data_nef_c18418_2ls9 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 BMRB 18420 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 GLY start . false 2 A 2 TRP middle . . 3 A 3 GLY middle . false 4 A 4 SER middle . . 5 A 5 PHE middle . . 6 A 6 PHE middle . . 7 A 7 LYS middle . . 8 A 8 LYS middle . . 9 A 9 ALA middle . . 10 A 10 ALA middle . . 11 A 11 HIS middle . . 12 A 12 VAL middle . . 13 A 13 GLY middle . false 14 A 14 LYS middle . . 15 A 15 HIS middle . . 16 A 16 VAL middle . . 17 A 17 GLY middle . false 18 A 18 LYS middle . . 19 A 19 ALA middle . . 20 A 20 ALA middle . . 21 A 21 LEU middle . . 22 A 22 THR middle . . 23 A 23 HIS middle . . 24 A 24 TYR middle . . 25 A 25 LEU end . . 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 HA2 H 1 4.249 0.000 A 1 GLY HA3 H 1 4.249 0.000 A 2 TRP H H 1 8.575 0.006 A 2 TRP HA H 1 4.595 0.004 A 3 GLY H H 1 8.113 0.006 A 3 GLY HA2 H 1 4.096 0.133 A 3 GLY HA3 H 1 4.096 0.133 A 4 SER H H 1 8.490 0.174 A 4 SER HA H 1 4.803 0.006 A 4 SER HB2 H 1 3.984 0.076 A 4 SER HB3 H 1 3.984 0.076 A 5 PHE H H 1 8.067 0.006 A 5 PHE HA H 1 4.284 0.015 A 5 PHE HB2 H 1 3.179 0.099 A 5 PHE HB3 H 1 3.179 0.099 A 6 PHE H H 1 8.306 0.009 A 6 PHE HA H 1 4.183 0.012 A 6 PHE HB2 H 1 3.266 0.002 A 6 PHE HB3 H 1 3.266 0.002 A 7 LYS H H 1 8.100 0.003 A 7 LYS HA H 1 4.028 0.007 A 7 LYS HB2 H 1 1.894 0.098 A 7 LYS HB3 H 1 1.894 0.098 A 7 LYS HD2 H 1 1.701 0.011 A 7 LYS HD3 H 1 1.701 0.011 A 7 LYS HE2 H 1 3.016 0.001 A 7 LYS HE3 H 1 3.016 0.001 A 7 LYS HG2 H 1 1.510 0.004 A 7 LYS HG3 H 1 1.510 0.004 A 8 LYS H H 1 7.734 0.003 A 8 LYS HA H 1 4.159 0.012 A 8 LYS HB2 H 1 1.830 0.110 A 8 LYS HB3 H 1 1.830 0.110 A 8 LYS HD2 H 1 1.622 0.006 A 8 LYS HD3 H 1 1.622 0.006 A 8 LYS HE2 H 1 2.984 0.005 A 8 LYS HE3 H 1 2.984 0.005 A 8 LYS HG2 H 1 1.505 0.012 A 8 LYS HG3 H 1 1.505 0.012 A 9 ALA H H 1 8.328 0.005 A 9 ALA HA H 1 3.970 0.011 A 9 ALA HB% H 1 1.280 0.007 A 10 ALA H H 1 8.295 0.009 A 10 ALA HA H 1 3.988 0.003 A 10 ALA HB% H 1 1.503 0.001 A 11 HIS H H 1 7.890 0.003 A 11 HIS HA H 1 4.415 0.004 A 11 HIS HB2 H 1 3.911 1.408 A 11 HIS HB3 H 1 3.911 1.408 A 11 HIS HD2 H 1 8.261 0.000 A 11 HIS HE1 H 1 7.211 0.001 A 12 VAL H H 1 8.154 0.003 A 12 VAL HA H 1 3.848 0.006 A 12 VAL HB H 1 2.236 0.005 A 12 VAL HG1% H 1 1.084 0.060 A 12 VAL HG2% H 1 1.084 0.060 A 13 GLY H H 1 8.869 0.003 A 13 GLY HA3 H 1 3.714 0.001 A 14 LYS H H 1 8.321 0.006 A 14 LYS HA H 1 4.002 0.010 A 14 LYS HB2 H 1 1.930 0.012 A 14 LYS HB3 H 1 1.930 0.012 A 14 LYS HD2 H 1 1.559 0.000 A 14 LYS HD3 H 1 1.559 0.000 A 14 LYS HE2 H 1 2.966 0.000 A 14 LYS HE3 H 1 2.966 0.000 A 14 LYS HG2 H 1 1.509 0.000 A 14 LYS HG3 H 1 1.509 0.000 A 15 HIS H H 1 7.749 0.005 A 15 HIS HA H 1 4.413 0.001 A 15 HIS HB2 H 1 3.330 0.046 A 15 HIS HB3 H 1 3.330 0.046 A 16 VAL H H 1 8.540 0.007 A 16 VAL HA H 1 3.829 0.008 A 16 VAL HB H 1 2.222 0.005 A 16 VAL HG1% H 1 1.073 0.055 A 16 VAL HG2% H 1 1.073 0.055 A 17 GLY H H 1 8.711 0.002 A 17 GLY HA3 H 1 3.762 0.000 A 18 LYS H H 1 8.312 0.007 A 18 LYS HA H 1 4.065 0.061 A 18 LYS HB2 H 1 1.961 0.000 A 18 LYS HB3 H 1 1.961 0.000 A 18 LYS HD2 H 1 1.749 0.008 A 18 LYS HD3 H 1 1.749 0.008 A 18 LYS HG2 H 1 1.510 0.000 A 18 LYS HG3 H 1 1.510 0.000 A 19 ALA H H 1 7.968 0.001 A 19 ALA HA H 1 4.215 0.004 A 19 ALA HB% H 1 1.559 0.001 A 20 ALA H H 1 8.562 0.003 A 20 ALA HA H 1 4.162 0.005 A 20 ALA HB% H 1 1.606 0.002 A 21 LEU H H 1 8.437 0.009 A 21 LEU HA H 1 4.175 0.004 A 21 LEU HB2 H 1 1.885 0.002 A 21 LEU HB3 H 1 1.885 0.002 A 21 LEU HG H 1 0.994 0.001 A 22 THR H H 1 8.338 0.007 A 22 THR HA H 1 3.960 0.005 A 22 THR HB H 1 4.331 0.007 A 22 THR HG2% H 1 1.297 0.006 A 23 HIS H H 1 8.067 0.006 A 23 HIS HA H 1 4.333 0.005 A 23 HIS HE1 H 1 7.208 0.000 A 24 TYR H H 1 8.333 0.007 A 24 TYR HA H 1 4.306 0.004 A 24 TYR HB2 H 1 3.110 0.041 A 24 TYR HB3 H 1 3.110 0.041 A 24 TYR HD1 H 1 7.207 0.002 A 24 TYR HD2 H 1 7.207 0.002 A 24 TYR HE1 H 1 6.855 0.000 A 24 TYR HE2 H 1 6.855 0.000 A 25 LEU H H 1 8.262 0.003 A 25 LEU HA H 1 4.215 0.004 A 25 LEU HB2 H 1 1.891 0.007 A 25 LEU HB3 H 1 1.891 0.007 A 25 LEU HD1% H 1 0.986 0.003 A 25 LEU HD2% H 1 0.986 0.003 A 25 LEU HG H 1 1.635 0.003 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 20 ALA HB% A 22 THR H 1.0 1.858 4.010 2 2 A 24 TYR HB2 A 24 TYR HA 1.0 1.813 3.745 3 3 A 3 GLY HA2 A 5 PHE H 1.0 1.680 3.118 4 4 A 8 LYS HA A 12 VAL H 1.0 2.000 6.022 5 5 A 20 ALA HA A 23 HIS H 1.0 1.815 3.749 6 6 A 15 HIS HA A 15 HIS H 1.0 1.837 3.877 7 7 A 5 PHE H A 5 PHE HA 1.0 1.716 3.266 8 8 A 5 PHE HA A 6 PHE H 1.0 1.810 3.724 9 9 A 5 PHE HA A 8 LYS H 1.0 1.923 4.509 10 10 A 5 PHE H A 5 PHE HB2 1.0 1.600 2.824 11 11 A 5 PHE HA A 5 PHE HB2 1.0 1.741 3.379 12 12 A 6 PHE H A 6 PHE HA 1.0 1.812 3.732 13 13 A 6 PHE H A 6 PHE HB2 1.0 1.597 2.811 14 14 A 6 PHE HA A 6 PHE HB2 1.0 1.700 3.202 15 15 A 7 LYS HA A 7 LYS H 1.0 1.747 3.407 16 16 A 8 LYS H A 7 LYS HA 1.0 1.914 4.426 17 17 A 7 LYS H A 7 LYS HB2 1.0 1.715 3.263 18 18 A 7 LYS HA A 7 LYS HB2 1.0 1.957 4.873 19 19 A 7 LYS HB2 A 7 LYS HE2 1.0 1.516 2.546 20 20 A 7 LYS H A 7 LYS HD2 1.0 1.959 4.891 21 21 A 7 LYS HA A 7 LYS HD2 1.0 1.554 2.668 22 22 A 7 LYS HA A 7 LYS HE3 1.0 1.966 5.000 23 22 A 7 LYS HA A 7 LYS HE2 1.0 1.966 5.000 24 23 A 7 LYS H A 7 LYS HG2 1.0 1.893 4.259 25 24 A 7 LYS HB2 A 7 LYS HG2 1.0 1.825 3.813 26 25 A 7 LYS HD2 A 7 LYS HG2 1.0 1.713 3.259 27 26 A 7 LYS HE2 A 7 LYS HG2 1.0 1.760 3.464 28 27 A 8 LYS H A 7 LYS H 1.0 1.871 4.097 29 28 A 8 LYS H A 9 ALA H 1.0 1.753 3.435 30 29 A 8 LYS HA A 8 LYS H 1.0 1.826 3.812 31 30 A 8 LYS HA A 9 ALA H 1.0 1.695 3.181 32 31 A 8 LYS HA A 11 HIS H 1.0 1.940 4.674 33 32 A 8 LYS H A 8 LYS HB2 1.0 1.606 2.844 34 33 A 8 LYS HA A 8 LYS HB2 1.0 1.755 3.449 35 34 A 8 LYS HB2 A 8 LYS HE2 1.0 1.650 3.004 36 35 A 8 LYS H A 8 LYS HD2 1.0 1.894 4.270 37 36 A 8 LYS HA A 8 LYS HD2 1.0 1.761 3.475 38 37 A 8 LYS HE2 A 8 LYS HD2 1.0 1.689 3.157 39 38 A 8 LYS H A 8 LYS HG2 1.0 1.859 4.017 40 39 A 8 LYS HA A 8 LYS HG2 1.0 1.905 4.353 41 40 A 8 LYS HE2 A 8 LYS HG2 1.0 1.638 2.960 42 41 A 9 ALA H A 9 ALA HA 1.0 1.693 3.175 43 42 A 9 ALA H A 9 ALA HB% 1.0 1.630 2.926 44 43 A 9 ALA HA A 9 ALA HB% 1.0 1.518 2.556 45 44 A 9 ALA HB% A 10 ALA H 1.0 1.787 3.605 46 45 A 10 ALA H A 10 ALA HA 1.0 1.623 2.901 47 46 A 11 HIS H A 10 ALA HA 1.0 1.911 4.395 48 47 A 10 ALA H A 10 ALA HB% 1.0 1.675 3.097 49 48 A 10 ALA HA A 10 ALA HB% 1.0 1.683 3.129 50 49 A 11 HIS H A 10 ALA HB% 1.0 1.888 4.212 51 50 A 11 HIS H A 10 ALA H 1.0 1.916 4.448 52 51 A 11 HIS H A 11 HIS HA 1.0 1.883 4.181 53 52 A 11 HIS HA A 11 HIS HE1 1.0 1.980 5.216 54 53 A 12 VAL H A 11 HIS HA 1.0 1.962 4.938 55 54 A 11 HIS H A 11 HIS HB2 1.0 1.946 4.746 56 55 A 11 HIS HA A 11 HIS HB2 1.0 1.658 3.034 57 56 A 12 VAL H A 11 HIS HB2 1.0 1.942 4.700 58 57 A 11 HIS HE1 A 11 HIS HD2 1.0 1.947 4.759 59 58 A 12 VAL H A 13 GLY H 1.0 1.940 4.676 60 59 A 12 VAL H A 12 VAL HA 1.0 1.935 4.617 61 60 A 13 GLY H A 12 VAL HA 1.0 1.911 4.395 62 61 A 12 VAL H A 12 VAL HB 1.0 1.831 3.845 63 62 A 12 VAL HA A 12 VAL HB 1.0 1.863 4.039 64 63 A 12 VAL H A 12 VAL HG2% 1.0 1.859 4.017 65 64 A 12 VAL HA A 12 VAL HG2% 1.0 1.688 3.154 66 65 A 12 VAL HB A 12 VAL HG2% 1.0 1.517 2.551 67 66 A 13 GLY H A 13 GLY HAx 1.0 1.716 3.266 68 67 A 13 GLY H A 14 LYS H 1.0 1.913 4.415 69 68 A 14 LYS H A 14 LYS HA 1.0 1.760 3.464 70 69 A 14 LYS H A 14 LYS HB2 1.0 1.473 2.421 71 70 A 14 LYS HA A 14 LYS HB2 1.0 1.463 2.391 72 71 A 14 LYS HB2 A 14 LYS HE2 1.0 1.875 4.125 73 72 A 14 LYS H A 14 LYS HG2 1.0 1.401 2.223 74 73 A 16 VAL HA A 16 VAL H 1.0 1.762 3.480 75 74 A 16 VAL H A 16 VAL HB 1.0 1.783 3.581 76 75 A 16 VAL HA A 16 VAL HB 1.0 1.764 3.490 77 76 A 16 VAL H A 16 VAL HG2% 1.0 1.747 3.407 78 77 A 16 VAL HA A 16 VAL HG2% 1.0 1.661 3.043 79 78 A 16 VAL HB A 16 VAL HG2% 1.0 1.734 3.350 80 79 A 17 GLY HAx A 17 GLY H 1.0 1.649 2.999 81 80 A 17 GLY HAx A 18 LYS H 1.0 1.803 3.687 82 81 A 17 GLY H A 18 LYS H 1.0 1.862 4.034 83 82 A 18 LYS H A 18 LYS HA 1.0 1.635 2.949 84 83 A 18 LYS HA A 19 ALA H 1.0 1.950 4.792 85 84 A 18 LYS H A 18 LYS HB2 1.0 1.865 4.059 86 85 A 18 LYS H A 18 LYS HD2 1.0 1.661 3.045 87 86 A 18 LYS HD2 A 18 LYS HG2 1.0 0.000 17.654 88 87 A 18 LYS H A 19 ALA H 1.0 1.856 3.994 89 88 A 19 ALA H A 20 ALA H 1.0 1.870 4.088 90 89 A 19 ALA H A 19 ALA HA 1.0 1.856 3.998 91 90 A 20 ALA H A 19 ALA HA 1.0 1.866 4.064 92 91 A 19 ALA H A 19 ALA HB% 1.0 1.696 3.184 93 92 A 19 ALA HA A 19 ALA HB% 1.0 1.821 3.785 94 93 A 20 ALA H A 19 ALA HB% 1.0 1.791 3.625 95 94 A 20 ALA HA A 20 ALA H 1.0 1.818 3.768 96 95 A 20 ALA HB% A 20 ALA H 1.0 1.689 3.157 97 96 A 20 ALA HB% A 20 ALA HA 1.0 1.638 2.958 98 97 A 20 ALA HB% A 21 LEU H 1.0 1.817 3.763 99 98 A 20 ALA H A 21 LEU H 1.0 1.889 4.227 100 99 A 21 LEU H A 21 LEU HA 1.0 1.793 3.631 101 100 A 21 LEU H A 21 LEU HB2 1.0 1.672 3.090 102 101 A 21 LEU H A 21 LEU HG 1.0 1.747 3.411 103 102 A 22 THR H A 21 LEU HG 1.0 1.697 3.187 104 103 A 22 THR H A 21 LEU H 1.0 1.860 4.024 105 104 A 22 THR H A 22 THR HA 1.0 1.712 3.252 106 105 A 22 THR H A 22 THR HB 1.0 1.651 3.005 107 106 A 22 THR H A 23 HIS H 1.0 1.681 3.121 108 107 A 23 HIS H A 23 HIS HA 1.0 1.775 3.539 109 108 A 25 LEU HA A 25 LEU H 1.0 1.903 4.331 110 109 A 25 LEU H A 25 LEU HB2 1.0 1.787 3.605 111 110 A 25 LEU HA A 25 LEU HB2 1.0 1.809 3.717 112 111 A 25 LEU H A 25 LEU HD2% 1.0 1.762 3.480 113 112 A 25 LEU HA A 25 LEU HD2% 1.0 1.704 3.218 114 113 A 25 LEU HD2% A 25 LEU HB3 1.0 1.365 2.127 115 113 A 25 LEU HD2% A 25 LEU HB2 1.0 1.365 2.127 116 114 A 25 LEU HD2% A 25 LEU HG 1.0 1.520 2.560 117 115 A 25 LEU H A 25 LEU HG 1.0 1.906 4.360 118 116 A 25 LEU HA A 25 LEU HG 1.0 1.922 4.504 119 117 A 25 LEU HB2 A 25 LEU HG 1.0 1.478 2.436 120 118 A 24 TYR HB2 A 24 TYR H 1.0 1.785 3.593 121 119 A 15 HIS H A 15 HIS HB2 1.0 1.801 3.673 122 120 A 24 TYR HB2 A 25 LEU H 1.0 1.906 4.360 123 121 A 16 VAL HA A 15 HIS HB2 1.0 1.880 4.158 124 122 A 15 HIS HA A 16 VAL H 1.0 1.903 4.333 125 123 A 11 HIS HA A 14 LYS H 1.0 1.900 4.310 126 124 A 15 HIS H A 12 VAL HA 1.0 1.915 4.441 127 125 A 15 HIS H A 16 VAL H 1.0 1.895 4.277 128 126 A 12 VAL H A 11 HIS H 1.0 1.999 5.811 129 127 A 21 LEU HA A 24 TYR HD1 1.0 1.802 3.680 130 128 A 24 TYR HB2 A 24 TYR HD1 1.0 1.663 3.053 131 129 A 24 TYR HA A 24 TYR H 1.0 1.732 3.342 132 130 A 24 TYR HD1 A 24 TYR HE1 1.0 1.559 2.685 133 131 A 24 TYR HA A 25 LEU H 1.0 1.821 3.787 134 132 A 10 ALA HA A 13 GLY H 1.0 1.885 4.197 135 133 A 22 THR H A 21 LEU HA 1.0 1.740 3.376 136 134 A 23 HIS HA A 24 TYR H 1.0 1.962 4.942 137 135 A 20 ALA H A 21 LEU HB2 1.0 1.903 4.331 138 136 A 16 VAL HB A 17 GLY H 1.0 1.852 3.970 139 137 A 13 GLY H A 12 VAL HB 1.0 1.830 3.836 140 138 A 25 LEU HB2 A 24 TYR HD1 1.0 1.796 3.652 141 139 A 8 LYS H A 9 ALA HB% 1.0 1.945 4.731 142 140 A 25 LEU HD2% A 24 TYR HD1 1.0 1.704 3.222 143 140 A 25 LEU HD2% A 24 TYR HD2 1.0 1.704 3.222 144 141 A 25 LEU HD2% A 24 TYR HE1 1.0 1.823 3.799 145 141 A 25 LEU HD2% A 24 TYR HE2 1.0 1.823 3.799 146 142 A 20 ALA HB% A 24 TYR HE1 1.0 1.988 5.390 147 142 A 20 ALA HB% A 24 TYR HE2 1.0 1.988 5.390 148 143 A 16 VAL HA A 19 ALA H 1.0 1.952 4.806 149 144 A 2 TRP HA A 2 TRP H 1.0 1.880 4.158 150 145 A 3 GLY H A 4 SER H 1.0 1.939 4.665 151 146 A 2 TRP H A 1 GLY H1 1.0 1.926 4.540 152 147 A 5 PHE H A 4 SER HA 1.0 1.943 4.697 153 148 A 19 ALA H A 21 LEU H 1.0 1.661 9.631 154 149 A 22 THR H A 20 ALA H 1.0 1.873 4.111 155 150 A 16 VAL H A 17 GLY H 1.0 1.818 3.770 156 151 A 17 GLY HAx A 20 ALA H 1.0 1.884 4.192 157 152 A 13 GLY HAx A 16 VAL H 1.0 2.000 5.872 158 153 A 16 VAL HA A 18 LYS H 1.0 1.720 3.288 159 154 A 15 HIS H A 16 VAL HB 1.0 1.998 6.234 160 155 A 4 SER H A 4 SER HB2 1.0 1.723 3.299 161 156 A 18 LYS HA A 21 LEU H 1.0 1.970 5.044 162 157 A 4 SER H A 4 SER HA 1.0 1.924 4.518 163 158 A 5 PHE H A 4 SER H 1.0 1.981 5.245 164 159 A 2 TRP HA A 4 SER H 1.0 2.000 5.996 165 160 A 17 GLY H A 14 LYS HD2 1.0 1.984 5.290 166 161 A 16 VAL HB A 18 LYS H 1.0 1.863 4.041 167 162 A 14 LYS HA A 17 GLY H 1.0 1.927 4.543 168 163 A 3 GLY HA2 A 3 GLY H 1.0 1.812 3.732 169 164 A 22 THR HA A 22 THR HB 1.0 1.916 4.444 170 165 A 2 TRP H A 3 GLY H 1.0 1.932 7.548 171 166 A 15 HIS H A 14 LYS HA 1.0 1.867 4.067 172 167 A 13 GLY HAx A 14 LYS H 1.0 1.743 3.389 173 168 A 5 PHE H A 2 TRP HA 1.0 1.966 5.004 stop_ save_