############################## # 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 26723 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Name . _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 integral' _Heteronucl_NOE_list.NOE_ref_val 0 _Heteronucl_NOE_list.NOE_ref_description 'Normalized to reference integral by nlinLS, the peak fitting routine in NMRPipe' _Heteronucl_NOE_list.Details . _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 16 'Heteronuclear NOE ratio' . . . 26723 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 LYS N N 15 . 1 1 3 3 LYS H H 1 -0.2850 -0.0080 . . . 119 LYS N . 119 LYS H 26723 1 2 . 1 1 5 5 LYS N N 15 . 1 1 5 5 LYS H H 1 0.5156 0.0155 . . . 121 LYS N . 121 LYS H 26723 1 3 . 1 1 6 6 TYR N N 15 . 1 1 6 6 TYR H H 1 0.6864 0.0206 . . . 122 TYR N . 122 TYR H 26723 1 4 . 1 1 7 7 ASN N N 15 . 1 1 7 7 ASN H H 1 0.7431 0.0223 . . . 123 ASN N . 123 ASN H 26723 1 5 . 1 1 9 9 GLU N N 15 . 1 1 9 9 GLU H H 1 0.7686 0.0231 . . . 125 GLU N . 125 GLU H 26723 1 6 . 1 1 10 10 VAL N N 15 . 1 1 10 10 VAL H H 1 0.7574 0.0227 . . . 126 VAL N . 126 VAL H 26723 1 7 . 1 1 11 11 GLU N N 15 . 1 1 11 11 GLU H H 1 0.7778 0.0233 . . . 127 GLU N . 127 GLU H 26723 1 8 . 1 1 12 12 ALA N N 15 . 1 1 12 12 ALA H H 1 0.7535 0.0226 . . . 128 ALA N . 128 ALA H 26723 1 9 . 1 1 13 13 LYS N N 15 . 1 1 13 13 LYS H H 1 0.7488 0.0225 . . . 129 LYS N . 129 LYS H 26723 1 10 . 1 1 14 14 LEU N N 15 . 1 1 14 14 LEU H H 1 0.7691 0.0231 . . . 130 LEU N . 130 LEU H 26723 1 11 . 1 1 15 15 ASP N N 15 . 1 1 15 15 ASP H H 1 0.7856 0.0236 . . . 131 ASP N . 131 ASP H 26723 1 12 . 1 1 16 16 VAL N N 15 . 1 1 16 16 VAL H H 1 0.7955 0.0239 . . . 132 VAL N . 132 VAL H 26723 1 13 . 1 1 17 17 ALA N N 15 . 1 1 17 17 ALA H H 1 0.8065 0.0242 . . . 133 ALA N . 133 ALA H 26723 1 14 . 1 1 18 18 ARG N N 15 . 1 1 18 18 ARG H H 1 0.7761 0.0233 . . . 134 ARG N . 134 ARG H 26723 1 15 . 1 1 19 19 ARG N N 15 . 1 1 19 19 ARG H H 1 0.7791 0.0234 . . . 135 ARG N . 135 ARG H 26723 1 16 . 1 1 20 20 LEU N N 15 . 1 1 20 20 LEU H H 1 0.7798 0.0234 . . . 136 LEU N . 136 LEU H 26723 1 17 . 1 1 21 21 PHE N N 15 . 1 1 21 21 PHE H H 1 0.7084 0.0213 . . . 137 PHE N . 137 PHE H 26723 1 18 . 1 1 22 22 LYS N N 15 . 1 1 22 22 LYS H H 1 0.7631 0.0229 . . . 138 LYS N . 138 LYS H 26723 1 19 . 1 1 23 23 ARG N N 15 . 1 1 23 23 ARG H H 1 0.7336 0.0220 . . . 139 ARG N . 139 ARG H 26723 1 20 . 1 1 24 24 TYR N N 15 . 1 1 24 24 TYR H H 1 0.7376 0.0221 . . . 140 TYR N . 140 TYR H 26723 1 21 . 1 1 25 25 ASP N N 15 . 1 1 25 25 ASP H H 1 0.7256 0.0218 . . . 141 ASP N . 141 ASP H 26723 1 22 . 1 1 26 26 LYS N N 15 . 1 1 26 26 LYS H H 1 0.5933 0.0178 . . . 142 LYS N . 142 LYS H 26723 1 23 . 1 1 27 27 ASP N N 15 . 1 1 27 27 ASP H H 1 0.5993 0.0180 . . . 143 ASP N . 143 ASP H 26723 1 24 . 1 1 28 28 GLY N N 15 . 1 1 28 28 GLY H H 1 0.6796 0.0204 . . . 144 GLY N . 144 GLY H 26723 1 25 . 1 1 29 29 SER N N 15 . 1 1 29 29 SER H H 1 0.6480 0.0194 . . . 145 SER N . 145 SER H 26723 1 26 . 1 1 30 30 GLY N N 15 . 1 1 30 30 GLY H H 1 0.7488 0.0225 . . . 146 GLY N . 146 GLY H 26723 1 27 . 1 1 31 31 GLN N N 15 . 1 1 31 31 GLN H H 1 0.7464 0.0224 . . . 147 GLN N . 147 GLN H 26723 1 28 . 1 1 32 32 LEU N N 15 . 1 1 32 32 LEU H H 1 0.6784 0.0204 . . . 148 LEU N . 148 LEU H 26723 1 29 . 1 1 34 34 ASP N N 15 . 1 1 34 34 ASP H H 1 0.7751 0.0233 . . . 150 ASP N . 150 ASP H 26723 1 30 . 1 1 35 35 ASP N N 15 . 1 1 35 35 ASP H H 1 0.7237 0.0217 . . . 151 ASP N . 151 ASP H 26723 1 31 . 1 1 36 36 GLU N N 15 . 1 1 36 36 GLU H H 1 0.6649 0.0199 . . . 152 GLU N . 152 GLU H 26723 1 32 . 1 1 37 37 ILE N N 15 . 1 1 37 37 ILE H H 1 0.7672 0.0230 . . . 153 ILE N . 153 ILE H 26723 1 33 . 1 1 38 38 ALA N N 15 . 1 1 38 38 ALA H H 1 0.7587 0.0228 . . . 154 ALA N . 154 ALA H 26723 1 34 . 1 1 39 39 GLY N N 15 . 1 1 39 39 GLY H H 1 0.7488 0.0225 . . . 155 GLY N . 155 GLY H 26723 1 35 . 1 1 40 40 LEU N N 15 . 1 1 40 40 LEU H H 1 0.7598 0.0228 . . . 156 LEU N . 156 LEU H 26723 1 36 . 1 1 41 41 LEU N N 15 . 1 1 41 41 LEU H H 1 0.8096 0.0243 . . . 157 LEU N . 157 LEU H 26723 1 37 . 1 1 42 42 LYS N N 15 . 1 1 42 42 LYS H H 1 0.7703 0.0231 . . . 158 LYS N . 158 LYS H 26723 1 38 . 1 1 43 43 ASP N N 15 . 1 1 43 43 ASP H H 1 0.7387 0.0222 . . . 159 ASP N . 159 ASP H 26723 1 39 . 1 1 44 44 THR N N 15 . 1 1 44 44 THR H H 1 0.7332 0.0220 . . . 160 THR N . 160 THR H 26723 1 40 . 1 1 45 45 TYR N N 15 . 1 1 45 45 TYR H H 1 0.7270 0.0218 . . . 161 TYR N . 161 TYR H 26723 1 41 . 1 1 46 46 ALA N N 15 . 1 1 46 46 ALA H H 1 0.7669 0.0230 . . . 162 ALA N . 162 ALA H 26723 1 42 . 1 1 47 47 GLU N N 15 . 1 1 47 47 GLU H H 1 0.7718 0.0232 . . . 163 GLU N . 163 GLU H 26723 1 43 . 1 1 48 48 MET N N 15 . 1 1 48 48 MET H H 1 0.7473 0.0224 . . . 164 MET N . 164 MET H 26723 1 44 . 1 1 49 49 GLY N N 15 . 1 1 49 49 GLY H H 1 0.8007 0.0240 . . . 165 GLY N . 165 GLY H 26723 1 45 . 1 1 50 50 MET N N 15 . 1 1 50 50 MET H H 1 0.7157 0.0215 . . . 166 MET N . 166 MET H 26723 1 46 . 1 1 51 51 SER N N 15 . 1 1 51 51 SER H H 1 0.7803 0.0234 . . . 167 SER N . 167 SER H 26723 1 47 . 1 1 53 53 PHE N N 15 . 1 1 53 53 PHE H H 1 0.7376 0.0221 . . . 169 PHE N . 169 PHE H 26723 1 48 . 1 1 54 54 THR N N 15 . 1 1 54 54 THR H H 1 0.7360 0.0221 . . . 170 THR N . 170 THR H 26723 1 49 . 1 1 56 56 THR N N 15 . 1 1 56 56 THR H H 1 0.7298 0.0219 . . . 172 THR N . 172 THR H 26723 1 50 . 1 1 57 57 LYS N N 15 . 1 1 57 57 LYS H H 1 0.7252 0.0218 . . . 173 LYS N . 173 LYS H 26723 1 51 . 1 1 58 58 GLU N N 15 . 1 1 58 58 GLU H H 1 0.7186 0.0216 . . . 174 GLU N . 174 GLU H 26723 1 52 . 1 1 59 59 ASP N N 15 . 1 1 59 59 ASP H H 1 0.7356 0.0221 . . . 175 ASP N . 175 ASP H 26723 1 53 . 1 1 60 60 VAL N N 15 . 1 1 60 60 VAL H H 1 0.7275 0.0218 . . . 176 VAL N . 176 VAL H 26723 1 54 . 1 1 61 61 LYS N N 15 . 1 1 61 61 LYS H H 1 0.7076 0.0212 . . . 177 LYS N . 177 LYS H 26723 1 55 . 1 1 62 62 ILE N N 15 . 1 1 62 62 ILE H H 1 0.7558 0.0227 . . . 178 ILE N . 178 ILE H 26723 1 56 . 1 1 63 63 TRP N N 15 . 1 1 63 63 TRP H H 1 0.7528 0.0226 . . . 179 TRP N . 179 TRP H 26723 1 57 . 1 1 65 65 GLN N N 15 . 1 1 65 65 GLN H H 1 0.7158 0.0215 . . . 181 GLN N . 181 GLN H 26723 1 58 . 1 1 66 66 MET N N 15 . 1 1 66 66 MET H H 1 0.6516 0.0195 . . . 182 MET N . 182 MET H 26723 1 59 . 1 1 67 67 ALA N N 15 . 1 1 67 67 ALA H H 1 0.6848 0.0205 . . . 183 ALA N . 183 ALA H 26723 1 60 . 1 1 74 74 SER N N 15 . 1 1 74 74 SER H H 1 0.6919 0.0208 . . . 190 SER N . 190 SER H 26723 1 61 . 1 1 75 75 VAL N N 15 . 1 1 75 75 VAL H H 1 0.7210 0.0216 . . . 191 VAL N . 191 VAL H 26723 1 62 . 1 1 77 77 LEU N N 15 . 1 1 77 77 LEU H H 1 0.7574 0.0227 . . . 193 LEU N . 193 LEU H 26723 1 63 . 1 1 78 78 GLU N N 15 . 1 1 78 78 GLU H H 1 0.7725 0.0232 . . . 194 GLU N . 194 GLU H 26723 1 64 . 1 1 79 79 GLU N N 15 . 1 1 79 79 GLU H H 1 0.7947 0.0238 . . . 195 GLU N . 195 GLU H 26723 1 65 . 1 1 80 80 TYR N N 15 . 1 1 80 80 TYR H H 1 0.7591 0.0228 . . . 196 TYR N . 196 TYR H 26723 1 66 . 1 1 81 81 GLU N N 15 . 1 1 81 81 GLU H H 1 0.7852 0.0236 . . . 197 GLU N . 197 GLU H 26723 1 67 . 1 1 82 82 ASP N N 15 . 1 1 82 82 ASP H H 1 0.7677 0.0230 . . . 198 ASP N . 198 ASP H 26723 1 68 . 1 1 83 83 LEU N N 15 . 1 1 83 83 LEU H H 1 0.7911 0.0237 . . . 199 LEU N . 199 LEU H 26723 1 69 . 1 1 84 84 ILE N N 15 . 1 1 84 84 ILE H H 1 0.7655 0.0230 . . . 200 ILE N . 200 ILE H 26723 1 70 . 1 1 85 85 ILE N N 15 . 1 1 85 85 ILE H H 1 0.7354 0.0221 . . . 201 ILE N . 201 ILE H 26723 1 71 . 1 1 86 86 LYS N N 15 . 1 1 86 86 LYS H H 1 0.8366 0.0251 . . . 202 LYS N . 202 LYS H 26723 1 72 . 1 1 87 87 SER N N 15 . 1 1 87 87 SER H H 1 0.7407 0.0222 . . . 203 SER N . 203 SER H 26723 1 73 . 1 1 88 88 LEU N N 15 . 1 1 88 88 LEU H H 1 0.7706 0.0231 . . . 204 LEU N . 204 LEU H 26723 1 74 . 1 1 89 89 GLN N N 15 . 1 1 89 89 GLN H H 1 0.7151 0.0215 . . . 205 GLN N . 205 GLN H 26723 1 75 . 1 1 90 90 LYS N N 15 . 1 1 90 90 LYS H H 1 0.7491 0.0225 . . . 206 LYS N . 206 LYS H 26723 1 76 . 1 1 91 91 ALA N N 15 . 1 1 91 91 ALA H H 1 0.7472 0.0224 . . . 207 ALA N . 207 ALA H 26723 1 77 . 1 1 92 92 GLY N N 15 . 1 1 92 92 GLY H H 1 0.6844 0.0205 . . . 208 GLY N . 208 GLY H 26723 1 78 . 1 1 93 93 ILE N N 15 . 1 1 93 93 ILE H H 1 0.7215 0.0216 . . . 209 ILE N . 209 ILE H 26723 1 79 . 1 1 94 94 ARG N N 15 . 1 1 94 94 ARG H H 1 0.6292 0.0189 . . . 210 ARG N . 210 ARG H 26723 1 80 . 1 1 95 95 VAL N N 15 . 1 1 95 95 VAL H H 1 0.6017 0.0181 . . . 211 VAL N . 211 VAL H 26723 1 81 . 1 1 96 96 GLU N N 15 . 1 1 96 96 GLU H H 1 0.6800 0.0204 . . . 212 GLU N . 212 GLU H 26723 1 82 . 1 1 97 97 LYS N N 15 . 1 1 97 97 LYS H H 1 0.5727 0.0172 . . . 213 LYS N . 213 LYS H 26723 1 83 . 1 1 98 98 GLN N N 15 . 1 1 98 98 GLN H H 1 0.5331 0.0160 . . . 214 GLN N . 214 GLN H 26723 1 84 . 1 1 99 99 SER N N 15 . 1 1 99 99 SER H H 1 0.1852 0.0056 . . . 215 SER N . 215 SER H 26723 1 85 . 1 1 100 100 LEU N N 15 . 1 1 100 100 LEU H H 1 -0.0840 -0.0020 . . . 216 LEU N . 216 LEU H 26723 1 86 . 1 1 101 101 VAL N N 15 . 1 1 101 101 VAL H H 1 -0.3990 -0.0120 . . . 217 VAL N . 217 VAL H 26723 1 87 . 1 1 102 102 PHE N N 15 . 1 1 102 102 PHE H H 1 -0.7180 -0.0210 . . . 218 PHE N . 218 PHE H 26723 1 stop_ save_