Content for NMR-STAR saveframe, "theoretical_heteronucl_T2_relaxation_1"
save_theoretical_heteronucl_T2_relaxation_1
_Theoretical_heteronucl_T2_list.Sf_category theoretical_heteronucl_T2_relaxation
_Theoretical_heteronucl_T2_list.Sf_framecode theoretical_heteronucl_T2_relaxation_1
_Theoretical_heteronucl_T2_list.Entry_ID 52155
_Theoretical_heteronucl_T2_list.ID 1
_Theoretical_heteronucl_T2_list.Name 'D11F/R122D R2'
_Theoretical_heteronucl_T2_list.Sample_condition_list_ID 1
_Theoretical_heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1
_Theoretical_heteronucl_T2_list.Temp_calibration_method .
_Theoretical_heteronucl_T2_list.Temp_control_method .
_Theoretical_heteronucl_T2_list.Spectrometer_frequency_1H 800
_Theoretical_heteronucl_T2_list.T2_coherence_type S(+,-)
_Theoretical_heteronucl_T2_list.T2_val_units s-1
_Theoretical_heteronucl_T2_list.Rex_units .
_Theoretical_heteronucl_T2_list.Details 'R2 values calculated from R1 and R1rho values'
_Theoretical_heteronucl_T2_list.Text_data_format .
_Theoretical_heteronucl_T2_list.Text_data .
loop_
_Theoretical_heteronucl_T2_experiment.Experiment_ID
_Theoretical_heteronucl_T2_experiment.Experiment_name
_Theoretical_heteronucl_T2_experiment.Sample_ID
_Theoretical_heteronucl_T2_experiment.Sample_label
_Theoretical_heteronucl_T2_experiment.Sample_state
_Theoretical_heteronucl_T2_experiment.Entry_ID
_Theoretical_heteronucl_T2_experiment.Theoretical_Heteronucl_T2_list_ID
1 '2D 1H-15N T1' . . . 52155 1
2 '2D 1H-15N T1rho' . . . 52155 1
stop_
loop_
_Theoretical_heteronucl_T2_software.Software_ID
_Theoretical_heteronucl_T2_software.Software_label
_Theoretical_heteronucl_T2_software.Method_ID
_Theoretical_heteronucl_T2_software.Method_label
_Theoretical_heteronucl_T2_software.Entry_ID
_Theoretical_heteronucl_T2_software.Theoretical_heteronucl_T2_list_ID
1 $software_1 . . 52155 1
2 $software_2 . . 52155 1
3 $software_3 . . 52155 1
stop_
loop_
_Theoretical_T2.ID
_Theoretical_T2.Assembly_atom_ID
_Theoretical_T2.Entity_assembly_ID
_Theoretical_T2.Entity_ID
_Theoretical_T2.Comp_index_ID
_Theoretical_T2.Seq_ID
_Theoretical_T2.Comp_ID
_Theoretical_T2.Atom_ID
_Theoretical_T2.Atom_type
_Theoretical_T2.Atom_isotope_number
_Theoretical_T2.T2_val
_Theoretical_T2.T2_val_err
_Theoretical_T2.Rex_val
_Theoretical_T2.Rex_err
_Theoretical_T2.Resonance_ID
_Theoretical_T2.Auth_entity_assembly_ID
_Theoretical_T2.Auth_seq_ID
_Theoretical_T2.Auth_comp_ID
_Theoretical_T2.Auth_atom_ID
_Theoretical_T2.Entry_ID
_Theoretical_T2.Theoretical_heteronucl_T2_list_ID
1 . 1 1 5 5 ALA N N 15 4.388765591 0.315191411 . . . . 1 ALA N 52155 1
2 . 1 1 6 6 SER N N 15 6.226915596 0.225555446 . . . . 2 SER N 52155 1
3 . 1 1 7 7 THR N N 15 10.36728052 0.211198767 . . . . 3 THR N 52155 1
4 . 1 1 8 8 ASP N N 15 11.48321917 0.282995825 . . . . 4 ASP N 52155 1
5 . 1 1 9 9 TYR N N 15 13.1114901 0.555624887 . . . . 5 TYR N 52155 1
6 . 1 1 10 10 TRP N N 15 12.88245949 0.549115405 . . . . 6 TRP N 52155 1
7 . 1 1 11 11 GLN N N 15 13.23409921 0.675068616 . . . . 7 GLN N 52155 1
8 . 1 1 12 12 ASN N N 15 12.0622444 0.392633316 . . . . 8 ASN N 52155 1
9 . 1 1 13 13 TRP N N 15 13.08462027 2.439272338 . . . . 9 TRP N 52155 1
10 . 1 1 21 21 ASN N N 15 13.15285236 1.941704661 . . . . 17 ASN N 52155 1
11 . 1 1 22 22 ALA N N 15 11.84421142 0.561932056 . . . . 18 ALA N 52155 1
12 . 1 1 23 23 VAL N N 15 12.38621241 0.249130670 . . . . 19 VAL N 52155 1
13 . 1 1 24 24 ASN N N 15 13.09494311 0.490072502 . . . . 20 ASN N 52155 1
14 . 1 1 25 25 GLY N N 15 12.44612284 0.469412938 . . . . 21 GLY N 52155 1
15 . 1 1 26 26 SER N N 15 11.84406859 0.398942874 . . . . 22 SER N 52155 1
16 . 1 1 27 27 GLY N N 15 12.93509865 1.212281748 . . . . 23 GLY N 52155 1
17 . 1 1 28 28 GLY N N 15 21.44382217 6.492402849 . . . . 24 GLY N 52155 1
18 . 1 1 29 29 ASN N N 15 15.31054475 0.620239950 . . . . 25 ASN N 52155 1
19 . 1 1 30 30 TYR N N 15 13.59565945 0.389179610 . . . . 26 TYR N 52155 1
20 . 1 1 31 31 SER N N 15 13.22332899 0.303630548 . . . . 27 SER N 52155 1
21 . 1 1 32 32 VAL N N 15 12.97619766 0.551873796 . . . . 28 VAL N 52155 1
22 . 1 1 33 33 ASN N N 15 12.89693338 0.358830883 . . . . 29 ASN N 52155 1
23 . 1 1 41 41 VAL N N 15 12.7940979 0.295860155 . . . . 37 VAL N 52155 1
24 . 1 1 42 42 VAL N N 15 13.10980405 0.501034089 . . . . 38 VAL N 52155 1
25 . 1 1 43 43 GLY N N 15 12.59098619 0.434421458 . . . . 39 GLY N 52155 1
26 . 1 1 44 44 LYS N N 15 11.90880986 0.440376006 . . . . 40 LYS N 52155 1
27 . 1 1 45 45 GLY N N 15 11.60564323 0.239728552 . . . . 41 GLY N 52155 1
28 . 1 1 46 46 TRP N N 15 14.34651565 0.674910160 . . . . 42 TRP N 52155 1
29 . 1 1 47 47 THR N N 15 12.96290757 0.406904335 . . . . 43 THR N 52155 1
30 . 1 1 48 48 THR N N 15 14.44185109 1.040065387 . . . . 44 THR N 52155 1
31 . 1 1 49 49 GLY N N 15 10.94717443 0.628401779 . . . . 45 GLY N 52155 1
32 . 1 1 50 50 SER N N 15 13.27311894 0.944642755 . . . . 46 SER N 52155 1
33 . 1 1 52 52 PHE N N 15 13.08362891 0.505910282 . . . . 48 PHE N 52155 1
34 . 1 1 53 53 ARG N N 15 13.1831597 0.371008268 . . . . 49 ARG N 52155 1
35 . 1 1 54 54 THR N N 15 12.20355545 0.503150377 . . . . 50 THR N 52155 1
36 . 1 1 55 55 ILE N N 15 13.77356575 0.403322426 . . . . 51 ILE N 52155 1
37 . 1 1 56 56 ASN N N 15 13.14007022 0.505666774 . . . . 52 ASN N 52155 1
38 . 1 1 57 57 TYR N N 15 13.38696058 0.268790877 . . . . 53 TYR N 52155 1
39 . 1 1 58 58 ASN N N 15 12.20528692 0.420093500 . . . . 54 ASN N 52155 1
40 . 1 1 59 59 ALA N N 15 14.07491967 0.472120339 . . . . 55 ALA N 52155 1
41 . 1 1 60 60 GLY N N 15 12.21054325 0.244923831 . . . . 56 GLY N 52155 1
42 . 1 1 61 61 VAL N N 15 12.7698247 0.420951246 . . . . 57 VAL N 52155 1
43 . 1 1 62 62 TRP N N 15 13.32501427 0.394011987 . . . . 58 TRP N 52155 1
44 . 1 1 63 63 ALA N N 15 12.28097124 0.457575641 . . . . 59 ALA N 52155 1
45 . 1 1 65 65 ASN N N 15 12.68957306 0.339593523 . . . . 61 ASN N 52155 1
46 . 1 1 66 66 GLY N N 15 9.651534665 0.372461490 . . . . 62 GLY N 52155 1
47 . 1 1 67 67 ASN N N 15 12.90059492 0.507324596 . . . . 63 ASN N 52155 1
48 . 1 1 68 68 GLY N N 15 12.65973097 0.974702833 . . . . 64 GLY N 52155 1
49 . 1 1 69 69 TYR N N 15 13.14681568 0.488457540 . . . . 65 TYR N 52155 1
50 . 1 1 70 70 LEU N N 15 12.73447595 0.558066790 . . . . 66 LEU N 52155 1
51 . 1 1 71 71 THR N N 15 13.7617281 0.475267736 . . . . 67 THR N 52155 1
52 . 1 1 72 72 LEU N N 15 15.87254556 0.775501940 . . . . 68 LEU N 52155 1
53 . 1 1 73 73 TYR N N 15 14.48929533 0.468671045 . . . . 69 TYR N 52155 1
54 . 1 1 74 74 GLY N N 15 14.50228436 0.780658061 . . . . 70 GLY N 52155 1
55 . 1 1 75 75 TRP N N 15 13.37896736 0.557634060 . . . . 71 TRP N 52155 1
56 . 1 1 76 76 THR N N 15 12.90611759 0.379018506 . . . . 72 THR N 52155 1
57 . 1 1 77 77 ARG N N 15 12.61642534 0.893334856 . . . . 73 ARG N 52155 1
58 . 1 1 78 78 SER N N 15 12.74756562 0.714229045 . . . . 74 SER N 52155 1
59 . 1 1 80 80 LEU N N 15 12.16854652 0.405771578 . . . . 76 LEU N 52155 1
60 . 1 1 81 81 ILE N N 15 13.18017279 0.390135677 . . . . 77 ILE N 52155 1
61 . 1 1 82 82 GLU N N 15 14.44337892 0.764066495 . . . . 78 GLU N 52155 1
62 . 1 1 83 83 TYR N N 15 14.77043242 0.421051723 . . . . 79 TYR N 52155 1
63 . 1 1 84 84 TYR N N 15 13.48407011 0.843996817 . . . . 80 TYR N 52155 1
64 . 1 1 85 85 VAL N N 15 13.2670122 0.452495605 . . . . 81 VAL N 52155 1
65 . 1 1 86 86 VAL N N 15 13.27122737 0.372881409 . . . . 82 VAL N 52155 1
66 . 1 1 87 87 ASP N N 15 13.35772974 0.566094256 . . . . 83 ASP N 52155 1
67 . 1 1 88 88 SER N N 15 13.10207898 0.389367203 . . . . 84 SER N 52155 1
68 . 1 1 89 89 TRP N N 15 12.92565982 0.543801548 . . . . 85 TRP N 52155 1
69 . 1 1 90 90 GLY N N 15 12.983858 0.705588841 . . . . 86 GLY N 52155 1
70 . 1 1 91 91 THR N N 15 12.05533014 0.535043389 . . . . 87 THR N 52155 1
71 . 1 1 92 92 TYR N N 15 13.79227895 0.454372755 . . . . 88 TYR N 52155 1
72 . 1 1 93 93 ARG N N 15 13.96571535 0.954064690 . . . . 89 ARG N 52155 1
73 . 1 1 95 95 THR N N 15 10.62574504 0.981487414 . . . . 91 THR N 52155 1
74 . 1 1 96 96 GLY N N 15 9.947039038 1.135698267 . . . . 92 GLY N 52155 1
75 . 1 1 97 97 THR N N 15 12.64028582 0.371621830 . . . . 93 THR N 52155 1
76 . 1 1 98 98 TYR N N 15 13.93953373 0.477760938 . . . . 94 TYR N 52155 1
77 . 1 1 99 99 LYS N N 15 12.66503185 0.749458790 . . . . 95 LYS N 52155 1
78 . 1 1 100 100 GLY N N 15 10.74713358 0.647921062 . . . . 96 GLY N 52155 1
79 . 1 1 101 101 THR N N 15 12.64916523 0.457753176 . . . . 97 THR N 52155 1
80 . 1 1 102 102 VAL N N 15 12.86740246 0.296632948 . . . . 98 VAL N 52155 1
81 . 1 1 103 103 LYS N N 15 13.1548408 0.267488033 . . . . 99 LYS N 52155 1
82 . 1 1 104 104 SER N N 15 12.4953646 0.390866596 . . . . 100 SER N 52155 1
83 . 1 1 105 105 ASP N N 15 13.11966531 0.824999695 . . . . 101 ASP N 52155 1
84 . 1 1 106 106 GLY N N 15 13.9379343 1.468602399 . . . . 102 GLY N 52155 1
85 . 1 1 107 107 GLY N N 15 12.9313308 0.435451713 . . . . 103 GLY N 52155 1
86 . 1 1 108 108 THR N N 15 11.94237241 0.239472408 . . . . 104 THR N 52155 1
87 . 1 1 109 109 TYR N N 15 12.65559375 0.402064552 . . . . 105 TYR N 52155 1
88 . 1 1 110 110 ASP N N 15 13.81139284 0.644326609 . . . . 106 ASP N 52155 1
89 . 1 1 111 111 ILE N N 15 13.34992824 0.355576175 . . . . 107 ILE N 52155 1
90 . 1 1 112 112 TYR N N 15 14.20487572 0.432541473 . . . . 108 TYR N 52155 1
91 . 1 1 113 113 THR N N 15 13.61397239 0.539297458 . . . . 109 THR N 52155 1
92 . 1 1 114 114 THR N N 15 13.16088499 0.470079532 . . . . 110 THR N 52155 1
93 . 1 1 115 115 THR N N 15 12.2534026 0.268202912 . . . . 111 THR N 52155 1
94 . 1 1 116 116 ARG N N 15 11.55105711 0.459846684 . . . . 112 ARG N 52155 1
95 . 1 1 117 117 TYR N N 15 11.56086544 0.287474058 . . . . 113 TYR N 52155 1
96 . 1 1 118 118 ASN N N 15 11.00842903 0.417385186 . . . . 114 ASN N 52155 1
97 . 1 1 119 119 ALA N N 15 12.90587677 0.258412777 . . . . 115 ALA N 52155 1
98 . 1 1 121 121 SER N N 15 13.2886398 0.550004636 . . . . 117 SER N 52155 1
99 . 1 1 122 122 ILE N N 15 16.37179492 2.413320156 . . . . 118 ILE N 52155 1
100 . 1 1 123 123 ASP N N 15 12.18891166 0.517993695 . . . . 119 ASP N 52155 1
101 . 1 1 124 124 GLY N N 15 11.71239769 0.407549445 . . . . 120 GLY N 52155 1
102 . 1 1 125 125 ASP N N 15 11.56753598 0.337007373 . . . . 121 ASP N 52155 1
103 . 1 1 126 126 ASP N N 15 11.14054658 0.222811597 . . . . 122 ASP N 52155 1
104 . 1 1 127 127 THR N N 15 11.83533249 0.607475371 . . . . 123 THR N 52155 1
105 . 1 1 128 128 THR N N 15 12.29240859 0.485661421 . . . . 124 THR N 52155 1
106 . 1 1 129 129 PHE N N 15 14.33716452 0.543627761 . . . . 125 PHE N 52155 1
107 . 1 1 130 130 THR N N 15 10.85249085 0.327796425 . . . . 126 THR N 52155 1
108 . 1 1 131 131 GLN N N 15 13.47178508 0.435816145 . . . . 127 GLN N 52155 1
109 . 1 1 132 132 TYR N N 15 12.19509987 0.603038683 . . . . 128 TYR N 52155 1
110 . 1 1 133 133 TRP N N 15 12.73420792 0.285194655 . . . . 129 TRP N 52155 1
111 . 1 1 134 134 SER N N 15 12.11095485 0.458621632 . . . . 130 SER N 52155 1
112 . 1 1 135 135 VAL N N 15 11.83504373 0.345895563 . . . . 131 VAL N 52155 1
113 . 1 1 136 136 ARG N N 15 13.05989492 0.764177972 . . . . 132 ARG N 52155 1
114 . 1 1 137 137 GLN N N 15 13.51770984 0.762531499 . . . . 133 GLN N 52155 1
115 . 1 1 138 138 SER N N 15 12.92549648 0.493532116 . . . . 134 SER N 52155 1
116 . 1 1 139 139 LYS N N 15 13.65955275 0.328453332 . . . . 135 LYS N 52155 1
117 . 1 1 140 140 ARG N N 15 14.49642632 0.395324441 . . . . 136 ARG N 52155 1
118 . 1 1 142 142 THR N N 15 11.98054557 0.277607796 . . . . 138 THR N 52155 1
119 . 1 1 143 143 GLY N N 15 14.49844961 0.758418467 . . . . 139 GLY N 52155 1
120 . 1 1 144 144 SER N N 15 11.85206994 0.318046361 . . . . 140 SER N 52155 1
121 . 1 1 145 145 ASN N N 15 14.3102693 0.793628558 . . . . 141 ASN N 52155 1
122 . 1 1 146 146 ALA N N 15 12.15601955 0.364758627 . . . . 142 ALA N 52155 1
123 . 1 1 147 147 THR N N 15 11.41503807 0.519462376 . . . . 143 THR N 52155 1
124 . 1 1 148 148 ILE N N 15 12.60536437 0.398164740 . . . . 144 ILE N 52155 1
125 . 1 1 149 149 THR N N 15 13.1928914 0.692362515 . . . . 145 THR N 52155 1
126 . 1 1 150 150 PHE N N 15 12.29434435 0.524260608 . . . . 146 PHE N 52155 1
127 . 1 1 151 151 SER N N 15 13.90611799 0.279985077 . . . . 147 SER N 52155 1
128 . 1 1 152 152 ASN N N 15 14.60851487 0.403556657 . . . . 148 ASN N 52155 1
129 . 1 1 153 153 HIS N N 15 13.76477658 0.542024923 . . . . 149 HIS N 52155 1
130 . 1 1 154 154 VAL N N 15 13.30121161 0.505033474 . . . . 150 VAL N 52155 1
131 . 1 1 155 155 ASN N N 15 14.12028255 0.297526275 . . . . 151 ASN N 52155 1
132 . 1 1 156 156 ALA N N 15 14.54853237 0.327441490 . . . . 152 ALA N 52155 1
133 . 1 1 157 157 TRP N N 15 13.9658122 0.304000596 . . . . 153 TRP N 52155 1
134 . 1 1 158 158 LYS N N 15 14.57995154 0.291779493 . . . . 154 LYS N 52155 1
135 . 1 1 159 159 SER N N 15 14.26206584 0.338224844 . . . . 155 SER N 52155 1
136 . 1 1 160 160 HIS N N 15 13.90201878 0.471549164 . . . . 156 HIS N 52155 1
137 . 1 1 161 161 GLY N N 15 13.49046669 0.278540739 . . . . 157 GLY N 52155 1
138 . 1 1 162 162 MET N N 15 12.74056462 0.337345354 . . . . 158 MET N 52155 1
139 . 1 1 163 163 ASN N N 15 11.84708392 0.579533624 . . . . 159 ASN N 52155 1
140 . 1 1 164 164 LEU N N 15 12.5789662 0.893234343 . . . . 160 LEU N 52155 1
141 . 1 1 165 165 GLY N N 15 11.96730801 1.004155218 . . . . 161 GLY N 52155 1
142 . 1 1 166 166 SER N N 15 12.08117227 0.854560557 . . . . 162 SER N 52155 1
143 . 1 1 167 167 ASN N N 15 14.27191778 0.481998965 . . . . 163 ASN N 52155 1
144 . 1 1 168 168 TRP N N 15 12.4283629 0.975554975 . . . . 164 TRP N 52155 1
145 . 1 1 169 169 ALA N N 15 12.43107845 0.479172118 . . . . 165 ALA N 52155 1
146 . 1 1 170 170 TYR N N 15 12.34790282 0.401779240 . . . . 166 TYR N 52155 1
147 . 1 1 171 171 GLN N N 15 14.43655617 0.779337826 . . . . 167 GLN N 52155 1
148 . 1 1 172 172 VAL N N 15 14.16289628 0.372202525 . . . . 168 VAL N 52155 1
149 . 1 1 173 173 MET N N 15 14.07595375 0.281840379 . . . . 169 MET N 52155 1
150 . 1 1 174 174 ALA N N 15 14.73639451 0.485454728 . . . . 170 ALA N 52155 1
151 . 1 1 175 175 THR N N 15 12.41230614 0.491972232 . . . . 171 THR N 52155 1
152 . 1 1 176 176 GLU N N 15 13.985863 0.897722449 . . . . 172 GLU N 52155 1
153 . 1 1 177 177 GLY N N 15 14.06428817 4.475804831 . . . . 173 GLY N 52155 1
154 . 1 1 183 183 SER N N 15 13.33242674 0.398450022 . . . . 179 SER N 52155 1
155 . 1 1 184 184 SER N N 15 13.86578343 0.277997737 . . . . 180 SER N 52155 1
156 . 1 1 185 185 ASN N N 15 13.34609199 0.365284124 . . . . 181 ASN N 52155 1
157 . 1 1 186 186 VAL N N 15 13.70197782 0.476528985 . . . . 182 VAL N 52155 1
158 . 1 1 187 187 THR N N 15 12.51303961 0.519462496 . . . . 183 THR N 52155 1
159 . 1 1 188 188 VAL N N 15 13.17405317 0.567062316 . . . . 184 VAL N 52155 1
160 . 1 1 189 189 TRP N N 15 14.23006194 0.292351274 . . . . 185 TRP N 52155 1
stop_
save_