######################################## # Heteronuclear T2 relaxation values # ######################################## save_heteronucl_T2_relaxation_1 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronucl_T2_relaxation_1 _Heteronucl_T2_list.Entry_ID 50115 _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Name . _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method - _Heteronucl_T2_list.Temp_control_method 'Loop for compensation of heating effects.' _Heteronucl_T2_list.Spectrometer_frequency_1H 800 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units ms _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details ; Bruker pulse sequence used hsqct2etf3gpsi with the following delays: 5 ms, 30 ms, 62.5 ms, 125 ms, 187.5 ms, 250 ms, 312.5 ms and 375 ms. Relaxation delay between scans: 4 s ; _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 8 'Het. Nuc. T2 relaxation' . . . 50115 1 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 3 3 ALA N N 15 301.66 23.52 . . . . 0 ALA N 50115 1 2 . 1 1 4 4 MET N N 15 359.83 23.36 . . . . 1 MET N 50115 1 3 . 1 1 5 5 THR N N 15 345.49 23.01 . . . . 2 THR N 50115 1 4 . 1 1 7 7 VAL N N 15 378.31 10.88 . . . . 4 VAL N 50115 1 5 . 1 1 8 8 ARG N N 15 242.69 10.23 . . . . 5 ARG N 50115 1 6 . 1 1 12 12 THR N N 15 210.8 15.55 . . . . 9 THR N 50115 1 7 . 1 1 14 14 ASP N N 15 182.5 6.66 . . . . 11 ASP N 50115 1 8 . 1 1 16 16 LEU N N 15 222.49 6.08 . . . . 13 LEU N 50115 1 9 . 1 1 17 17 ASN N N 15 211.65 9.52 . . . . 14 ASN N 50115 1 10 . 1 1 18 18 LEU N N 15 192.69 8.78 . . . . 15 LEU N 50115 1 11 . 1 1 19 19 ARG N N 15 248.05 8.7 . . . . 16 ARG N 50115 1 12 . 1 1 20 20 GLY N N 15 260.39 12.74 . . . . 17 GLY N 50115 1 13 . 1 1 22 22 LEU N N 15 246.15 7.21 . . . . 19 LEU N 50115 1 14 . 1 1 23 23 ASP N N 15 242.83 8.16 . . . . 20 ASP N 50115 1 15 . 1 1 24 24 GLY N N 15 241.61 10.49 . . . . 21 GLY N 50115 1 16 . 1 1 26 26 ARG N N 15 196.78 9.49 . . . . 23 ARG N 50115 1 17 . 1 1 27 27 TRP N N 15 200.01 7.02 . . . . 24 TRP N 50115 1 18 . 1 1 28 28 ARG N N 15 151.52 6.13 . . . . 25 ARG N 50115 1 19 . 1 1 29 29 ARG N N 15 162.63 7.38 . . . . 26 ARG N 50115 1 20 . 1 1 30 30 ALA N N 15 169.47 6.68 . . . . 27 ALA N 50115 1 21 . 1 1 31 31 GLU N N 15 204.65 6.15 . . . . 28 GLU N 50115 1 22 . 1 1 33 33 ALA N N 15 182.63 10.15 . . . . 30 ALA N 50115 1 23 . 1 1 34 34 GLN N N 15 243.38 13.37 . . . . 31 GLN N 50115 1 24 . 1 1 35 35 SER N N 15 222.98 9.99 . . . . 32 SER N 50115 1 25 . 1 1 36 36 ARG N N 15 191.42 9.07 . . . . 33 ARG N 50115 1 26 . 1 1 37 37 ARG N N 15 194.95 9.89 . . . . 34 ARG N 50115 1 27 . 1 1 39 39 GLY N N 15 244.78 13.29 . . . . 36 GLY N 50115 1 28 . 1 1 40 40 ARG N N 15 246.72 10.4 . . . . 37 ARG N 50115 1 29 . 1 1 41 41 SER N N 15 237.95 10.29 . . . . 38 SER N 50115 1 30 . 1 1 42 42 ARG N N 15 198.12 12.18 . . . . 39 ARG N 50115 1 31 . 1 1 44 44 GLY N N 15 279.46 15.13 . . . . 41 GLY N 50115 1 32 . 1 1 45 45 GLY N N 15 267.62 14.77 . . . . 42 GLY N 50115 1 33 . 1 1 46 46 ALA N N 15 209.69 10.76 . . . . 43 ALA N 50115 1 34 . 1 1 48 48 LEU N N 15 177.09 3.9 . . . . 45 LEU N 50115 1 35 . 1 1 49 49 ARG N N 15 234.83 9.64 . . . . 46 ARG N 50115 1 36 . 1 1 50 50 TYR N N 15 223.94 10.05 . . . . 47 TYR N 50115 1 37 . 1 1 52 52 ARG N N 15 196.54 14.53 . . . . 49 ARG N 50115 1 38 . 1 1 53 53 THR N N 15 216.52 10.68 . . . . 50 THR N 50115 1 39 . 1 1 54 54 GLY N N 15 257.17 15.74 . . . . 51 GLY N 50115 1 40 . 1 1 55 55 VAL N N 15 280.06 15.55 . . . . 52 VAL N 50115 1 41 . 1 1 56 56 GLY N N 15 268.14 18.78 . . . . 53 GLY N 50115 1 42 . 1 1 57 57 MET N N 15 284.16 17.16 . . . . 54 MET N 50115 1 43 . 1 1 58 58 SER N N 15 271.42 11.99 . . . . 55 SER N 50115 1 44 . 1 1 59 59 ARG N N 15 208.05 8.42 . . . . 56 ARG N 50115 1 45 . 1 1 60 60 THR N N 15 261.14 12.89 . . . . 57 THR N 50115 1 46 . 1 1 61 61 GLY N N 15 287.12 14.08 . . . . 58 GLY N 50115 1 47 . 1 1 63 63 GLY N N 15 311.45 18.63 . . . . 60 GLY N 50115 1 48 . 1 1 64 64 SER N N 15 292.4 15.04 . . . . 61 SER N 50115 1 49 . 1 1 65 65 ARG N N 15 257.15 18.11 . . . . 62 ARG N 50115 1 50 . 1 1 67 67 VAL N N 15 426.9 20.21 . . . . 64 VAL N 50115 1 stop_ save_