Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 25212
_Assigned_chem_shift_list.ID 1
_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 $TSP-d4
_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
2 '2D 1H-1H TOCSY' . . . 25212 1
3 '2D 1H-1H COSY' . . . 25212 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_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.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 ARG HA H 1 4.075 0.002 . . . . . A 1 ARG HA . 25212 1
2 . 1 1 1 1 ARG HB2 H 1 1.924 0.004 . . . . . A 1 ARG HB2 . 25212 1
3 . 1 1 1 1 ARG HB3 H 1 1.924 0.004 . . . . . A 1 ARG HB3 . 25212 1
4 . 1 1 1 1 ARG HG2 H 1 1.669 0.004 . . . . . A 1 ARG HG2 . 25212 1
5 . 1 1 1 1 ARG HG3 H 1 1.669 0.004 . . . . . A 1 ARG HG3 . 25212 1
6 . 1 1 1 1 ARG HD2 H 1 3.196 0.004 . . . . . A 1 ARG HD2 . 25212 1
7 . 1 1 1 1 ARG HD3 H 1 3.196 0.004 . . . . . A 1 ARG HD3 . 25212 1
8 . 1 1 1 1 ARG HE H 1 7.403 0.007 . . . . . A 1 ARG HE . 25212 1
9 . 1 1 2 2 GLY H H 1 8.946 0.005 . . . . . A 2 GLY H . 25212 1
10 . 1 1 2 2 GLY HA2 H 1 3.995 0.005 . . . . . A 2 GLY HA2 . 25212 1
11 . 1 1 2 2 GLY HA3 H 1 3.995 0.005 . . . . . A 2 GLY HA3 . 25212 1
12 . 1 1 3 3 GLY H H 1 8.333 0.006 . . . . . A 3 GLY H . 25212 1
13 . 1 1 3 3 GLY HA2 H 1 3.861 0.004 . . . . . A 3 GLY HA2 . 25212 1
14 . 1 1 3 3 GLY HA3 H 1 3.861 0.004 . . . . . A 3 GLY HA3 . 25212 1
15 . 1 1 4 4 ARG H H 1 8.283 0.008 . . . . . A 4 ARG H . 25212 1
16 . 1 1 4 4 ARG HA H 1 4.380 0.010 . . . . . A 4 ARG HA . 25212 1
17 . 1 1 4 4 ARG HB2 H 1 1.738 0.004 . . . . . A 4 ARG HB2 . 25212 1
18 . 1 1 4 4 ARG HB3 H 1 1.738 0.004 . . . . . A 4 ARG HB3 . 25212 1
19 . 1 1 4 4 ARG HG2 H 1 1.596 0.007 . . . . . A 4 ARG HG2 . 25212 1
20 . 1 1 4 4 ARG HG3 H 1 1.596 0.007 . . . . . A 4 ARG HG3 . 25212 1
21 . 1 1 4 4 ARG HD2 H 1 3.105 0.008 . . . . . A 4 ARG HD2 . 25212 1
22 . 1 1 4 4 ARG HD3 H 1 3.105 0.008 . . . . . A 4 ARG HD3 . 25212 1
23 . 1 1 4 4 ARG HE H 1 7.266 0.006 . . . . . A 4 ARG HE . 25212 1
24 . 1 1 5 5 LEU H H 1 8.486 0.013 . . . . . A 5 LEU H . 25212 1
25 . 1 1 5 5 LEU HA H 1 4.550 0.004 . . . . . A 5 LEU HA . 25212 1
26 . 1 1 5 5 LEU HB2 H 1 1.738 0.005 . . . . . A 5 LEU HB2 . 25212 1
27 . 1 1 5 5 LEU HB3 H 1 1.738 0.005 . . . . . A 5 LEU HB3 . 25212 1
28 . 1 1 5 5 LEU HG H 1 1.579 0.007 . . . . . A 5 LEU HG . 25212 1
29 . 1 1 5 5 LEU HD11 H 1 0.897 0.027 . . . . . A 5 LEU HD11 . 25212 1
30 . 1 1 5 5 LEU HD12 H 1 0.897 0.027 . . . . . A 5 LEU HD12 . 25212 1
31 . 1 1 5 5 LEU HD13 H 1 0.897 0.027 . . . . . A 5 LEU HD13 . 25212 1
32 . 1 1 5 5 LEU HD21 H 1 0.897 0.027 . . . . . A 5 LEU HD21 . 25212 1
33 . 1 1 5 5 LEU HD22 H 1 0.897 0.027 . . . . . A 5 LEU HD22 . 25212 1
34 . 1 1 5 5 LEU HD23 H 1 0.897 0.027 . . . . . A 5 LEU HD23 . 25212 1
35 . 1 1 6 6 CYS H H 1 8.298 0.008 . . . . . A 6 CYS H . 25212 1
36 . 1 1 6 6 CYS HA H 1 5.694 0.017 . . . . . A 6 CYS HA . 25212 1
37 . 1 1 6 6 CYS HB2 H 1 2.853 0.012 . . . . . A 6 CYS HB2 . 25212 1
38 . 1 1 6 6 CYS HB3 H 1 2.661 0.006 . . . . . A 6 CYS HB3 . 25212 1
39 . 1 1 7 7 TYR H H 1 8.184 0.009 . . . . . A 7 TYR H . 25212 1
40 . 1 1 7 7 TYR HA H 1 4.675 0.005 . . . . . A 7 TYR HA . 25212 1
41 . 1 1 7 7 TYR HB2 H 1 2.837 0.010 . . . . . A 7 TYR HB2 . 25212 1
42 . 1 1 7 7 TYR HB3 H 1 2.837 0.010 . . . . . A 7 TYR HB3 . 25212 1
43 . 1 1 7 7 TYR HD1 H 1 7.001 0.004 . . . . . A 7 TYR HD1 . 25212 1
44 . 1 1 7 7 TYR HD2 H 1 7.001 0.004 . . . . . A 7 TYR HD2 . 25212 1
45 . 1 1 7 7 TYR HE1 H 1 6.695 0.005 . . . . . A 7 TYR HE1 . 25212 1
46 . 1 1 7 7 TYR HE2 H 1 6.695 0.005 . . . . . A 7 TYR HE2 . 25212 1
47 . 1 1 8 8 CYS H H 1 9.155 0.006 . . . . . A 8 CYS H . 25212 1
48 . 1 1 8 8 CYS HA H 1 5.695 0.012 . . . . . A 8 CYS HA . 25212 1
49 . 1 1 8 8 CYS HB2 H 1 2.858 0.007 . . . . . A 8 CYS HB2 . 25212 1
50 . 1 1 8 8 CYS HB3 H 1 2.661 0.005 . . . . . A 8 CYS HB3 . 25212 1
51 . 1 1 9 9 ARG H H 1 9.231 0.012 . . . . . A 9 ARG H . 25212 1
52 . 1 1 9 9 ARG HA H 1 4.347 0.006 . . . . . A 9 ARG HA . 25212 1
53 . 1 1 9 9 ARG HB2 H 1 1.845 0.006 . . . . . A 9 ARG HB2 . 25212 1
54 . 1 1 9 9 ARG HB3 H 1 1.845 0.006 . . . . . A 9 ARG HB3 . 25212 1
55 . 1 1 9 9 ARG HG2 H 1 1.609 0.008 . . . . . A 9 ARG HG2 . 25212 1
56 . 1 1 9 9 ARG HG3 H 1 1.609 0.008 . . . . . A 9 ARG HG3 . 25212 1
57 . 1 1 9 9 ARG HD2 H 1 3.300 0.006 . . . . . A 9 ARG HD2 . 25212 1
58 . 1 1 9 9 ARG HD3 H 1 3.300 0.006 . . . . . A 9 ARG HD3 . 25212 1
59 . 1 1 9 9 ARG HE H 1 7.754 0.006 . . . . . A 9 ARG HE . 25212 1
60 . 1 1 10 10 ARG H H 1 9.236 0.007 . . . . . A 10 ARG H . 25212 1
61 . 1 1 10 10 ARG HA H 1 3.774 0.007 . . . . . A 10 ARG HA . 25212 1
62 . 1 1 10 10 ARG HB2 H 1 2.044 0.007 . . . . . A 10 ARG HB2 . 25212 1
63 . 1 1 10 10 ARG HB3 H 1 2.044 0.007 . . . . . A 10 ARG HB3 . 25212 1
64 . 1 1 10 10 ARG HG2 H 1 1.655 0.008 . . . . . A 10 ARG HG2 . 25212 1
65 . 1 1 10 10 ARG HG3 H 1 1.655 0.008 . . . . . A 10 ARG HG3 . 25212 1
66 . 1 1 10 10 ARG HD2 H 1 3.273 0.008 . . . . . A 10 ARG HD2 . 25212 1
67 . 1 1 10 10 ARG HD3 H 1 3.273 0.008 . . . . . A 10 ARG HD3 . 25212 1
68 . 1 1 10 10 ARG HE H 1 7.610 0.003 . . . . . A 10 ARG HE . 25212 1
69 . 1 1 11 11 ARG H H 1 8.125 0.008 . . . . . A 11 ARG H . 25212 1
70 . 1 1 11 11 ARG HA H 1 3.971 0.014 . . . . . A 11 ARG HA . 25212 1
71 . 1 1 11 11 ARG HB2 H 1 2.031 0.007 . . . . . A 11 ARG HB2 . 25212 1
72 . 1 1 11 11 ARG HB3 H 1 1.865 0.008 . . . . . A 11 ARG HB3 . 25212 1
73 . 1 1 11 11 ARG HG2 H 1 1.368 0.009 . . . . . A 11 ARG HG2 . 25212 1
74 . 1 1 11 11 ARG HG3 H 1 1.368 0.009 . . . . . A 11 ARG HG3 . 25212 1
75 . 1 1 11 11 ARG HD2 H 1 3.101 0.009 . . . . . A 11 ARG HD2 . 25212 1
76 . 1 1 11 11 ARG HD3 H 1 3.101 0.009 . . . . . A 11 ARG HD3 . 25212 1
77 . 1 1 11 11 ARG HE H 1 7.257 0.008 . . . . . A 11 ARG HE . 25212 1
78 . 1 1 12 12 PHE H H 1 8.478 0.007 . . . . . A 12 PHE H . 25212 1
79 . 1 1 12 12 PHE HA H 1 3.862 0.007 . . . . . A 12 PHE HA . 25212 1
80 . 1 1 12 12 PHE HB2 H 1 2.946 0.004 . . . . . A 12 PHE HB2 . 25212 1
81 . 1 1 12 12 PHE HB3 H 1 2.675 0.004 . . . . . A 12 PHE HB3 . 25212 1
82 . 1 1 13 13 CYS H H 1 8.807 0.004 . . . . . A 13 CYS H . 25212 1
83 . 1 1 13 13 CYS HA H 1 5.674 0.021 . . . . . A 13 CYS HA . 25212 1
84 . 1 1 13 13 CYS HB2 H 1 2.945 0.014 . . . . . A 13 CYS HB2 . 25212 1
85 . 1 1 13 13 CYS HB3 H 1 2.685 0.006 . . . . . A 13 CYS HB3 . 25212 1
86 . 1 1 14 14 VAL H H 1 8.945 0.006 . . . . . A 14 VAL H . 25212 1
87 . 1 1 14 14 VAL HA H 1 4.380 0.007 . . . . . A 14 VAL HA . 25212 1
88 . 1 1 14 14 VAL HB H 1 2.038 0.008 . . . . . A 14 VAL HB . 25212 1
89 . 1 1 14 14 VAL HG11 H 1 1.006 0.011 . . . . . A 14 VAL HG11 . 25212 1
90 . 1 1 14 14 VAL HG12 H 1 1.006 0.011 . . . . . A 14 VAL HG12 . 25212 1
91 . 1 1 14 14 VAL HG13 H 1 1.006 0.011 . . . . . A 14 VAL HG13 . 25212 1
92 . 1 1 14 14 VAL HG21 H 1 1.006 0.011 . . . . . A 14 VAL HG21 . 25212 1
93 . 1 1 14 14 VAL HG22 H 1 1.006 0.011 . . . . . A 14 VAL HG22 . 25212 1
94 . 1 1 14 14 VAL HG23 H 1 1.006 0.011 . . . . . A 14 VAL HG23 . 25212 1
95 . 1 1 15 15 CYS H H 1 8.858 0.005 . . . . . A 15 CYS H . 25212 1
96 . 1 1 15 15 CYS HA H 1 5.565 0.012 . . . . . A 15 CYS HA . 25212 1
97 . 1 1 15 15 CYS HB2 H 1 2.857 0.007 . . . . . A 15 CYS HB2 . 25212 1
98 . 1 1 15 15 CYS HB3 H 1 2.654 0.006 . . . . . A 15 CYS HB3 . 25212 1
99 . 1 1 16 16 VAL H H 1 8.813 0.009 . . . . . A 16 VAL H . 25212 1
100 . 1 1 16 16 VAL HA H 1 4.338 0.007 . . . . . A 16 VAL HA . 25212 1
101 . 1 1 16 16 VAL HB H 1 2.238 0.005 . . . . . A 16 VAL HB . 25212 1
102 . 1 1 16 16 VAL HG11 H 1 0.952 0.009 . . . . . A 16 VAL HG11 . 25212 1
103 . 1 1 16 16 VAL HG12 H 1 0.952 0.009 . . . . . A 16 VAL HG12 . 25212 1
104 . 1 1 16 16 VAL HG13 H 1 0.952 0.009 . . . . . A 16 VAL HG13 . 25212 1
105 . 1 1 16 16 VAL HG21 H 1 0.952 0.009 . . . . . A 16 VAL HG21 . 25212 1
106 . 1 1 16 16 VAL HG22 H 1 0.952 0.009 . . . . . A 16 VAL HG22 . 25212 1
107 . 1 1 16 16 VAL HG23 H 1 0.952 0.009 . . . . . A 16 VAL HG23 . 25212 1
stop_
save_