HBy 1.0 1.8 3.6 578 315 A 15 ARG H A 15 ARG HBx 1.0 1.8 3.6 579 316 A 15 ARG HE A 15 ARG HDx 1.0 1.9 3.9 580 316 A 15 ARG HDy A 15 ARG HE 1.0 1.9 3.9 581 317 A 15 ARG HDx A 15 ARG HGx 1.0 1.6 3.2 582 317 A 15 ARG HDy A 15 ARG HGx 1.0 1.6 3.2 583 317 A 15 ARG HGy A 15 ARG HDx 1.0 1.6 3.2 584 317 A 15 ARG HDy A 15 ARG HGy 1.0 1.6 3.2 585 318 A 15 ARG H A 15 ARG HDx 1.0 1.9 3.9 586 318 A 15 ARG HDy A 15 ARG H 1.0 1.9 3.9 587 319 A 15 ARG HE A 15 ARG HGx 1.0 2.0 4.2 588 319 A 15 ARG HGy A 15 ARG HE 1.0 2.0 4.2 589 320 A 15 ARG H A 15 ARG HGx 1.0 1.7 3.5 590 320 A 15 ARG HGy A 15 ARG H 1.0 1.7 3.5 591 321 A 15 ARG HA A 16 LYS HBy 1.0 1.6 3.8 592 321 A 15 ARG HA A 16 LYS HBx 1.0 1.6 3.8 593 322 A 15 ARG HA A 16 LYS HGx 1.0 2.0 4.2 594 322 A 15 ARG HA A 16 LYS HGy 1.0 2.0 4.2 595 323 A 15 ARG HA A 16 LYS H 1.0 1.7 3.5 596 324 A 15 ARG HBy A 16 LYS HBy 1.0 1.5 3.1 597 324 A 15 ARG HBy A 16 LYS HBx 1.0 1.5 3.1 598 324 A 15 ARG HBx A 16 LYS HBy 1.0 1.5 3.1 599 324 A 15 ARG HBx A 16 LYS HBx 1.0 1.5 3.1 600 325 A 15 ARG HBy A 16 LYS HGx 1.0 1.5 3.1 601 325 A 15 ARG HBx A 16 LYS HGx 1.0 1.5 3.1 602 325 A 15 ARG HBy A 16 LYS HGy 1.0 1.5 3.1 603 325 A 15 ARG HBx A 16 LYS HGy 1.0 1.5 3.1 604 326 A 16 LYS H A 15 ARG HDx 1.0 2.1 4.3 605 326 A 15 ARG HDy A 16 LYS H 1.0 2.1 4.3 606 327 A 16 LYS H A 15 ARG HGx 1.0 1.8 3.8 607 327 A 15 ARG HGy A 16 LYS H 1.0 1.8 3.8 608 328 A 15 ARG H A 16 LYS HBy 1.0 1.7 4.7 609 328 A 15 ARG H A 16 LYS HBx 1.0 1.7 4.7 610 329 A 15 ARG H A 16 LYS H 1.0 1.8 3.8 611 330 A 17 LYS HBx A 15 ARG HDx 1.0 1.7 3.5 612 330 A 15 ARG HDy A 17 LYS HBy 1.0 1.7 3.5 613 330 A 15 ARG HDy A 17 LYS HBx 1.0 1.7 3.5 614 330 A 17 LYS HBy A 15 ARG HDx 1.0 1.7 3.5 615 331 A 15 ARG H A 17 LYS HBy 1.0 1.7 3.5 616 331 A 15 ARG H A 17 LYS HBx 1.0 1.7 3.5 617 332 A 16 LYS HBy A 16 LYS HA 1.0 1.6 3.4 618 332 A 16 LYS HBx A 16 LYS HA 1.0 1.6 3.4 619 333 A 16 LYS HBy A 16 LYS HA 1.0 1.6 3.4 620 333 A 16 LYS HBx A 16 LYS HA 1.0 1.6 3.4 621 334 A 16 LYS HA A 16 LYS HDx 1.0 1.8 3.6 622 334 A 16 LYS HA A 16 LYS HDy 1.0 1.8 3.6 623 335 A 16 LYS HA A 16 LYS HGx 1.0 1.7 3.5 624 335 A 16 LYS HGy A 16 LYS HA 1.0 1.7 3.5 625 336 A 16 LYS H A 16 LYS HA 1.0 1.8 3.6 626 337 A 16 LYS H A 16 LYS HBy 1.0 1.7 3.5 627 337 A 16 LYS H A 16 LYS HBx 1.0 1.7 3.5 628 338 A 16 LYS H A 16 LYS HBy 1.0 1.6 3.4 629 338 A 16 LYS H A 16 LYS HBx 1.0 1.6 3.4 630 339 A 16 LYS HDx A 16 LYS HGx 1.0 1.7 3.5 631 339 A 16 LYS HDy A 16 LYS HGx 1.0 1.7 3.5 632 339 A 16 LYS HGy A 16 LYS HDx 1.0 1.7 3.5 633 339 A 16 LYS HGy A 16 LYS HDy 1.0 1.7 3.5 634 340 A 16 LYS H A 16 LYS HGx 1.0 1.8 3.8 635 340 A 16 LYS H A 16 LYS HGy 1.0 1.8 3.8 636 341 A 16 LYS HA A 17 LYS H 1.0 1.6 3.4 637 342 A 16 LYS HBy A 17 LYS H 1.0 1.8 3.6 638 342 A 16 LYS HBx A 17 LYS H 1.0 1.8 3.6 639 343 A 16 LYS HBy A 17 LYS HGx 1.0 2.1 4.3 640 343 A 16 LYS HBx A 17 LYS HGx 1.0 2.1 4.3 641 343 A 16 LYS HBy A 17 LYS HGy 1.0 2.1 4.3 642 343 A 16 LYS HBx A 17 LYS HGy 1.0 2.1 4.3 643 344 A 16 LYS HDx A 17 LYS HGx 1.0 1.7 3.5 644 344 A 16 LYS HDy A 17 LYS HGx 1.0 1.7 3.5 645 344 A 17 LYS HGy A 16 LYS HDx 1.0 1.7 3.5 646 344 A 16 LYS HDy A 17 LYS HGy 1.0 1.7 3.5 647 345 A 17 LYS H A 16 LYS HGx 1.0 2.0 4.0 648 345 A 16 LYS HGy A 17 LYS H 1.0 2.0 4.0 649 346 A 16 LYS H A 17 LYS HBy 1.0 1.7 3.5 650 346 A 16 LYS H A 17 LYS HBx 1.0 1.7 3.5 651 347 A 16 LYS H A 17 LYS H 1.0 1.9 3.9 652 348 A 17 LYS HBy A 17 LYS HA 1.0 1.7 3.5 653 348 A 17 LYS HBx A 17 LYS HA 1.0 1.7 3.5 654 349 A 17 LYS HBy A 17 LYS HA 1.0 1.7 3.5 655 349 A 17 LYS HBx A 17 LYS HA 1.0 1.7 3.5 656 350 A 17 LYS HA A 17 LYS HDx 1.0 1.9 3.9 657 350 A 17 LYS HA A 17 LYS HDy 1.0 1.9 3.9 658 351 A 17 LYS HA A 17 LYS HGx 1.0 1.9 3.9 659 351 A 17 LYS HGy A 17 LYS HA 1.0 1.9 3.9 660 352 A 17 LYS H A 17 LYS HA 1.0 1.7 3.5 661 353 A 17 LYS HBy A 17 LYS H 1.0 1.7 3.5 662 353 A 17 LYS HBx A 17 LYS H 1.0 1.7 3.5 663 354 A 17 LYS HBy A 17 LYS H 1.0 1.6 3.4 664 354 A 17 LYS HBx A 17 LYS H 1.0 1.6 3.4 665 355 A 17 LYS H A 17 LYS HGx 1.0 1.9 3.9 666 355 A 17 LYS H A 17 LYS HGy 1.0 1.9 3.9 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _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 9 LEU N A 9 LEU CA A 9 LEU CB A 9 LEU CG 1.0 -90.0 -30.0 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 . . 9.0 . . . . 2 ppm . . 10.0 . . . . stop_ save_