############################## # Heteronuclear NOE values # ############################## save_heteronucl_NOEs_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronucl_NOEs_1 _Heteronucl_NOE_list.Entry_ID 51530 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Name '1H-15N heteronuclear nOes of calcium loaded human calmodulin in complex with the antagonist calmidazolium' _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 599.3928 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak integral' _Heteronucl_NOE_list.NOE_ref_val 1 _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 3 '1H-15N heteronoe' . . . 51530 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 $software_1 . . 51530 1 2 $software_2 . . 51530 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 GLN N N 15 . 1 1 3 3 GLN H H 1 -0.488 0.150 . . . . . . . . . . 51530 1 2 . 1 1 4 4 LEU N N 15 . 1 1 4 4 LEU H H 1 0.313 0.027 . . . . . . . . . . 51530 1 3 . 1 1 5 5 THR N N 15 . 1 1 5 5 THR H H 1 0.750 0.058 . . . . . . . . . . 51530 1 4 . 1 1 6 6 GLU N N 15 . 1 1 6 6 GLU H H 1 0.748 0.046 . . . . . . . . . . 51530 1 5 . 1 1 7 7 GLU N N 15 . 1 1 7 7 GLU H H 1 0.820 0.033 . . . . . . . . . . 51530 1 6 . 1 1 9 9 ILE N N 15 . 1 1 9 9 ILE H H 1 0.792 0.070 . . . . . . . . . . 51530 1 7 . 1 1 10 10 ALA N N 15 . 1 1 10 10 ALA H H 1 0.795 0.041 . . . . . . . . . . 51530 1 8 . 1 1 11 11 GLU N N 15 . 1 1 11 11 GLU H H 1 0.795 0.044 . . . . . . . . . . 51530 1 9 . 1 1 13 13 LYS N N 15 . 1 1 13 13 LYS H H 1 0.831 0.067 . . . . . . . . . . 51530 1 10 . 1 1 15 15 ALA N N 15 . 1 1 15 15 ALA H H 1 0.737 0.053 . . . . . . . . . . 51530 1 11 . 1 1 17 17 SER N N 15 . 1 1 17 17 SER H H 1 0.828 0.099 . . . . . . . . . . 51530 1 12 . 1 1 18 18 LEU N N 15 . 1 1 18 18 LEU H H 1 0.800 0.046 . . . . . . . . . . 51530 1 13 . 1 1 19 19 PHE N N 15 . 1 1 19 19 PHE H H 1 0.787 0.114 . . . . . . . . . . 51530 1 14 . 1 1 20 20 ASP N N 15 . 1 1 20 20 ASP H H 1 0.742 0.049 . . . . . . . . . . 51530 1 15 . 1 1 21 21 LYS N N 15 . 1 1 21 21 LYS H H 1 0.679 0.052 . . . . . . . . . . 51530 1 16 . 1 1 22 22 ASP N N 15 . 1 1 22 22 ASP H H 1 0.824 0.036 . . . . . . . . . . 51530 1 17 . 1 1 23 23 GLY N N 15 . 1 1 23 23 GLY H H 1 0.860 0.035 . . . . . . . . . . 51530 1 18 . 1 1 24 24 ASP N N 15 . 1 1 24 24 ASP H H 1 0.826 0.029 . . . . . . . . . . 51530 1 19 . 1 1 25 25 GLY N N 15 . 1 1 25 25 GLY H H 1 0.797 0.037 . . . . . . . . . . 51530 1 20 . 1 1 26 26 THR N N 15 . 1 1 26 26 THR H H 1 0.793 0.035 . . . . . . . . . . 51530 1 21 . 1 1 27 27 ILE N N 15 . 1 1 27 27 ILE H H 1 0.792 0.052 . . . . . . . . . . 51530 1 22 . 1 1 28 28 THR N N 15 . 1 1 28 28 THR H H 1 0.838 0.049 . . . . . . . . . . 51530 1 23 . 1 1 29 29 THR N N 15 . 1 1 29 29 THR H H 1 0.779 0.063 . . . . . . . . . . 51530 1 24 . 1 1 30 30 LYS N N 15 . 1 1 30 30 LYS H H 1 0.733 0.074 . . . . . . . . . . 51530 1 25 . 1 1 31 31 GLU N N 15 . 1 1 31 31 GLU H H 1 0.895 0.076 . . . . . . . . . . 51530 1 26 . 1 1 32 32 LEU N N 15 . 1 1 32 32 LEU H H 1 0.796 0.047 . . . . . . . . . . 51530 1 27 . 1 1 33 33 GLY N N 15 . 1 1 33 33 GLY H H 1 0.894 0.051 . . . . . . . . . . 51530 1 28 . 1 1 34 34 THR N N 15 . 1 1 34 34 THR H H 1 0.806 0.027 . . . . . . . . . . 51530 1 29 . 1 1 35 35 VAL N N 15 . 1 1 35 35 VAL H H 1 0.718 0.041 . . . . . . . . . . 51530 1 30 . 1 1 36 36 MET N N 15 . 1 1 36 36 MET H H 1 0.816 0.047 . . . . . . . . . . 51530 1 31 . 1 1 37 37 ARG N N 15 . 1 1 37 37 ARG H H 1 0.624 0.049 . . . . . . . . . . 51530 1 32 . 1 1 39 39 LEU N N 15 . 1 1 39 39 LEU H H 1 0.800 0.051 . . . . . . . . . . 51530 1 33 . 1 1 40 40 GLY N N 15 . 1 1 40 40 GLY H H 1 0.563 0.185 . . . . . . . . . . 51530 1 34 . 1 1 41 41 GLN N N 15 . 1 1 41 41 GLN H H 1 0.735 0.030 . . . . . . . . . . 51530 1 35 . 1 1 42 42 ASN N N 15 . 1 1 42 42 ASN H H 1 0.590 0.171 . . . . . . . . . . 51530 1 36 . 1 1 44 44 THR N N 15 . 1 1 44 44 THR H H 1 0.701 0.028 . . . . . . . . . . 51530 1 37 . 1 1 45 45 GLU N N 15 . 1 1 45 45 GLU H H 1 0.784 0.040 . . . . . . . . . . 51530 1 38 . 1 1 46 46 ALA N N 15 . 1 1 46 46 ALA H H 1 0.737 0.032 . . . . . . . . . . 51530 1 39 . 1 1 47 47 GLU N N 15 . 1 1 47 47 GLU H H 1 0.754 0.034 . . . . . . . . . . 51530 1 40 . 1 1 48 48 LEU N N 15 . 1 1 48 48 LEU H H 1 0.826 0.040 . . . . . . . . . . 51530 1 41 . 1 1 49 49 GLN N N 15 . 1 1 49 49 GLN H H 1 0.807 0.068 . . . . . . . . . . 51530 1 42 . 1 1 50 50 ASP N N 15 . 1 1 50 50 ASP H H 1 0.798 0.019 . . . . . . . . . . 51530 1 43 . 1 1 53 53 ASN N N 15 . 1 1 53 53 ASN H H 1 0.757 0.059 . . . . . . . . . . 51530 1 44 . 1 1 54 54 GLU N N 15 . 1 1 54 54 GLU H H 1 0.790 0.065 . . . . . . . . . . 51530 1 45 . 1 1 55 55 VAL N N 15 . 1 1 55 55 VAL H H 1 0.789 0.065 . . . . . . . . . . 51530 1 46 . 1 1 56 56 ASP N N 15 . 1 1 56 56 ASP H H 1 0.700 0.041 . . . . . . . . . . 51530 1 47 . 1 1 57 57 ALA N N 15 . 1 1 57 57 ALA H H 1 0.710 0.050 . . . . . . . . . . 51530 1 48 . 1 1 58 58 ASP N N 15 . 1 1 58 58 ASP H H 1 0.804 0.033 . . . . . . . . . . 51530 1 49 . 1 1 59 59 GLY N N 15 . 1 1 59 59 GLY H H 1 0.833 0.033 . . . . . . . . . . 51530 1 50 . 1 1 60 60 ASN N N 15 . 1 1 60 60 ASN H H 1 0.750 0.029 . . . . . . . . . . 51530 1 51 . 1 1 61 61 GLY N N 15 . 1 1 61 61 GLY H H 1 0.860 0.043 . . . . . . . . . . 51530 1 52 . 1 1 62 62 THR N N 15 . 1 1 62 62 THR H H 1 0.832 0.026 . . . . . . . . . . 51530 1 53 . 1 1 63 63 ILE N N 15 . 1 1 63 63 ILE H H 1 0.753 0.073 . . . . . . . . . . 51530 1 54 . 1 1 64 64 ASP N N 15 . 1 1 64 64 ASP H H 1 0.882 0.078 . . . . . . . . . . 51530 1 55 . 1 1 65 65 PHE N N 15 . 1 1 65 65 PHE H H 1 0.893 0.055 . . . . . . . . . . 51530 1 56 . 1 1 67 67 GLU N N 15 . 1 1 67 67 GLU H H 1 0.772 0.073 . . . . . . . . . . 51530 1 57 . 1 1 68 68 PHE N N 15 . 1 1 68 68 PHE H H 1 0.763 0.082 . . . . . . . . . . 51530 1 58 . 1 1 69 69 LEU N N 15 . 1 1 69 69 LEU H H 1 0.791 0.052 . . . . . . . . . . 51530 1 59 . 1 1 70 70 THR N N 15 . 1 1 70 70 THR H H 1 0.833 0.046 . . . . . . . . . . 51530 1 60 . 1 1 71 71 MET N N 15 . 1 1 71 71 MET H H 1 0.766 0.068 . . . . . . . . . . 51530 1 61 . 1 1 73 73 ALA N N 15 . 1 1 73 73 ALA H H 1 0.697 0.050 . . . . . . . . . . 51530 1 62 . 1 1 74 74 ARG N N 15 . 1 1 74 74 ARG H H 1 0.822 0.072 . . . . . . . . . . 51530 1 63 . 1 1 80 80 ASP N N 15 . 1 1 80 80 ASP H H 1 0.623 0.077 . . . . . . . . . . 51530 1 64 . 1 1 81 81 SER N N 15 . 1 1 81 81 SER H H 1 0.630 0.060 . . . . . . . . . . 51530 1 65 . 1 1 84 84 GLU N N 15 . 1 1 84 84 GLU H H 1 0.877 0.064 . . . . . . . . . . 51530 1 66 . 1 1 85 85 ILE N N 15 . 1 1 85 85 ILE H H 1 0.741 0.061 . . . . . . . . . . 51530 1 67 . 1 1 86 86 ARG N N 15 . 1 1 86 86 ARG H H 1 0.841 0.049 . . . . . . . . . . 51530 1 68 . 1 1 87 87 GLU N N 15 . 1 1 87 87 GLU H H 1 0.801 0.034 . . . . . . . . . . 51530 1 69 . 1 1 89 89 PHE N N 15 . 1 1 89 89 PHE H H 1 0.810 0.052 . . . . . . . . . . 51530 1 70 . 1 1 90 90 ARG N N 15 . 1 1 90 90 ARG H H 1 0.782 0.104 . . . . . . . . . . 51530 1 71 . 1 1 91 91 VAL N N 15 . 1 1 91 91 VAL H H 1 0.773 0.042 . . . . . . . . . . 51530 1 72 . 1 1 93 93 ASP N N 15 . 1 1 93 93 ASP H H 1 0.758 0.056 . . . . . . . . . . 51530 1 73 . 1 1 94 94 LYS N N 15 . 1 1 94 94 LYS H H 1 0.880 0.075 . . . . . . . . . . 51530 1 74 . 1 1 95 95 ASP N N 15 . 1 1 95 95 ASP H H 1 0.755 0.047 . . . . . . . . . . 51530 1 75 . 1 1 96 96 GLY N N 15 . 1 1 96 96 GLY H H 1 0.878 0.038 . . . . . . . . . . 51530 1 76 . 1 1 97 97 ASN N N 15 . 1 1 97 97 ASN H H 1 0.857 0.033 . . . . . . . . . . 51530 1 77 . 1 1 98 98 GLY N N 15 . 1 1 98 98 GLY H H 1 0.813 0.037 . . . . . . . . . . 51530 1 78 . 1 1 99 99 TYR N N 15 . 1 1 99 99 TYR H H 1 0.857 0.046 . . . . . . . . . . 51530 1 79 . 1 1 100 100 ILE N N 15 . 1 1 100 100 ILE H H 1 0.849 0.071 . . . . . . . . . . 51530 1 80 . 1 1 101 101 SER N N 15 . 1 1 101 101 SER H H 1 0.841 0.047 . . . . . . . . . . 51530 1 81 . 1 1 102 102 ALA N N 15 . 1 1 102 102 ALA H H 1 0.799 0.054 . . . . . . . . . . 51530 1 82 . 1 1 103 103 ALA N N 15 . 1 1 103 103 ALA H H 1 0.750 0.045 . . . . . . . . . . 51530 1 83 . 1 1 104 104 GLU N N 15 . 1 1 104 104 GLU H H 1 0.745 0.028 . . . . . . . . . . 51530 1 84 . 1 1 105 105 LEU N N 15 . 1 1 105 105 LEU H H 1 0.766 0.033 . . . . . . . . . . 51530 1 85 . 1 1 108 108 VAL N N 15 . 1 1 108 108 VAL H H 1 0.847 0.025 . . . . . . . . . . 51530 1 86 . 1 1 109 109 MET N N 15 . 1 1 109 109 MET H H 1 0.747 0.041 . . . . . . . . . . 51530 1 87 . 1 1 110 110 THR N N 15 . 1 1 110 110 THR H H 1 0.814 0.041 . . . . . . . . . . 51530 1 88 . 1 1 111 111 ASN N N 15 . 1 1 111 111 ASN H H 1 0.792 0.088 . . . . . . . . . . 51530 1 89 . 1 1 113 113 GLY N N 15 . 1 1 113 113 GLY H H 1 0.735 0.079 . . . . . . . . . . 51530 1 90 . 1 1 115 115 LYS N N 15 . 1 1 115 115 LYS H H 1 0.507 0.076 . . . . . . . . . . 51530 1 91 . 1 1 116 116 LEU N N 15 . 1 1 116 116 LEU H H 1 0.446 0.035 . . . . . . . . . . 51530 1 92 . 1 1 117 117 THR N N 15 . 1 1 117 117 THR H H 1 0.715 0.038 . . . . . . . . . . 51530 1 93 . 1 1 118 118 ASP N N 15 . 1 1 118 118 ASP H H 1 0.728 0.050 . . . . . . . . . . 51530 1 94 . 1 1 119 119 GLU N N 15 . 1 1 119 119 GLU H H 1 0.787 0.024 . . . . . . . . . . 51530 1 95 . 1 1 120 120 GLU N N 15 . 1 1 120 120 GLU H H 1 0.788 0.029 . . . . . . . . . . 51530 1 96 . 1 1 121 121 VAL N N 15 . 1 1 121 121 VAL H H 1 0.771 0.035 . . . . . . . . . . 51530 1 97 . 1 1 122 122 ASP N N 15 . 1 1 122 122 ASP H H 1 0.798 0.031 . . . . . . . . . . 51530 1 98 . 1 1 123 123 GLU N N 15 . 1 1 123 123 GLU H H 1 0.812 0.037 . . . . . . . . . . 51530 1 99 . 1 1 125 125 ILE N N 15 . 1 1 125 125 ILE H H 1 0.695 0.044 . . . . . . . . . . 51530 1 100 . 1 1 128 128 ALA N N 15 . 1 1 128 128 ALA H H 1 0.769 0.055 . . . . . . . . . . 51530 1 101 . 1 1 130 130 ILE N N 15 . 1 1 130 130 ILE H H 1 0.692 0.086 . . . . . . . . . . 51530 1 102 . 1 1 131 131 ASP N N 15 . 1 1 131 131 ASP H H 1 0.892 0.038 . . . . . . . . . . 51530 1 103 . 1 1 132 132 GLY N N 15 . 1 1 132 132 GLY H H 1 0.841 0.038 . . . . . . . . . . 51530 1 104 . 1 1 133 133 ASP N N 15 . 1 1 133 133 ASP H H 1 0.831 0.023 . . . . . . . . . . 51530 1 105 . 1 1 134 134 GLY N N 15 . 1 1 134 134 GLY H H 1 0.758 0.041 . . . . . . . . . . 51530 1 106 . 1 1 135 135 GLN N N 15 . 1 1 135 135 GLN H H 1 0.746 0.029 . . . . . . . . . . 51530 1 107 . 1 1 136 136 VAL N N 15 . 1 1 136 136 VAL H H 1 0.743 0.044 . . . . . . . . . . 51530 1 108 . 1 1 137 137 ASN N N 15 . 1 1 137 137 ASN H H 1 0.763 0.043 . . . . . . . . . . 51530 1 109 . 1 1 138 138 TYR N N 15 . 1 1 138 138 TYR H H 1 0.704 0.046 . . . . . . . . . . 51530 1 110 . 1 1 140 140 GLU N N 15 . 1 1 140 140 GLU H H 1 0.848 0.042 . . . . . . . . . . 51530 1 111 . 1 1 141 141 PHE N N 15 . 1 1 141 141 PHE H H 1 0.815 0.180 . . . . . . . . . . 51530 1 112 . 1 1 142 142 VAL N N 15 . 1 1 142 142 VAL H H 1 0.798 0.022 . . . . . . . . . . 51530 1 113 . 1 1 147 147 ALA N N 15 . 1 1 147 147 ALA H H 1 0.657 0.099 . . . . . . . . . . 51530 1 114 . 1 1 148 148 LYS N N 15 . 1 1 148 148 LYS H H 1 0.365 0.088 . . . . . . . . . . 51530 1 stop_ save_