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 31241
_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 TOCSY' . . . 31241 1
2 '2D 1H-1H NOESY' . . . 31241 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 ACE H1 H 1 2.043 0.001 . 1 . . . . A 0 ACE H1 . 31241 1
2 . 1 . 1 1 1 ACE H2 H 1 2.043 0.001 . 1 . . . . A 0 ACE H2 . 31241 1
3 . 1 . 1 1 1 ACE H3 H 1 2.043 0.001 . 1 . . . . A 0 ACE H3 . 31241 1
4 . 1 . 1 2 2 SER H H 1 8.444 0.000 . 1 . . . . A 1 SER H . 31241 1
5 . 1 . 1 2 2 SER HA H 1 4.371 0.000 . 1 . . . . A 1 SER HA . 31241 1
6 . 1 . 1 2 2 SER HB2 H 1 3.823 0.000 . 2 . . . . A 1 SER HB2 . 31241 1
7 . 1 . 1 2 2 SER HB3 H 1 3.823 0.000 . 2 . . . . A 1 SER HB3 . 31241 1
8 . 1 . 1 3 3 LYS H H 1 8.527 0.000 . 1 . . . . A 2 LYS H . 31241 1
9 . 1 . 1 3 3 LYS HA H 1 4.447 0.000 . 1 . . . . A 2 LYS HA . 31241 1
10 . 1 . 1 3 3 LYS HB2 H 1 1.617 0.000 . 2 . . . . A 2 LYS HB2 . 31241 1
11 . 1 . 1 3 3 LYS HB3 H 1 1.617 0.000 . 2 . . . . A 2 LYS HB3 . 31241 1
12 . 1 . 1 3 3 LYS HG2 H 1 1.419 0.000 . 2 . . . . A 2 LYS HG2 . 31241 1
13 . 1 . 1 3 3 LYS HG3 H 1 1.328 0.000 . 2 . . . . A 2 LYS HG3 . 31241 1
14 . 1 . 1 3 3 LYS HD2 H 1 1.632 0.000 . 2 . . . . A 2 LYS HD2 . 31241 1
15 . 1 . 1 3 3 LYS HD3 H 1 1.632 0.000 . 2 . . . . A 2 LYS HD3 . 31241 1
16 . 1 . 1 3 3 LYS HE2 H 1 2.956 0.000 . 2 . . . . A 2 LYS HE2 . 31241 1
17 . 1 . 1 3 3 LYS HE3 H 1 2.956 0.000 . 2 . . . . A 2 LYS HE3 . 31241 1
18 . 1 . 1 3 3 LYS HZ1 H 1 7.615 0.000 . 1 . . . . A 2 LYS HZ1 . 31241 1
19 . 1 . 1 3 3 LYS HZ2 H 1 7.615 0.000 . 1 . . . . A 2 LYS HZ2 . 31241 1
20 . 1 . 1 3 3 LYS HZ3 H 1 7.615 0.000 . 1 . . . . A 2 LYS HZ3 . 31241 1
21 . 1 . 1 4 4 THR H H 1 8.191 0.000 . 1 . . . . A 3 THR H . 31241 1
22 . 1 . 1 4 4 THR HA H 1 4.291 0.000 . 1 . . . . A 3 THR HA . 31241 1
23 . 1 . 1 4 4 THR HB H 1 4.029 0.000 . 1 . . . . A 3 THR HB . 31241 1
24 . 1 . 1 4 4 THR HG21 H 1 1.107 0.000 . 1 . . . . A 3 THR HG21 . 31241 1
25 . 1 . 1 4 4 THR HG22 H 1 1.107 0.000 . 1 . . . . A 3 THR HG22 . 31241 1
26 . 1 . 1 4 4 THR HG23 H 1 1.107 0.000 . 1 . . . . A 3 THR HG23 . 31241 1
27 . 1 . 1 5 5 PHE H H 1 8.273 0.000 . 1 . . . . A 4 PHE H . 31241 1
28 . 1 . 1 5 5 PHE HA H 1 5.082 0.000 . 1 . . . . A 4 PHE HA . 31241 1
29 . 1 . 1 5 5 PHE HB2 H 1 2.841 0.000 . 2 . . . . A 4 PHE HB2 . 31241 1
30 . 1 . 1 5 5 PHE HB3 H 1 2.841 0.000 . 2 . . . . A 4 PHE HB3 . 31241 1
31 . 1 . 1 5 5 PHE HD1 H 1 7.046 0.000 . 3 . . . . A 4 PHE HD1 . 31241 1
32 . 1 . 1 5 5 PHE HD2 H 1 7.046 0.000 . 3 . . . . A 4 PHE HD2 . 31241 1
33 . 1 . 1 5 5 PHE HE1 H 1 7.289 0.000 . 3 . . . . A 4 PHE HE1 . 31241 1
34 . 1 . 1 5 5 PHE HE2 H 1 7.289 0.000 . 3 . . . . A 4 PHE HE2 . 31241 1
35 . 1 . 1 5 5 PHE HZ H 1 7.264 0.000 . 1 . . . . A 4 PHE HZ . 31241 1
36 . 1 . 1 6 6 ILE H H 1 8.687 0.000 . 1 . . . . A 5 ILE H . 31241 1
37 . 1 . 1 6 6 ILE HA H 1 4.194 0.000 . 1 . . . . A 5 ILE HA . 31241 1
38 . 1 . 1 6 6 ILE HB H 1 1.613 0.000 . 1 . . . . A 5 ILE HB . 31241 1
39 . 1 . 1 6 6 ILE HG12 H 1 1.336 0.000 . 2 . . . . A 5 ILE HG12 . 31241 1
40 . 1 . 1 6 6 ILE HG13 H 1 1.043 0.000 . 2 . . . . A 5 ILE HG13 . 31241 1
41 . 1 . 1 6 6 ILE HG21 H 1 0.904 0.000 . 1 . . . . A 5 ILE HG21 . 31241 1
42 . 1 . 1 6 6 ILE HG22 H 1 0.904 0.000 . 1 . . . . A 5 ILE HG22 . 31241 1
43 . 1 . 1 6 6 ILE HG23 H 1 0.904 0.000 . 1 . . . . A 5 ILE HG23 . 31241 1
44 . 1 . 1 6 6 ILE HD11 H 1 0.759 0.000 . 1 . . . . A 5 ILE HD11 . 31241 1
45 . 1 . 1 6 6 ILE HD12 H 1 0.759 0.000 . 1 . . . . A 5 ILE HD12 . 31241 1
46 . 1 . 1 6 6 ILE HD13 H 1 0.759 0.000 . 1 . . . . A 5 ILE HD13 . 31241 1
47 . 1 . 1 7 7 GLN H H 1 8.911 0.000 . 1 . . . . A 6 GLN H . 31241 1
48 . 1 . 1 7 7 GLN HA H 1 4.720 0.000 . 1 . . . . A 6 GLN HA . 31241 1
49 . 1 . 1 7 7 GLN HB2 H 1 2.069 0.000 . 2 . . . . A 6 GLN HB2 . 31241 1
50 . 1 . 1 7 7 GLN HB3 H 1 2.001 0.000 . 2 . . . . A 6 GLN HB3 . 31241 1
51 . 1 . 1 7 7 GLN HG2 H 1 2.262 0.000 . 2 . . . . A 6 GLN HG2 . 31241 1
52 . 1 . 1 7 7 GLN HG3 H 1 2.262 0.000 . 2 . . . . A 6 GLN HG3 . 31241 1
53 . 1 . 1 7 7 GLN HE21 H 1 7.020 0.000 . 2 . . . . A 6 GLN HE21 . 31241 1
54 . 1 . 1 7 7 GLN HE22 H 1 7.505 0.000 . 2 . . . . A 6 GLN HE22 . 31241 1
55 . 1 . 1 8 8 VAL H H 1 8.912 0.000 . 1 . . . . A 7 VAL H . 31241 1
56 . 1 . 1 8 8 VAL HA H 1 4.620 0.000 . 1 . . . . A 7 VAL HA . 31241 1
57 . 1 . 1 8 8 VAL HB H 1 2.065 0.000 . 1 . . . . A 7 VAL HB . 31241 1
58 . 1 . 1 8 8 VAL HG11 H 1 0.914 0.000 . 2 . . . . A 7 VAL HG11 . 31241 1
59 . 1 . 1 8 8 VAL HG12 H 1 0.914 0.000 . 2 . . . . A 7 VAL HG12 . 31241 1
60 . 1 . 1 8 8 VAL HG13 H 1 0.914 0.000 . 2 . . . . A 7 VAL HG13 . 31241 1
61 . 1 . 1 8 8 VAL HG21 H 1 0.952 0.000 . 2 . . . . A 7 VAL HG21 . 31241 1
62 . 1 . 1 8 8 VAL HG22 H 1 0.952 0.000 . 2 . . . . A 7 VAL HG22 . 31241 1
63 . 1 . 1 8 8 VAL HG23 H 1 0.952 0.000 . 2 . . . . A 7 VAL HG23 . 31241 1
64 . 1 . 1 9 9 DPR HA H 1 4.278 0.001 . 1 . . . . A 8 DPR HA . 31241 1
65 . 1 . 1 9 9 DPR HB2 H 1 2.280 0.000 . 2 . . . . A 8 DPR HB2 . 31241 1
66 . 1 . 1 9 9 DPR HB3 H 1 1.927 0.000 . 2 . . . . A 8 DPR HB3 . 31241 1
67 . 1 . 1 9 9 DPR HD2 H 1 3.883 0.000 . 2 . . . . A 8 DPR HD2 . 31241 1
68 . 1 . 1 9 9 DPR HD3 H 1 3.773 0.000 . 2 . . . . A 8 DPR HD3 . 31241 1
69 . 1 . 1 9 9 DPR HG2 H 1 2.134 0.000 . 2 . . . . A 8 DPR HG2 . 31241 1
70 . 1 . 1 9 9 DPR HG3 H 1 2.004 0.000 . 2 . . . . A 8 DPR HG3 . 31241 1
71 . 1 . 1 10 10 4G6 H H 1 7.863 0.006 . 1 . . . . A 9 4G6 H . 31241 1
72 . 1 . 1 10 10 4G6 HAA H 1 1.157 0.001 . 2 . . . . A 9 4G6 HAA . 31241 1
73 . 1 . 1 10 10 4G6 HAB H 1 1.157 0.001 . 2 . . . . A 9 4G6 HAB . 31241 1
74 . 1 . 1 10 10 4G6 HAC H 1 1.157 0.001 . 2 . . . . A 9 4G6 HAC . 31241 1
75 . 1 . 1 10 10 4G6 HAD H 1 1.308 0.002 . 2 . . . . A 9 4G6 HAD . 31241 1
76 . 1 . 1 10 10 4G6 HAE H 1 1.308 0.002 . 2 . . . . A 9 4G6 HAE . 31241 1
77 . 1 . 1 10 10 4G6 HAF H 1 1.308 0.002 . 2 . . . . A 9 4G6 HAF . 31241 1
78 . 1 . 1 10 10 4G6 HAG H 1 3.522 0.003 . 2 . . . . A 9 4G6 HAG . 31241 1
79 . 1 . 1 10 10 4G6 HAH H 1 3.575 0.000 . 2 . . . . A 9 4G6 HAH . 31241 1
80 . 1 . 1 10 10 4G6 HAL H 1 8.076 0.003 . 1 . . . . A 9 4G6 HAL . 31241 1
81 . 2 . 2 1 1 ACE H1 H 1 2.037 0.000 . 1 . . . . B 10 ACE H1 . 31241 1
82 . 2 . 2 1 1 ACE H2 H 1 2.037 0.000 . 1 . . . . B 10 ACE H2 . 31241 1
83 . 2 . 2 1 1 ACE H3 H 1 2.037 0.000 . 1 . . . . B 10 ACE H3 . 31241 1
84 . 2 . 2 2 2 LYS H H 1 8.463 0.000 . 1 . . . . B 11 LYS H . 31241 1
85 . 2 . 2 2 2 LYS HA H 1 4.230 0.000 . 1 . . . . B 11 LYS HA . 31241 1
86 . 2 . 2 2 2 LYS HB2 H 1 1.789 0.000 . 2 . . . . B 11 LYS HB2 . 31241 1
87 . 2 . 2 2 2 LYS HB3 H 1 1.717 0.000 . 2 . . . . B 11 LYS HB3 . 31241 1
88 . 2 . 2 2 2 LYS HG2 H 1 1.450 0.000 . 2 . . . . B 11 LYS HG2 . 31241 1
89 . 2 . 2 2 2 LYS HG3 H 1 1.408 0.000 . 2 . . . . B 11 LYS HG3 . 31241 1
90 . 2 . 2 2 2 LYS HD2 H 1 1.667 0.000 . 2 . . . . B 11 LYS HD2 . 31241 1
91 . 2 . 2 2 2 LYS HD3 H 1 1.667 0.000 . 2 . . . . B 11 LYS HD3 . 31241 1
92 . 2 . 2 2 2 LYS HE2 H 1 2.975 0.000 . 2 . . . . B 11 LYS HE2 . 31241 1
93 . 2 . 2 2 2 LYS HE3 H 1 2.975 0.000 . 2 . . . . B 11 LYS HE3 . 31241 1
94 . 2 . 2 2 2 LYS HZ1 H 1 7.607 0.000 . 1 . . . . B 11 LYS HZ1 . 31241 1
95 . 2 . 2 2 2 LYS HZ2 H 1 7.607 0.000 . 1 . . . . B 11 LYS HZ2 . 31241 1
96 . 2 . 2 2 2 LYS HZ3 H 1 7.607 0.000 . 1 . . . . B 11 LYS HZ3 . 31241 1
97 . 2 . 2 3 3 ASN H H 1 8.657 0.000 . 1 . . . . B 12 ASN H . 31241 1
98 . 2 . 2 3 3 ASN HA H 1 4.694 0.000 . 1 . . . . B 12 ASN HA . 31241 1
99 . 2 . 2 3 3 ASN HB2 H 1 2.818 0.000 . 2 . . . . B 12 ASN HB2 . 31241 1
100 . 2 . 2 3 3 ASN HB3 H 1 2.722 0.000 . 2 . . . . B 12 ASN HB3 . 31241 1
101 . 2 . 2 3 3 ASN HD21 H 1 6.991 0.000 . 2 . . . . B 12 ASN HD21 . 31241 1
102 . 2 . 2 3 3 ASN HD22 H 1 7.668 0.000 . 2 . . . . B 12 ASN HD22 . 31241 1
103 . 2 . 2 4 4 VAL H H 1 7.850 0.002 . 1 . . . . B 13 VAL H . 31241 1
104 . 2 . 2 4 4 VAL HA H 1 4.115 0.000 . 1 . . . . B 13 VAL HA . 31241 1
105 . 2 . 2 4 4 VAL HB H 1 1.836 0.001 . 1 . . . . B 13 VAL HB . 31241 1
106 . 2 . 2 4 4 VAL HG11 H 1 0.574 0.000 . 2 . . . . B 13 VAL HG11 . 31241 1
107 . 2 . 2 4 4 VAL HG12 H 1 0.574 0.000 . 2 . . . . B 13 VAL HG12 . 31241 1
108 . 2 . 2 4 4 VAL HG13 H 1 0.574 0.000 . 2 . . . . B 13 VAL HG13 . 31241 1
109 . 2 . 2 4 4 VAL HG21 H 1 0.758 0.002 . 2 . . . . B 13 VAL HG21 . 31241 1
110 . 2 . 2 4 4 VAL HG22 H 1 0.758 0.002 . 2 . . . . B 13 VAL HG22 . 31241 1
111 . 2 . 2 4 4 VAL HG23 H 1 0.758 0.002 . 2 . . . . B 13 VAL HG23 . 31241 1
112 . 2 . 2 5 5 LEU H H 1 8.335 0.000 . 1 . . . . B 14 LEU H . 31241 1
113 . 2 . 2 5 5 LEU HA H 1 4.452 0.000 . 1 . . . . B 14 LEU HA . 31241 1
114 . 2 . 2 5 5 LEU HB2 H 1 1.628 0.000 . 2 . . . . B 14 LEU HB2 . 31241 1
115 . 2 . 2 5 5 LEU HB3 H 1 1.447 0.000 . 2 . . . . B 14 LEU HB3 . 31241 1
116 . 2 . 2 5 5 LEU HG H 1 1.327 0.000 . 1 . . . . B 14 LEU HG . 31241 1
117 . 2 . 2 5 5 LEU HD11 H 1 0.823 0.000 . 2 . . . . B 14 LEU HD11 . 31241 1
118 . 2 . 2 5 5 LEU HD12 H 1 0.823 0.000 . 2 . . . . B 14 LEU HD12 . 31241 1
119 . 2 . 2 5 5 LEU HD13 H 1 0.823 0.000 . 2 . . . . B 14 LEU HD13 . 31241 1
120 . 2 . 2 5 5 LEU HD21 H 1 0.823 0.000 . 2 . . . . B 14 LEU HD21 . 31241 1
121 . 2 . 2 5 5 LEU HD22 H 1 0.823 0.000 . 2 . . . . B 14 LEU HD22 . 31241 1
122 . 2 . 2 5 5 LEU HD23 H 1 0.823 0.000 . 2 . . . . B 14 LEU HD23 . 31241 1
123 . 2 . 2 6 6 TYR H H 1 8.393 0.000 . 1 . . . . B 15 TYR H . 31241 1
124 . 2 . 2 6 6 TYR HA H 1 5.338 0.000 . 1 . . . . B 15 TYR HA . 31241 1
125 . 2 . 2 6 6 TYR HB2 H 1 2.884 0.000 . 2 . . . . B 15 TYR HB2 . 31241 1
126 . 2 . 2 6 6 TYR HB3 H 1 2.815 0.000 . 2 . . . . B 15 TYR HB3 . 31241 1
127 . 2 . 2 6 6 TYR HD1 H 1 7.061 0.000 . 3 . . . . B 15 TYR HD1 . 31241 1
128 . 2 . 2 6 6 TYR HD2 H 1 7.061 0.000 . 3 . . . . B 15 TYR HD2 . 31241 1
129 . 2 . 2 6 6 TYR HE1 H 1 6.747 0.000 . 3 . . . . B 15 TYR HE1 . 31241 1
130 . 2 . 2 6 6 TYR HE2 H 1 6.747 0.000 . 3 . . . . B 15 TYR HE2 . 31241 1
131 . 2 . 2 7 7 ARG H H 1 8.906 0.000 . 1 . . . . B 16 ARG H . 31241 1
132 . 2 . 2 7 7 ARG HA H 1 5.557 0.000 . 1 . . . . B 16 ARG HA . 31241 1
133 . 2 . 2 7 7 ARG HB2 H 1 1.813 0.000 . 2 . . . . B 16 ARG HB2 . 31241 1
134 . 2 . 2 7 7 ARG HB3 H 1 1.813 0.000 . 2 . . . . B 16 ARG HB3 . 31241 1
135 . 2 . 2 7 7 ARG HG2 H 1 1.508 0.000 . 2 . . . . B 16 ARG HG2 . 31241 1
136 . 2 . 2 7 7 ARG HG3 H 1 1.449 0.000 . 2 . . . . B 16 ARG HG3 . 31241 1
137 . 2 . 2 7 7 ARG HD2 H 1 2.962 0.000 . 2 . . . . B 16 ARG HD2 . 31241 1
138 . 2 . 2 7 7 ARG HD3 H 1 2.866 0.000 . 2 . . . . B 16 ARG HD3 . 31241 1
139 . 2 . 2 7 7 ARG HE H 1 6.961 0.000 . 1 . . . . B 16 ARG HE . 31241 1
140 . 2 . 2 8 8 A1CCS H1 H 1 1.895 0.000 . 2 . . . . B 17 A1CCS H1 . 31241 1
141 . 2 . 2 8 8 A1CCS H2 H 1 1.547 0.000 . 2 . . . . B 17 A1CCS H2 . 31241 1
142 . 2 . 2 8 8 A1CCS H3 H 1 3.244 0.000 . 1 . . . . B 17 A1CCS H3 . 31241 1
143 . 2 . 2 8 8 A1CCS HA H 1 5.488 0.002 . 1 . . . . B 17 A1CCS HA . 31241 1
144 . 2 . 2 8 8 A1CCS HB3 H 1 2.077 0.000 . 2 . . . . B 17 A1CCS HB3 . 31241 1
145 . 2 . 2 8 8 A1CCS HE H 1 7.329 0.000 . 1 . . . . B 17 A1CCS HE . 31241 1
146 . 2 . 2 8 8 A1CCS HG3 H 1 1.643 0.000 . 2 . . . . B 17 A1CCS HG3 . 31241 1
stop_
save_