############################## # Heteronuclear NOE values # ############################## save_CKR-hetNOE-exptl _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode CKR-hetNOE-exptl _Heteronucl_NOE_list.Entry_ID 16978 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $CKR-brazzein_conditions _Heteronucl_NOE_list.Spectrometer_frequency_1H 600 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type na _Heteronucl_NOE_list.NOE_ref_val 0.0 _Heteronucl_NOE_list.NOE_ref_description na _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 11 '2D 1H-15N HSQC' . . . 16978 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 5 $SPARKY . . 16978 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 1 1 ASP N N 15 . 1 1 1 1 ASP H H 1 0 0 . . . 1 ASP N . 1 ASP H 16978 1 2 . 1 1 2 2 CYS N N 15 . 1 1 2 2 CYS H H 1 0.0162 0 . . . 2 CYS N . 2 CYS H 16978 1 3 . 1 1 3 3 LYS N N 15 . 1 1 3 3 LYS H H 1 0.5616 0 . . . 3 LYS N . 3 LYS H 16978 1 4 . 1 1 4 4 ARG N N 15 . 1 1 4 4 ARG H H 1 0.6506 0 . . . 4 ARG N . 4 ARG H 16978 1 5 . 1 1 5 5 LYS N N 15 . 1 1 5 5 LYS H H 1 0.7126 0 . . . 5 LYS N . 5 LYS H 16978 1 6 . 1 1 6 6 VAL N N 15 . 1 1 6 6 VAL H H 1 0.7067 0 . . . 6 VAL N . 6 VAL H 16978 1 7 . 1 1 7 7 TYR N N 15 . 1 1 7 7 TYR H H 1 0.6936 0 . . . 7 TYR N . 7 TYR H 16978 1 8 . 1 1 8 8 GLU N N 15 . 1 1 8 8 GLU H H 1 0.7159 0 . . . 8 GLU N . 8 GLU H 16978 1 9 . 1 1 9 9 ASN N N 15 . 1 1 9 9 ASN H H 1 0.6695 0 . . . 9 ASN N . 9 ASN H 16978 1 10 . 1 1 10 10 TYR N N 15 . 1 1 10 10 TYR H H 1 0.7394 0 . . . 10 TYR N . 10 TYR H 16978 1 11 . 1 1 12 12 VAL N N 15 . 1 1 12 12 VAL H H 1 0.7512 0 . . . 12 VAL N . 12 VAL H 16978 1 12 . 1 1 13 13 SER N N 15 . 1 1 13 13 SER H H 1 0.7797 0 . . . 13 SER N . 13 SER H 16978 1 13 . 1 1 14 14 LYS N N 15 . 1 1 14 14 LYS H H 1 0.6923 0 . . . 14 LYS N . 14 LYS H 16978 1 14 . 1 1 15 15 CYS N N 15 . 1 1 15 15 CYS H H 1 0.6715 0 . . . 15 CYS N . 15 CYS H 16978 1 15 . 1 1 16 16 GLN N N 15 . 1 1 16 16 GLN H H 1 0.6940 0 . . . 16 GLN N . 16 GLN H 16978 1 16 . 1 1 17 17 LEU N N 15 . 1 1 17 17 LEU H H 1 0.6434 0 . . . 17 LEU N . 17 LEU H 16978 1 17 . 1 1 18 18 ALA N N 15 . 1 1 18 18 ALA H H 1 0.5862 0 . . . 18 ALA N . 18 ALA H 16978 1 18 . 1 1 19 19 ASN N N 15 . 1 1 19 19 ASN H H 1 0.7505 0 . . . 19 ASN N . 19 ASN H 16978 1 19 . 1 1 20 20 GLN N N 15 . 1 1 20 20 GLN H H 1 0.7151 0 . . . 20 GLN N . 20 GLN H 16978 1 20 . 1 1 21 21 CYS N N 15 . 1 1 21 21 CYS H H 1 0.8171 0 . . . 21 CYS N . 21 CYS H 16978 1 21 . 1 1 22 22 ASN N N 15 . 1 1 22 22 ASN H H 1 0.7166 0 . . . 22 ASN N . 22 ASN H 16978 1 22 . 1 1 23 23 TYR N N 15 . 1 1 23 23 TYR H H 1 0.7877 0 . . . 23 TYR N . 23 TYR H 16978 1 23 . 1 1 24 24 ASP N N 15 . 1 1 24 24 ASP H H 1 0.7790 0 . . . 24 ASP N . 24 ASP H 16978 1 24 . 1 1 25 25 CYS N N 15 . 1 1 25 25 CYS H H 1 0.7599 0 . . . 25 CYS N . 25 CYS H 16978 1 25 . 1 1 26 26 LYS N N 15 . 1 1 26 26 LYS H H 1 0.7243 0 . . . 26 LYS N . 26 LYS H 16978 1 26 . 1 1 27 27 LEU N N 15 . 1 1 27 27 LEU H H 1 0.7280 0 . . . 27 LEU N . 27 LEU H 16978 1 27 . 1 1 28 28 ASP N N 15 . 1 1 28 28 ASP H H 1 0.7505 0 . . . 28 ASP N . 28 ASP H 16978 1 28 . 1 1 29 29 LYS N N 15 . 1 1 29 29 LYS H H 1 0.7270 0 . . . 29 LYS N . 29 LYS H 16978 1 29 . 1 1 30 30 HIS N N 15 . 1 1 30 30 HIS H H 1 0.7910 0 . . . 30 HIS N . 30 HIS H 16978 1 30 . 1 1 31 31 ALA N N 15 . 1 1 31 31 ALA H H 1 0.7756 0 . . . 31 ALA N . 31 ALA H 16978 1 31 . 1 1 32 32 ARG N N 15 . 1 1 32 32 ARG H H 1 0.7130 0 . . . 32 ARG N . 32 ARG H 16978 1 32 . 1 1 33 33 SER N N 15 . 1 1 33 33 SER H H 1 0.6814 0 . . . 33 SER N . 33 SER H 16978 1 33 . 1 1 34 34 GLY N N 15 . 1 1 34 34 GLY H H 1 0.7734 0 . . . 34 GLY N . 34 GLY H 16978 1 34 . 1 1 35 35 GLU N N 15 . 1 1 35 35 GLU H H 1 0.7770 0 . . . 35 GLU N . 35 GLU H 16978 1 35 . 1 1 36 36 CYS N N 15 . 1 1 36 36 CYS H H 1 0.7393 0 . . . 36 CYS N . 36 CYS H 16978 1 36 . 1 1 37 37 PHE N N 15 . 1 1 37 37 PHE H H 1 0.7177 0 . . . 37 PHE N . 37 PHE H 16978 1 37 . 1 1 38 38 TYR N N 15 . 1 1 38 38 TYR H H 1 0.6003 0 . . . 38 TYR N . 38 TYR H 16978 1 38 . 1 1 39 39 ASP N N 15 . 1 1 39 39 ASP H H 1 0.6307 0 . . . 39 ASP N . 39 ASP H 16978 1 39 . 1 1 40 40 GLU N N 15 . 1 1 40 40 GLU H H 1 0.7064 0 . . . 40 GLU N . 40 GLU H 16978 1 40 . 1 1 41 41 LYS N N 15 . 1 1 41 41 LYS H H 1 0.6450 0 . . . 41 LYS N . 41 LYS H 16978 1 41 . 1 1 42 42 ARG N N 15 . 1 1 42 42 ARG H H 1 0.6171 0 . . . 42 ARG N . 42 ARG H 16978 1 42 . 1 1 43 43 ASN N N 15 . 1 1 43 43 ASN H H 1 0.6900 0 . . . 43 ASN N . 43 ASN H 16978 1 43 . 1 1 44 44 LEU N N 15 . 1 1 44 44 LEU H H 1 0.7114 0 . . . 44 LEU N . 44 LEU H 16978 1 44 . 1 1 45 45 GLN N N 15 . 1 1 45 45 GLN H H 1 0.7040 0 . . . 45 GLN N . 45 GLN H 16978 1 45 . 1 1 46 46 CYS N N 15 . 1 1 46 46 CYS H H 1 0.7048 0 . . . 46 CYS N . 46 CYS H 16978 1 46 . 1 1 47 47 ILE N N 15 . 1 1 47 47 ILE H H 1 0.7480 0 . . . 47 ILE N . 47 ILE H 16978 1 47 . 1 1 48 48 CYS N N 15 . 1 1 48 48 CYS H H 1 0.7151 0 . . . 48 CYS N . 48 CYS H 16978 1 48 . 1 1 49 49 ASP N N 15 . 1 1 49 49 ASP H H 1 0.7060 0 . . . 49 ASP N . 49 ASP H 16978 1 49 . 1 1 50 50 TYR N N 15 . 1 1 50 50 TYR H H 1 0.7237 0 . . . 50 TYR N . 50 TYR H 16978 1 50 . 1 1 51 51 CYS N N 15 . 1 1 51 51 CYS H H 1 0.6652 0 . . . 51 CYS N . 51 CYS H 16978 1 51 . 1 1 52 52 GLU N N 15 . 1 1 52 52 GLU H H 1 0.3935 0 . . . 52 GLU N . 52 GLU H 16978 1 52 . 1 1 53 53 TYR N N 15 . 1 1 53 53 TYR H H 1 0.1929 0 . . . 53 TYR N . 53 TYR H 16978 1 stop_ save_