######################################## # Heteronuclear T1 relaxation values # ######################################## save_heteronucl_T1_relaxation_1 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronucl_T1_relaxation_1 _Heteronucl_T1_list.Entry_ID 53710 _Heteronucl_T1_list.ID 1 _Heteronucl_T1_list.Name R1_800 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 800 _Heteronucl_T1_list.T1_coherence_type Sz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details 'relaxation rates, not times' _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 1 'T1/R1 relaxation' . . . 53710 1 stop_ loop_ _Heteronucl_T1_software.Software_ID _Heteronucl_T1_software.Software_label _Heteronucl_T1_software.Method_ID _Heteronucl_T1_software.Method_label _Heteronucl_T1_software.Entry_ID _Heteronucl_T1_software.Heteronucl_T1_list_ID 1 $software_1 . . 53710 1 2 $software_2 . . 53710 1 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 4 4 ARG N N 15 1.543 0.048 . . . . . 53710 1 2 . 1 1 5 5 LEU N N 15 1.785 0.123 . . . . . 53710 1 3 . 1 1 7 7 CYS N N 15 1.399 0.170 . . . . . 53710 1 4 . 1 1 8 8 GLN N N 15 2.079 0.388 . . . . . 53710 1 5 . 1 1 9 9 LEU N N 15 1.537 0.102 . . . . . 53710 1 6 . 1 1 10 10 ASP N N 15 1.665 0.124 . . . . . 53710 1 7 . 1 1 12 12 ALA N N 15 1.538 0.110 . . . . . 53710 1 8 . 1 1 13 13 ARG N N 15 1.766 0.073 . . . . . 53710 1 9 . 1 1 14 14 ASP N N 15 1.526 0.058 . . . . . 53710 1 10 . 1 1 15 15 VAL N N 15 1.674 0.059 . . . . . 53710 1 11 . 1 1 16 16 LEU N N 15 1.727 0.070 . . . . . 53710 1 12 . 1 1 17 17 CYS N N 15 1.507 0.037 . . . . . 53710 1 13 . 1 1 18 18 LEU N N 15 1.892 0.307 . . . . . 53710 1 14 . 1 1 19 19 ARG N N 15 1.641 0.142 . . . . . 53710 1 15 . 1 1 21 21 VAL N N 15 1.485 0.045 . . . . . 53710 1 16 . 1 1 22 22 GLY N N 15 1.438 0.057 . . . . . 53710 1 17 . 1 1 23 23 ALA N N 15 1.559 0.133 . . . . . 53710 1 18 . 1 1 24 24 GLU N N 15 1.604 0.067 . . . . . 53710 1 19 . 1 1 25 25 SER N N 15 1.747 0.095 . . . . . 53710 1 20 . 1 1 26 26 CYS N N 15 1.443 0.215 . . . . . 53710 1 21 . 1 1 27 27 GLY N N 15 1.272 0.119 . . . . . 53710 1 22 . 1 1 28 28 ARG N N 15 1.399 0.026 . . . . . 53710 1 23 . 1 1 30 30 PHE N N 15 1.739 0.088 . . . . . 53710 1 24 . 1 1 31 31 SER N N 15 1.349 0.044 . . . . . 53710 1 25 . 1 1 32 32 GLY N N 15 1.512 0.181 . . . . . 53710 1 26 . 1 1 33 33 SER N N 15 1.824 0.248 . . . . . 53710 1 27 . 1 1 34 34 LEU N N 15 1.582 0.081 . . . . . 53710 1 28 . 1 1 35 35 GLY N N 15 1.521 0.079 . . . . . 53710 1 29 . 1 1 36 36 THR N N 15 1.564 0.079 . . . . . 53710 1 30 . 1 1 37 37 LEU N N 15 1.498 0.086 . . . . . 53710 1 31 . 1 1 38 38 SER N N 15 1.428 0.080 . . . . . 53710 1 32 . 1 1 39 39 SER N N 15 1.378 0.081 . . . . . 53710 1 33 . 1 1 41 41 SER N N 15 1.434 0.131 . . . . . 53710 1 34 . 1 1 43 43 SER N N 15 1.382 0.123 . . . . . 53710 1 35 . 1 1 44 44 ALA N N 15 1.495 0.080 . . . . . 53710 1 36 . 1 1 45 45 VAL N N 15 1.612 0.188 . . . . . 53710 1 37 . 1 1 47 47 THR N N 15 1.587 0.080 . . . . . 53710 1 38 . 1 1 48 48 ASP N N 15 1.613 0.059 . . . . . 53710 1 39 . 1 1 50 50 GLY N N 15 1.519 0.080 . . . . . 53710 1 40 . 1 1 51 51 ALA N N 15 1.449 0.135 . . . . . 53710 1 41 . 1 1 52 52 HIS N N 15 1.278 0.097 . . . . . 53710 1 42 . 1 1 53 53 LEU N N 15 1.668 0.114 . . . . . 53710 1 43 . 1 1 54 54 SER N N 15 1.411 0.137 . . . . . 53710 1 44 . 1 1 55 55 LEU N N 15 1.596 0.060 . . . . . 53710 1 45 . 1 1 56 56 ARG N N 15 1.538 0.135 . . . . . 53710 1 46 . 1 1 57 57 GLY N N 15 1.329 0.133 . . . . . 53710 1 47 . 1 1 58 58 LEU N N 15 1.564 0.066 . . . . . 53710 1 48 . 1 1 60 60 VAL N N 15 1.366 0.059 . . . . . 53710 1 49 . 1 1 62 62 ALA N N 15 1.505 0.112 . . . . . 53710 1 50 . 1 1 63 63 PHE N N 15 1.530 0.186 . . . . . 53710 1 51 . 1 1 64 64 SER N N 15 1.479 0.107 . . . . . 53710 1 52 . 1 1 65 65 SER N N 15 1.831 0.225 . . . . . 53710 1 53 . 1 1 66 66 ALA N N 15 1.448 0.208 . . . . . 53710 1 54 . 1 1 67 67 GLY N N 15 1.509 0.063 . . . . . 53710 1 55 . 1 1 69 69 CYS N N 15 1.665 0.151 . . . . . 53710 1 56 . 1 1 70 70 ALA N N 15 1.452 0.067 . . . . . 53710 1 57 . 1 1 71 71 LEU N N 15 1.372 0.122 . . . . . 53710 1 58 . 1 1 72 72 ARG N N 15 1.584 0.176 . . . . . 53710 1 59 . 1 1 74 74 THR N N 15 1.276 0.292 . . . . . 53710 1 60 . 1 1 75 75 SER N N 15 1.277 0.096 . . . . . 53710 1 61 . 1 1 76 76 ALA N N 15 1.247 0.154 . . . . . 53710 1 62 . 1 1 77 77 ARG N N 15 1.530 0.024 . . . . . 53710 1 63 . 1 1 78 78 ARG N N 15 1.588 0.208 . . . . . 53710 1 64 . 1 1 79 79 MET N N 15 1.462 0.126 . . . . . 53710 1 65 . 1 1 80 80 GLU N N 15 1.502 0.173 . . . . . 53710 1 66 . 1 1 81 81 THR N N 15 1.109 0.161 . . . . . 53710 1 67 . 1 1 82 82 THR N N 15 1.419 0.157 . . . . . 53710 1 68 . 1 1 83 83 VAL N N 15 1.468 0.055 . . . . . 53710 1 69 . 1 1 84 84 ASN N N 15 1.545 0.096 . . . . . 53710 1 70 . 1 1 85 85 ALA N N 15 1.957 0.173 . . . . . 53710 1 71 . 1 1 86 86 HIS N N 15 1.710 0.191 . . . . . 53710 1 72 . 1 1 87 87 GLN N N 15 1.725 0.196 . . . . . 53710 1 73 . 1 1 88 88 ILE N N 15 1.529 0.024 . . . . . 53710 1 74 . 1 1 89 89 LEU N N 15 1.506 0.139 . . . . . 53710 1 75 . 1 1 91 91 LYS N N 15 1.477 0.058 . . . . . 53710 1 76 . 1 1 92 92 VAL N N 15 1.450 0.135 . . . . . 53710 1 77 . 1 1 93 93 LEU N N 15 1.507 0.066 . . . . . 53710 1 78 . 1 1 94 94 HIS N N 15 1.192 0.112 . . . . . 53710 1 79 . 1 1 95 95 LYS N N 15 1.392 0.092 . . . . . 53710 1 80 . 1 1 96 96 ARG N N 15 1.854 0.158 . . . . . 53710 1 81 . 1 1 97 97 THR N N 15 1.193 0.126 . . . . . 53710 1 82 . 1 1 98 98 LEU N N 15 1.601 0.081 . . . . . 53710 1 83 . 1 1 99 99 GLY N N 15 1.521 0.079 . . . . . 53710 1 84 . 1 1 100 100 LEU N N 15 1.462 0.092 . . . . . 53710 1 85 . 1 1 101 101 SER N N 15 1.426 0.137 . . . . . 53710 1 86 . 1 1 102 102 ALA N N 15 1.225 0.236 . . . . . 53710 1 87 . 1 1 103 103 MET N N 15 1.564 0.069 . . . . . 53710 1 88 . 1 1 104 104 SER N N 15 2.011 0.207 . . . . . 53710 1 89 . 1 1 105 105 THR N N 15 1.331 0.071 . . . . . 53710 1 90 . 1 1 106 106 THR N N 15 1.643 0.116 . . . . . 53710 1 91 . 1 1 107 107 ASP N N 15 1.561 0.211 . . . . . 53710 1 92 . 1 1 108 108 LEU N N 15 1.397 0.200 . . . . . 53710 1 93 . 1 1 109 109 GLU N N 15 1.423 0.123 . . . . . 53710 1 94 . 1 1 110 110 ALA N N 15 1.732 0.153 . . . . . 53710 1 95 . 1 1 111 111 TYR N N 15 1.778 0.053 . . . . . 53710 1 96 . 1 1 112 112 PHE N N 15 1.475 0.129 . . . . . 53710 1 97 . 1 1 113 113 LYS N N 15 1.278 0.208 . . . . . 53710 1 98 . 1 1 114 114 ASP N N 15 1.369 0.080 . . . . . 53710 1 99 . 1 1 115 115 CYS N N 15 1.239 0.158 . . . . . 53710 1 100 . 1 1 116 116 LEU N N 15 1.764 0.171 . . . . . 53710 1 101 . 1 1 117 117 PHE N N 15 1.415 0.112 . . . . . 53710 1 102 . 1 1 118 118 LYS N N 15 1.483 0.202 . . . . . 53710 1 103 . 1 1 119 119 ASP N N 15 1.561 0.149 . . . . . 53710 1 104 . 1 1 120 120 TRP N N 15 1.461 0.061 . . . . . 53710 1 stop_ save_ ######################################## # Heteronuclear T1 relaxation values # ######################################## save_heteronucl_T1_relaxation_2 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronucl_T1_relaxation_2 _Heteronucl_T1_list.Entry_ID 53710 _Heteronucl_T1_list.ID 2 _Heteronucl_T1_list.Name R1_1200 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 1200 _Heteronucl_T1_list.T1_coherence_type Sz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details 'relaxation rates, not times' _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 4 'T1/R1 relaxation' . . . 53710 2 stop_ loop_ _Heteronucl_T1_software.Software_ID _Heteronucl_T1_software.Software_label _Heteronucl_T1_software.Method_ID _Heteronucl_T1_software.Method_label _Heteronucl_T1_software.Entry_ID _Heteronucl_T1_software.Heteronucl_T1_list_ID 1 $software_1 . . 53710 2 2 $software_2 . . 53710 2 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 4 4 ARG N N 15 1.541 0.113 . . . . . 53710 2 2 . 1 1 5 5 LEU N N 15 1.727 0.128 . . . . . 53710 2 3 . 1 1 7 7 CYS N N 15 1.021 0.130 . . . . . 53710 2 4 . 1 1 8 8 GLN N N 15 1.592 0.216 . . . . . 53710 2 5 . 1 1 9 9 LEU N N 15 1.543 0.059 . . . . . 53710 2 6 . 1 1 10 10 ASP N N 15 1.635 0.093 . . . . . 53710 2 7 . 1 1 12 12 ALA N N 15 1.504 0.052 . . . . . 53710 2 8 . 1 1 13 13 ARG N N 15 1.546 0.045 . . . . . 53710 2 9 . 1 1 14 14 ASP N N 15 1.376 0.083 . . . . . 53710 2 10 . 1 1 15 15 VAL N N 15 1.537 0.036 . . . . . 53710 2 11 . 1 1 16 16 LEU N N 15 1.583 0.056 . . . . . 53710 2 12 . 1 1 17 17 CYS N N 15 1.397 0.088 . . . . . 53710 2 13 . 1 1 18 18 LEU N N 15 1.316 0.179 . . . . . 53710 2 14 . 1 1 19 19 ARG N N 15 1.435 0.071 . . . . . 53710 2 15 . 1 1 21 21 VAL N N 15 1.479 0.042 . . . . . 53710 2 16 . 1 1 22 22 GLY N N 15 1.527 0.081 . . . . . 53710 2 17 . 1 1 23 23 ALA N N 15 1.499 0.057 . . . . . 53710 2 18 . 1 1 24 24 GLU N N 15 1.533 0.068 . . . . . 53710 2 19 . 1 1 25 25 SER N N 15 1.504 0.070 . . . . . 53710 2 20 . 1 1 26 26 CYS N N 15 1.332 0.026 . . . . . 53710 2 21 . 1 1 27 27 GLY N N 15 1.417 0.101 . . . . . 53710 2 22 . 1 1 28 28 ARG N N 15 1.335 0.054 . . . . . 53710 2 23 . 1 1 30 30 PHE N N 15 1.455 0.079 . . . . . 53710 2 24 . 1 1 31 31 SER N N 15 1.354 0.094 . . . . . 53710 2 25 . 1 1 32 32 GLY N N 15 1.479 0.137 . . . . . 53710 2 26 . 1 1 33 33 SER N N 15 1.377 0.062 . . . . . 53710 2 27 . 1 1 34 34 LEU N N 15 1.499 0.105 . . . . . 53710 2 28 . 1 1 35 35 GLY N N 15 1.598 0.062 . . . . . 53710 2 29 . 1 1 36 36 THR N N 15 1.422 0.099 . . . . . 53710 2 30 . 1 1 37 37 LEU N N 15 1.531 0.076 . . . . . 53710 2 31 . 1 1 38 38 SER N N 15 1.480 0.076 . . . . . 53710 2 32 . 1 1 39 39 SER N N 15 1.393 0.057 . . . . . 53710 2 33 . 1 1 41 41 SER N N 15 1.466 0.126 . . . . . 53710 2 34 . 1 1 44 44 ALA N N 15 1.347 0.076 . . . . . 53710 2 35 . 1 1 45 45 VAL N N 15 1.404 0.109 . . . . . 53710 2 36 . 1 1 47 47 THR N N 15 1.454 0.068 . . . . . 53710 2 37 . 1 1 48 48 ASP N N 15 1.346 0.063 . . . . . 53710 2 38 . 1 1 50 50 GLY N N 15 1.549 0.107 . . . . . 53710 2 39 . 1 1 51 51 ALA N N 15 1.438 0.086 . . . . . 53710 2 40 . 1 1 52 52 HIS N N 15 1.406 0.096 . . . . . 53710 2 41 . 1 1 53 53 LEU N N 15 1.540 0.068 . . . . . 53710 2 42 . 1 1 54 54 SER N N 15 1.454 0.068 . . . . . 53710 2 43 . 1 1 55 55 LEU N N 15 1.475 0.041 . . . . . 53710 2 44 . 1 1 56 56 ARG N N 15 1.392 0.093 . . . . . 53710 2 45 . 1 1 57 57 GLY N N 15 1.483 0.116 . . . . . 53710 2 46 . 1 1 58 58 LEU N N 15 1.504 0.032 . . . . . 53710 2 47 . 1 1 60 60 VAL N N 15 1.450 0.049 . . . . . 53710 2 48 . 1 1 61 61 CYS N N 15 1.707 0.233 . . . . . 53710 2 49 . 1 1 62 62 ALA N N 15 1.232 0.152 . . . . . 53710 2 50 . 1 1 63 63 PHE N N 15 1.190 0.193 . . . . . 53710 2 51 . 1 1 64 64 SER N N 15 1.367 0.066 . . . . . 53710 2 52 . 1 1 66 66 ALA N N 15 1.242 0.159 . . . . . 53710 2 53 . 1 1 67 67 GLY N N 15 1.518 0.065 . . . . . 53710 2 54 . 1 1 69 69 CYS N N 15 0.929 0.163 . . . . . 53710 2 55 . 1 1 70 70 ALA N N 15 1.626 0.178 . . . . . 53710 2 56 . 1 1 71 71 LEU N N 15 1.265 0.099 . . . . . 53710 2 57 . 1 1 72 72 ARG N N 15 1.576 0.127 . . . . . 53710 2 58 . 1 1 73 73 PHE N N 15 1.370 0.217 . . . . . 53710 2 59 . 1 1 75 75 SER N N 15 1.406 0.096 . . . . . 53710 2 60 . 1 1 76 76 ALA N N 15 1.507 0.149 . . . . . 53710 2 61 . 1 1 77 77 ARG N N 15 1.389 0.077 . . . . . 53710 2 62 . 1 1 78 78 ARG N N 15 1.417 0.060 . . . . . 53710 2 63 . 1 1 79 79 MET N N 15 1.391 0.119 . . . . . 53710 2 64 . 1 1 80 80 GLU N N 15 1.378 0.244 . . . . . 53710 2 65 . 1 1 81 81 THR N N 15 1.324 0.123 . . . . . 53710 2 66 . 1 1 82 82 THR N N 15 1.247 0.165 . . . . . 53710 2 67 . 1 1 83 83 VAL N N 15 1.435 0.034 . . . . . 53710 2 68 . 1 1 84 84 ASN N N 15 1.415 0.099 . . . . . 53710 2 69 . 1 1 85 85 ALA N N 15 1.834 0.134 . . . . . 53710 2 70 . 1 1 86 86 HIS N N 15 1.369 0.111 . . . . . 53710 2 71 . 1 1 87 87 GLN N N 15 1.150 0.137 . . . . . 53710 2 72 . 1 1 88 88 ILE N N 15 1.559 0.046 . . . . . 53710 2 73 . 1 1 89 89 LEU N N 15 1.511 0.109 . . . . . 53710 2 74 . 1 1 91 91 LYS N N 15 1.383 0.072 . . . . . 53710 2 75 . 1 1 92 92 VAL N N 15 1.335 0.120 . . . . . 53710 2 76 . 1 1 93 93 LEU N N 15 1.550 0.209 . . . . . 53710 2 77 . 1 1 94 94 HIS N N 15 1.564 0.047 . . . . . 53710 2 78 . 1 1 95 95 LYS N N 15 1.345 0.072 . . . . . 53710 2 79 . 1 1 96 96 ARG N N 15 2.025 0.105 . . . . . 53710 2 80 . 1 1 97 97 THR N N 15 1.454 0.085 . . . . . 53710 2 81 . 1 1 98 98 LEU N N 15 1.536 0.092 . . . . . 53710 2 82 . 1 1 99 99 GLY N N 15 1.255 0.195 . . . . . 53710 2 83 . 1 1 100 100 LEU N N 15 1.307 0.092 . . . . . 53710 2 84 . 1 1 101 101 SER N N 15 1.340 0.063 . . . . . 53710 2 85 . 1 1 102 102 ALA N N 15 1.185 0.183 . . . . . 53710 2 86 . 1 1 103 103 MET N N 15 1.516 0.199 . . . . . 53710 2 87 . 1 1 104 104 SER N N 15 0.995 0.179 . . . . . 53710 2 88 . 1 1 105 105 THR N N 15 2.001 0.310 . . . . . 53710 2 89 . 1 1 106 106 THR N N 15 1.303 0.105 . . . . . 53710 2 90 . 1 1 107 107 ASP N N 15 1.134 0.075 . . . . . 53710 2 91 . 1 1 108 108 LEU N N 15 1.306 0.155 . . . . . 53710 2 92 . 1 1 109 109 GLU N N 15 1.081 0.052 . . . . . 53710 2 93 . 1 1 110 110 ALA N N 15 1.242 0.107 . . . . . 53710 2 94 . 1 1 111 111 TYR N N 15 1.199 0.187 . . . . . 53710 2 95 . 1 1 112 112 PHE N N 15 1.266 0.054 . . . . . 53710 2 96 . 1 1 113 113 LYS N N 15 1.306 0.078 . . . . . 53710 2 97 . 1 1 114 114 ASP N N 15 1.440 0.120 . . . . . 53710 2 98 . 1 1 115 115 CYS N N 15 1.341 0.122 . . . . . 53710 2 99 . 1 1 116 116 LEU N N 15 1.511 0.133 . . . . . 53710 2 100 . 1 1 117 117 PHE N N 15 1.405 0.086 . . . . . 53710 2 101 . 1 1 118 118 LYS N N 15 1.506 0.105 . . . . . 53710 2 102 . 1 1 119 119 ASP N N 15 1.564 0.158 . . . . . 53710 2 103 . 1 1 120 120 TRP N N 15 1.486 0.090 . . . . . 53710 2 stop_ save_