######################## # Kinetic parameters # ######################## ############################# # Hydrogen exchange rates # ############################# save_H_exch_rates_1 _H_exch_rate_list.Sf_category H_exch_rates _H_exch_rate_list.Sf_framecode H_exch_rates_1 _H_exch_rate_list.Entry_ID 17718 _H_exch_rate_list.ID 1 _H_exch_rate_list.Sample_condition_list_ID 1 _H_exch_rate_list.Sample_condition_list_label $sample_conditions_1 _H_exch_rate_list.Val_units h _H_exch_rate_list.Details . _H_exch_rate_list.Text_data_format . _H_exch_rate_list.Text_data . loop_ _H_exch_rate_experiment.Experiment_ID _H_exch_rate_experiment.Experiment_name _H_exch_rate_experiment.Sample_ID _H_exch_rate_experiment.Sample_label _H_exch_rate_experiment.Sample_state _H_exch_rate_experiment.Entry_ID _H_exch_rate_experiment.H_exch_rate_list_ID 1 '2D HSMQC' 1 $sample_1 . 17718 1 stop_ loop_ _H_exch_rate.ID _H_exch_rate.Assembly_atom_ID _H_exch_rate.Entity_assembly_ID _H_exch_rate.Entity_ID _H_exch_rate.Comp_index_ID _H_exch_rate.Seq_ID _H_exch_rate.Comp_ID _H_exch_rate.Atom_ID _H_exch_rate.Atom_type _H_exch_rate.Atom_isotope_number _H_exch_rate.Val _H_exch_rate.Val_min _H_exch_rate.Val_max _H_exch_rate.Val_err _H_exch_rate.Resonance_ID _H_exch_rate.Auth_entity_assembly_ID _H_exch_rate.Auth_seq_ID _H_exch_rate.Auth_comp_ID _H_exch_rate.Auth_atom_ID _H_exch_rate.Entry_ID _H_exch_rate.H_exch_rate_list_ID 1 . 1 1 12 12 ALA H H 1 39.3 . . 9.2 . . 12 A H 17718 1 2 . 1 1 13 13 THR H H 1 8.28 . . 1.1 . . 13 T H 17718 1 3 . 1 1 16 16 LYS H H 1 131 . . 12 . . 16 K H 17718 1 4 . 1 1 21 21 ASP H H 1 13 . . 4 . . 21 D H 17718 1 5 . 1 1 23 23 VAL H H 1 273 . . 47 . . 23 V H 17718 1 6 . 1 1 24 24 LYS H H 1 377 . . 44 . . 24 K H 17718 1 7 . 1 1 25 25 LEU H H 1 386 . . 110 . . 25 L H 17718 1 8 . 1 1 26 26 MET H H 1 679 . . 230 . . 26 M H 17718 1 9 . 1 1 27 27 TYR H H 1 14.3 . . 2.6 . . 27 Y H 17718 1 10 . 1 1 32 32 MET H H 1 125 . . 17 . . 32 M H 17718 1 11 . 1 1 34 34 PHE H H 1 410 . . 95 . . 34 F H 17718 1 12 . 1 1 35 35 ARG H H 1 353 . . 97 . . 35 R H 17718 1 13 . 1 1 37 37 LEU H H 1 279 . . 100 . . 37 L H 17718 1 14 . 1 1 38 38 LEU H H 1 8.12 . . 0.90 . . 38 L H 17718 1 15 . 1 1 39 39 VAL H H 1 690 . . 240 . . 39 V H 17718 1 16 . 1 1 40 40 ASP H H 1 40.6 . . 4.0 . . 40 D H 17718 1 17 . 1 1 61 61 PHE H H 1 35.7 . . 2.7 . . 61 F H 17718 1 18 . 1 1 62 62 THR H H 1 139 . . 13 . . 62 T H 17718 1 19 . 1 1 63 63 LYS H H 1 124 . . 19 . . 63 K H 17718 1 20 . 1 1 64 64 LYS H H 1 203 . . 18 . . 64 K H 17718 1 21 . 1 1 65 65 MET H H 1 90.5 . . 14 . . 65 M H 17718 1 22 . 1 1 66 66 VAL H H 1 406 . . 87 . . 66 V H 17718 1 23 . 1 1 67 67 GLU H H 1 109 . . 9.9 . . 67 E H 17718 1 24 . 1 1 69 69 ALA H H 1 1.29 . . 0.047 . . 69 A H 17718 1 25 . 1 1 71 71 LYS H H 1 1.37 . . 0.40 . . 71 K H 17718 1 26 . 1 1 73 73 GLU H H 1 337 . . 87 . . 73 E H 17718 1 27 . 1 1 74 74 VAL H H 1 263 . . 42 . . 74 V H 17718 1 28 . 1 1 75 75 GLU H H 1 265 . . 87 . . 75 E H 17718 1 29 . 1 1 76 76 PHE H H 1 2.23 . . 0.32 . . 76 F H 17718 1 30 . 1 1 77 77 ASP H H 1 16.2 . . 2.40 . . 77 D H 17718 1 31 . 1 1 78 78 LYS H H 1 1.82 . . 0.19 . . 78 K H 17718 1 32 . 1 1 83 83 ASP H H 1 41.8 . . 6.1 . . 83 D H 17718 1 33 . 1 1 88 88 GLY H H 1 76.9 . . 11 . . 88 G H 17718 1 34 . 1 1 89 89 LEU H H 1 554 . . 390 . . 89 L H 17718 1 35 . 1 1 90 90 ALA H H 1 535 . . 220 . . 90 A H 17718 1 36 . 1 1 91 91 TYR H H 1 763 . . 290 . . 91 Y H 17718 1 37 . 1 1 93 93 TYR H H 1 1100 . . 900 . . 93 Y H 17718 1 38 . 1 1 94 94 ALA H H 1 437 . . 91 . . 94 A H 17718 1 39 . 1 1 97 97 LYS H H 1 58.7 . . 2.6 . . 97 K H 17718 1 40 . 1 1 99 99 VAL H H 1 388 . . 71 . . 99 V H 17718 1 41 . 1 1 100 100 ASN H H 1 244 . . 24 . . 100 N H 17718 1 42 . 1 1 101 101 GLU H H 1 280 . . 44 . . 101 E H 17718 1 43 . 1 1 102 102 ALA H H 1 249 . . 84 . . 102 A H 17718 1 44 . 1 1 103 103 LEU H H 1 298 . . 69 . . 103 L H 17718 1 45 . 1 1 104 104 VAL H H 1 630 . . 170 . . 104 V H 17718 1 46 . 1 1 105 105 ARG H H 1 264 . . 44 . . 105 R H 17718 1 47 . 1 1 106 106 GLN H H 1 209 . . 22 . . 106 Q H 17718 1 48 . 1 1 107 107 GLY H H 1 126 . . 15 . . 107 G H 17718 1 49 . 1 1 108 108 LEU H H 1 148 . . 18 . . 108 L H 17718 1 50 . 1 1 109 109 ALA H H 1 244 . . 53 . . 109 A H 17718 1 51 . 1 1 111 111 VAL H H 1 2.98 . . 0.22 . . 111 V H 17718 1 52 . 1 1 122 122 GLU H H 1 0.95 . . 0.2 . . 122 E H 17718 1 53 . 1 1 125 125 LEU H H 1 122 . . 12 . . 125 L H 17718 1 54 . 1 1 126 126 ARG H H 1 96.7 . . 6.7 . . 126 R H 17718 1 55 . 1 1 127 127 LYS H H 1 2.61 . . 0.20 . . 127 K H 17718 1 56 . 1 1 128 128 SER H H 1 2.43 . . 0.27 . . 128 S H 17718 1 57 . 1 1 129 129 GLU H H 1 115 . . 9.9 . . 129 E H 17718 1 58 . 1 1 130 130 ALA H H 1 95.3 . . 7.5 . . 130 A H 17718 1 59 . 1 1 131 131 GLN H H 1 3.99 . . 0.23 . . 131 Q H 17718 1 60 . 1 1 132 132 ALA H H 1 177 . . 34 . . 132 A H 17718 1 61 . 1 1 133 133 LYS H H 1 151 . . 11 . . 133 K H 17718 1 62 . 1 1 134 134 LYS H H 1 91.9 . . 6.6 . . 134 K H 17718 1 63 . 1 1 135 135 GLU H H 1 21.0 . . 7.3 . . 135 E H 17718 1 64 . 1 1 136 136 LYS H H 1 35.2 . . 4.3 . . 136 K H 17718 1 65 . 1 1 138 138 ASN H H 1 74.6 . . 25 . . 138 N H 17718 1 66 . 1 1 141 141 SER H H 1 8.33 . . 1.5 . . 141 S H 17718 1 stop_ save_ ######################## # Kinetic parameters # ######################## ############################# # Hydrogen exchange rates # ############################# save_H_exch_rates_2 _H_exch_rate_list.Sf_category H_exch_rates _H_exch_rate_list.Sf_framecode H_exch_rates_2 _H_exch_rate_list.Entry_ID 17718 _H_exch_rate_list.ID 2 _H_exch_rate_list.Sample_condition_list_ID 1 _H_exch_rate_list.Sample_condition_list_label $sample_conditions_1 _H_exch_rate_list.Val_units h _H_exch_rate_list.Details . _H_exch_rate_list.Text_data_format . _H_exch_rate_list.Text_data . loop_ _H_exch_rate_experiment.Experiment_ID _H_exch_rate_experiment.Experiment_name _H_exch_rate_experiment.Sample_ID _H_exch_rate_experiment.Sample_label _H_exch_rate_experiment.Sample_state _H_exch_rate_experiment.Entry_ID _H_exch_rate_experiment.H_exch_rate_list_ID 1 '2D HSMQC' 1 $sample_1 . 17718 2 stop_ loop_ _H_exch_rate.ID _H_exch_rate.Assembly_atom_ID _H_exch_rate.Entity_assembly_ID _H_exch_rate.Entity_ID _H_exch_rate.Comp_index_ID _H_exch_rate.Seq_ID _H_exch_rate.Comp_ID _H_exch_rate.Atom_ID _H_exch_rate.Atom_type _H_exch_rate.Atom_isotope_number _H_exch_rate.Val _H_exch_rate.Val_min _H_exch_rate.Val_max _H_exch_rate.Val_err _H_exch_rate.Resonance_ID _H_exch_rate.Auth_entity_assembly_ID _H_exch_rate.Auth_seq_ID _H_exch_rate.Auth_comp_ID _H_exch_rate.Auth_atom_ID _H_exch_rate.Entry_ID _H_exch_rate.H_exch_rate_list_ID 1 . 1 1 12 12 ALA H H 1 3.38 . . 0.32 . . 12 A H 17718 2 2 . 1 1 13 13 THR H H 1 1.72 . . 0.12 . . 13 T H 17718 2 3 . 1 1 15 15 ILE H H 1 15.6 . . 1.8 . . 16 I H 17718 2 4 . 1 1 16 16 LYS H H 1 5.3 . . 0.7 . . 21 K H 17718 2 5 . 1 1 22 22 THR H H 1 9.71 . . 0.88 . . 23 T H 17718 2 6 . 1 1 23 23 VAL H H 1 19.1 . . 1.3 . . 24 V H 17718 2 7 . 1 1 24 24 LYS H H 1 25.0 . . 1.9 . . 25 K H 17718 2 8 . 1 1 25 25 LEU H H 1 23.9 . . 2.3 . . 26 L H 17718 2 9 . 1 1 26 26 MET H H 1 22.0 . . 2.4 . . 27 M H 17718 2 10 . 1 1 27 27 TYR H H 1 4.25 . . 0.63 . . 32 Y H 17718 2 11 . 1 1 30 30 GLN H H 1 4.50 . . 0.51 . . 34 Q H 17718 2 12 . 1 1 34 34 PHE H H 1 16.0 . . 4.3 . . 35 F H 17718 2 13 . 1 1 37 37 LEU H H 1 42.0 . . 7.6 . . 37 L H 17718 2 14 . 1 1 39 39 VAL H H 1 19.4 . . 1.2 . . 38 V H 17718 2 15 . 1 1 61 61 PHE H H 1 2.93 . . 0.26 . . 39 F H 17718 2 16 . 1 1 62 62 THR H H 1 4.40 . . 0.32 . . 40 T H 17718 2 17 . 1 1 64 64 LYS H H 1 5.82 . . 0.27 . . 61 K H 17718 2 18 . 1 1 65 65 MET H H 1 5.89 . . 0.23 . . 62 M H 17718 2 19 . 1 1 66 66 VAL H H 1 17.0 . . 1.1 . . 63 V H 17718 2 20 . 1 1 67 67 GLU H H 1 9.39 . . 0.60 . . 64 E H 17718 2 21 . 1 1 73 73 GLU H H 1 15.7 . . 1.1 . . 65 E H 17718 2 22 . 1 1 74 74 VAL H H 1 27.9 . . 2.7 . . 66 V H 17718 2 23 . 1 1 75 75 GLU H H 1 13.3 . . 1.5 . . 67 E H 17718 2 24 . 1 1 89 89 LEU H H 1 6.75 . . 1.1 . . 69 L H 17718 2 25 . 1 1 90 90 ALA H H 1 14.0 . . 1.8 . . 71 A H 17718 2 26 . 1 1 91 91 TYR H H 1 14.8 . . 1.3 . . 73 Y H 17718 2 27 . 1 1 92 92 ILE H H 1 15.9 . . 1.7 . . 74 I H 17718 2 28 . 1 1 93 93 TYR H H 1 35.6 . . 9.4 . . 75 Y H 17718 2 29 . 1 1 94 94 ALA H H 1 14.1 . . 1.3 . . 76 A H 17718 2 30 . 1 1 99 99 VAL H H 1 19.9 . . 2.0 . . 77 V H 17718 2 31 . 1 1 100 100 ASN H H 1 6.45 . . 0.40 . . 78 N H 17718 2 32 . 1 1 101 101 GLU H H 1 6.88 . . 0.22 . . 83 E H 17718 2 33 . 1 1 104 104 VAL H H 1 48 . . 5.2 . . 88 V H 17718 2 34 . 1 1 105 105 ARG H H 1 3.91 . . 1.3 . . 89 R H 17718 2 35 . 1 1 106 106 GLN H H 1 4.99 . . 0.66 . . 90 Q H 17718 2 36 . 1 1 107 107 GLY H H 1 2.06 . . 0.44 . . 91 G H 17718 2 37 . 1 1 108 108 LEU H H 1 4.47 . . 0.62 . . 93 L H 17718 2 38 . 1 1 109 109 ALA H H 1 5.41 . . 0.51 . . 94 A H 17718 2 39 . 1 1 111 111 VAL H H 1 4.43 . . 0.28 . . 97 V H 17718 2 40 . 1 1 125 125 LEU H H 1 3.75 . . 0.31 . . 99 L H 17718 2 41 . 1 1 126 126 ARG H H 1 2.59 . . 0.044 . . 100 R H 17718 2 42 . 1 1 129 129 GLU H H 1 1.31 . . 0.18 . . 101 E H 17718 2 43 . 1 1 130 130 ALA H H 1 2.53 . . 0.11 . . 102 A H 17718 2 44 . 1 1 131 131 GLN H H 1 1.23 . . 0.11 . . 103 Q H 17718 2 45 . 1 1 132 132 ALA H H 1 2.48 . . 0.27 . . 104 A H 17718 2 46 . 1 1 133 133 LYS H H 1 2.5 . . 0.13 . . 105 K H 17718 2 47 . 1 1 135 135 GLU H H 1 2.92 . . 0.55 . . 106 E H 17718 2 48 . 1 1 136 136 LYS H H 1 2.14 . . 0.29 . . 107 K H 17718 2 49 . 1 1 137 137 LEU H H 1 3.3 . . 0.28 . . 108 L H 17718 2 stop_ save_