############################## # Heteronuclear NOE values # ############################## save_heteronuclear_noe_list_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronuclear_noe_list_1 _Heteronucl_NOE_list.Entry_ID 30523 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 600 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak height' _Heteronucl_NOE_list.NOE_ref_val . _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details ; Residues 49, 57, 58, 95, 102, 112 (numbered with respect to the full-length protein) should be used with caution or omitted due to resonance overlap. ; _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 20 'HN hNOE' . . . 30523 1 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 3 3 MET N N 15 . 1 1 3 3 MET H H 1 -1.0722 0.0399 . . . 45 MET N . 45 MET H 30523 1 2 . 1 1 4 4 ALA N N 15 . 1 1 4 4 ALA H H 1 -1.0666 0.0503 . . . 46 ALA N . 46 ALA H 30523 1 3 . 1 1 5 5 THR N N 15 . 1 1 5 5 THR H H 1 -0.4934 0.0144 . . . 47 THR N . 47 THR H 30523 1 4 . 1 1 6 6 ALA N N 15 . 1 1 6 6 ALA H H 1 -0.0803 0.0194 . . . 48 ALA N . 48 ALA H 30523 1 5 . 1 1 7 7 LYS N N 15 . 1 1 7 7 LYS H H 1 0.4086 0.0029 . . . 49 LYS N . 49 LYS H 30523 1 6 . 1 1 8 8 LEU N N 15 . 1 1 8 8 LEU H H 1 0.2998 0.0056 . . . 50 LEU N . 50 LEU H 30523 1 7 . 1 1 9 9 ALA N N 15 . 1 1 9 9 ALA H H 1 0.2778 0.0050 . . . 51 ALA N . 51 ALA H 30523 1 8 . 1 1 10 10 THR N N 15 . 1 1 10 10 THR H H 1 0.4148 0.0079 . . . 52 THR N . 52 THR H 30523 1 9 . 1 1 11 11 ASP N N 15 . 1 1 11 11 ASP H H 1 0.4573 0.0028 . . . 53 ASP N . 53 ASP H 30523 1 10 . 1 1 12 12 ILE N N 15 . 1 1 12 12 ILE H H 1 0.4698 0.0089 . . . 54 ILE N . 54 ILE H 30523 1 11 . 1 1 13 13 GLU N N 15 . 1 1 13 13 GLU H H 1 0.5237 0.0090 . . . 55 GLU N . 55 GLU H 30523 1 12 . 1 1 14 14 ASN N N 15 . 1 1 14 14 ASN H H 1 0.6350 0.0224 . . . 56 ASN N . 56 ASN H 30523 1 13 . 1 1 15 15 ASN N N 15 . 1 1 15 15 ASN H H 1 0.7244 0.0012 . . . 57 ASN N . 57 ASN H 30523 1 14 . 1 1 16 16 VAL N N 15 . 1 1 16 16 VAL H H 1 0.7343 0.0060 . . . 58 VAL N . 58 VAL H 30523 1 15 . 1 1 17 17 ARG N N 15 . 1 1 17 17 ARG H H 1 0.7270 0.0184 . . . 59 ARG N . 59 ARG H 30523 1 16 . 1 1 18 18 VAL N N 15 . 1 1 18 18 VAL H H 1 0.7470 0.0216 . . . 60 VAL N . 60 VAL H 30523 1 17 . 1 1 19 19 VAL N N 15 . 1 1 19 19 VAL H H 1 0.8177 0.0131 . . . 61 VAL N . 61 VAL H 30523 1 18 . 1 1 20 20 VAL N N 15 . 1 1 20 20 VAL H H 1 0.7931 0.0150 . . . 62 VAL N . 62 VAL H 30523 1 19 . 1 1 21 21 TYR N N 15 . 1 1 21 21 TYR H H 1 0.8091 0.0206 . . . 63 TYR N . 63 TYR H 30523 1 20 . 1 1 22 22 ILE N N 15 . 1 1 22 22 ILE H H 1 0.8222 0.0199 . . . 64 ILE N . 64 ILE H 30523 1 21 . 1 1 23 23 ARG N N 15 . 1 1 23 23 ARG H H 1 0.7752 0.0109 . . . 65 ARG N . 65 ARG H 30523 1 22 . 1 1 24 24 LYS N N 15 . 1 1 24 24 LYS H H 1 0.7644 0.0152 . . . 66 LYS N . 66 LYS H 30523 1 23 . 1 1 25 25 ASP N N 15 . 1 1 25 25 ASP H H 1 0.7740 0.0258 . . . 67 ASP N . 67 ASP H 30523 1 24 . 1 1 26 26 VAL N N 15 . 1 1 26 26 VAL H H 1 0.7449 0.0232 . . . 68 VAL N . 68 VAL H 30523 1 25 . 1 1 27 27 GLU N N 15 . 1 1 27 27 GLU H H 1 0.7674 0.0275 . . . 69 GLU N . 69 GLU H 30523 1 26 . 1 1 28 28 ASP N N 15 . 1 1 28 28 ASP H H 1 0.7396 0.0235 . . . 70 ASP N . 70 ASP H 30523 1 27 . 1 1 29 29 ASN N N 15 . 1 1 29 29 ASN H H 1 0.8139 0.0436 . . . 71 ASN N . 71 ASN H 30523 1 28 . 1 1 30 30 SER N N 15 . 1 1 30 30 SER H H 1 0.7670 0.0086 . . . 72 SER N . 72 SER H 30523 1 29 . 1 1 31 31 GLN N N 15 . 1 1 31 31 GLN H H 1 0.7752 0.0317 . . . 73 GLN N . 73 GLN H 30523 1 30 . 1 1 32 32 THR N N 15 . 1 1 32 32 THR H H 1 0.7558 0.0182 . . . 74 THR N . 74 THR H 30523 1 31 . 1 1 33 33 ILE N N 15 . 1 1 33 33 ILE H H 1 0.7101 0.0114 . . . 75 ILE N . 75 ILE H 30523 1 32 . 1 1 34 34 GLU N N 15 . 1 1 34 34 GLU H H 1 0.6697 0.0045 . . . 76 GLU N . 76 GLU H 30523 1 33 . 1 1 35 35 LYS N N 15 . 1 1 35 35 LYS H H 1 0.5333 0.0180 . . . 77 LYS N . 77 LYS H 30523 1 34 . 1 1 36 36 GLU N N 15 . 1 1 36 36 GLU H H 1 0.6113 0.0586 . . . 78 GLU N . 78 GLU H 30523 1 35 . 1 1 37 37 GLY N N 15 . 1 1 37 37 GLY H H 1 0.5992 0.0058 . . . 79 GLY N . 79 GLY H 30523 1 36 . 1 1 38 38 GLN N N 15 . 1 1 38 38 GLN H H 1 0.4987 0.0092 . . . 80 GLN N . 80 GLN H 30523 1 37 . 1 1 39 39 THR N N 15 . 1 1 39 39 THR H H 1 0.5953 0.0056 . . . 81 THR N . 81 THR H 30523 1 38 . 1 1 40 40 VAL N N 15 . 1 1 40 40 VAL H H 1 0.6805 0.0085 . . . 82 VAL N . 82 VAL H 30523 1 39 . 1 1 41 41 THR N N 15 . 1 1 41 41 THR H H 1 0.7078 0.0140 . . . 83 THR N . 83 THR H 30523 1 40 . 1 1 42 42 ASN N N 15 . 1 1 42 42 ASN H H 1 0.7464 0.0125 . . . 84 ASN N . 84 ASN H 30523 1 41 . 1 1 44 44 ASP N N 15 . 1 1 44 44 ASP H H 1 0.8015 0.0221 . . . 86 ASP N . 86 ASP H 30523 1 42 . 1 1 45 45 TYR N N 15 . 1 1 45 45 TYR H H 1 0.7653 0.0037 . . . 87 TYR N . 87 TYR H 30523 1 43 . 1 1 46 46 HIS N N 15 . 1 1 46 46 HIS H H 1 0.8297 0.0035 . . . 88 HIS N . 88 HIS H 30523 1 44 . 1 1 47 47 LYS N N 15 . 1 1 47 47 LYS H H 1 0.7771 0.0086 . . . 89 LYS N . 89 LYS H 30523 1 45 . 1 1 48 48 VAL N N 15 . 1 1 48 48 VAL H H 1 0.8210 0.0415 . . . 90 VAL N . 90 VAL H 30523 1 46 . 1 1 49 49 TYR N N 15 . 1 1 49 49 TYR H H 1 1.0276 0.0300 . . . 91 TYR N . 91 TYR H 30523 1 47 . 1 1 50 50 ASP N N 15 . 1 1 50 50 ASP H H 1 0.8642 0.0182 . . . 92 ASP N . 92 ASP H 30523 1 48 . 1 1 51 51 SER N N 15 . 1 1 51 51 SER H H 1 0.8108 0.0294 . . . 93 SER N . 93 SER H 30523 1 49 . 1 1 52 52 LEU N N 15 . 1 1 52 52 LEU H H 1 0.8158 0.0268 . . . 94 LEU N . 94 LEU H 30523 1 50 . 1 1 53 53 LYS N N 15 . 1 1 53 53 LYS H H 1 0.7984 0.0128 . . . 95 LYS N . 95 LYS H 30523 1 51 . 1 1 54 54 ASN N N 15 . 1 1 54 54 ASN H H 1 0.7892 0.0093 . . . 96 ASN N . 96 ASN H 30523 1 52 . 1 1 55 55 MET N N 15 . 1 1 55 55 MET H H 1 0.7554 0.0019 . . . 97 MET N . 97 MET H 30523 1 53 . 1 1 56 56 SER N N 15 . 1 1 56 56 SER H H 1 0.8219 0.0945 . . . 98 SER N . 98 SER H 30523 1 54 . 1 1 57 57 THR N N 15 . 1 1 57 57 THR H H 1 0.8022 0.0053 . . . 99 THR N . 99 THR H 30523 1 55 . 1 1 58 58 VAL N N 15 . 1 1 58 58 VAL H H 1 0.7728 0.0187 . . . 100 VAL N . 100 VAL H 30523 1 56 . 1 1 59 59 LYS N N 15 . 1 1 59 59 LYS H H 1 0.8503 0.0186 . . . 101 LYS N . 101 LYS H 30523 1 57 . 1 1 60 60 SER N N 15 . 1 1 60 60 SER H H 1 0.7343 0.0060 . . . 102 SER N . 102 SER H 30523 1 58 . 1 1 61 61 VAL N N 15 . 1 1 61 61 VAL H H 1 0.8136 0.0125 . . . 103 VAL N . 103 VAL H 30523 1 59 . 1 1 62 62 THR N N 15 . 1 1 62 62 THR H H 1 0.8111 0.0109 . . . 104 THR N . 104 THR H 30523 1 60 . 1 1 63 63 PHE N N 15 . 1 1 63 63 PHE H H 1 0.8609 0.0188 . . . 105 PHE N . 105 PHE H 30523 1 61 . 1 1 64 64 SER N N 15 . 1 1 64 64 SER H H 1 0.8506 0.0026 . . . 106 SER N . 106 SER H 30523 1 62 . 1 1 65 65 SER N N 15 . 1 1 65 65 SER H H 1 0.8322 0.0154 . . . 107 SER N . 107 SER H 30523 1 63 . 1 1 66 66 LYS N N 15 . 1 1 66 66 LYS H H 1 0.8214 0.0165 . . . 108 LYS N . 108 LYS H 30523 1 64 . 1 1 67 67 GLU N N 15 . 1 1 67 67 GLU H H 1 0.8292 0.0094 . . . 109 GLU N . 109 GLU H 30523 1 65 . 1 1 68 68 GLU N N 15 . 1 1 68 68 GLU H H 1 0.7907 0.0207 . . . 110 GLU N . 110 GLU H 30523 1 66 . 1 1 69 69 GLN N N 15 . 1 1 69 69 GLN H H 1 0.7992 0.0179 . . . 111 GLN N . 111 GLN H 30523 1 67 . 1 1 70 70 TYR N N 15 . 1 1 70 70 TYR H H 1 0.4086 0.0029 . . . 112 TYR N . 112 TYR H 30523 1 68 . 1 1 71 71 GLU N N 15 . 1 1 71 71 GLU H H 1 0.7155 0.0073 . . . 113 GLU N . 113 GLU H 30523 1 69 . 1 1 72 72 LYS N N 15 . 1 1 72 72 LYS H H 1 0.7704 0.0087 . . . 114 LYS N . 114 LYS H 30523 1 70 . 1 1 73 73 LEU N N 15 . 1 1 73 73 LEU H H 1 0.7179 0.0080 . . . 115 LEU N . 115 LEU H 30523 1 71 . 1 1 74 74 THR N N 15 . 1 1 74 74 THR H H 1 0.7815 0.0099 . . . 116 THR N . 116 THR H 30523 1 72 . 1 1 75 75 GLU N N 15 . 1 1 75 75 GLU H H 1 0.6745 0.0273 . . . 117 GLU N . 117 GLU H 30523 1 73 . 1 1 76 76 ILE N N 15 . 1 1 76 76 ILE H H 1 0.6570 0.0184 . . . 118 ILE N . 118 ILE H 30523 1 74 . 1 1 77 77 MET N N 15 . 1 1 77 77 MET H H 1 0.6763 0.0076 . . . 119 MET N . 119 MET H 30523 1 75 . 1 1 78 78 GLY N N 15 . 1 1 78 78 GLY H H 1 0.6301 0.0051 . . . 120 GLY N . 120 GLY H 30523 1 76 . 1 1 79 79 ASP N N 15 . 1 1 79 79 ASP H H 1 0.6591 0.0211 . . . 121 ASP N . 121 ASP H 30523 1 77 . 1 1 80 80 ASN N N 15 . 1 1 80 80 ASN H H 1 0.5484 0.0170 . . . 122 ASN N . 122 ASN H 30523 1 78 . 1 1 81 81 TRP N N 15 . 1 1 81 81 TRP H H 1 0.5510 0.0091 . . . 123 TRP N . 123 TRP H 30523 1 79 . 1 1 82 82 LYS N N 15 . 1 1 82 82 LYS H H 1 0.6268 0.0063 . . . 124 LYS N . 124 LYS H 30523 1 80 . 1 1 83 83 ILE N N 15 . 1 1 83 83 ILE H H 1 0.5807 0.0118 . . . 125 ILE N . 125 ILE H 30523 1 81 . 1 1 84 84 PHE N N 15 . 1 1 84 84 PHE H H 1 0.5511 0.0088 . . . 126 PHE N . 126 PHE H 30523 1 82 . 1 1 85 85 GLU N N 15 . 1 1 85 85 GLU H H 1 0.4833 0.0066 . . . 127 GLU N . 127 GLU H 30523 1 83 . 1 1 86 86 GLY N N 15 . 1 1 86 86 GLY H H 1 0.4657 0.0105 . . . 128 GLY N . 128 GLY H 30523 1 84 . 1 1 87 87 ASP N N 15 . 1 1 87 87 ASP H H 1 0.6129 0.0044 . . . 129 ASP N . 129 ASP H 30523 1 85 . 1 1 88 88 ALA N N 15 . 1 1 88 88 ALA H H 1 0.4413 0.0049 . . . 130 ALA N . 130 ALA H 30523 1 86 . 1 1 89 89 ASN N N 15 . 1 1 89 89 ASN H H 1 0.5030 0.0080 . . . 131 ASN N . 131 ASN H 30523 1 87 . 1 1 91 91 LEU N N 15 . 1 1 91 91 LEU H H 1 0.6683 0.0065 . . . 133 LEU N . 133 LEU H 30523 1 88 . 1 1 92 92 TYR N N 15 . 1 1 92 92 TYR H H 1 0.7534 0.0294 . . . 134 TYR N . 134 TYR H 30523 1 89 . 1 1 93 93 ASP N N 15 . 1 1 93 93 ASP H H 1 0.8062 0.0160 . . . 135 ASP N . 135 ASP H 30523 1 90 . 1 1 94 94 ALA N N 15 . 1 1 94 94 ALA H H 1 0.8177 0.0048 . . . 136 ALA N . 136 ALA H 30523 1 91 . 1 1 95 95 TYR N N 15 . 1 1 95 95 TYR H H 1 0.8502 0.0254 . . . 137 TYR N . 137 TYR H 30523 1 92 . 1 1 96 96 ILE N N 15 . 1 1 96 96 ILE H H 1 0.8066 0.0309 . . . 138 ILE N . 138 ILE H 30523 1 93 . 1 1 97 97 VAL N N 15 . 1 1 97 97 VAL H H 1 0.8224 0.0109 . . . 139 VAL N . 139 VAL H 30523 1 94 . 1 1 98 98 GLU N N 15 . 1 1 98 98 GLU H H 1 0.7908 0.0120 . . . 140 GLU N . 140 GLU H 30523 1 95 . 1 1 99 99 ALA N N 15 . 1 1 99 99 ALA H H 1 0.8227 0.0099 . . . 141 ALA N . 141 ALA H 30523 1 96 . 1 1 100 100 ASN N N 15 . 1 1 100 100 ASN H H 1 0.8341 0.0146 . . . 142 ASN N . 142 ASN H 30523 1 97 . 1 1 101 101 ALA N N 15 . 1 1 101 101 ALA H H 1 0.7965 0.0076 . . . 143 ALA N . 143 ALA H 30523 1 98 . 1 1 103 103 ASN N N 15 . 1 1 103 103 ASN H H 1 0.8190 0.0283 . . . 145 ASN N . 145 ASN H 30523 1 99 . 1 1 104 104 ASP N N 15 . 1 1 104 104 ASP H H 1 0.7862 0.0066 . . . 146 ASP N . 146 ASP H 30523 1 100 . 1 1 105 105 VAL N N 15 . 1 1 105 105 VAL H H 1 0.7836 0.0154 . . . 147 VAL N . 147 VAL H 30523 1 101 . 1 1 106 106 LYS N N 15 . 1 1 106 106 LYS H H 1 0.8244 0.0059 . . . 148 LYS N . 148 LYS H 30523 1 102 . 1 1 107 107 THR N N 15 . 1 1 107 107 THR H H 1 0.7266 0.0094 . . . 149 THR N . 149 THR H 30523 1 103 . 1 1 108 108 ILE N N 15 . 1 1 108 108 ILE H H 1 0.7695 0.0091 . . . 150 ILE N . 150 ILE H 30523 1 104 . 1 1 109 109 ALA N N 15 . 1 1 109 109 ALA H H 1 0.7953 0.0144 . . . 151 ALA N . 151 ALA H 30523 1 105 . 1 1 110 110 GLU N N 15 . 1 1 110 110 GLU H H 1 0.7358 0.0183 . . . 152 GLU N . 152 GLU H 30523 1 106 . 1 1 111 111 ASP N N 15 . 1 1 111 111 ASP H H 1 0.8113 0.0256 . . . 153 ASP N . 153 ASP H 30523 1 107 . 1 1 112 112 ALA N N 15 . 1 1 112 112 ALA H H 1 0.8294 0.0110 . . . 154 ALA N . 154 ALA H 30523 1 108 . 1 1 113 113 LYS N N 15 . 1 1 113 113 LYS H H 1 0.8138 0.0060 . . . 155 LYS N . 155 LYS H 30523 1 109 . 1 1 114 114 LYS N N 15 . 1 1 114 114 LYS H H 1 0.7851 0.0201 . . . 156 LYS N . 156 LYS H 30523 1 110 . 1 1 115 115 ILE N N 15 . 1 1 115 115 ILE H H 1 0.7473 0.0059 . . . 157 ILE N . 157 ILE H 30523 1 111 . 1 1 116 116 GLU N N 15 . 1 1 116 116 GLU H H 1 0.8005 0.0197 . . . 158 GLU N . 158 GLU H 30523 1 112 . 1 1 117 117 GLY N N 15 . 1 1 117 117 GLY H H 1 0.7572 0.0237 . . . 159 GLY N . 159 GLY H 30523 1 113 . 1 1 118 118 VAL N N 15 . 1 1 118 118 VAL H H 1 0.8301 0.0138 . . . 160 VAL N . 160 VAL H 30523 1 114 . 1 1 119 119 SER N N 15 . 1 1 119 119 SER H H 1 0.8083 0.0103 . . . 161 SER N . 161 SER H 30523 1 115 . 1 1 120 120 GLU N N 15 . 1 1 120 120 GLU H H 1 0.7470 0.0022 . . . 162 GLU N . 162 GLU H 30523 1 116 . 1 1 121 121 VAL N N 15 . 1 1 121 121 VAL H H 1 0.7919 0.0205 . . . 163 VAL N . 163 VAL H 30523 1 117 . 1 1 122 122 GLN N N 15 . 1 1 122 122 GLN H H 1 0.7626 0.0085 . . . 164 GLN N . 164 GLN H 30523 1 118 . 1 1 123 123 ASP N N 15 . 1 1 123 123 ASP H H 1 0.6847 0.0011 . . . 165 ASP N . 165 ASP H 30523 1 119 . 1 1 124 124 GLY N N 15 . 1 1 124 124 GLY H H 1 0.4640 0.0069 . . . 166 GLY N . 166 GLY H 30523 1 120 . 1 1 125 125 GLY N N 15 . 1 1 125 125 GLY H H 1 0.4738 0.0059 . . . 167 GLY N . 167 GLY H 30523 1 121 . 1 1 126 126 ALA N N 15 . 1 1 126 126 ALA H H 1 0.0346 0.0014 . . . 168 ALA N . 168 ALA H 30523 1 stop_ save_