Content for NMR-STAR saveframe, "assigned_chem_shift_list_2"
save_assigned_chem_shift_list_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2
_Assigned_chem_shift_list.Entry_ID 27745
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name .
_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 $chemical_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' . . . 27745 2
2 '3D HNCO' . . . 27745 2
3 '3D HNCACB' . . . 27745 2
4 '3D CBCA(CO)NH' . . . 27745 2
5 '3D HN(CA)CO' . . . 27745 2
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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
3 $Analysis . . 27745 2
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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 . 2 . 2 2 2 PRO C C 13 177.476 0.000 . 1 . . . . . -3 PRO C . 27745 2
2 . 2 . 2 2 2 PRO CA C 13 63.537 0.021 . 1 . . . . . -3 PRO CA . 27745 2
3 . 2 . 2 2 2 PRO CB C 13 32.191 0.000 . 1 . . . . . -3 PRO CB . 27745 2
4 . 2 . 2 3 3 GLY C C 13 174.229 0.023 . 1 . . . . . -2 GLY C . 27745 2
5 . 2 . 2 3 3 GLY CA C 13 45.318 0.000 . 1 . . . . . -2 GLY CA . 27745 2
6 . 2 . 2 3 3 GLY H H 1 8.657 0.004 . 1 . . . . . -2 GLY H . 27745 2
7 . 2 . 2 3 3 GLY N N 15 109.930 0.027 . 1 . . . . . -2 GLY N . 27745 2
8 . 2 . 2 4 4 SER C C 13 174.529 0.034 . 1 . . . . . -1 SER C . 27745 2
9 . 2 . 2 4 4 SER CA C 13 58.476 0.000 . 1 . . . . . -1 SER CA . 27745 2
10 . 2 . 2 4 4 SER CB C 13 63.841 0.000 . 1 . . . . . -1 SER CB . 27745 2
11 . 2 . 2 4 4 SER H H 1 8.157 0.003 . 1 . . . . . -1 SER H . 27745 2
12 . 2 . 2 4 4 SER N N 15 115.791 0.015 . 1 . . . . . -1 SER N . 27745 2
13 . 2 . 2 5 5 LYS C C 13 176.539 0.018 . 1 . . . . . 1901 LYS C . 27745 2
14 . 2 . 2 5 5 LYS CA C 13 56.414 0.000 . 1 . . . . . 1901 LYS CA . 27745 2
15 . 2 . 2 5 5 LYS CB C 13 33.032 0.000 . 1 . . . . . 1901 LYS CB . 27745 2
16 . 2 . 2 5 5 LYS H H 1 8.412 0.003 . 1 . . . . . 1901 LYS H . 27745 2
17 . 2 . 2 5 5 LYS N N 15 123.470 0.008 . 1 . . . . . 1901 LYS N . 27745 2
18 . 2 . 2 6 6 ARG C C 13 176.372 0.000 . 1 . . . . . 1902 ARG C . 27745 2
19 . 2 . 2 6 6 ARG CA C 13 56.371 0.000 . 1 . . . . . 1902 ARG CA . 27745 2
20 . 2 . 2 6 6 ARG CB C 13 31.008 0.000 . 1 . . . . . 1902 ARG CB . 27745 2
21 . 2 . 2 6 6 ARG H H 1 8.360 0.002 . 1 . . . . . 1902 ARG H . 27745 2
22 . 2 . 2 6 6 ARG N N 15 122.665 0.005 . 1 . . . . . 1902 ARG N . 27745 2
23 . 2 . 2 7 7 LYS C C 13 176.841 0.030 . 1 . . . . . 1903 LYS C . 27745 2
24 . 2 . 2 7 7 LYS CA C 13 56.157 0.000 . 1 . . . . . 1903 LYS CA . 27745 2
25 . 2 . 2 7 7 LYS CB C 13 32.988 0.000 . 1 . . . . . 1903 LYS CB . 27745 2
26 . 2 . 2 7 7 LYS H H 1 8.512 0.003 . 1 . . . . . 1903 LYS H . 27745 2
27 . 2 . 2 7 7 LYS N N 15 123.375 0.011 . 1 . . . . . 1903 LYS N . 27745 2
28 . 2 . 2 8 8 GLN C C 13 176.074 0.006 . 1 . . . . . 1904 GLN C . 27745 2
29 . 2 . 2 8 8 GLN CA C 13 57.064 0.000 . 1 . . . . . 1904 GLN CA . 27745 2
30 . 2 . 2 8 8 GLN CB C 13 30.083 0.000 . 1 . . . . . 1904 GLN CB . 27745 2
31 . 2 . 2 8 8 GLN H H 1 8.522 0.002 . 1 . . . . . 1904 GLN H . 27745 2
32 . 2 . 2 8 8 GLN N N 15 121.676 0.010 . 1 . . . . . 1904 GLN N . 27745 2
33 . 2 . 2 9 9 GLU C C 13 176.530 0.002 . 1 . . . . . 1905 GLU C . 27745 2
34 . 2 . 2 9 9 GLU CA C 13 56.736 0.000 . 1 . . . . . 1905 GLU CA . 27745 2
35 . 2 . 2 9 9 GLU CB C 13 29.246 0.000 . 1 . . . . . 1905 GLU CB . 27745 2
36 . 2 . 2 9 9 GLU H H 1 8.589 0.002 . 1 . . . . . 1905 GLU H . 27745 2
37 . 2 . 2 9 9 GLU N N 15 120.694 0.016 . 1 . . . . . 1905 GLU N . 27745 2
38 . 2 . 2 10 10 GLU C C 13 176.179 0.003 . 1 . . . . . 1906 GLU C . 27745 2
39 . 2 . 2 10 10 GLU CA C 13 56.290 0.000 . 1 . . . . . 1906 GLU CA . 27745 2
40 . 2 . 2 10 10 GLU CB C 13 30.844 0.000 . 1 . . . . . 1906 GLU CB . 27745 2
41 . 2 . 2 10 10 GLU H H 1 8.155 0.003 . 1 . . . . . 1906 GLU H . 27745 2
42 . 2 . 2 10 10 GLU N N 15 120.895 0.062 . 1 . . . . . 1906 GLU N . 27745 2
43 . 2 . 2 11 11 VAL C C 13 177.232 0.000 . 1 . . . . . 1907 VAL C . 27745 2
44 . 2 . 2 11 11 VAL CA C 13 62.626 0.000 . 1 . . . . . 1907 VAL CA . 27745 2
45 . 2 . 2 11 11 VAL CB C 13 32.566 0.000 . 1 . . . . . 1907 VAL CB . 27745 2
46 . 2 . 2 11 11 VAL H H 1 8.080 0.006 . 1 . . . . . 1907 VAL H . 27745 2
47 . 2 . 2 11 11 VAL N N 15 119.301 0.043 . 1 . . . . . 1907 VAL N . 27745 2
48 . 2 . 2 24 24 LEU C C 13 180.132 0.000 . 1 . . . . . 1920 LEU C . 27745 2
49 . 2 . 2 24 24 LEU CA C 13 55.036 0.000 . 1 . . . . . 1920 LEU CA . 27745 2
50 . 2 . 2 25 25 LEU C C 13 178.934 0.014 . 1 . . . . . 1921 LEU C . 27745 2
51 . 2 . 2 25 25 LEU CA C 13 57.264 0.000 . 1 . . . . . 1921 LEU CA . 27745 2
52 . 2 . 2 25 25 LEU CB C 13 42.031 0.000 . 1 . . . . . 1921 LEU CB . 27745 2
53 . 2 . 2 25 25 LEU H H 1 7.665 0.004 . 1 . . . . . 1921 LEU H . 27745 2
54 . 2 . 2 25 25 LEU N N 15 118.825 0.023 . 1 . . . . . 1921 LEU N . 27745 2
55 . 2 . 2 26 26 LYS C C 13 177.840 0.000 . 1 . . . . . 1922 LYS C . 27745 2
56 . 2 . 2 26 26 LYS CA C 13 57.899 0.000 . 1 . . . . . 1922 LYS CA . 27745 2
57 . 2 . 2 26 26 LYS H H 1 7.630 0.005 . 1 . . . . . 1922 LYS H . 27745 2
58 . 2 . 2 26 26 LYS N N 15 118.228 0.005 . 1 . . . . . 1922 LYS N . 27745 2
59 . 2 . 2 27 27 GLN C C 13 176.577 0.000 . 1 . . . . . 1923 GLN C . 27745 2
60 . 2 . 2 27 27 GLN CA C 13 58.880 0.000 . 1 . . . . . 1923 GLN CA . 27745 2
61 . 2 . 2 27 27 GLN CB C 13 28.091 0.000 . 1 . . . . . 1923 GLN CB . 27745 2
62 . 2 . 2 27 27 GLN H H 1 7.573 0.000 . 1 . . . . . 1923 GLN H . 27745 2
63 . 2 . 2 27 27 GLN N N 15 117.745 0.000 . 1 . . . . . 1923 GLN N . 27745 2
64 . 2 . 2 28 28 LYS C C 13 176.619 0.000 . 1 . . . . . 1924 LYS C . 27745 2
65 . 2 . 2 28 28 LYS CA C 13 56.758 0.012 . 1 . . . . . 1924 LYS CA . 27745 2
66 . 2 . 2 28 28 LYS CB C 13 32.942 0.000 . 1 . . . . . 1924 LYS CB . 27745 2
67 . 2 . 2 28 28 LYS H H 1 7.720 0.007 . 1 . . . . . 1924 LYS H . 27745 2
68 . 2 . 2 28 28 LYS N N 15 119.810 0.024 . 1 . . . . . 1924 LYS N . 27745 2
69 . 2 . 2 29 29 VAL C C 13 175.729 0.000 . 1 . . . . . 1925 VAL C . 27745 2
70 . 2 . 2 29 29 VAL CA C 13 62.669 0.000 . 1 . . . . . 1925 VAL CA . 27745 2
71 . 2 . 2 29 29 VAL CB C 13 32.632 0.000 . 1 . . . . . 1925 VAL CB . 27745 2
72 . 2 . 2 29 29 VAL H H 1 7.771 0.006 . 1 . . . . . 1925 VAL H . 27745 2
73 . 2 . 2 29 29 VAL N N 15 119.795 0.066 . 1 . . . . . 1925 VAL N . 27745 2
74 . 2 . 2 30 30 LYS C C 13 175.359 0.024 . 1 . . . . . 1926 LYS C . 27745 2
75 . 2 . 2 30 30 LYS CA C 13 56.263 0.000 . 1 . . . . . 1926 LYS CA . 27745 2
76 . 2 . 2 30 30 LYS CB C 13 33.047 0.000 . 1 . . . . . 1926 LYS CB . 27745 2
77 . 2 . 2 30 30 LYS H H 1 8.201 0.001 . 1 . . . . . 1926 LYS H . 27745 2
78 . 2 . 2 30 30 LYS N N 15 125.778 0.060 . 1 . . . . . 1926 LYS N . 27745 2
79 . 2 . 2 31 31 LYS C C 13 175.324 0.000 . 1 . . . . . 1927 LYS C . 27745 2
80 . 2 . 2 31 31 LYS CA C 13 57.918 0.000 . 1 . . . . . 1927 LYS CA . 27745 2
81 . 2 . 2 31 31 LYS CB C 13 33.741 0.000 . 1 . . . . . 1927 LYS CB . 27745 2
82 . 2 . 2 31 31 LYS H H 1 7.979 0.002 . 1 . . . . . 1927 LYS H . 27745 2
83 . 2 . 2 31 31 LYS N N 15 128.718 0.015 . 1 . . . . . 1927 LYS N . 27745 2
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