############################## # 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 52576 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Name HetNOE_NSD2 _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 200000 _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 1 '1H-15N heteronoe' . . . 52576 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 . . 52576 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 ARG N N 15 . 1 1 3 3 ARG H H 1 -0.230 0.014 . . . . . . . . . . 52576 1 2 . 1 1 4 4 ALA N N 15 . 1 1 4 4 ALA H H 1 -0.058 0.010 . . . . . . . . . . 52576 1 3 . 1 1 5 5 LYS N N 15 . 1 1 5 5 LYS H H 1 -0.057 0.009 . . . . . . . . . . 52576 1 4 . 1 1 6 6 GLY N N 15 . 1 1 6 6 GLY H H 1 0.032 0.012 . . . . . . . . . . 52576 1 5 . 1 1 7 7 GLU N N 15 . 1 1 7 7 GLU H H 1 0.097 0.009 . . . . . . . . . . 52576 1 6 . 1 1 8 8 GLY N N 15 . 1 1 8 8 GLY H H 1 0.056 0.010 . . . . . . . . . . 52576 1 7 . 1 1 9 9 LYS N N 15 . 1 1 9 9 LYS H H 1 0.259 0.014 . . . . . . . . . . 52576 1 8 . 1 1 10 10 ARG N N 15 . 1 1 10 10 ARG H H 1 0.285 0.016 . . . . . . . . . . 52576 1 9 . 1 1 11 11 GLN N N 15 . 1 1 11 11 GLN H H 1 0.425 0.025 . . . . . . . . . . 52576 1 10 . 1 1 12 12 SER N N 15 . 1 1 12 12 SER H H 1 0.341 0.066 . . . . . . . . . . 52576 1 11 . 1 1 13 13 GLU N N 15 . 1 1 13 13 GLU H H 1 0.635 0.078 . . . . . . . . . . 52576 1 12 . 1 1 14 14 ASP N N 15 . 1 1 14 14 ASP H H 1 0.582 0.134 . . . . . . . . . . 52576 1 13 . 1 1 15 15 GLU N N 15 . 1 1 15 15 GLU H H 1 0.623 0.041 . . . . . . . . . . 52576 1 14 . 1 1 16 16 CYS N N 15 . 1 1 16 16 CYS H H 1 0.791 0.079 . . . . . . . . . . 52576 1 15 . 1 1 17 17 PHE N N 15 . 1 1 17 17 PHE H H 1 0.909 0.226 . . . . . . . . . . 52576 1 16 . 1 1 18 18 ARG N N 15 . 1 1 18 18 ARG H H 1 0.776 0.075 . . . . . . . . . . 52576 1 17 . 1 1 19 19 CYS N N 15 . 1 1 19 19 CYS H H 1 0.827 0.096 . . . . . . . . . . 52576 1 18 . 1 1 20 20 GLY N N 15 . 1 1 20 20 GLY H H 1 0.893 0.105 . . . . . . . . . . 52576 1 19 . 1 1 21 21 ASP N N 15 . 1 1 21 21 ASP H H 1 0.788 0.060 . . . . . . . . . . 52576 1 20 . 1 1 22 22 GLY N N 15 . 1 1 22 22 GLY H H 1 0.784 0.058 . . . . . . . . . . 52576 1 21 . 1 1 23 23 GLY N N 15 . 1 1 23 23 GLY H H 1 0.771 0.059 . . . . . . . . . . 52576 1 22 . 1 1 24 24 GLN N N 15 . 1 1 24 24 GLN H H 1 0.714 0.053 . . . . . . . . . . 52576 1 23 . 1 1 25 25 LEU N N 15 . 1 1 25 25 LEU H H 1 0.723 0.063 . . . . . . . . . . 52576 1 24 . 1 1 26 26 VAL N N 15 . 1 1 26 26 VAL H H 1 0.852 0.125 . . . . . . . . . . 52576 1 25 . 1 1 27 27 LEU N N 15 . 1 1 27 27 LEU H H 1 0.837 0.106 . . . . . . . . . . 52576 1 26 . 1 1 28 28 CYS N N 15 . 1 1 28 28 CYS H H 1 0.632 0.116 . . . . . . . . . . 52576 1 27 . 1 1 30 30 ARG N N 15 . 1 1 30 30 ARG H H 1 0.846 0.141 . . . . . . . . . . 52576 1 28 . 1 1 31 31 LYS N N 15 . 1 1 31 31 LYS H H 1 0.831 0.139 . . . . . . . . . . 52576 1 29 . 1 1 32 32 PHE N N 15 . 1 1 32 32 PHE H H 1 0.639 0.241 . . . . . . . . . . 52576 1 30 . 1 1 33 33 CYS N N 15 . 1 1 33 33 CYS H H 1 0.800 0.264 . . . . . . . . . . 52576 1 31 . 1 1 35 35 LYS N N 15 . 1 1 35 35 LYS H H 1 0.731 0.089 . . . . . . . . . . 52576 1 32 . 1 1 36 36 ALA N N 15 . 1 1 36 36 ALA H H 1 0.665 0.173 . . . . . . . . . . 52576 1 33 . 1 1 37 37 TYR N N 15 . 1 1 37 37 TYR H H 1 0.723 0.097 . . . . . . . . . . 52576 1 34 . 1 1 38 38 HIS N N 15 . 1 1 38 38 HIS H H 1 0.865 0.104 . . . . . . . . . . 52576 1 35 . 1 1 39 39 LEU N N 15 . 1 1 39 39 LEU H H 1 0.773 0.069 . . . . . . . . . . 52576 1 36 . 1 1 40 40 SER N N 15 . 1 1 40 40 SER H H 1 0.776 0.066 . . . . . . . . . . 52576 1 37 . 1 1 41 41 CYS N N 15 . 1 1 41 41 CYS H H 1 0.750 0.072 . . . . . . . . . . 52576 1 38 . 1 1 42 42 LEU N N 15 . 1 1 42 42 LEU H H 1 0.692 0.076 . . . . . . . . . . 52576 1 39 . 1 1 43 43 GLY N N 15 . 1 1 43 43 GLY H H 1 0.761 0.068 . . . . . . . . . . 52576 1 40 . 1 1 44 44 LEU N N 15 . 1 1 44 44 LEU H H 1 0.770 0.073 . . . . . . . . . . 52576 1 41 . 1 1 45 45 GLY N N 15 . 1 1 45 45 GLY H H 1 0.800 0.113 . . . . . . . . . . 52576 1 42 . 1 1 46 46 LYS N N 15 . 1 1 46 46 LYS H H 1 0.651 0.071 . . . . . . . . . . 52576 1 43 . 1 1 47 47 ARG N N 15 . 1 1 47 47 ARG H H 1 0.618 0.047 . . . . . . . . . . 52576 1 44 . 1 1 49 49 PHE N N 15 . 1 1 49 49 PHE H H 1 0.587 0.038 . . . . . . . . . . 52576 1 45 . 1 1 50 50 GLY N N 15 . 1 1 50 50 GLY H H 1 0.503 0.029 . . . . . . . . . . 52576 1 46 . 1 1 51 51 LYS N N 15 . 1 1 51 51 LYS H H 1 0.681 0.041 . . . . . . . . . . 52576 1 47 . 1 1 52 52 TRP N N 15 . 1 1 52 52 TRP H H 1 0.253 0.340 . . . . . . . . . . 52576 1 48 . 1 1 53 53 GLU N N 15 . 1 1 53 53 GLU H H 1 0.863 0.475 . . . . . . . . . . 52576 1 49 . 1 1 54 54 CYS N N 15 . 1 1 54 54 CYS H H 1 0.824 0.166 . . . . . . . . . . 52576 1 50 . 1 1 56 56 TRP N N 15 . 1 1 56 56 TRP H H 1 0.822 0.155 . . . . . . . . . . 52576 1 51 . 1 1 57 57 HIS N N 15 . 1 1 57 57 HIS H H 1 0.834 0.115 . . . . . . . . . . 52576 1 52 . 1 1 58 58 HIS N N 15 . 1 1 58 58 HIS H H 1 0.668 0.114 . . . . . . . . . . 52576 1 53 . 1 1 59 59 CYS N N 15 . 1 1 59 59 CYS H H 1 0.825 0.106 . . . . . . . . . . 52576 1 54 . 1 1 60 60 ASP N N 15 . 1 1 60 60 ASP H H 1 0.790 0.107 . . . . . . . . . . 52576 1 55 . 1 1 61 61 VAL N N 15 . 1 1 61 61 VAL H H 1 0.786 0.100 . . . . . . . . . . 52576 1 56 . 1 1 62 62 CYS N N 15 . 1 1 62 62 CYS H H 1 0.745 0.099 . . . . . . . . . . 52576 1 57 . 1 1 63 63 GLY N N 15 . 1 1 63 63 GLY H H 1 0.865 0.108 . . . . . . . . . . 52576 1 58 . 1 1 64 64 LYS N N 15 . 1 1 64 64 LYS H H 1 0.793 0.079 . . . . . . . . . . 52576 1 59 . 1 1 66 66 SER N N 15 . 1 1 66 66 SER H H 1 0.774 0.091 . . . . . . . . . . 52576 1 60 . 1 1 67 67 THR N N 15 . 1 1 67 67 THR H H 1 0.795 0.174 . . . . . . . . . . 52576 1 61 . 1 1 68 68 SER N N 15 . 1 1 68 68 SER H H 1 0.824 0.133 . . . . . . . . . . 52576 1 62 . 1 1 69 69 PHE N N 15 . 1 1 69 69 PHE H H 1 0.387 0.034 . . . . . . . . . . 52576 1 63 . 1 1 70 70 CYS N N 15 . 1 1 70 70 CYS H H 1 0.844 0.200 . . . . . . . . . . 52576 1 64 . 1 1 71 71 HIS N N 15 . 1 1 71 71 HIS H H 1 0.538 0.134 . . . . . . . . . . 52576 1 65 . 1 1 72 72 LEU N N 15 . 1 1 72 72 LEU H H 1 0.759 0.311 . . . . . . . . . . 52576 1 66 . 1 1 73 73 CYS N N 15 . 1 1 73 73 CYS H H 1 0.885 0.111 . . . . . . . . . . 52576 1 67 . 1 1 75 75 ASN N N 15 . 1 1 75 75 ASN H H 1 0.834 0.075 . . . . . . . . . . 52576 1 68 . 1 1 76 76 SER N N 15 . 1 1 76 76 SER H H 1 0.876 0.143 . . . . . . . . . . 52576 1 69 . 1 1 77 77 PHE N N 15 . 1 1 77 77 PHE H H 1 0.802 0.124 . . . . . . . . . . 52576 1 70 . 1 1 78 78 CYS N N 15 . 1 1 78 78 CYS H H 1 0.866 0.130 . . . . . . . . . . 52576 1 71 . 1 1 79 79 LYS N N 15 . 1 1 79 79 LYS H H 1 0.684 0.067 . . . . . . . . . . 52576 1 72 . 1 1 80 80 GLU N N 15 . 1 1 80 80 GLU H H 1 0.705 0.057 . . . . . . . . . . 52576 1 73 . 1 1 81 81 HIS N N 15 . 1 1 81 81 HIS H H 1 0.749 0.077 . . . . . . . . . . 52576 1 74 . 1 1 82 82 GLN N N 15 . 1 1 82 82 GLN H H 1 0.656 0.054 . . . . . . . . . . 52576 1 75 . 1 1 83 83 ASP N N 15 . 1 1 83 83 ASP H H 1 0.656 0.049 . . . . . . . . . . 52576 1 76 . 1 1 84 84 GLY N N 15 . 1 1 84 84 GLY H H 1 0.606 0.054 . . . . . . . . . . 52576 1 77 . 1 1 85 85 THR N N 15 . 1 1 85 85 THR H H 1 0.588 0.055 . . . . . . . . . . 52576 1 78 . 1 1 86 86 ALA N N 15 . 1 1 86 86 ALA H H 1 0.484 0.040 . . . . . . . . . . 52576 1 79 . 1 1 87 87 PHE N N 15 . 1 1 87 87 PHE H H 1 0.486 0.046 . . . . . . . . . . 52576 1 80 . 1 1 88 88 SER N N 15 . 1 1 88 88 SER H H 1 0.746 0.189 . . . . . . . . . . 52576 1 81 . 1 1 89 89 CYS N N 15 . 1 1 89 89 CYS H H 1 0.677 0.065 . . . . . . . . . . 52576 1 82 . 1 1 90 90 THR N N 15 . 1 1 90 90 THR H H 1 0.702 0.178 . . . . . . . . . . 52576 1 83 . 1 1 92 92 ASP N N 15 . 1 1 92 92 ASP H H 1 0.578 0.307 . . . . . . . . . . 52576 1 84 . 1 1 93 93 GLY N N 15 . 1 1 93 93 GLY H H 1 0.679 0.089 . . . . . . . . . . 52576 1 85 . 1 1 94 94 ARG N N 15 . 1 1 94 94 ARG H H 1 0.777 0.209 . . . . . . . . . . 52576 1 86 . 1 1 96 96 TYR N N 15 . 1 1 96 96 TYR H H 1 0.782 0.187 . . . . . . . . . . 52576 1 87 . 1 1 97 97 CYS N N 15 . 1 1 97 97 CYS H H 1 0.653 0.309 . . . . . . . . . . 52576 1 88 . 1 1 99 99 GLU N N 15 . 1 1 99 99 GLU H H 1 0.756 0.085 . . . . . . . . . . 52576 1 89 . 1 1 100 100 HIS N N 15 . 1 1 100 100 HIS H H 1 0.676 0.113 . . . . . . . . . . 52576 1 90 . 1 1 101 101 ASP N N 15 . 1 1 101 101 ASP H H 1 0.711 0.109 . . . . . . . . . . 52576 1 91 . 1 1 102 102 LEU N N 15 . 1 1 102 102 LEU H H 1 0.423 0.038 . . . . . . . . . . 52576 1 92 . 1 1 103 103 GLY N N 15 . 1 1 103 103 GLY H H 1 0.174 0.018 . . . . . . . . . . 52576 1 93 . 1 1 104 104 ALA N N 15 . 1 1 104 104 ALA H H 1 -0.198 0.014 . . . . . . . . . . 52576 1 94 . 1 1 105 105 ALA N N 15 . 1 1 105 105 ALA H H 1 -1.171 0.039 . . . . . . . . . . 52576 1 stop_ save_