############################## # 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 16342 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $pH3 _Heteronucl_NOE_list.Spectrometer_frequency_1H 600 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak height' _Heteronucl_NOE_list.NOE_ref_val 0 _Heteronucl_NOE_list.NOE_ref_description . _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 4 '2D Heteronuclear NOE' . . . 16342 1 stop_ loop_ _Heteronucl_NOE_software.Software_ID _Heteronucl_NOE_software.Software_label _Heteronucl_NOE_software.Method_ID _Heteronucl_NOE_software.Method_label _Heteronucl_NOE_software.Entry_ID _Heteronucl_NOE_software.Heteronucl_NOE_list_ID 1 $NMRPipe . . 16342 1 3 $SPARKY . . 16342 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 2 2 ASP N N 15 . 1 1 2 2 ASP H H 1 -1.47 0.158 . . . . . . . . . . 16342 1 2 . 1 1 3 3 VAL N N 15 . 1 1 3 3 VAL H H 1 0.125 0.065 . . . . . . . . . . 16342 1 3 . 1 1 4 4 PHE N N 15 . 1 1 4 4 PHE H H 1 -0.316 0.091 . . . . . . . . . . 16342 1 4 . 1 1 5 5 MET N N 15 . 1 1 5 5 MET H H 1 -0.319 0.081 . . . . . . . . . . 16342 1 5 . 1 1 6 6 LYS N N 15 . 1 1 6 6 LYS H H 1 0.0794 0.066 . . . . . . . . . . 16342 1 6 . 1 1 7 7 GLY N N 15 . 1 1 7 7 GLY H H 1 -0.065 0.045 . . . . . . . . . . 16342 1 7 . 1 1 8 8 LEU N N 15 . 1 1 8 8 LEU H H 1 -0.0445 0.082 . . . . . . . . . . 16342 1 8 . 1 1 9 9 SER N N 15 . 1 1 9 9 SER H H 1 -0.221 0.079 . . . . . . . . . . 16342 1 9 . 1 1 10 10 LYS N N 15 . 1 1 10 10 LYS H H 1 -0.179 0.066 . . . . . . . . . . 16342 1 10 . 1 1 11 11 ALA N N 15 . 1 1 11 11 ALA H H 1 0.0182 0.050 . . . . . . . . . . 16342 1 11 . 1 1 12 12 LYS N N 15 . 1 1 12 12 LYS H H 1 0.0738 0.054 . . . . . . . . . . 16342 1 12 . 1 1 13 13 GLU N N 15 . 1 1 13 13 GLU H H 1 -0.113 0.044 . . . . . . . . . . 16342 1 13 . 1 1 14 14 GLY N N 15 . 1 1 14 14 GLY H H 1 -0.145 0.080 . . . . . . . . . . 16342 1 14 . 1 1 15 15 VAL N N 15 . 1 1 15 15 VAL H H 1 -0.133 0.048 . . . . . . . . . . 16342 1 15 . 1 1 16 16 VAL N N 15 . 1 1 16 16 VAL H H 1 -0.258 0.063 . . . . . . . . . . 16342 1 16 . 1 1 17 17 ALA N N 15 . 1 1 17 17 ALA H H 1 -0.317 0.043 . . . . . . . . . . 16342 1 17 . 1 1 18 18 ALA N N 15 . 1 1 18 18 ALA H H 1 0.0431 0.023 . . . . . . . . . . 16342 1 18 . 1 1 19 19 ALA N N 15 . 1 1 19 19 ALA H H 1 0.111 0.041 . . . . . . . . . . 16342 1 19 . 1 1 20 20 GLU N N 15 . 1 1 20 20 GLU H H 1 -0.138 0.043 . . . . . . . . . . 16342 1 20 . 1 1 21 21 LYS N N 15 . 1 1 21 21 LYS H H 1 -0.00286 0.050 . . . . . . . . . . 16342 1 21 . 1 1 22 22 THR N N 15 . 1 1 22 22 THR H H 1 -0.159 0.030 . . . . . . . . . . 16342 1 22 . 1 1 23 23 LYS N N 15 . 1 1 23 23 LYS H H 1 -0.016 0.045 . . . . . . . . . . 16342 1 23 . 1 1 25 25 GLY N N 15 . 1 1 25 25 GLY H H 1 -0.372 0.060 . . . . . . . . . . 16342 1 24 . 1 1 26 26 VAL N N 15 . 1 1 26 26 VAL H H 1 0.0168 0.042 . . . . . . . . . . 16342 1 25 . 1 1 27 27 ALA N N 15 . 1 1 27 27 ALA H H 1 -0.279 0.037 . . . . . . . . . . 16342 1 26 . 1 1 28 28 GLU N N 15 . 1 1 28 28 GLU H H 1 -0.00316 0.042 . . . . . . . . . . 16342 1 27 . 1 1 29 29 ALA N N 15 . 1 1 29 29 ALA H H 1 -0.12 0.044 . . . . . . . . . . 16342 1 28 . 1 1 31 31 GLY N N 15 . 1 1 31 31 GLY H H 1 -0.168 0.044 . . . . . . . . . . 16342 1 29 . 1 1 32 32 LYS N N 15 . 1 1 32 32 LYS H H 1 -0.083 0.047 . . . . . . . . . . 16342 1 30 . 1 1 33 33 THR N N 15 . 1 1 33 33 THR H H 1 -0.0859 0.048 . . . . . . . . . . 16342 1 31 . 1 1 34 34 LYS N N 15 . 1 1 34 34 LYS H H 1 -0.109 0.050 . . . . . . . . . . 16342 1 32 . 1 1 36 36 GLY N N 15 . 1 1 36 36 GLY H H 1 -0.275 0.044 . . . . . . . . . . 16342 1 33 . 1 1 37 37 VAL N N 15 . 1 1 37 37 VAL H H 1 0.073 0.046 . . . . . . . . . . 16342 1 34 . 1 1 38 38 LEU N N 15 . 1 1 38 38 LEU H H 1 0.0508 0.051 . . . . . . . . . . 16342 1 35 . 1 1 39 39 TYR N N 15 . 1 1 39 39 TYR H H 1 0.00377 0.046 . . . . . . . . . . 16342 1 36 . 1 1 41 41 GLY N N 15 . 1 1 41 41 GLY H H 1 -0.0852 0.049 . . . . . . . . . . 16342 1 37 . 1 1 42 42 SER N N 15 . 1 1 42 42 SER H H 1 0.21 0.042 . . . . . . . . . . 16342 1 38 . 1 1 43 43 LYS N N 15 . 1 1 43 43 LYS H H 1 -0.00561 0.049 . . . . . . . . . . 16342 1 39 . 1 1 45 45 LYS N N 15 . 1 1 45 45 LYS H H 1 -0.248 0.047 . . . . . . . . . . 16342 1 40 . 1 1 46 46 GLU N N 15 . 1 1 46 46 GLU H H 1 -0.19 0.044 . . . . . . . . . . 16342 1 41 . 1 1 48 48 VAL N N 15 . 1 1 48 48 VAL H H 1 0.116 0.038 . . . . . . . . . . 16342 1 42 . 1 1 49 49 VAL N N 15 . 1 1 49 49 VAL H H 1 -0.0618 0.044 . . . . . . . . . . 16342 1 43 . 1 1 50 50 HIS N N 15 . 1 1 50 50 HIS H H 1 -0.117 0.040 . . . . . . . . . . 16342 1 44 . 1 1 51 51 GLY N N 15 . 1 1 51 51 GLY H H 1 -0.203 0.041 . . . . . . . . . . 16342 1 45 . 1 1 52 52 VAL N N 15 . 1 1 52 52 VAL H H 1 -0.304 0.047 . . . . . . . . . . 16342 1 46 . 1 1 53 53 ALA N N 15 . 1 1 53 53 ALA H H 1 -0.311 0.043 . . . . . . . . . . 16342 1 47 . 1 1 54 54 THR N N 15 . 1 1 54 54 THR H H 1 -0.208 0.041 . . . . . . . . . . 16342 1 48 . 1 1 55 55 VAL N N 15 . 1 1 55 55 VAL H H 1 0.248 0.047 . . . . . . . . . . 16342 1 49 . 1 1 56 56 ALA N N 15 . 1 1 56 56 ALA H H 1 -0.418 0.047 . . . . . . . . . . 16342 1 50 . 1 1 57 57 GLU N N 15 . 1 1 57 57 GLU H H 1 0.0395 0.044 . . . . . . . . . . 16342 1 51 . 1 1 58 58 LYS N N 15 . 1 1 58 58 LYS H H 1 -0.21 0.044 . . . . . . . . . . 16342 1 52 . 1 1 59 59 THR N N 15 . 1 1 59 59 THR H H 1 -0.00551 0.046 . . . . . . . . . . 16342 1 53 . 1 1 60 60 LYS N N 15 . 1 1 60 60 LYS H H 1 -0.189 0.053 . . . . . . . . . . 16342 1 54 . 1 1 61 61 GLU N N 15 . 1 1 61 61 GLU H H 1 -0.138 0.038 . . . . . . . . . . 16342 1 55 . 1 1 62 62 GLN N N 15 . 1 1 62 62 GLN H H 1 0.0203 0.047 . . . . . . . . . . 16342 1 56 . 1 1 63 63 VAL N N 15 . 1 1 63 63 VAL H H 1 0.0262 0.048 . . . . . . . . . . 16342 1 57 . 1 1 64 64 THR N N 15 . 1 1 64 64 THR H H 1 0.0959 0.044 . . . . . . . . . . 16342 1 58 . 1 1 65 65 ASN N N 15 . 1 1 65 65 ASN H H 1 -0.124 0.050 . . . . . . . . . . 16342 1 59 . 1 1 66 66 VAL N N 15 . 1 1 66 66 VAL H H 1 -0.378 0.081 . . . . . . . . . . 16342 1 60 . 1 1 67 67 GLY N N 15 . 1 1 67 67 GLY H H 1 -0.106 0.037 . . . . . . . . . . 16342 1 61 . 1 1 68 68 GLY N N 15 . 1 1 68 68 GLY H H 1 -0.092 0.039 . . . . . . . . . . 16342 1 62 . 1 1 69 69 ALA N N 15 . 1 1 69 69 ALA H H 1 -0.229 0.036 . . . . . . . . . . 16342 1 63 . 1 1 70 70 VAL N N 15 . 1 1 70 70 VAL H H 1 -0.116 0.038 . . . . . . . . . . 16342 1 64 . 1 1 71 71 VAL N N 15 . 1 1 71 71 VAL H H 1 -0.389 0.050 . . . . . . . . . . 16342 1 65 . 1 1 72 72 THR N N 15 . 1 1 72 72 THR H H 1 -0.0717 0.043 . . . . . . . . . . 16342 1 66 . 1 1 73 73 GLY N N 15 . 1 1 73 73 GLY H H 1 -0.358 0.048 . . . . . . . . . . 16342 1 67 . 1 1 74 74 VAL N N 15 . 1 1 74 74 VAL H H 1 -0.211 0.041 . . . . . . . . . . 16342 1 68 . 1 1 75 75 THR N N 15 . 1 1 75 75 THR H H 1 -0.176 0.043 . . . . . . . . . . 16342 1 69 . 1 1 76 76 ALA N N 15 . 1 1 76 76 ALA H H 1 -0.426 0.043 . . . . . . . . . . 16342 1 70 . 1 1 77 77 VAL N N 15 . 1 1 77 77 VAL H H 1 -0.287 0.045 . . . . . . . . . . 16342 1 71 . 1 1 78 78 ALA N N 15 . 1 1 78 78 ALA H H 1 -0.41 0.035 . . . . . . . . . . 16342 1 72 . 1 1 79 79 GLN N N 15 . 1 1 79 79 GLN H H 1 -0.374 0.044 . . . . . . . . . . 16342 1 73 . 1 1 80 80 LYS N N 15 . 1 1 80 80 LYS H H 1 -0.0899 0.040 . . . . . . . . . . 16342 1 74 . 1 1 81 81 THR N N 15 . 1 1 81 81 THR H H 1 0.0563 0.045 . . . . . . . . . . 16342 1 75 . 1 1 82 82 VAL N N 15 . 1 1 82 82 VAL H H 1 -0.155 0.054 . . . . . . . . . . 16342 1 76 . 1 1 83 83 GLU N N 15 . 1 1 83 83 GLU H H 1 -0.129 0.044 . . . . . . . . . . 16342 1 77 . 1 1 84 84 GLY N N 15 . 1 1 84 84 GLY H H 1 -0.219 0.041 . . . . . . . . . . 16342 1 78 . 1 1 85 85 ALA N N 15 . 1 1 85 85 ALA H H 1 -0.0205 0.034 . . . . . . . . . . 16342 1 79 . 1 1 86 86 GLY N N 15 . 1 1 86 86 GLY H H 1 -0.299 0.041 . . . . . . . . . . 16342 1 80 . 1 1 87 87 SER N N 15 . 1 1 87 87 SER H H 1 -0.321 0.040 . . . . . . . . . . 16342 1 81 . 1 1 88 88 ILE N N 15 . 1 1 88 88 ILE H H 1 -0.154 0.050 . . . . . . . . . . 16342 1 82 . 1 1 89 89 ALA N N 15 . 1 1 89 89 ALA H H 1 -0.26 0.037 . . . . . . . . . . 16342 1 83 . 1 1 90 90 ALA N N 15 . 1 1 90 90 ALA H H 1 -0.174 0.044 . . . . . . . . . . 16342 1 84 . 1 1 91 91 ALA N N 15 . 1 1 91 91 ALA H H 1 -0.0836 0.021 . . . . . . . . . . 16342 1 85 . 1 1 92 92 THR N N 15 . 1 1 92 92 THR H H 1 -0.248 0.044 . . . . . . . . . . 16342 1 86 . 1 1 93 93 GLY N N 15 . 1 1 93 93 GLY H H 1 0.0555 0.047 . . . . . . . . . . 16342 1 87 . 1 1 94 94 PHE N N 15 . 1 1 94 94 PHE H H 1 -0.099 0.047 . . . . . . . . . . 16342 1 88 . 1 1 95 95 VAL N N 15 . 1 1 95 95 VAL H H 1 -0.0701 0.054 . . . . . . . . . . 16342 1 89 . 1 1 96 96 LYS N N 15 . 1 1 96 96 LYS H H 1 0.11 0.041 . . . . . . . . . . 16342 1 90 . 1 1 97 97 LYS N N 15 . 1 1 97 97 LYS H H 1 -0.0471 0.040 . . . . . . . . . . 16342 1 91 . 1 1 98 98 ASP N N 15 . 1 1 98 98 ASP H H 1 0.0892 0.050 . . . . . . . . . . 16342 1 92 . 1 1 99 99 GLN N N 15 . 1 1 99 99 GLN H H 1 -0.0481 0.040 . . . . . . . . . . 16342 1 93 . 1 1 100 100 LEU N N 15 . 1 1 100 100 LEU H H 1 0.014 0.044 . . . . . . . . . . 16342 1 94 . 1 1 101 101 GLY N N 15 . 1 1 101 101 GLY H H 1 -0.156 0.047 . . . . . . . . . . 16342 1 95 . 1 1 102 102 LYS N N 15 . 1 1 102 102 LYS H H 1 0.174 0.041 . . . . . . . . . . 16342 1 96 . 1 1 103 103 ASN N N 15 . 1 1 103 103 ASN H H 1 0.178 0.036 . . . . . . . . . . 16342 1 97 . 1 1 104 104 GLU N N 15 . 1 1 104 104 GLU H H 1 0.0948 0.042 . . . . . . . . . . 16342 1 98 . 1 1 105 105 GLU N N 15 . 1 1 105 105 GLU H H 1 -0.159 0.042 . . . . . . . . . . 16342 1 99 . 1 1 106 106 GLY N N 15 . 1 1 106 106 GLY H H 1 -0.347 0.042 . . . . . . . . . . 16342 1 100 . 1 1 107 107 ALA N N 15 . 1 1 107 107 ALA H H 1 -0.0142 0.039 . . . . . . . . . . 16342 1 101 . 1 1 109 109 GLN N N 15 . 1 1 109 109 GLN H H 1 0.0709 0.055 . . . . . . . . . . 16342 1 102 . 1 1 110 110 GLU N N 15 . 1 1 110 110 GLU H H 1 -0.0151 0.049 . . . . . . . . . . 16342 1 103 . 1 1 111 111 GLY N N 15 . 1 1 111 111 GLY H H 1 -0.152 0.043 . . . . . . . . . . 16342 1 104 . 1 1 112 112 ILE N N 15 . 1 1 112 112 ILE H H 1 0.391 0.054 . . . . . . . . . . 16342 1 105 . 1 1 113 113 LEU N N 15 . 1 1 113 113 LEU H H 1 0.0123 0.056 . . . . . . . . . . 16342 1 106 . 1 1 114 114 GLU N N 15 . 1 1 114 114 GLU H H 1 0.0143 0.046 . . . . . . . . . . 16342 1 107 . 1 1 115 115 ASP N N 15 . 1 1 115 115 ASP H H 1 -0.0617 0.067 . . . . . . . . . . 16342 1 108 . 1 1 116 116 MET N N 15 . 1 1 116 116 MET H H 1 0.0256 0.064 . . . . . . . . . . 16342 1 109 . 1 1 118 118 VAL N N 15 . 1 1 118 118 VAL H H 1 -0.0261 0.047 . . . . . . . . . . 16342 1 110 . 1 1 119 119 ASP N N 15 . 1 1 119 119 ASP H H 1 0.384 0.063 . . . . . . . . . . 16342 1 111 . 1 1 121 121 ASP N N 15 . 1 1 121 121 ASP H H 1 0.164 0.069 . . . . . . . . . . 16342 1 112 . 1 1 122 122 ASN N N 15 . 1 1 122 122 ASN H H 1 0.234 0.063 . . . . . . . . . . 16342 1 113 . 1 1 123 123 GLU N N 15 . 1 1 123 123 GLU H H 1 0.344 0.070 . . . . . . . . . . 16342 1 114 . 1 1 124 124 ALA N N 15 . 1 1 124 124 ALA H H 1 0.303 0.053 . . . . . . . . . . 16342 1 115 . 1 1 125 125 TYR N N 15 . 1 1 125 125 TYR H H 1 0.303 0.063 . . . . . . . . . . 16342 1 116 . 1 1 126 126 GLU N N 15 . 1 1 126 126 GLU H H 1 0.283 0.065 . . . . . . . . . . 16342 1 117 . 1 1 127 127 MET N N 15 . 1 1 127 127 MET H H 1 0.337 0.050 . . . . . . . . . . 16342 1 118 . 1 1 129 129 SER N N 15 . 1 1 129 129 SER H H 1 0.0899 0.055 . . . . . . . . . . 16342 1 119 . 1 1 130 130 GLU N N 15 . 1 1 130 130 GLU H H 1 0.334 0.068 . . . . . . . . . . 16342 1 120 . 1 1 131 131 GLU N N 15 . 1 1 131 131 GLU H H 1 0.173 0.030 . . . . . . . . . . 16342 1 121 . 1 1 132 132 GLY N N 15 . 1 1 132 132 GLY H H 1 0.0336 0.041 . . . . . . . . . . 16342 1 122 . 1 1 133 133 TYR N N 15 . 1 1 133 133 TYR H H 1 0.168 0.045 . . . . . . . . . . 16342 1 123 . 1 1 134 134 GLN N N 15 . 1 1 134 134 GLN H H 1 -0.311 0.064 . . . . . . . . . . 16342 1 124 . 1 1 135 135 ASP N N 15 . 1 1 135 135 ASP H H 1 0.284 0.066 . . . . . . . . . . 16342 1 125 . 1 1 136 136 TYR N N 15 . 1 1 136 136 TYR H H 1 -0.0741 0.049 . . . . . . . . . . 16342 1 126 . 1 1 137 137 GLU N N 15 . 1 1 137 137 GLU H H 1 -0.153 0.055 . . . . . . . . . . 16342 1 127 . 1 1 139 139 GLU N N 15 . 1 1 139 139 GLU H H 1 -0.484 0.044 . . . . . . . . . . 16342 1 128 . 1 1 140 140 ALA N N 15 . 1 1 140 140 ALA H H 1 -0.928 0.055 . . . . . . . . . . 16342 1 stop_ save_