######################################## # Heteronuclear T2 relaxation values # ######################################## save_R2_400 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode R2_400 _Heteronucl_T2_list.Entry_ID 18545 _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method 'ethylene glycol' _Heteronucl_T2_list.Temp_control_method 'single scan interleaving' _Heteronucl_T2_list.Spectrometer_frequency_1H 400 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _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 12 '1H-15N HSQC type R1/R2' . . . 18545 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 4 4 LEU N N 15 12.8659 0.5043 . . . . . . . 18545 1 2 . 1 1 5 5 GLU N N 15 12.2669 0.1468 . . . . . . . 18545 1 3 . 1 1 6 6 THR N N 15 12.2587 0.1167 . . . . . . . 18545 1 4 . 1 1 7 7 ALA N N 15 12.1874 0.2659 . . . . . . . 18545 1 5 . 1 1 8 8 MET N N 15 13.2532 0.2603 . . . . . . . 18545 1 6 . 1 1 10 10 THR N N 15 12.8121 0.2091 . . . . . . . 18545 1 7 . 1 1 11 11 LEU N N 15 12.7182 0.1857 . . . . . . . 18545 1 8 . 1 1 12 12 ILE N N 15 12.7003 0.3788 . . . . . . . 18545 1 9 . 1 1 13 13 ASN N N 15 13.8044 0.7946 . . . . . . . 18545 1 10 . 1 1 14 14 VAL N N 15 12.6866 0.1171 . . . . . . . 18545 1 11 . 1 1 15 15 PHE N N 15 14.4844 0.2003 . . . . . . . 18545 1 12 . 1 1 16 16 HIS N N 15 14.6123 0.2738 . . . . . . . 18545 1 13 . 1 1 17 17 ALA N N 15 12.1742 0.1346 . . . . . . . 18545 1 14 . 1 1 18 18 HIS N N 15 13.3838 0.2632 . . . . . . . 18545 1 15 . 1 1 19 19 SER N N 15 12.4053 0.3012 . . . . . . . 18545 1 16 . 1 1 20 20 GLY N N 15 16.1391 1.5237 . . . . . . . 18545 1 17 . 1 1 21 21 LYS N N 15 11.3314 0.2133 . . . . . . . 18545 1 18 . 1 1 22 22 GLU N N 15 11.8146 0.1119 . . . . . . . 18545 1 19 . 1 1 26 26 TYR N N 15 11.9853 0.1913 . . . . . . . 18545 1 20 . 1 1 27 27 LYS N N 15 12.4670 0.1763 . . . . . . . 18545 1 21 . 1 1 28 28 LEU N N 15 11.3544 0.4719 . . . . . . . 18545 1 22 . 1 1 29 29 SER N N 15 11.5544 0.5060 . . . . . . . 18545 1 23 . 1 1 30 30 LYS N N 15 11.8525 0.2809 . . . . . . . 18545 1 24 . 1 1 31 31 LYS N N 15 11.4317 0.0966 . . . . . . . 18545 1 25 . 1 1 32 32 GLU N N 15 12.5713 0.3916 . . . . . . . 18545 1 26 . 1 1 33 33 LEU N N 15 11.9530 0.1848 . . . . . . . 18545 1 27 . 1 1 35 35 GLU N N 15 11.9747 0.2014 . . . . . . . 18545 1 28 . 1 1 36 36 LEU N N 15 12.3705 0.2315 . . . . . . . 18545 1 29 . 1 1 37 37 LEU N N 15 12.1879 0.1520 . . . . . . . 18545 1 30 . 1 1 38 38 GLN N N 15 11.9267 0.2490 . . . . . . . 18545 1 31 . 1 1 39 39 THR N N 15 11.0406 0.2571 . . . . . . . 18545 1 32 . 1 1 40 40 GLU N N 15 11.9083 0.3640 . . . . . . . 18545 1 33 . 1 1 42 42 SER N N 15 10.2234 0.1571 . . . . . . . 18545 1 34 . 1 1 43 43 GLY N N 15 10.7921 0.7524 . . . . . . . 18545 1 35 . 1 1 44 44 PHE N N 15 11.7814 0.3533 . . . . . . . 18545 1 36 . 1 1 47 47 ALA N N 15 11.1020 0.2239 . . . . . . . 18545 1 37 . 1 1 50 50 ASP N N 15 7.8839 0.1617 . . . . . . . 18545 1 38 . 1 1 51 51 VAL N N 15 9.5966 0.4127 . . . . . . . 18545 1 39 . 1 1 52 52 ASP N N 15 9.3471 0.2578 . . . . . . . 18545 1 40 . 1 1 53 53 ALA N N 15 10.2055 0.2164 . . . . . . . 18545 1 41 . 1 1 54 54 VAL N N 15 11.4536 0.2377 . . . . . . . 18545 1 42 . 1 1 55 55 ASP N N 15 11.5889 0.1816 . . . . . . . 18545 1 43 . 1 1 56 56 LYS N N 15 11.6213 0.0635 . . . . . . . 18545 1 44 . 1 1 57 57 VAL N N 15 10.8497 0.2176 . . . . . . . 18545 1 45 . 1 1 58 58 MET N N 15 12.8015 0.1929 . . . . . . . 18545 1 46 . 1 1 60 60 GLU N N 15 11.9946 0.2393 . . . . . . . 18545 1 47 . 1 1 61 61 LEU N N 15 12.5335 0.2355 . . . . . . . 18545 1 48 . 1 1 63 63 GLU N N 15 10.4617 0.2227 . . . . . . . 18545 1 49 . 1 1 64 64 ASN N N 15 10.7349 0.1493 . . . . . . . 18545 1 50 . 1 1 65 65 GLY N N 15 10.7228 0.0812 . . . . . . . 18545 1 51 . 1 1 67 67 GLY N N 15 11.6643 0.1585 . . . . . . . 18545 1 52 . 1 1 68 68 GLU N N 15 11.9494 0.1298 . . . . . . . 18545 1 53 . 1 1 69 69 VAL N N 15 11.3037 0.4142 . . . . . . . 18545 1 54 . 1 1 70 70 ASP N N 15 11.1390 0.2559 . . . . . . . 18545 1 55 . 1 1 71 71 PHE N N 15 11.7248 0.3256 . . . . . . . 18545 1 56 . 1 1 74 74 TYR N N 15 11.0066 0.3309 . . . . . . . 18545 1 57 . 1 1 75 75 VAL N N 15 12.3239 0.3174 . . . . . . . 18545 1 58 . 1 1 76 76 VAL N N 15 12.4035 0.2827 . . . . . . . 18545 1 59 . 1 1 77 77 LEU N N 15 12.0991 0.4699 . . . . . . . 18545 1 60 . 1 1 78 78 VAL N N 15 12.2074 0.3668 . . . . . . . 18545 1 61 . 1 1 79 79 ALA N N 15 11.5143 0.4534 . . . . . . . 18545 1 62 . 1 1 80 80 ALA N N 15 12.3087 0.1560 . . . . . . . 18545 1 63 . 1 1 81 81 LEU N N 15 13.3919 0.4719 . . . . . . . 18545 1 64 . 1 1 82 82 THR N N 15 11.6706 0.1670 . . . . . . . 18545 1 65 . 1 1 83 83 VAL N N 15 11.1449 0.3340 . . . . . . . 18545 1 66 . 1 1 84 84 ALA N N 15 10.9336 0.1498 . . . . . . . 18545 1 67 . 1 1 87 87 ASN N N 15 11.6375 0.1101 . . . . . . . 18545 1 68 . 1 1 88 88 PHE N N 15 11.2883 0.1356 . . . . . . . 18545 1 69 . 1 1 89 89 PHE N N 15 14.4129 0.4498 . . . . . . . 18545 1 70 . 1 1 91 91 GLU N N 15 7.5333 0.0703 . . . . . . . 18545 1 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_R2_500 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode R2_500 _Heteronucl_T2_list.Entry_ID 18545 _Heteronucl_T2_list.ID 2 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method 'ethylene glycol' _Heteronucl_T2_list.Temp_control_method 'single scan interleaving' _Heteronucl_T2_list.Spectrometer_frequency_1H 500 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _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 12 '1H-15N HSQC type R1/R2' . . . 18545 2 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 GLU N N 15 16.0683 2.2131 . . . . . . . 18545 2 2 . 1 1 4 4 LEU N N 15 13.3497 0.2407 . . . . . . . 18545 2 3 . 1 1 5 5 GLU N N 15 12.4673 0.1997 . . . . . . . 18545 2 4 . 1 1 6 6 THR N N 15 12.0586 0.1951 . . . . . . . 18545 2 5 . 1 1 7 7 ALA N N 15 12.8162 0.3791 . . . . . . . 18545 2 6 . 1 1 8 8 MET N N 15 12.8758 0.4371 . . . . . . . 18545 2 7 . 1 1 10 10 THR N N 15 13.4389 0.2913 . . . . . . . 18545 2 8 . 1 1 11 11 LEU N N 15 13.6366 0.2393 . . . . . . . 18545 2 9 . 1 1 12 12 ILE N N 15 13.2896 0.4663 . . . . . . . 18545 2 10 . 1 1 13 13 ASN N N 15 16.3043 0.9717 . . . . . . . 18545 2 11 . 1 1 14 14 VAL N N 15 13.8529 0.3561 . . . . . . . 18545 2 12 . 1 1 15 15 PHE N N 15 15.4974 0.4984 . . . . . . . 18545 2 13 . 1 1 16 16 HIS N N 15 15.5990 0.4632 . . . . . . . 18545 2 14 . 1 1 17 17 ALA N N 15 13.0401 0.2679 . . . . . . . 18545 2 15 . 1 1 18 18 HIS N N 15 13.8559 0.2782 . . . . . . . 18545 2 16 . 1 1 19 19 SER N N 15 12.4709 0.5613 . . . . . . . 18545 2 17 . 1 1 20 20 GLY N N 15 16.6274 1.0712 . . . . . . . 18545 2 18 . 1 1 21 21 LYS N N 15 11.8645 0.1950 . . . . . . . 18545 2 19 . 1 1 22 22 GLU N N 15 11.8544 0.1117 . . . . . . . 18545 2 20 . 1 1 25 25 LYS N N 15 13.2663 0.4352 . . . . . . . 18545 2 21 . 1 1 26 26 TYR N N 15 12.4935 0.4442 . . . . . . . 18545 2 22 . 1 1 27 27 LYS N N 15 12.6972 0.2963 . . . . . . . 18545 2 23 . 1 1 28 28 LEU N N 15 13.1296 0.4029 . . . . . . . 18545 2 24 . 1 1 29 29 SER N N 15 12.5676 0.4750 . . . . . . . 18545 2 25 . 1 1 30 30 LYS N N 15 11.7554 0.3612 . . . . . . . 18545 2 26 . 1 1 31 31 LYS N N 15 12.0744 0.1758 . . . . . . . 18545 2 27 . 1 1 32 32 GLU N N 15 13.2602 0.3317 . . . . . . . 18545 2 28 . 1 1 33 33 LEU N N 15 12.7207 0.3744 . . . . . . . 18545 2 29 . 1 1 35 35 GLU N N 15 12.4401 0.2038 . . . . . . . 18545 2 30 . 1 1 36 36 LEU N N 15 13.6472 0.3480 . . . . . . . 18545 2 31 . 1 1 37 37 LEU N N 15 13.0674 0.2282 . . . . . . . 18545 2 32 . 1 1 38 38 GLN N N 15 12.5455 0.2024 . . . . . . . 18545 2 33 . 1 1 39 39 THR N N 15 11.8434 0.2837 . . . . . . . 18545 2 34 . 1 1 40 40 GLU N N 15 12.8230 0.3154 . . . . . . . 18545 2 35 . 1 1 42 42 SER N N 15 10.9742 0.2918 . . . . . . . 18545 2 36 . 1 1 44 44 PHE N N 15 11.9856 0.4002 . . . . . . . 18545 2 37 . 1 1 47 47 ALA N N 15 11.8246 0.3352 . . . . . . . 18545 2 38 . 1 1 50 50 ASP N N 15 8.0190 0.2148 . . . . . . . 18545 2 39 . 1 1 51 51 VAL N N 15 9.2218 0.5434 . . . . . . . 18545 2 40 . 1 1 52 52 ASP N N 15 10.3160 0.8320 . . . . . . . 18545 2 41 . 1 1 53 53 ALA N N 15 10.6037 0.3840 . . . . . . . 18545 2 42 . 1 1 54 54 VAL N N 15 12.2194 0.2430 . . . . . . . 18545 2 43 . 1 1 55 55 ASP N N 15 11.8070 0.2728 . . . . . . . 18545 2 44 . 1 1 56 56 LYS N N 15 12.0595 0.2284 . . . . . . . 18545 2 45 . 1 1 57 57 VAL N N 15 12.4036 0.1905 . . . . . . . 18545 2 46 . 1 1 58 58 MET N N 15 13.4525 0.2829 . . . . . . . 18545 2 47 . 1 1 60 60 GLU N N 15 12.4616 0.2868 . . . . . . . 18545 2 48 . 1 1 61 61 LEU N N 15 12.0136 0.3684 . . . . . . . 18545 2 49 . 1 1 62 62 ASP N N 15 12.6246 0.2698 . . . . . . . 18545 2 50 . 1 1 63 63 GLU N N 15 10.4893 0.2284 . . . . . . . 18545 2 51 . 1 1 64 64 ASN N N 15 10.9600 0.2765 . . . . . . . 18545 2 52 . 1 1 65 65 GLY N N 15 11.2267 0.2412 . . . . . . . 18545 2 53 . 1 1 67 67 GLY N N 15 12.1109 0.2873 . . . . . . . 18545 2 54 . 1 1 68 68 GLU N N 15 12.0959 0.1744 . . . . . . . 18545 2 55 . 1 1 69 69 VAL N N 15 12.2141 0.6240 . . . . . . . 18545 2 56 . 1 1 70 70 ASP N N 15 12.0079 0.5667 . . . . . . . 18545 2 57 . 1 1 71 71 PHE N N 15 12.6201 0.3237 . . . . . . . 18545 2 58 . 1 1 72 72 GLN N N 15 12.1114 0.1254 . . . . . . . 18545 2 59 . 1 1 74 74 TYR N N 15 11.8570 0.2216 . . . . . . . 18545 2 60 . 1 1 75 75 VAL N N 15 13.6334 0.2857 . . . . . . . 18545 2 61 . 1 1 76 76 VAL N N 15 13.1539 0.4432 . . . . . . . 18545 2 62 . 1 1 77 77 LEU N N 15 13.3764 0.6316 . . . . . . . 18545 2 63 . 1 1 78 78 VAL N N 15 13.3693 0.7267 . . . . . . . 18545 2 64 . 1 1 79 79 ALA N N 15 11.9920 0.4377 . . . . . . . 18545 2 65 . 1 1 80 80 ALA N N 15 12.6547 0.3030 . . . . . . . 18545 2 66 . 1 1 81 81 LEU N N 15 12.8394 0.6943 . . . . . . . 18545 2 67 . 1 1 82 82 THR N N 15 13.0652 0.5042 . . . . . . . 18545 2 68 . 1 1 83 83 VAL N N 15 11.6120 0.5723 . . . . . . . 18545 2 69 . 1 1 84 84 ALA N N 15 12.4532 0.3116 . . . . . . . 18545 2 70 . 1 1 87 87 ASN N N 15 12.3009 0.3162 . . . . . . . 18545 2 71 . 1 1 88 88 PHE N N 15 11.6513 0.2300 . . . . . . . 18545 2 72 . 1 1 89 89 PHE N N 15 17.2320 0.7887 . . . . . . . 18545 2 73 . 1 1 91 91 GLU N N 15 8.0675 0.1647 . . . . . . . 18545 2 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_R2_700 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode R2_700 _Heteronucl_T2_list.Entry_ID 18545 _Heteronucl_T2_list.ID 3 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method 'ethylene glycol' _Heteronucl_T2_list.Temp_control_method 'single scan interleaving' _Heteronucl_T2_list.Spectrometer_frequency_1H 700 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _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 12 '1H-15N HSQC type R1/R2' . . . 18545 3 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 GLU N N 15 15.3755 0.3843 . . . . . . . 18545 3 2 . 1 1 4 4 LEU N N 15 15.6990 0.2282 . . . . . . . 18545 3 3 . 1 1 5 5 GLU N N 15 14.7364 0.1048 . . . . . . . 18545 3 4 . 1 1 6 6 THR N N 15 14.4180 0.0941 . . . . . . . 18545 3 5 . 1 1 7 7 ALA N N 15 15.8966 0.2575 . . . . . . . 18545 3 6 . 1 1 8 8 MET N N 15 15.1203 0.1911 . . . . . . . 18545 3 7 . 1 1 10 10 THR N N 15 15.5724 0.0961 . . . . . . . 18545 3 8 . 1 1 11 11 LEU N N 15 15.7958 0.1583 . . . . . . . 18545 3 9 . 1 1 12 12 ILE N N 15 15.5064 0.3149 . . . . . . . 18545 3 10 . 1 1 13 13 ASN N N 15 21.8944 0.4799 . . . . . . . 18545 3 11 . 1 1 14 14 VAL N N 15 16.3690 0.1713 . . . . . . . 18545 3 12 . 1 1 15 15 PHE N N 15 19.1356 0.2954 . . . . . . . 18545 3 13 . 1 1 16 16 HIS N N 15 19.6543 0.2954 . . . . . . . 18545 3 14 . 1 1 17 17 ALA N N 15 16.1493 0.2106 . . . . . . . 18545 3 15 . 1 1 18 18 HIS N N 15 17.2952 0.2671 . . . . . . . 18545 3 16 . 1 1 19 19 SER N N 15 15.1361 0.2021 . . . . . . . 18545 3 17 . 1 1 20 20 GLY N N 15 21.4981 4.9517 . . . . . . . 18545 3 18 . 1 1 21 21 LYS N N 15 14.8240 0.1132 . . . . . . . 18545 3 19 . 1 1 22 22 GLU N N 15 14.3007 0.0783 . . . . . . . 18545 3 20 . 1 1 25 25 LYS N N 15 14.6837 0.1497 . . . . . . . 18545 3 21 . 1 1 26 26 TYR N N 15 15.2069 0.1131 . . . . . . . 18545 3 22 . 1 1 27 27 LYS N N 15 14.5478 0.1170 . . . . . . . 18545 3 23 . 1 1 28 28 LEU N N 15 14.4730 0.1302 . . . . . . . 18545 3 24 . 1 1 29 29 SER N N 15 14.1014 0.1589 . . . . . . . 18545 3 25 . 1 1 30 30 LYS N N 15 14.6432 0.0940 . . . . . . . 18545 3 26 . 1 1 31 31 LYS N N 15 14.0207 0.1130 . . . . . . . 18545 3 27 . 1 1 32 32 GLU N N 15 15.4630 0.1801 . . . . . . . 18545 3 28 . 1 1 33 33 LEU N N 15 15.4293 0.1574 . . . . . . . 18545 3 29 . 1 1 35 35 GLU N N 15 14.0970 0.1657 . . . . . . . 18545 3 30 . 1 1 36 36 LEU N N 15 17.3049 0.1547 . . . . . . . 18545 3 31 . 1 1 37 37 LEU N N 15 14.9737 0.2317 . . . . . . . 18545 3 32 . 1 1 38 38 GLN N N 15 14.1490 0.1472 . . . . . . . 18545 3 33 . 1 1 39 39 THR N N 15 13.9105 0.0668 . . . . . . . 18545 3 34 . 1 1 40 40 GLU N N 15 14.6768 0.1511 . . . . . . . 18545 3 35 . 1 1 42 42 SER N N 15 12.5420 0.1238 . . . . . . . 18545 3 36 . 1 1 43 43 GLY N N 15 12.9856 0.2023 . . . . . . . 18545 3 37 . 1 1 44 44 PHE N N 15 15.7345 0.3183 . . . . . . . 18545 3 38 . 1 1 46 46 ASP N N 15 13.2558 0.1035 . . . . . . . 18545 3 39 . 1 1 47 47 ALA N N 15 14.5908 0.1814 . . . . . . . 18545 3 40 . 1 1 50 50 ASP N N 15 8.8497 0.0764 . . . . . . . 18545 3 41 . 1 1 51 51 VAL N N 15 11.9488 0.1967 . . . . . . . 18545 3 42 . 1 1 52 52 ASP N N 15 11.3825 0.1956 . . . . . . . 18545 3 43 . 1 1 53 53 ALA N N 15 13.5233 0.1710 . . . . . . . 18545 3 44 . 1 1 54 54 VAL N N 15 14.1425 0.1071 . . . . . . . 18545 3 45 . 1 1 55 55 ASP N N 15 14.0487 0.0591 . . . . . . . 18545 3 46 . 1 1 56 56 LYS N N 15 13.8179 0.0491 . . . . . . . 18545 3 47 . 1 1 57 57 VAL N N 15 13.8742 0.1100 . . . . . . . 18545 3 48 . 1 1 58 58 MET N N 15 15.4983 0.1618 . . . . . . . 18545 3 49 . 1 1 60 60 GLU N N 15 14.8889 0.1360 . . . . . . . 18545 3 50 . 1 1 61 61 LEU N N 15 14.6476 0.1869 . . . . . . . 18545 3 51 . 1 1 63 63 GLU N N 15 12.6590 0.0470 . . . . . . . 18545 3 52 . 1 1 64 64 ASN N N 15 13.2432 0.0651 . . . . . . . 18545 3 53 . 1 1 65 65 GLY N N 15 13.7621 0.0727 . . . . . . . 18545 3 54 . 1 1 67 67 GLY N N 15 14.5766 0.1210 . . . . . . . 18545 3 55 . 1 1 68 68 GLU N N 15 14.0429 0.1050 . . . . . . . 18545 3 56 . 1 1 69 69 VAL N N 15 13.6942 0.2589 . . . . . . . 18545 3 57 . 1 1 70 70 ASP N N 15 13.9603 0.3150 . . . . . . . 18545 3 58 . 1 1 71 71 PHE N N 15 13.8139 0.1697 . . . . . . . 18545 3 59 . 1 1 74 74 TYR N N 15 13.8847 0.1131 . . . . . . . 18545 3 60 . 1 1 75 75 VAL N N 15 16.0616 0.2081 . . . . . . . 18545 3 61 . 1 1 76 76 VAL N N 15 15.0589 0.3437 . . . . . . . 18545 3 62 . 1 1 77 77 LEU N N 15 15.9337 0.2637 . . . . . . . 18545 3 63 . 1 1 78 78 VAL N N 15 15.2011 0.2941 . . . . . . . 18545 3 64 . 1 1 79 79 ALA N N 15 15.0697 0.4205 . . . . . . . 18545 3 65 . 1 1 80 80 ALA N N 15 15.4173 0.1271 . . . . . . . 18545 3 66 . 1 1 81 81 LEU N N 15 16.2401 0.2479 . . . . . . . 18545 3 67 . 1 1 82 82 THR N N 15 16.5527 0.3891 . . . . . . . 18545 3 68 . 1 1 83 83 VAL N N 15 14.4838 0.2756 . . . . . . . 18545 3 69 . 1 1 84 84 ALA N N 15 13.6641 0.2877 . . . . . . . 18545 3 70 . 1 1 87 87 ASN N N 15 14.5782 0.1870 . . . . . . . 18545 3 71 . 1 1 88 88 PHE N N 15 12.8361 0.1016 . . . . . . . 18545 3 72 . 1 1 89 89 PHE N N 15 22.5108 1.0350 . . . . . . . 18545 3 73 . 1 1 91 91 GLU N N 15 9.2452 0.0745 . . . . . . . 18545 3 stop_ save_