data_nef_2mw6 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 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 GLY start . false 2 A 2 ILE middle . . 3 A 3 GLY middle . false 4 A 4 ALA middle . . 5 A 5 VAL middle . . 6 A 6 LEU middle . . 7 A 7 LYS middle . . 8 A 8 VAL middle . . 9 A 9 LEU middle . . 10 A 10 THR middle . . 11 A 11 THR middle . . 12 A 12 GLY middle . false 13 A 13 LEU middle . . 14 A 14 PRO middle . false 15 A 15 ALA middle . . 16 A 16 LEU middle . . 17 A 17 ILE middle . . 18 A 18 SER middle . . 19 A 19 TRP middle . . 20 A 20 ILE middle . . 21 A 21 LYS middle . . 22 A 22 ARG middle . . 23 A 23 LYS middle . . 24 A 24 ARG middle . . 25 A 25 GLN middle . . 26 A 26 GLN middle -OXT . 27 A 27 NH2 end . . 28 A 101 3UQ . . . stop_ 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 A 26 GLN C A 27 NH2 N stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_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 GLY HAx H 1 3.893 . A 1 GLY HAy H 1 4.306 . A 1 GLY CA C 13 40.53 . A 2 ILE H H 1 9.067 . A 2 ILE HA H 1 4.042 . A 2 ILE HB H 1 1.893 . A 2 ILE HG1x H 1 1.371 . A 2 ILE HG1y H 1 1.604 . A 2 ILE HG2% H 1 0.995 . A 2 ILE HD1% H 1 1.024 . A 2 ILE CA C 13 60.43 . A 2 ILE CB C 13 36.14 . A 3 GLY H H 1 8.961 . A 3 GLY HAx H 1 3.768 . A 3 GLY HAy H 1 3.866 . A 4 ALA H H 1 7.928 . A 4 ALA HA H 1 4.080 . A 4 ALA HB% H 1 1.546 . A 4 ALA CA C 13 52.65 . A 5 VAL H H 1 7.493 . A 5 VAL HA H 1 3.579 . A 5 VAL HB H 1 2.317 . A 5 VAL HGx% H 1 1.101 . A 5 VAL HGy% H 1 0.983 . A 5 VAL CA C 13 63.91 . A 6 LEU H H 1 8.26 . A 6 LEU HA H 1 4.09 . A 7 LYS H H 1 8.26 . A 7 LYS HA H 1 4.09 . A 8 VAL H H 1 8.153 . A 8 VAL HA H 1 3.699 . A 8 VAL HB H 1 2.352 . A 8 VAL HGx% H 1 1.151 . A 8 VAL HGy% H 1 1.010 . A 8 VAL CA C 13 64.40 . A 9 LEU H H 1 8.324 . A 9 LEU HA H 1 4.157 . A 9 LEU HBx H 1 2.019 . A 9 LEU HBy H 1 2.019 . A 9 LEU HG H 1 1.988 . A 9 LEU HDx% H 1 0.916 . A 9 LEU HDy% H 1 0.916 . A 10 THR H H 1 8.132 . A 10 THR HA H 1 4.150 . A 10 THR HB H 1 4.337 . A 10 THR HG1 H 1 1.323 . A 10 THR CA C 13 62.65 . A 10 THR CB C 13 66.90 . A 11 THR H H 1 7.869 . A 11 THR HA H 1 4.313 . A 11 THR HB H 1 4.313 . A 11 THR HG1 H 1 1.313 . A 11 THR CA C 13 61.73 . A 11 THR CB C 13 67.41 . A 12 GLY H H 1 8.188 . A 12 GLY HAy H 1 4.120 . A 12 GLY HAx H 1 3.958 . A 12 GLY CA C 13 43.24 . A 13 LEU H H 1 8.321 . A 13 LEU HA H 1 4.388 . A 13 LEU HBy H 1 1.989 . A 13 LEU HBx H 1 1.921 . A 13 LEU HG H 1 1.815 . A 13 LEU HDx% H 1 1.060 . A 13 LEU HDy% H 1 0.994 . A 13 LEU CA C 13 56.76 . A 14 PRO HA H 1 4.240 . A 14 PRO HBy H 1 2.357 . A 14 PRO HBx H 1 1.962 . A 14 PRO HGy H 1 2.248 . A 14 PRO HGx H 1 1.962 . A 14 PRO HDx H 1 3.796 . A 14 PRO HDy H 1 3.796 . A 14 PRO CA C 13 64.11 . A 14 PRO CD C 13 47.31 . A 15 ALA H H 1 7.554 . A 15 ALA HA H 1 4.189 . A 15 ALA HB% H 1 1.579 . A 16 LEU H H 1 8.166 . A 16 LEU HA H 1 4.235 . A 16 LEU HBy H 1 2.085 . A 16 LEU HBx H 1 1.780 . A 16 LEU HG H 1 1.780 . A 16 LEU HDx% H 1 0.961 . A 16 LEU HDy% H 1 0.961 . A 16 LEU CA C 13 55.95 . A 17 ILE H H 1 8.611 . A 17 ILE HA H 1 3.728 . A 17 ILE HB H 1 2.078 . A 17 ILE HG1y H 1 1.783 . A 17 ILE HG1x H 1 1.307 . A 17 ILE HG2% H 1 0.897 . A 17 ILE HD1% H 1 0.979 . A 17 ILE CA C 13 62.46 . A 18 SER H H 1 8.395 . A 18 SER HA H 1 4.123 . A 18 SER HBx H 1 4.053 . A 18 SER HBy H 1 4.053 . A 18 SER CA C 13 54.95 . A 18 SER CB C 13 55.83 . A 19 TRP H H 1 8.436 . A 19 TRP HA H 1 4.148 . A 19 TRP HBy H 1 3.581 . A 19 TRP HBx H 1 3.446 . A 19 TRP HD1 H 1 7.628 . A 19 TRP HE1 H 1 8.593 . A 19 TRP HE3 H 1 7.044 . A 19 TRP HZ2 H 1 6.845 . A 19 TRP HZ3 H 1 5.959 . A 19 TRP HH2 H 1 5.865 . A 19 TRP CA C 13 58.82 . A 20 ILE H H 1 8.564 . A 20 ILE HA H 1 3.540 . A 20 ILE HB H 1 2.112 . A 20 ILE HG1y H 1 2.141 . A 20 ILE HG1x H 1 1.209 . A 20 ILE HG2% H 1 0.964 . A 20 ILE CA C 13 63.30 . A 21 LYS H H 1 8.594 . A 21 LYS HA H 1 3.890 . A 21 LYS HBx H 1 1.929 . A 21 LYS HBy H 1 1.995 . A 21 LYS HGx H 1 1.434 . A 21 LYS HGy H 1 1.434 . A 21 LYS HDx H 1 1.671 . A 21 LYS HDy H 1 1.671 . A 21 LYS HEx H 1 2.891 . A 21 LYS HEy H 1 2.891 . A 21 LYS CA C 13 57.90 . A 22 ARG H H 1 8.26 . A 22 ARG HA H 1 4.091 . A 22 ARG HBx H 1 1.977 . A 22 ARG HBy H 1 1.977 . A 22 ARG HDx H 1 3.188 . A 22 ARG HDy H 1 3.188 . A 22 ARG HE H 1 7.364 . A 23 LYS H H 1 8.325 . A 23 LYS HA H 1 4.15 . A 24 ARG H H 1 8.222 . A 24 ARG HA H 1 4.094 . A 24 ARG HBx H 1 1.984 . A 24 ARG HBy H 1 1.984 . A 24 ARG HDx H 1 3.139 . A 24 ARG HDy H 1 3.139 . A 24 ARG HE H 1 7.536 . A 25 GLN H H 1 7.986 . A 25 GLN HA H 1 4.120 . A 25 GLN HBy H 1 2.332 . A 25 GLN HBx H 1 2.301 . A 25 GLN HGy H 1 2.611 . A 25 GLN HGx H 1 2.168 . A 26 GLN H H 1 7.777 . A 26 GLN HA H 1 4.199 . A 26 GLN HBx H 1 2.178 . A 26 GLN HBy H 1 2.178 . A 26 GLN HGy H 1 2.564 . A 26 GLN HGx H 1 2.551 . A 26 GLN CA C 13 53.77 . stop_ save_ save_XPLOR-NIH/CNS_distance_restraints_1 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode XPLOR-NIH/CNS_distance_restraints_1 _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.restraint_combination_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.target_value _nef_distance_restraint.target_value_uncertainty _nef_distance_restraint.lower_linear_limit _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit _nef_distance_restraint.upper_linear_limit 1 1 . A 2 ILE H A 3 GLY H 1.0 3.3 . . 1.5 5.0 . 2 2 . A 2 ILE H A 4 ALA H 1.0 6.5 . . 1.5 10.5 . 3 3 . A 3 GLY H A 4 ALA H 1.0 3.3 . . 1.5 5.0 . 4 4 . A 3 GLY H A 5 VAL H 1.0 6.5 . . 1.5 10.5 . 5 5 . A 3 GLY H A 6 LEU H 1.0 6.5 . . 1.5 10.5 . 6 6 . A 4 ALA H A 5 VAL H 1.0 3.3 . . 1.5 5.0 . 7 7 . A 5 VAL H A 6 LEU H 1.0 3.3 . . 1.5 5.0 . 8 8 . A 5 VAL H A 8 VAL H 1.0 6.5 . . 1.5 10.5 . 9 9 . A 5 VAL H A 9 LEU H 1.0 6.5 . . 1.5 10.5 . 10 10 . A 6 LEU H A 7 LYS H 1.0 5.0 . . 1.5 8.0 . 11 11 . A 7 LYS H A 8 VAL H 1.0 3.3 . . 1.5 5.0 . 12 12 . A 8 VAL H A 9 LEU H 1.0 3.3 . . 1.5 5.0 . 13 13 . A 9 LEU H A 10 THR H 1.0 4.0 . . 1.5 6.5 . 14 14 . A 9 LEU H A 11 THR H 1.0 6.5 . . 1.5 10.5 . 15 15 . A 10 THR H A 11 THR H 1.0 3.3 . . 1.5 5.0 . 16 16 . A 11 THR H A 12 GLY H 1.0 3.3 . . 1.5 5.0 . 17 17 . A 12 GLY H A 13 LEU H 1.0 4.0 . . 1.5 6.5 . 18 18 . A 13 LEU H A 17 ILE H 1.0 6.5 . . 1.5 10.5 . 19 19 . A 15 ALA H A 16 LEU H 1.0 4.0 . . 1.5 6.5 . 20 20 . A 15 ALA H A 17 ILE H 1.0 6.5 . . 1.5 10.5 . 21 21 . A 16 LEU H A 17 ILE H 1.0 4.0 . . 1.5 6.5 . 22 22 . A 17 ILE H A 18 SER H 1.0 4.0 . . 1.5 6.5 . 23 23 . A 18 SER H A 19 TRP H 1.0 4.0 . . 1.5 6.5 . 24 24 . A 19 TRP H A 20 ILE H 1.0 4.0 . . 1.5 6.5 . 25 25 . A 19 TRP H A 21 LYS H 1.0 6.5 . . 1.5 10.5 . 26 26 . A 20 ILE H A 21 LYS H 1.0 4.0 . . 1.5 6.5 . 27 27 . A 20 ILE H A 24 ARG H 1.0 6.5 . . 1.5 10.5 . 28 28 . A 21 LYS H A 24 ARG H 1.0 5.0 . . 1.5 8.0 . 29 29 . A 24 ARG H A 25 GLN H 1.0 5.0 . . 1.5 8.0 . 30 30 . A 24 ARG H A 26 GLN H 1.0 6.5 . . 1.5 10.5 . 31 31 . A 25 GLN H A 26 GLN H 1.0 4.0 . . 1.5 6.5 . 32 32 . A 1 GLY HAy A 2 ILE H 1.0 5.0 . . 1.5 8.0 . 33 33 . A 1 GLY HAx A 2 ILE H 1.0 5.0 . . 1.5 8.0 . 34 34 . A 1 GLY HAy A 3 GLY H 1.0 5.0 . . 1.5 8.0 . 35 35 . A 1 GLY HAx A 3 GLY H 1.0 5.0 . . 1.5 8.0 . 36 36 . A 2 ILE HA A 3 GLY H 1.0 5.0 . . 1.5 8.0 . 37 37 . A 2 ILE HA A 4 ALA H 1.0 6.5 . . 1.5 10.5 . 38 38 . A 2 ILE HA A 5 VAL H 1.0 4.0 . . 1.5 6.5 . 39 39 . A 3 GLY HAy A 4 ALA H 1.0 6.5 . . 1.5 10.5 . 40 40 . A 3 GLY HAx A 4 ALA H 1.0 6.5 . . 1.5 10.5 . 41 41 . A 3 GLY HAx A 5 VAL H 1.0 6.5 . . 1.5 10.5 . 42 42 . A 4 ALA HA A 8 VAL H 1.0 5.0 . . 1.5 8.0 . 43 43 . A 5 VAL HA A 8 VAL H 1.0 5.0 . . 1.5 8.0 . 44 44 . A 5 VAL HA A 4 ALA H 1.0 6.5 . . 1.5 10.5 . 45 45 . A 5 VAL HA A 9 LEU H 1.0 5.0 . . 1.5 8.0 . 46 46 . A 8 VAL HA A 9 LEU H 1.0 5.0 . . 1.5 8.0 . 47 47 . A 8 VAL HA A 10 THR H 1.0 6.5 . . 1.5 10.5 . 48 48 . A 8 VAL HA A 11 THR H 1.0 5.0 . . 1.5 8.0 . 49 49 . A 9 LEU HA A 8 VAL H 1.0 6.5 . . 1.5 10.5 . 50 50 . A 9 LEU HA A 10 THR H 1.0 5.0 . . 1.5 8.0 . 51 51 . A 9 LEU HA A 11 THR H 1.0 6.5 . . 1.5 10.5 . 52 52 . A 9 LEU HA A 13 LEU H 1.0 5.0 . . 1.5 8.0 . 53 53 . A 10 THR HA A 9 LEU H 1.0 5.0 . . 1.5 8.0 . 54 54 . A 10 THR HA A 11 THR H 1.0 6.5 . . 1.5 10.5 . 55 55 . A 10 THR HA A 12 GLY H 1.0 5.0 . . 1.5 8.0 . 56 56 . A 11 THR HA A 9 LEU H 1.0 5.0 . . 1.5 8.0 . 57 57 . A 11 THR HA A 10 THR H 1.0 6.5 . . 1.5 10.5 . 58 58 . A 11 THR HA A 12 GLY H 1.0 3.3 . . 1.5 5.0 . 59 59 . A 11 THR HA A 13 LEU H 1.0 6.5 . . 1.5 10.5 . 60 60 . A 12 GLY HAx A 9 LEU H 1.0 6.5 . . 1.5 10.5 . 61 61 . A 12 GLY HAx A 11 THR H 1.0 6.5 . . 1.5 10.5 . 62 62 . A 12 GLY HAx A 13 LEU H 1.0 6.5 . . 1.5 10.5 . 63 63 . A 12 GLY HAy A 11 THR H 1.0 6.5 . . 1.5 10.5 . 64 64 . A 12 GLY HAy A 13 LEU H 1.0 6.5 . . 1.5 10.5 . 65 65 . A 11 THR HA A 10 THR H 1.0 6.5 . . 1.5 10.5 . 66 66 . A 11 THR HA A 12 GLY H 1.0 3.3 . . 1.5 5.0 . 67 67 . A 13 LEU HA A 16 LEU H 1.0 6.5 . . 1.5 10.5 . 68 68 . A 13 LEU HA A 17 ILE H 1.0 6.5 . . 1.5 10.5 . 69 69 . A 14 PRO HA A 15 ALA H 1.0 6.5 . . 1.5 10.5 . 70 70 . A 14 PRO HA A 17 ILE H 1.0 6.5 . . 1.5 10.5 . 71 71 . A 15 ALA HA A 18 SER H 1.0 6.5 . . 1.5 10.5 . 72 72 . A 16 LEU HA A 15 ALA H 1.0 6.5 . . 1.5 10.5 . 73 73 . A 16 LEU HA A 17 ILE H 1.0 6.5 . . 1.5 10.5 . 74 74 . A 16 LEU HA A 19 TRP H 1.0 6.5 . . 1.5 10.5 . 75 75 . A 16 LEU HA A 20 ILE H 1.0 6.5 . . 1.5 10.5 . 76 76 . A 17 ILE HA A 20 ILE H 1.0 6.5 . . 1.5 10.5 . 77 77 . A 17 ILE HA A 21 LYS H 1.0 6.5 . . 1.5 10.5 . 78 78 . A 18 SER HA A 15 ALA H 1.0 5.0 . . 1.5 8.0 . 79 79 . A 18 SER HA A 17 ILE H 1.0 6.5 . . 1.5 10.5 . 80 80 . A 18 SER HA A 19 TRP H 1.0 5.0 . . 1.5 8.0 . 81 81 . A 18 SER HA A 20 ILE H 1.0 6.5 . . 1.5 10.5 . 82 82 . A 18 SER HA A 21 LYS H 1.0 5.0 . . 1.5 8.0 . 83 83 . A 19 TRP HA A 18 SER H 1.0 6.5 . . 1.5 10.5 . 84 84 . A 19 TRP HA A 20 ILE H 1.0 6.5 . . 1.5 10.5 . 85 85 . A 19 TRP HA A 21 LYS H 1.0 6.5 . . 1.5 10.5 . 86 86 . A 20 ILE HA A 21 LYS H 1.0 6.5 . . 1.5 10.5 . 87 87 . A 21 LYS HA A 19 TRP H 1.0 6.5 . . 1.5 10.5 . 88 88 . A 21 LYS HA A 20 ILE H 1.0 6.5 . . 1.5 10.5 . 89 89 . A 21 LYS HA A 24 ARG H 1.0 6.5 . . 1.5 10.5 . 90 90 . A 25 GLN HA A 26 GLN H 1.0 6.5 . . 1.5 10.5 . 91 91 . A 26 GLN HA A 25 GLN H 1.0 6.5 . . 1.5 10.5 . 92 92 . A 2 ILE HB A 3 GLY H 1.0 6.5 . . 1.5 10.5 . 93 93 . A 4 ALA HB% A 3 GLY H 1.0 6.5 . . 1.5 10.5 . 94 94 . A 4 ALA HB% A 5 VAL H 1.0 6.5 . . 1.5 10.5 . 95 95 . A 8 VAL HB A 9 LEU H 1.0 6.5 . . 1.5 10.5 . 96 96 . A 9 LEU HBy A 8 VAL H 1.0 6.5 . . 1.5 10.5 . 97 97 . A 9 LEU HBx A 13 LEU H 1.0 6.5 . . 1.5 10.5 . 98 98 . A 10 THR HB A 9 LEU H 1.0 6.5 . . 1.5 10.5 . 99 99 . A 10 THR HB A 11 THR H 1.0 6.5 . . 1.5 10.5 . 100 100 . A 11 THR HB A 9 LEU H 1.0 5.0 . . 1.5 8.0 . 101 101 . A 11 THR HB A 10 THR H 1.0 6.5 . . 1.5 10.5 . 102 102 . A 11 THR HB A 12 GLY H 1.0 5.0 . . 1.5 8.0 . 103 103 . A 11 THR HB A 13 LEU H 1.0 6.5 . . 1.5 10.5 . 104 104 . A 13 LEU HBx A 10 THR H 1.0 6.5 . . 1.5 10.5 . 105 105 . A 13 LEU HBy A 10 THR H 1.0 5.0 . . 1.5 8.0 . 106 106 . A 14 PRO HBx A 13 LEU H 1.0 6.5 . . 1.5 10.5 . 107 107 . A 14 PRO HBy A 13 LEU H 1.0 6.5 . . 1.5 10.5 . 108 108 . A 14 PRO HBy A 15 ALA H 1.0 6.5 . . 1.5 10.5 . 109 109 . A 15 ALA HB% A 16 LEU H 1.0 6.5 . . 1.5 10.5 . 110 110 . A 16 LEU HBy A 17 ILE H 1.0 6.5 . . 1.5 10.5 . 111 111 . A 18 SER HBy A 19 TRP H 1.0 6.5 . . 1.5 10.5 . 112 112 . A 19 TRP HBx A 20 ILE H 1.0 6.5 . . 1.5 10.5 . 113 113 . A 19 TRP HBy A 20 ILE H 1.0 6.5 . . 1.5 10.5 . 114 114 . A 20 ILE HB A 21 LYS H 1.0 6.5 . . 1.5 10.5 . 115 115 . A 25 GLN HBx A 26 GLN H 1.0 6.5 . . 1.5 10.5 . 116 116 . A 25 GLN HBy A 26 GLN H 1.0 6.5 . . 1.5 10.5 . 117 117 . A 26 GLN HBy A 25 GLN H 1.0 6.5 . . 1.5 10.5 . 118 118 . A 4 ALA HB% A 1 GLY HAy 1.0 6.5 . . 1.5 10.5 . 119 119 . A 4 ALA HB% A 1 GLY HAx 1.0 6.5 . . 1.5 10.5 . 120 120 . A 2 ILE HB A 5 VAL HA 1.0 6.5 . . 1.5 10.5 . 121 121 . A 4 ALA HB% A 5 VAL HA 1.0 6.5 . . 1.5 10.5 . 122 122 . A 5 VAL HB A 2 ILE HA 1.0 4.0 . . 1.5 6.5 . 123 123 . A 9 LEU HBx A 6 LEU HA 1.0 5.0 . . 1.5 8.0 . 124 124 . A 11 THR HB A 8 VAL HA 1.0 6.5 . . 1.5 10.5 . 125 125 . A 11 THR HB A 12 GLY HAx 1.0 6.5 . . 1.5 10.5 . 126 126 . A 15 ALA HB% A 12 GLY HAx 1.0 6.5 . . 1.5 10.5 . 127 127 . A 16 LEU HBx A 14 PRO HA 1.0 6.5 . . 1.5 10.5 . 128 128 . A 16 LEU HBx A 17 ILE HA 1.0 6.5 . . 1.5 10.5 . 129 129 . A 18 SER HBx A 15 ALA HA 1.0 6.5 . . 1.5 10.5 . 130 130 . A 19 TRP HBx A 16 LEU HA 1.0 6.5 . . 1.5 10.5 . 131 131 . A 19 TRP HBx A 16 LEU HA 1.0 6.5 . . 1.5 10.5 . 132 132 . A 20 ILE HB A 17 ILE HA 1.0 6.5 . . 1.5 10.5 . 133 133 . A 24 ARG HBy A 21 LYS HA 1.0 6.5 . . 1.5 10.5 . stop_ save_