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 52749
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'I4A mini-alphaA crystallin assignments'
_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-1H TOCSY' . . . 52749 1
2 '2D 1H-1H NOESY' . . . 52749 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 . . 52749 1
2 $software_2 . . 52749 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 LYS H H 1 7.957 0.001 . . . . . . . 1 LYS H . 52749 1
2 . 1 . 1 1 1 LYS HA H 1 4.158 0.028 . . . . . . . 1 LYS HA . 52749 1
3 . 1 . 1 1 1 LYS HG2 H 1 1.397 0.013 . . . . . . . 1 LYS HG# . 52749 1
4 . 1 . 1 1 1 LYS HG3 H 1 1.397 0.013 . . . . . . . 1 LYS HG# . 52749 1
5 . 1 . 1 1 1 LYS HD2 H 1 1.692 0.000 . . . . . . . 1 LYS HD# . 52749 1
6 . 1 . 1 1 1 LYS HD3 H 1 1.692 0.000 . . . . . . . 1 LYS HD# . 52749 1
7 . 1 . 1 1 1 LYS HE2 H 1 2.980 . . . . . . . . 1 LYS HE# . 52749 1
8 . 1 . 1 1 1 LYS HE3 H 1 2.980 . . . . . . . . 1 LYS HE# . 52749 1
9 . 1 . 1 2 2 PHE H H 1 8.104 0.004 . . . . . . . 2 PHE H . 52749 1
10 . 1 . 1 2 2 PHE HA H 1 4.561 0.016 . . . . . . . 2 PHE HA . 52749 1
11 . 1 . 1 2 2 PHE HB2 H 1 3.113 . . . . . . . . 2 PHE HB2 . 52749 1
12 . 1 . 1 2 2 PHE HB3 H 1 2.980 . . . . . . . . 2 PHE HB3 . 52749 1
13 . 1 . 1 3 3 VAL H H 1 7.521 1.348 . . . . . . . 3 VAL H . 52749 1
14 . 1 . 1 3 3 VAL HA H 1 3.942 . . . . . . . . 3 VAL HA . 52749 1
15 . 1 . 1 3 3 VAL HB H 1 1.864 0.006 . . . . . . . 3 VAL HB . 52749 1
16 . 1 . 1 3 3 VAL HG11 H 1 0.814 0.010 . . . . . . . 3 VAL HG# . 52749 1
17 . 1 . 1 3 3 VAL HG12 H 1 0.814 0.010 . . . . . . . 3 VAL HG# . 52749 1
18 . 1 . 1 3 3 VAL HG13 H 1 0.814 0.010 . . . . . . . 3 VAL HG# . 52749 1
19 . 1 . 1 3 3 VAL HG21 H 1 0.814 0.010 . . . . . . . 3 VAL HG# . 52749 1
20 . 1 . 1 3 3 VAL HG22 H 1 0.814 0.010 . . . . . . . 3 VAL HG# . 52749 1
21 . 1 . 1 3 3 VAL HG23 H 1 0.814 0.010 . . . . . . . 3 VAL HG# . 52749 1
22 . 1 . 1 4 4 ALA H H 1 8.020 0.004 . . . . . . . 4 ALA H . 52749 1
23 . 1 . 1 4 4 ALA HA H 1 4.293 . . . . . . . . 4 ALA HA . 52749 1
24 . 1 . 1 5 5 PHE H H 1 8.244 0.001 . . . . . . . 5 PHE H . 52749 1
25 . 1 . 1 5 5 PHE HA H 1 4.586 0.026 . . . . . . . 5 PHE HA . 52749 1
26 . 1 . 1 5 5 PHE HB2 H 1 3.111 0.005 . . . . . . . 5 PHE HB2 . 52749 1
27 . 1 . 1 5 5 PHE HB3 H 1 2.983 0.004 . . . . . . . 5 PHE HB3 . 52749 1
28 . 1 . 1 6 6 LEU H H 1 8.080 0.001 . . . . . . . 6 LEU H . 52749 1
29 . 1 . 1 6 6 LEU HA H 1 4.289 0.005 . . . . . . . 6 LEU HA . 52749 1
30 . 1 . 1 6 6 LEU HB2 H 1 1.524 0.005 . . . . . . . 6 LEU HB# . 52749 1
31 . 1 . 1 6 6 LEU HB3 H 1 1.524 0.005 . . . . . . . 6 LEU HB# . 52749 1
32 . 1 . 1 6 6 LEU HD11 H 1 0.845 0.022 . . . . . . . 6 LEU HD# . 52749 1
33 . 1 . 1 6 6 LEU HD12 H 1 0.845 0.022 . . . . . . . 6 LEU HD# . 52749 1
34 . 1 . 1 6 6 LEU HD13 H 1 0.845 0.022 . . . . . . . 6 LEU HD# . 52749 1
35 . 1 . 1 6 6 LEU HD21 H 1 0.845 0.022 . . . . . . . 6 LEU HD# . 52749 1
36 . 1 . 1 6 6 LEU HD22 H 1 0.845 0.022 . . . . . . . 6 LEU HD# . 52749 1
37 . 1 . 1 6 6 LEU HD23 H 1 0.845 0.022 . . . . . . . 6 LEU HD# . 52749 1
38 . 1 . 1 7 7 ASP H H 1 8.244 0.002 . . . . . . . 7 ASP H . 52749 1
39 . 1 . 1 7 7 ASP HA H 1 4.595 0.009 . . . . . . . 7 ASP HA . 52749 1
40 . 1 . 1 7 7 ASP HB2 H 1 4.106 2.391 . . . . . . . 7 ASP HB2 . 52749 1
41 . 1 . 1 7 7 ASP HB3 H 1 2.572 0.001 . . . . . . . 7 ASP HB3 . 52749 1
42 . 1 . 1 8 8 VAL H H 1 7.967 0.002 . . . . . . . 8 VAL H . 52749 1
43 . 1 . 1 8 8 VAL HA H 1 4.041 0.007 . . . . . . . 8 VAL HA . 52749 1
44 . 1 . 1 8 8 VAL HB H 1 2.078 0.004 . . . . . . . 8 VAL HB . 52749 1
45 . 1 . 1 8 8 VAL HG11 H 1 0.885 0.007 . . . . . . . 8 VAL HG# . 52749 1
46 . 1 . 1 8 8 VAL HG12 H 1 0.885 0.007 . . . . . . . 8 VAL HG# . 52749 1
47 . 1 . 1 8 8 VAL HG13 H 1 0.885 0.007 . . . . . . . 8 VAL HG# . 52749 1
48 . 1 . 1 8 8 VAL HG21 H 1 0.885 0.007 . . . . . . . 8 VAL HG# . 52749 1
49 . 1 . 1 8 8 VAL HG22 H 1 0.885 0.007 . . . . . . . 8 VAL HG# . 52749 1
50 . 1 . 1 8 8 VAL HG23 H 1 0.885 0.007 . . . . . . . 8 VAL HG# . 52749 1
51 . 1 . 1 9 9 LYS H H 1 8.284 0.005 . . . . . . . 9 LYS H . 52749 1
52 . 1 . 1 9 9 LYS HA H 1 4.220 0.005 . . . . . . . 9 LYS HA . 52749 1
53 . 1 . 1 9 9 LYS HB2 H 1 1.657 0.000 . . . . . . . 9 LYS HB# . 52749 1
54 . 1 . 1 9 9 LYS HB3 H 1 1.657 0.000 . . . . . . . 9 LYS HB# . 52749 1
55 . 1 . 1 9 9 LYS HD2 H 1 1.335 0.002 . . . . . . . 9 LYS HD# . 52749 1
56 . 1 . 1 9 9 LYS HD3 H 1 1.335 0.002 . . . . . . . 9 LYS HD# . 52749 1
57 . 1 . 1 10 10 HIS H H 1 7.227 0.005 . . . . . . . 10 HIS H . 52749 1
58 . 1 . 1 10 10 HIS HA H 1 4.652 0.042 . . . . . . . 10 HIS HA . 52749 1
59 . 1 . 1 10 10 HIS HB2 H 1 3.058 0.010 . . . . . . . 10 HIS HB# . 52749 1
60 . 1 . 1 10 10 HIS HB3 H 1 3.058 0.010 . . . . . . . 10 HIS HB# . 52749 1
61 . 1 . 1 11 11 PHE H H 1 7.392 1.558 . . . . . . . 11 PHE H . 52749 1
62 . 1 . 1 11 11 PHE HA H 1 4.652 0.006 . . . . . . . 11 PHE HA . 52749 1
63 . 1 . 1 11 11 PHE HB2 H 1 3.168 0.007 . . . . . . . 11 PHE HB2 . 52749 1
64 . 1 . 1 11 11 PHE HB3 H 1 3.053 0.007 . . . . . . . 11 PHE HB3 . 52749 1
65 . 1 . 1 12 12 SER H H 1 8.386 0.001 . . . . . . . 12 SER H . 52749 1
66 . 1 . 1 12 12 SER HA H 1 4.773 0.005 . . . . . . . 12 SER HA . 52749 1
67 . 1 . 1 12 12 SER HB2 H 1 3.827 0.003 . . . . . . . 12 SER HB# . 52749 1
68 . 1 . 1 12 12 SER HB3 H 1 3.827 0.003 . . . . . . . 12 SER HB# . 52749 1
69 . 1 . 1 13 13 PRO HA H 1 4.325 0.000 . . . . . . . 13 PRO HA . 52749 1
70 . 1 . 1 13 13 PRO HB2 H 1 2.333 0.004 . . . . . . . 13 PRO HB# . 52749 1
71 . 1 . 1 13 13 PRO HB3 H 1 2.333 0.004 . . . . . . . 13 PRO HB# . 52749 1
72 . 1 . 1 13 13 PRO HG2 H 1 1.997 0.036 . . . . . . . 13 PRO HG# . 52749 1
73 . 1 . 1 13 13 PRO HG3 H 1 1.997 0.036 . . . . . . . 13 PRO HG# . 52749 1
74 . 1 . 1 13 13 PRO HD2 H 1 3.735 0.015 . . . . . . . 13 PRO HD# . 52749 1
75 . 1 . 1 13 13 PRO HD3 H 1 3.735 0.015 . . . . . . . 13 PRO HD# . 52749 1
76 . 1 . 1 14 14 GLU H H 1 8.487 0.004 . . . . . . . 14 GLU H . 52749 1
77 . 1 . 1 14 14 GLU HA H 1 4.034 0.159 . . . . . . . 14 GLU HA . 52749 1
78 . 1 . 1 14 14 GLU HB2 H 1 1.899 0.025 . . . . . . . 14 GLU HB2 . 52749 1
79 . 1 . 1 14 14 GLU HB3 H 1 2.024 0.005 . . . . . . . 14 GLU HB3 . 52749 1
80 . 1 . 1 14 14 GLU HG2 H 1 2.257 0.006 . . . . . . . 14 GLU HG# . 52749 1
81 . 1 . 1 14 14 GLU HG3 H 1 2.257 0.006 . . . . . . . 14 GLU HG# . 52749 1
82 . 1 . 1 15 15 ASP H H 1 8.154 0.002 . . . . . . . 15 ASP H . 52749 1
83 . 1 . 1 15 15 ASP HA H 1 4.596 0.001 . . . . . . . 15 ASP HA . 52749 1
84 . 1 . 1 15 15 ASP HB2 H 1 2.753 0.012 . . . . . . . 15 ASP HB2 . 52749 1
85 . 1 . 1 15 15 ASP HB3 H 1 2.652 0.007 . . . . . . . 15 ASP HB3 . 52749 1
86 . 1 . 1 16 16 LEU H H 1 8.110 0.004 . . . . . . . 16 LEU H . 52749 1
87 . 1 . 1 16 16 LEU HA H 1 4.379 0.004 . . . . . . . 16 LEU HA . 52749 1
88 . 1 . 1 16 16 LEU HB2 H 1 1.665 0.005 . . . . . . . 16 LEU HB# . 52749 1
89 . 1 . 1 16 16 LEU HB3 H 1 1.665 0.005 . . . . . . . 16 LEU HB# . 52749 1
90 . 1 . 1 16 16 LEU HG H 1 0.801 . . . . . . . . 16 LEU HG . 52749 1
91 . 1 . 1 16 16 LEU HD11 H 1 0.932 . . . . . . . . 16 LEU HD1# . 52749 1
92 . 1 . 1 16 16 LEU HD12 H 1 0.932 . . . . . . . . 16 LEU HD1# . 52749 1
93 . 1 . 1 16 16 LEU HD13 H 1 0.932 . . . . . . . . 16 LEU HD1# . 52749 1
94 . 1 . 1 16 16 LEU HD21 H 1 0.824 0.021 . . . . . . . 16 LEU HD2# . 52749 1
95 . 1 . 1 16 16 LEU HD22 H 1 0.824 0.021 . . . . . . . 16 LEU HD2# . 52749 1
96 . 1 . 1 16 16 LEU HD23 H 1 0.824 0.021 . . . . . . . 16 LEU HD2# . 52749 1
97 . 1 . 1 17 17 THR H H 1 8.133 0.005 . . . . . . . 17 THR H . 52749 1
98 . 1 . 1 17 17 THR HA H 1 4.277 0.004 . . . . . . . 17 THR HA . 52749 1
99 . 1 . 1 17 17 THR HB H 1 4.184 0.005 . . . . . . . 17 THR HB . 52749 1
100 . 1 . 1 18 18 VAL H H 1 8.009 0.002 . . . . . . . 18 VAL H . 52749 1
101 . 1 . 1 18 18 VAL HA H 1 4.092 0.030 . . . . . . . 18 VAL HA . 52749 1
102 . 1 . 1 18 18 VAL HB H 1 2.081 0.002 . . . . . . . 18 VAL HB . 52749 1
103 . 1 . 1 18 18 VAL HG11 H 1 0.936 0.006 . . . . . . . 18 VAL HG# . 52749 1
104 . 1 . 1 18 18 VAL HG12 H 1 0.936 0.006 . . . . . . . 18 VAL HG# . 52749 1
105 . 1 . 1 18 18 VAL HG13 H 1 0.936 0.006 . . . . . . . 18 VAL HG# . 52749 1
106 . 1 . 1 18 18 VAL HG21 H 1 0.936 0.006 . . . . . . . 18 VAL HG# . 52749 1
107 . 1 . 1 18 18 VAL HG22 H 1 0.936 0.006 . . . . . . . 18 VAL HG# . 52749 1
108 . 1 . 1 18 18 VAL HG23 H 1 0.936 0.006 . . . . . . . 18 VAL HG# . 52749 1
109 . 1 . 1 19 19 LYS H H 1 8.335 0.003 . . . . . . . 19 LYS H . 52749 1
110 . 1 . 1 19 19 LYS HA H 1 4.191 . . . . . . . . 19 LYS HA . 52749 1
111 . 1 . 1 19 19 LYS HB2 H 1 1.646 0.001 . . . . . . . 19 LYS HB# . 52749 1
112 . 1 . 1 19 19 LYS HB3 H 1 1.646 0.001 . . . . . . . 19 LYS HB# . 52749 1
113 . 1 . 1 19 19 LYS HG2 H 1 1.212 . . . . . . . . 19 LYS HG2 . 52749 1
114 . 1 . 1 19 19 LYS HD2 H 1 1.310 . . . . . . . . 19 LYS HD2 . 52749 1
115 . 1 . 1 19 19 LYS HE2 H 1 2.948 0.005 . . . . . . . 19 LYS HE# . 52749 1
116 . 1 . 1 19 19 LYS HE3 H 1 2.948 0.005 . . . . . . . 19 LYS HE# . 52749 1
stop_
save_