Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 52007
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name cov2ac_t21e.BMRB
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 52007 1
2 '3D HNCACB' . . . 52007 1
3 '3D HNCO' . . . 52007 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 52007 1
2 $software_2 . . 52007 1
3 $software_3 . . 52007 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 1 1 ALA C C 13 174.183 0 . 1 . . . . . 1 ALA CO . 52007 1
2 . 1 . 1 2 2 CYS H H 1 8.458 0.001 . 1 . . . . . 2 CYS HN . 52007 1
3 . 1 . 1 2 2 CYS C C 13 174.461 0 . 1 . . . . . 2 CYS CO . 52007 1
4 . 1 . 1 2 2 CYS CA C 13 58.414 0 . 1 . . . . . 2 CYS CA . 52007 1
5 . 1 . 1 2 2 CYS CB C 13 33.059 0 . 1 . . . . . 2 CYS CB . 52007 1
6 . 1 . 1 2 2 CYS N N 15 124.233 0.065 . 1 . . . . . 2 CYS N . 52007 1
7 . 1 . 1 3 3 LYS H H 1 8.308 0.001 . 1 . . . . . 3 LYS HN . 52007 1
8 . 1 . 1 3 3 LYS C C 13 176.225 0 . 1 . . . . . 3 LYS CO . 52007 1
9 . 1 . 1 3 3 LYS CA C 13 57.509 0 . 1 . . . . . 3 LYS CA . 52007 1
10 . 1 . 1 3 3 LYS CB C 13 33.2 0 . 1 . . . . . 3 LYS CB . 52007 1
11 . 1 . 1 3 3 LYS N N 15 121.397 0.006 . 1 . . . . . 3 LYS N . 52007 1
12 . 1 . 1 4 4 PHE H H 1 8.269 0.009 . 1 . . . . . 4 PHE HN . 52007 1
13 . 1 . 1 4 4 PHE C C 13 175.455 0 . 1 . . . . . 4 PHE CO . 52007 1
14 . 1 . 1 4 4 PHE CA C 13 57.841 0 . 1 . . . . . 4 PHE CA . 52007 1
15 . 1 . 1 4 4 PHE CB C 13 39.14 0 . 1 . . . . . 4 PHE CB . 52007 1
16 . 1 . 1 4 4 PHE N N 15 121.771 0.002 . 1 . . . . . 4 PHE N . 52007 1
17 . 1 . 1 5 5 ASP H H 1 8.272 0.009 . 1 . . . . . 5 ASP HN . 52007 1
18 . 1 . 1 5 5 ASP C C 13 176.085 0 . 1 . . . . . 5 ASP CO . 52007 1
19 . 1 . 1 5 5 ASP CA C 13 54.62 0 . 1 . . . . . 5 ASP CA . 52007 1
20 . 1 . 1 5 5 ASP CB C 13 41.196 0 . 1 . . . . . 5 ASP CB . 52007 1
21 . 1 . 1 5 5 ASP N N 15 121.954 0.315 . 1 . . . . . 5 ASP N . 52007 1
22 . 1 . 1 6 6 GLU H H 1 8.22 0.002 . 1 . . . . . 6 GLU HN . 52007 1
23 . 1 . 1 6 6 GLU C C 13 176.176 0 . 1 . . . . . 6 GLU CO . 52007 1
24 . 1 . 1 6 6 GLU CA C 13 56.976 0 . 1 . . . . . 6 GLU CA . 52007 1
25 . 1 . 1 6 6 GLU CB C 13 30.621 0 . 1 . . . . . 6 GLU CB . 52007 1
26 . 1 . 1 6 6 GLU N N 15 120.662 0.071 . 1 . . . . . 6 GLU N . 52007 1
27 . 1 . 1 7 7 ASP H H 1 8.335 0.004 . 1 . . . . . 7 ASP HN . 52007 1
28 . 1 . 1 7 7 ASP C C 13 175.369 0 . 1 . . . . . 7 ASP CO . 52007 1
29 . 1 . 1 7 7 ASP CA C 13 54.346 0 . 1 . . . . . 7 ASP CA . 52007 1
30 . 1 . 1 7 7 ASP CB C 13 41.196 0 . 1 . . . . . 7 ASP CB . 52007 1
31 . 1 . 1 7 7 ASP N N 15 121.165 0.062 . 1 . . . . . 7 ASP N . 52007 1
32 . 1 . 1 8 8 ASP H H 1 8.261 0.002 . 1 . . . . . 8 ASP HN . 52007 1
33 . 1 . 1 8 8 ASP C C 13 176.332 0 . 1 . . . . . 8 ASP CO . 52007 1
34 . 1 . 1 8 8 ASP CA C 13 54.386 0 . 1 . . . . . 8 ASP CA . 52007 1
35 . 1 . 1 8 8 ASP CB C 13 41.077 0 . 1 . . . . . 8 ASP CB . 52007 1
36 . 1 . 1 8 8 ASP N N 15 121.249 0 . 1 . . . . . 8 ASP N . 52007 1
37 . 1 . 1 9 9 SER H H 1 8.223 0.002 . 1 . . . . . 9 SER HN . 52007 1
38 . 1 . 1 9 9 SER C C 13 174.305 0 . 1 . . . . . 9 SER CO . 52007 1
39 . 1 . 1 9 9 SER CA C 13 59.237 0 . 1 . . . . . 9 SER CA . 52007 1
40 . 1 . 1 9 9 SER CB C 13 64.522 0.025 . 1 . . . . . 9 SER CB . 52007 1
41 . 1 . 1 9 9 SER N N 15 115.99 0.007 . 1 . . . . . 9 SER N . 52007 1
42 . 1 . 1 10 10 GLU H H 1 8.298 0 . 1 . . . . . 10 GLU HN . 52007 1
43 . 1 . 1 10 10 GLU CA C 13 54.532 0.142 . 1 . . . . . 10 GLU CA . 52007 1
44 . 1 . 1 10 10 GLU CB C 13 29.911 0.331 . 1 . . . . . 10 GLU CB . 52007 1
45 . 1 . 1 10 10 GLU N N 15 123.583 0.008 . 1 . . . . . 10 GLU N . 52007 1
46 . 1 . 1 11 11 PRO C C 13 176.962 0 . 1 . . . . . 11 PRO CO . 52007 1
47 . 1 . 1 11 11 PRO CA C 13 62.873 0 . 1 . . . . . 11 PRO CA . 52007 1
48 . 1 . 1 11 11 PRO CB C 13 32.265 0 . 1 . . . . . 11 PRO CB . 52007 1
49 . 1 . 1 12 12 VAL H H 1 8.169 0.003 . 1 . . . . . 12 VAL HN . 52007 1
50 . 1 . 1 12 12 VAL C C 13 176.104 0 . 1 . . . . . 12 VAL CO . 52007 1
51 . 1 . 1 12 12 VAL CA C 13 62.794 0.318 . 1 . . . . . 12 VAL CA . 52007 1
52 . 1 . 1 12 12 VAL CB C 13 32.011 0.308 . 1 . . . . . 12 VAL CB . 52007 1
53 . 1 . 1 12 12 VAL N N 15 120.452 0.013 . 1 . . . . . 12 VAL N . 52007 1
54 . 1 . 1 13 13 LEU H H 1 8.261 0.003 . 1 . . . . . 13 LEU HN . 52007 1
55 . 1 . 1 13 13 LEU C C 13 177.102 0 . 1 . . . . . 13 LEU CO . 52007 1
56 . 1 . 1 13 13 LEU CA C 13 55.18 0.011 . 1 . . . . . 13 LEU CA . 52007 1
57 . 1 . 1 13 13 LEU CB C 13 42.181 0.056 . 1 . . . . . 13 LEU CB . 52007 1
58 . 1 . 1 13 13 LEU N N 15 125.593 0.066 . 1 . . . . . 13 LEU N . 52007 1
59 . 1 . 1 14 14 LYS H H 1 8.254 0.002 . 1 . . . . . 14 LYS HN . 52007 1
60 . 1 . 1 14 14 LYS C C 13 177.044 0 . 1 . . . . . 14 LYS CO . 52007 1
61 . 1 . 1 14 14 LYS CA C 13 56.373 0 . 1 . . . . . 14 LYS CA . 52007 1
62 . 1 . 1 14 14 LYS CB C 13 33.141 0 . 1 . . . . . 14 LYS CB . 52007 1
63 . 1 . 1 14 14 LYS N N 15 122.253 0.003 . 1 . . . . . 14 LYS N . 52007 1
64 . 1 . 1 15 15 GLY H H 1 8.361 0.005 . 1 . . . . . 15 GLY HN . 52007 1
65 . 1 . 1 15 15 GLY C C 13 173.902 0 . 1 . . . . . 15 GLY CO . 52007 1
66 . 1 . 1 15 15 GLY CA C 13 45.415 0 . 1 . . . . . 15 GLY CA . 52007 1
67 . 1 . 1 15 15 GLY N N 15 109.827 0.004 . 1 . . . . . 15 GLY N . 52007 1
68 . 1 . 1 16 16 VAL H H 1 7.881 0.002 . 1 . . . . . 16 VAL HN . 52007 1
69 . 1 . 1 16 16 VAL C C 13 175.8 0 . 1 . . . . . 16 VAL CO . 52007 1
70 . 1 . 1 16 16 VAL CA C 13 62.4 0 . 1 . . . . . 16 VAL CA . 52007 1
71 . 1 . 1 16 16 VAL CB C 13 32.703 0 . 1 . . . . . 16 VAL CB . 52007 1
72 . 1 . 1 16 16 VAL N N 15 119.391 0.013 . 1 . . . . . 16 VAL N . 52007 1
73 . 1 . 1 17 17 LYS H H 1 8.329 0.001 . 1 . . . . . 17 LYS HN . 52007 1
74 . 1 . 1 17 17 LYS C C 13 176.05 0 . 1 . . . . . 17 LYS CO . 52007 1
75 . 1 . 1 17 17 LYS CA C 13 56.455 0 . 1 . . . . . 17 LYS CA . 52007 1
76 . 1 . 1 17 17 LYS CB C 13 33.005 0 . 1 . . . . . 17 LYS CB . 52007 1
77 . 1 . 1 17 17 LYS N N 15 125.278 0.05 . 1 . . . . . 17 LYS N . 52007 1
78 . 1 . 1 18 18 LEU H H 1 8.267 0.001 . 1 . . . . . 18 LEU HN . 52007 1
79 . 1 . 1 18 18 LEU C C 13 176.643 0 . 1 . . . . . 18 LEU CO . 52007 1
80 . 1 . 1 18 18 LEU CA C 13 55.517 0 . 1 . . . . . 18 LEU CA . 52007 1
81 . 1 . 1 18 18 LEU CB C 13 42.739 0 . 1 . . . . . 18 LEU CB . 52007 1
82 . 1 . 1 18 18 LEU N N 15 124.245 0.152 . 1 . . . . . 18 LEU N . 52007 1
83 . 1 . 1 19 19 HIS H H 1 8.159 0.002 . 1 . . . . . 19 HIS HN . 52007 1
84 . 1 . 1 19 19 HIS C C 13 174.313 0 . 1 . . . . . 19 HIS CO . 52007 1
85 . 1 . 1 19 19 HIS CA C 13 55.442 0 . 1 . . . . . 19 HIS CA . 52007 1
86 . 1 . 1 19 19 HIS CB C 13 30.511 0 . 1 . . . . . 19 HIS CB . 52007 1
87 . 1 . 1 19 19 HIS N N 15 119.591 0.208 . 1 . . . . . 19 HIS N . 52007 1
88 . 1 . 1 20 20 TYR H H 1 8.003 0.002 . 1 . . . . . 20 TYR HN . 52007 1
89 . 1 . 1 20 20 TYR C C 13 174.442 0 . 1 . . . . . 20 TYR CO . 52007 1
90 . 1 . 1 20 20 TYR CA C 13 57.798 0 . 1 . . . . . 20 TYR CA . 52007 1
91 . 1 . 1 20 20 TYR CB C 13 39.004 0 . 1 . . . . . 20 TYR CB . 52007 1
92 . 1 . 1 20 20 TYR N N 15 121.778 0.023 . 1 . . . . . 20 TYR N . 52007 1
93 . 1 . 1 21 21 GLU H H 1 7.847 0.001 . 1 . . . . . 21 GLU HN . 52007 1
94 . 1 . 1 21 21 GLU CA C 13 57.798 0 . 1 . . . . . 21 GLU CA . 52007 1
95 . 1 . 1 21 21 GLU CB C 13 31.114 0 . 1 . . . . . 21 GLU CB . 52007 1
96 . 1 . 1 21 21 GLU N N 15 126.845 0.002 . 1 . . . . . 21 GLU N . 52007 1
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save_