############################## # 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 50243 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Name HX-NOE_PKIa_Bound _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 900 _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 8 '1H-15N heteronoe' . . . 50243 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 . . 50243 1 2 $software_2 . . 50243 1 3 $software_3 . . 50243 1 4 $software_4 . . 50243 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 -0.10287 0.00962 . . . . . . . . . . 50243 1 2 . 1 1 3 3 VAL N N 15 . 1 1 3 3 VAL H H 1 0.37396 0.0066 . . . . . . . . . . 50243 1 3 . 1 1 4 4 GLU N N 15 . 1 1 4 4 GLU H H 1 0.41363 0.00895 . . . . . . . . . . 50243 1 4 . 1 1 10 10 PHE N N 15 . 1 1 10 10 PHE H H 1 0.51477 0.01512 . . . . . . . . . . 50243 1 5 . 1 1 11 11 ILE N N 15 . 1 1 11 11 ILE H H 1 0.86014 0.03794 . . . . . . . . . . 50243 1 6 . 1 1 12 12 ALA N N 15 . 1 1 12 12 ALA H H 1 0.55017 0.02108 . . . . . . . . . . 50243 1 7 . 1 1 14 14 GLY N N 15 . 1 1 14 14 GLY H H 1 0.84585 0.03111 . . . . . . . . . . 50243 1 8 . 1 1 15 15 ARG N N 15 . 1 1 15 15 ARG H H 1 0.96034 0.05287 . . . . . . . . . . 50243 1 9 . 1 1 16 16 THR N N 15 . 1 1 16 16 THR H H 1 0.92022 0.0352 . . . . . . . . . . 50243 1 10 . 1 1 17 17 GLY N N 15 . 1 1 17 17 GLY H H 1 0.93533 0.02435 . . . . . . . . . . 50243 1 11 . 1 1 18 18 ARG N N 15 . 1 1 18 18 ARG H H 1 0.88239 0.05872 . . . . . . . . . . 50243 1 12 . 1 1 19 19 ARG N N 15 . 1 1 19 19 ARG H H 1 0.97861 0.03307 . . . . . . . . . . 50243 1 13 . 1 1 20 20 ASN N N 15 . 1 1 20 20 ASN H H 1 0.86842 0.06494 . . . . . . . . . . 50243 1 14 . 1 1 21 21 ALA N N 15 . 1 1 21 21 ALA H H 1 0.89022 0.05649 . . . . . . . . . . 50243 1 15 . 1 1 25 25 ILE N N 15 . 1 1 25 25 ILE H H 1 0.65284 0.04003 . . . . . . . . . . 50243 1 16 . 1 1 26 26 LEU N N 15 . 1 1 26 26 LEU H H 1 0.58126 0.03104 . . . . . . . . . . 50243 1 17 . 1 1 27 27 VAL N N 15 . 1 1 27 27 VAL H H 1 0.52554 0.02485 . . . . . . . . . . 50243 1 18 . 1 1 28 28 SER N N 15 . 1 1 28 28 SER H H 1 0.49704 0.02194 . . . . . . . . . . 50243 1 19 . 1 1 29 29 SER N N 15 . 1 1 29 29 SER H H 1 0.54912 0.02058 . . . . . . . . . . 50243 1 20 . 1 1 30 30 ALA N N 15 . 1 1 30 30 ALA H H 1 0.45028 0.01489 . . . . . . . . . . 50243 1 21 . 1 1 31 31 SER N N 15 . 1 1 31 31 SER H H 1 0.42012 0.01385 . . . . . . . . . . 50243 1 22 . 1 1 32 32 GLY N N 15 . 1 1 32 32 GLY H H 1 0.34075 0.00628 . . . . . . . . . . 50243 1 23 . 1 1 34 34 SER N N 15 . 1 1 34 34 SER H H 1 0.52394 0.01542 . . . . . . . . . . 50243 1 24 . 1 1 35 35 ASN N N 15 . 1 1 35 35 ASN H H 1 0.59746 0.01668 . . . . . . . . . . 50243 1 25 . 1 1 36 36 GLU N N 15 . 1 1 36 36 GLU H H 1 0.57657 0.018 . . . . . . . . . . 50243 1 26 . 1 1 37 37 LEU N N 15 . 1 1 37 37 LEU H H 1 0.69036 0.02067 . . . . . . . . . . 50243 1 27 . 1 1 38 38 ALA N N 15 . 1 1 38 38 ALA H H 1 0.57617 0.01556 . . . . . . . . . . 50243 1 28 . 1 1 39 39 LEU N N 15 . 1 1 39 39 LEU H H 1 0.62797 0.01532 . . . . . . . . . . 50243 1 29 . 1 1 40 40 LYS N N 15 . 1 1 40 40 LYS H H 1 0.55626 0.00938 . . . . . . . . . . 50243 1 30 . 1 1 41 41 LEU N N 15 . 1 1 41 41 LEU H H 1 0.6 0.01558 . . . . . . . . . . 50243 1 31 . 1 1 42 42 ALA N N 15 . 1 1 42 42 ALA H H 1 0.62128 0.01904 . . . . . . . . . . 50243 1 32 . 1 1 43 43 GLY N N 15 . 1 1 43 43 GLY H H 1 0.58335 0.0149 . . . . . . . . . . 50243 1 33 . 1 1 46 46 ILE N N 15 . 1 1 46 46 ILE H H 1 0.61878 0.00916 . . . . . . . . . . 50243 1 34 . 1 1 47 47 ASN N N 15 . 1 1 47 47 ASN H H 1 0.47896 0.00973 . . . . . . . . . . 50243 1 35 . 1 1 48 48 LYS N N 15 . 1 1 48 48 LYS H H 1 0.47506 0.00688 . . . . . . . . . . 50243 1 36 . 1 1 49 49 THR N N 15 . 1 1 49 49 THR H H 1 0.36383 0.00662 . . . . . . . . . . 50243 1 37 . 1 1 50 50 GLU N N 15 . 1 1 50 50 GLU H H 1 0.29722 0.00636 . . . . . . . . . . 50243 1 38 . 1 1 51 51 GLY N N 15 . 1 1 51 51 GLY H H 1 0.25623 0.00658 . . . . . . . . . . 50243 1 39 . 1 1 52 52 GLU N N 15 . 1 1 52 52 GLU H H 1 0.61068 0.00915 . . . . . . . . . . 50243 1 40 . 1 1 53 53 GLU N N 15 . 1 1 53 53 GLU H H 1 0.52001 0.006 . . . . . . . . . . 50243 1 41 . 1 1 54 54 ASP N N 15 . 1 1 54 54 ASP H H 1 0.5103 0.00656 . . . . . . . . . . 50243 1 42 . 1 1 55 55 ALA N N 15 . 1 1 55 55 ALA H H 1 0.39247 0.00685 . . . . . . . . . . 50243 1 43 . 1 1 58 58 SER N N 15 . 1 1 58 58 SER H H 1 0.44254 0.00851 . . . . . . . . . . 50243 1 44 . 1 1 59 59 SER N N 15 . 1 1 59 59 SER H H 1 0.39585 0.00959 . . . . . . . . . . 50243 1 45 . 1 1 60 60 THR N N 15 . 1 1 60 60 THR H H 1 0.38856 0.00689 . . . . . . . . . . 50243 1 46 . 1 1 61 61 GLU N N 15 . 1 1 61 61 GLU H H 1 0.42576 0.00745 . . . . . . . . . . 50243 1 47 . 1 1 62 62 GLN N N 15 . 1 1 62 62 GLN H H 1 0.32573 0.00555 . . . . . . . . . . 50243 1 48 . 1 1 63 63 SER N N 15 . 1 1 63 63 SER H H 1 0.34329 0.00623 . . . . . . . . . . 50243 1 49 . 1 1 64 64 GLY N N 15 . 1 1 64 64 GLY H H 1 0.19474 0.00756 . . . . . . . . . . 50243 1 50 . 1 1 65 65 GLU N N 15 . 1 1 65 65 GLU H H 1 0.19285 0.00682 . . . . . . . . . . 50243 1 51 . 1 1 66 66 ALA N N 15 . 1 1 66 66 ALA H H 1 0.27855 0.00691 . . . . . . . . . . 50243 1 52 . 1 1 67 67 GLN N N 15 . 1 1 67 67 GLN H H 1 0.17353 0.00649 . . . . . . . . . . 50243 1 53 . 1 1 68 68 GLY N N 15 . 1 1 68 68 GLY H H 1 0.16721 0.00664 . . . . . . . . . . 50243 1 54 . 1 1 69 69 GLU N N 15 . 1 1 69 69 GLU H H 1 0.26786 0.00326 . . . . . . . . . . 50243 1 55 . 1 1 70 70 ALA N N 15 . 1 1 70 70 ALA H H 1 0.13304 0.00724 . . . . . . . . . . 50243 1 56 . 1 1 71 71 ALA N N 15 . 1 1 71 71 ALA H H 1 0.04524 0.00704 . . . . . . . . . . 50243 1 57 . 1 1 72 72 LYS N N 15 . 1 1 72 72 LYS H H 1 -0.21616 0.00689 . . . . . . . . . . 50243 1 58 . 1 1 73 73 SER N N 15 . 1 1 73 73 SER H H 1 -0.10244 0.00855 . . . . . . . . . . 50243 1 59 . 1 1 74 74 GLU N N 15 . 1 1 74 74 GLU H H 1 -0.70801 0.0094 . . . . . . . . . . 50243 1 60 . 1 1 75 75 SER N N 15 . 1 1 75 75 SER H H 1 -1.46516 0.01162 . . . . . . . . . . 50243 1 stop_ save_