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 30595
_Assigned_chem_shift_list.ID 1
_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 $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 COSY' . . . 30595 1
2 '2D 1H-1H TOCSY' . . . 30595 1
3 '2D 1H-1H NOESY' . . . 30595 1
4 '2D 1H-15N HSQC' . . . 30595 1
5 '2D 1H-13C HSQC' . . . 30595 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 2 2 MET HA H 1 4.548 0.00 . . . . . . A 2 MET HA . 30595 1
2 . 1 . 1 2 2 MET HB2 H 1 2.094 0.00 . . . . . . A 2 MET HB2 . 30595 1
3 . 1 . 1 2 2 MET HG2 H 1 2.616 0.00 . . . . . . A 2 MET HG2 . 30595 1
4 . 1 . 1 2 2 MET HG3 H 1 2.583 0.00 . . . . . . A 2 MET HG3 . 30595 1
5 . 1 . 1 2 2 MET CA C 13 53.217 0.00 . . . . . . A 2 MET CA . 30595 1
6 . 1 . 1 3 3 ARG H H 1 8.777 0.00 . . . . . . A 3 ARG H . 30595 1
7 . 1 . 1 3 3 ARG HA H 1 4.440 0.00 . . . . . . A 3 ARG HA . 30595 1
8 . 1 . 1 3 3 ARG HB2 H 1 1.914 0.00 . . . . . . A 3 ARG HB2 . 30595 1
9 . 1 . 1 3 3 ARG HB3 H 1 1.844 0.00 . . . . . . A 3 ARG HB3 . 30595 1
10 . 1 . 1 3 3 ARG HG2 H 1 1.705 0.00 . . . . . . A 3 ARG HG2 . 30595 1
11 . 1 . 1 3 3 ARG HG3 H 1 1.643 0.00 . . . . . . A 3 ARG HG3 . 30595 1
12 . 1 . 1 3 3 ARG HD2 H 1 3.241 0.00 . . . . . . A 3 ARG HD2 . 30595 1
13 . 1 . 1 3 3 ARG HD3 H 1 3.214 0.00 . . . . . . A 3 ARG HD3 . 30595 1
14 . 1 . 1 3 3 ARG HE H 1 7.472 0.00 . . . . . . A 3 ARG HE . 30595 1
15 . 1 . 1 3 3 ARG CA C 13 53.865 0.00 . . . . . . A 3 ARG CA . 30595 1
16 . 1 . 1 3 3 ARG CB C 13 30.402 0.00 . . . . . . A 3 ARG CB . 30595 1
17 . 1 . 1 3 3 ARG N N 15 124.078 0.00 . . . . . . A 3 ARG N . 30595 1
18 . 1 . 1 4 4 LEU H H 1 8.823 0.00 . . . . . . A 4 LEU H . 30595 1
19 . 1 . 1 4 4 LEU HA H 1 4.240 0.00 . . . . . . A 4 LEU HA . 30595 1
20 . 1 . 1 4 4 LEU HB2 H 1 1.804 0.00 . . . . . . A 4 LEU HB2 . 30595 1
21 . 1 . 1 4 4 LEU HB3 H 1 1.765 0.00 . . . . . . A 4 LEU HB3 . 30595 1
22 . 1 . 1 4 4 LEU HG H 1 1.704 0.00 . . . . . . A 4 LEU HG . 30595 1
23 . 1 . 1 4 4 LEU HD11 H 1 0.971 0.00 . . . . . . A 4 LEU HD11 . 30595 1
24 . 1 . 1 4 4 LEU HD12 H 1 0.971 0.00 . . . . . . A 4 LEU HD12 . 30595 1
25 . 1 . 1 4 4 LEU HD13 H 1 0.971 0.00 . . . . . . A 4 LEU HD13 . 30595 1
26 . 1 . 1 4 4 LEU HD21 H 1 0.893 0.00 . . . . . . A 4 LEU HD21 . 30595 1
27 . 1 . 1 4 4 LEU HD22 H 1 0.893 0.00 . . . . . . A 4 LEU HD22 . 30595 1
28 . 1 . 1 4 4 LEU HD23 H 1 0.893 0.00 . . . . . . A 4 LEU HD23 . 30595 1
29 . 1 . 1 4 4 LEU CA C 13 59.169 0.00 . . . . . . A 4 LEU CA . 30595 1
30 . 1 . 1 4 4 LEU CB C 13 39.636 0.00 . . . . . . A 4 LEU CB . 30595 1
31 . 1 . 1 4 4 LEU N N 15 122.784 0.00 . . . . . . A 4 LEU N . 30595 1
32 . 1 . 1 5 5 SER H H 1 8.482 0.00 . . . . . . A 5 SER H . 30595 1
33 . 1 . 1 5 5 SER HA H 1 4.233 0.00 . . . . . . A 5 SER HA . 30595 1
34 . 1 . 1 5 5 SER HB2 H 1 4.018 0.00 . . . . . . A 5 SER HB2 . 30595 1
35 . 1 . 1 5 5 SER HB3 H 1 3.973 0.00 . . . . . . A 5 SER HB3 . 30595 1
36 . 1 . 1 5 5 SER CA C 13 54.359 0.00 . . . . . . A 5 SER CA . 30595 1
37 . 1 . 1 5 5 SER CB C 13 60.345 0.00 . . . . . . A 5 SER CB . 30595 1
38 . 1 . 1 5 5 SER N N 15 113.729 0.00 . . . . . . A 5 SER N . 30595 1
39 . 1 . 1 6 6 DAB H H 1 7.950 0.00 . . . . . . A 6 DAB H . 30595 1
40 . 1 . 1 6 6 DAB N N 15 121.756 0.00 . . . . . . A 6 DAB N . 30595 1
41 . 1 . 1 6 6 DAB HA H 1 4.349 0.00 . . . . . . A 6 DAB HA . 30595 1
42 . 1 . 1 6 6 DAB HB2 H 1 2.125 0.00 . . . . . . A 6 DAB HB2 . 30595 1
43 . 1 . 1 6 6 DAB HB3 H 1 2.080 0.00 . . . . . . A 6 DAB HB3 . 30595 1
44 . 1 . 1 6 6 DAB HG2 H 1 3.534 0.00 . . . . . . A 6 DAB HG2 . 30595 1
45 . 1 . 1 6 6 DAB HG3 H 1 3.285 0.00 . . . . . . A 6 DAB HG3 . 30595 1
46 . 1 . 1 7 7 PHE H H 1 8.355 0.00 . . . . . . A 7 PHE H . 30595 1
47 . 1 . 1 7 7 PHE HA H 1 4.272 0.00 . . . . . . A 7 PHE HA . 30595 1
48 . 1 . 1 7 7 PHE HB2 H 1 3.206 0.00 . . . . . . A 7 PHE HB2 . 30595 1
49 . 1 . 1 7 7 PHE HB3 H 1 3.002 0.00 . . . . . . A 7 PHE HB3 . 30595 1
50 . 1 . 1 7 7 PHE HD2 H 1 6.950 0.00 . . . . . . A 7 PHE HD2 . 30595 1
51 . 1 . 1 7 7 PHE HZ H 1 7.056 0.00 . . . . . . A 7 PHE HZ . 30595 1
52 . 1 . 1 7 7 PHE CA C 13 58.540 0.00 . . . . . . A 7 PHE CA . 30595 1
53 . 1 . 1 7 7 PHE CB C 13 40.807 0.00 . . . . . . A 7 PHE CB . 30595 1
54 . 1 . 1 7 7 PHE N N 15 120.745 0.00 . . . . . . A 7 PHE N . 30595 1
55 . 1 . 1 8 8 PHE H H 1 7.956 0.00 . . . . . . A 8 PHE H . 30595 1
56 . 1 . 1 8 8 PHE HA H 1 4.244 0.01 . . . . . . A 8 PHE HA . 30595 1
57 . 1 . 1 8 8 PHE HB2 H 1 3.099 0.00 . . . . . . A 8 PHE HB2 . 30595 1
58 . 1 . 1 8 8 PHE HE2 H 1 7.277 0.00 . . . . . . A 8 PHE HE2 . 30595 1
59 . 1 . 1 8 8 PHE CB C 13 40.602 0.00 . . . . . . A 8 PHE CB . 30595 1
60 . 1 . 1 9 9 ARG H H 1 8.312 0.00 . . . . . . A 9 ARG H . 30595 1
61 . 1 . 1 9 9 ARG HA H 1 3.919 0.00 . . . . . . A 9 ARG HA . 30595 1
62 . 1 . 1 9 9 ARG HB2 H 1 1.935 0.00 . . . . . . A 9 ARG HB2 . 30595 1
63 . 1 . 1 9 9 ARG HB3 H 1 1.738 0.00 . . . . . . A 9 ARG HB3 . 30595 1
64 . 1 . 1 9 9 ARG HG2 H 1 1.606 0.00 . . . . . . A 9 ARG HG2 . 30595 1
65 . 1 . 1 9 9 ARG HD2 H 1 3.254 0.00 . . . . . . A 9 ARG HD2 . 30595 1
66 . 1 . 1 9 9 ARG HD3 H 1 3.216 0.00 . . . . . . A 9 ARG HD3 . 30595 1
67 . 1 . 1 9 9 ARG HE H 1 7.615 0.00 . . . . . . A 9 ARG HE . 30595 1
68 . 1 . 1 10 10 GLN H H 1 7.948 0.00 . . . . . . A 10 GLN H . 30595 1
69 . 1 . 1 10 10 GLN HA H 1 4.068 0.00 . . . . . . A 10 GLN HA . 30595 1
70 . 1 . 1 10 10 GLN HB2 H 1 1.996 0.00 . . . . . . A 10 GLN HB2 . 30595 1
71 . 1 . 1 10 10 GLN HB3 H 1 1.863 0.00 . . . . . . A 10 GLN HB3 . 30595 1
72 . 1 . 1 10 10 GLN HG2 H 1 2.403 0.00 . . . . . . A 10 GLN HG2 . 30595 1
73 . 1 . 1 10 10 GLN HG3 H 1 2.098 0.00 . . . . . . A 10 GLN HG3 . 30595 1
74 . 1 . 1 11 11 PHE H H 1 7.777 0.00 . . . . . . A 11 PHE H . 30595 1
75 . 1 . 1 11 11 PHE HA H 1 4.397 0.00 . . . . . . A 11 PHE HA . 30595 1
76 . 1 . 1 11 11 PHE HB2 H 1 2.984 0.00 . . . . . . A 11 PHE HB2 . 30595 1
77 . 1 . 1 11 11 PHE HB3 H 1 2.908 0.00 . . . . . . A 11 PHE HB3 . 30595 1
78 . 1 . 1 11 11 PHE HD2 H 1 7.140 0.00 . . . . . . A 11 PHE HD2 . 30595 1
79 . 1 . 1 11 11 PHE HE2 H 1 7.281 0.00 . . . . . . A 11 PHE HE2 . 30595 1
80 . 1 . 1 11 11 PHE CA C 13 57.048 0.00 . . . . . . A 11 PHE CA . 30595 1
81 . 1 . 1 11 11 PHE CB C 13 39.443 0.00 . . . . . . A 11 PHE CB . 30595 1
82 . 1 . 1 12 12 ILE H H 1 7.533 0.00 . . . . . . A 12 ILE H . 30595 1
83 . 1 . 1 12 12 ILE HA H 1 3.939 0.00 . . . . . . A 12 ILE HA . 30595 1
84 . 1 . 1 12 12 ILE HB H 1 2.017 0.00 . . . . . . A 12 ILE HB . 30595 1
85 . 1 . 1 12 12 ILE HG12 H 1 1.476 0.00 . . . . . . A 12 ILE HG12 . 30595 1
86 . 1 . 1 12 12 ILE HG13 H 1 1.150 0.00 . . . . . . A 12 ILE HG13 . 30595 1
87 . 1 . 1 12 12 ILE HG21 H 1 0.840 0.00 . . . . . . A 12 ILE HG21 . 30595 1
88 . 1 . 1 12 12 ILE HG22 H 1 0.840 0.00 . . . . . . A 12 ILE HG22 . 30595 1
89 . 1 . 1 12 12 ILE HG23 H 1 0.840 0.00 . . . . . . A 12 ILE HG23 . 30595 1
90 . 1 . 1 12 12 ILE HD11 H 1 0.799 0.00 . . . . . . A 12 ILE HD11 . 30595 1
91 . 1 . 1 12 12 ILE HD12 H 1 0.799 0.00 . . . . . . A 12 ILE HD12 . 30595 1
92 . 1 . 1 12 12 ILE HD13 H 1 0.799 0.00 . . . . . . A 12 ILE HD13 . 30595 1
93 . 1 . 1 13 13 LEU H H 1 8.054 0.00 . . . . . . A 13 LEU H . 30595 1
94 . 1 . 1 13 13 LEU HA H 1 4.172 0.00 . . . . . . A 13 LEU HA . 30595 1
95 . 1 . 1 13 13 LEU HB2 H 1 1.763 0.00 . . . . . . A 13 LEU HB2 . 30595 1
96 . 1 . 1 13 13 LEU HG H 1 1.565 0.00 . . . . . . A 13 LEU HG . 30595 1
97 . 1 . 1 13 13 LEU HD11 H 1 0.904 0.00 . . . . . . A 13 LEU HD11 . 30595 1
98 . 1 . 1 13 13 LEU HD12 H 1 0.904 0.00 . . . . . . A 13 LEU HD12 . 30595 1
99 . 1 . 1 13 13 LEU HD13 H 1 0.904 0.00 . . . . . . A 13 LEU HD13 . 30595 1
100 . 1 . 1 13 13 LEU HD21 H 1 0.865 0.00 . . . . . . A 13 LEU HD21 . 30595 1
101 . 1 . 1 13 13 LEU HD22 H 1 0.865 0.00 . . . . . . A 13 LEU HD22 . 30595 1
102 . 1 . 1 13 13 LEU HD23 H 1 0.865 0.00 . . . . . . A 13 LEU HD23 . 30595 1
103 . 1 . 1 13 13 LEU CA C 13 53.212 0.00 . . . . . . A 13 LEU CA . 30595 1
104 . 1 . 1 13 13 LEU CB C 13 39.115 0.00 . . . . . . A 13 LEU CB . 30595 1
105 . 1 . 1 14 14 GLN H H 1 8.011 0.00 . . . . . . A 14 GLN H . 30595 1
106 . 1 . 1 14 14 GLN HA H 1 4.202 0.00 . . . . . . A 14 GLN HA . 30595 1
107 . 1 . 1 14 14 GLN HB2 H 1 2.069 0.00 . . . . . . A 14 GLN HB2 . 30595 1
108 . 1 . 1 14 14 GLN HB3 H 1 1.978 0.00 . . . . . . A 14 GLN HB3 . 30595 1
109 . 1 . 1 14 14 GLN HG2 H 1 2.290 0.00 . . . . . . A 14 GLN HG2 . 30595 1
110 . 1 . 1 14 14 GLN HG3 H 1 2.269 0.00 . . . . . . A 14 GLN HG3 . 30595 1
111 . 1 . 1 14 14 GLN CA C 13 53.322 0.00 . . . . . . A 14 GLN CA . 30595 1
112 . 1 . 1 15 15 ARG H H 1 8.008 0.01 . . . . . . A 15 ARG H . 30595 1
113 . 1 . 1 15 15 ARG HA H 1 4.263 0.00 . . . . . . A 15 ARG HA . 30595 1
114 . 1 . 1 15 15 ARG HB2 H 1 1.828 0.00 . . . . . . A 15 ARG HB2 . 30595 1
115 . 1 . 1 15 15 ARG HB3 H 1 1.695 0.00 . . . . . . A 15 ARG HB3 . 30595 1
116 . 1 . 1 15 15 ARG HG2 H 1 1.574 0.00 . . . . . . A 15 ARG HG2 . 30595 1
117 . 1 . 1 15 15 ARG HD2 H 1 3.112 0.00 . . . . . . A 15 ARG HD2 . 30595 1
118 . 1 . 1 15 15 ARG HE H 1 7.449 0.00 . . . . . . A 15 ARG HE . 30595 1
119 . 1 . 1 15 15 ARG CA C 13 53.671 0.00 . . . . . . A 15 ARG CA . 30595 1
120 . 1 . 1 15 15 ARG CB C 13 28.082 0.00 . . . . . . A 15 ARG CB . 30595 1
121 . 1 . 1 16 16 LYS H H 1 8.282 0.00 . . . . . . A 16 LYS H . 30595 1
122 . 1 . 1 16 16 LYS HA H 1 4.268 0.00 . . . . . . A 16 LYS HA . 30595 1
123 . 1 . 1 16 16 LYS HB2 H 1 1.847 0.00 . . . . . . A 16 LYS HB2 . 30595 1
124 . 1 . 1 16 16 LYS HB3 H 1 1.737 0.00 . . . . . . A 16 LYS HB3 . 30595 1
125 . 1 . 1 16 16 LYS HG2 H 1 1.446 0.00 . . . . . . A 16 LYS HG2 . 30595 1
126 . 1 . 1 16 16 LYS HD2 H 1 1.575 0.00 . . . . . . A 16 LYS HD2 . 30595 1
127 . 1 . 1 16 16 LYS N N 15 122.730 0.00 . . . . . . A 16 LYS N . 30595 1
128 . 1 . 1 17 17 LYS H H 1 7.924 0.00 . . . . . . A 17 LYS H . 30595 1
129 . 1 . 1 17 17 LYS HA H 1 4.101 0.00 . . . . . . A 17 LYS HA . 30595 1
130 . 1 . 1 17 17 LYS HB2 H 1 1.785 0.00 . . . . . . A 17 LYS HB2 . 30595 1
131 . 1 . 1 17 17 LYS HB3 H 1 1.698 0.00 . . . . . . A 17 LYS HB3 . 30595 1
132 . 1 . 1 17 17 LYS HG2 H 1 1.383 0.00 . . . . . . A 17 LYS HG2 . 30595 1
133 . 1 . 1 17 17 LYS CA C 13 55.162 0.00 . . . . . . A 17 LYS CA . 30595 1
134 . 1 . 1 17 17 LYS CB C 13 31.005 0.00 . . . . . . A 17 LYS CB . 30595 1
135 . 1 . 1 17 17 LYS N N 15 127.883 0.00 . . . . . . A 17 LYS N . 30595 1
stop_
save_