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 34380
_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 TOCSY . . . 34380 1
2 COSY . . . 34380 1
3 NOESY . . . 34380 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 . . 34380 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 PRO HA H 1 4.349 0.002 . 1 . . . . A 1 PRO HA . 34380 1
2 . 1 . 1 1 1 PRO HB2 H 1 2.221 0.002 . 2 . . . . A 1 PRO HB2 . 34380 1
3 . 1 . 1 1 1 PRO HB3 H 1 1.903 0.005 . 2 . . . . A 1 PRO HB3 . 34380 1
4 . 1 . 1 1 1 PRO HG2 H 1 1.963 0.004 . 1 . . . . A 1 PRO HG2 . 34380 1
5 . 1 . 1 1 1 PRO HD2 H 1 3.755 0.004 . 2 . . . . A 1 PRO HD2 . 34380 1
6 . 1 . 1 1 1 PRO HD3 H 1 3.621 0.002 . 2 . . . . A 1 PRO HD3 . 34380 1
7 . 1 . 1 2 2 SER HA H 1 4.457 0.005 . 1 . . . . A 2 SER HA . 34380 1
8 . 1 . 1 2 2 SER HB2 H 1 3.721 0.003 . 2 . . . . A 2 SER HB2 . 34380 1
9 . 1 . 1 2 2 SER HB3 H 1 3.747 0.003 . 2 . . . . A 2 SER HB3 . 34380 1
10 . 1 . 1 3 3 ILE H H 1 8.238 0.001 . 1 . . . . A 3 ILE H . 34380 1
11 . 1 . 1 3 3 ILE HA H 1 4.120 0.002 . 1 . . . . A 3 ILE HA . 34380 1
12 . 1 . 1 3 3 ILE HB H 1 1.699 0.004 . 1 . . . . A 3 ILE HB . 34380 1
13 . 1 . 1 3 3 ILE HG12 H 1 1.304 0.002 . 2 . . . . A 3 ILE HG12 . 34380 1
14 . 1 . 1 3 3 ILE HG13 H 1 1.045 0.003 . 2 . . . . A 3 ILE HG13 . 34380 1
15 . 1 . 1 3 3 ILE HG21 H 1 0.707 0.003 . 1 . . . . A 3 ILE HG21 . 34380 1
16 . 1 . 1 3 3 ILE HG22 H 1 0.707 0.003 . 1 . . . . A 3 ILE HG22 . 34380 1
17 . 1 . 1 3 3 ILE HG23 H 1 0.707 0.003 . 1 . . . . A 3 ILE HG23 . 34380 1
18 . 1 . 1 3 3 ILE HD11 H 1 0.734 0.004 . 1 . . . . A 3 ILE HD11 . 34380 1
19 . 1 . 1 3 3 ILE HD12 H 1 0.734 0.004 . 1 . . . . A 3 ILE HD12 . 34380 1
20 . 1 . 1 3 3 ILE HD13 H 1 0.734 0.004 . 1 . . . . A 3 ILE HD13 . 34380 1
21 . 1 . 1 4 4 HCS H H 1 8.295 0.002 . 1 . . . . A 4 HCS H . 34380 1
22 . 1 . 1 4 4 HCS HB2 H 1 1.912 0.002 . 2 . . . . A 4 HCS HB2 . 34380 1
23 . 1 . 1 4 4 HCS HB3 H 1 1.963 0.004 . 2 . . . . A 4 HCS HB3 . 34380 1
24 . 1 . 1 4 4 HCS HCA H 1 4.404 0.001 . 1 . . . . A 4 HCS HCA . 34380 1
25 . 1 . 1 4 4 HCS HG2 H 1 2.485 0.005 . 2 . . . . A 4 HCS HG2 . 34380 1
26 . 1 . 1 4 4 HCS HG3 H 1 2.642 0.004 . 2 . . . . A 4 HCS HG3 . 34380 1
27 . 1 . 1 5 5 HIS H H 1 7.783 0.002 . 1 . . . . A 5 HIS H . 34380 1
28 . 1 . 1 5 5 HIS HA H 1 4.541 0.004 . 1 . . . . A 5 HIS HA . 34380 1
29 . 1 . 1 5 5 HIS HB2 H 1 2.921 0.002 . 2 . . . . A 5 HIS HB2 . 34380 1
30 . 1 . 1 5 5 HIS HB3 H 1 2.948 0.003 . 2 . . . . A 5 HIS HB3 . 34380 1
31 . 1 . 1 5 5 HIS HD2 H 1 6.857 0.002 . 1 . . . . A 5 HIS HD2 . 34380 1
32 . 1 . 1 5 5 HIS HE1 H 1 7.784 0.001 . 1 . . . . A 5 HIS HE1 . 34380 1
33 . 1 . 1 6 6 VAL H H 1 7.980 0.000 . 1 . . . . A 6 VAL H . 34380 1
34 . 1 . 1 6 6 VAL HA H 1 3.903 0.002 . 1 . . . . A 6 VAL HA . 34380 1
35 . 1 . 1 6 6 VAL HB H 1 1.868 0.003 . 1 . . . . A 6 VAL HB . 34380 1
36 . 1 . 1 6 6 VAL HG11 H 1 0.732 0.005 . 2 . . . . A 6 VAL HG11 . 34380 1
37 . 1 . 1 6 6 VAL HG12 H 1 0.732 0.005 . 2 . . . . A 6 VAL HG12 . 34380 1
38 . 1 . 1 6 6 VAL HG13 H 1 0.732 0.005 . 2 . . . . A 6 VAL HG13 . 34380 1
39 . 1 . 1 6 6 VAL HG21 H 1 0.699 0.003 . 2 . . . . A 6 VAL HG21 . 34380 1
40 . 1 . 1 6 6 VAL HG22 H 1 0.699 0.003 . 2 . . . . A 6 VAL HG22 . 34380 1
41 . 1 . 1 6 6 VAL HG23 H 1 0.699 0.003 . 2 . . . . A 6 VAL HG23 . 34380 1
42 . 1 . 1 7 7 HIS H H 1 8.530 0.001 . 1 . . . . A 7 HIS H . 34380 1
43 . 1 . 1 7 7 HIS HA H 1 4.524 0.002 . 1 . . . . A 7 HIS HA . 34380 1
44 . 1 . 1 7 7 HIS HB2 H 1 3.008 0.006 . 2 . . . . A 7 HIS HB2 . 34380 1
45 . 1 . 1 7 7 HIS HB3 H 1 2.959 0.004 . 2 . . . . A 7 HIS HB3 . 34380 1
46 . 1 . 1 7 7 HIS HD2 H 1 6.853 0.004 . 1 . . . . A 7 HIS HD2 . 34380 1
47 . 1 . 1 7 7 HIS HE1 H 1 7.737 0.002 . 1 . . . . A 7 HIS HE1 . 34380 1
48 . 1 . 1 8 8 ARG H H 1 7.737 0.001 . 1 . . . . A 8 ARG H . 34380 1
49 . 1 . 1 8 8 ARG HA H 1 4.534 0.002 . 1 . . . . A 8 ARG HA . 34380 1
50 . 1 . 1 8 8 ARG HB2 H 1 1.487 0.004 . 2 . . . . A 8 ARG HB2 . 34380 1
51 . 1 . 1 8 8 ARG HB3 H 1 1.324 0.005 . 2 . . . . A 8 ARG HB3 . 34380 1
52 . 1 . 1 8 8 ARG HG2 H 1 0.988 0.004 . 2 . . . . A 8 ARG HG2 . 34380 1
53 . 1 . 1 8 8 ARG HG3 H 1 1.112 0.005 . 2 . . . . A 8 ARG HG3 . 34380 1
54 . 1 . 1 8 8 ARG HD2 H 1 2.492 0.004 . 2 . . . . A 8 ARG HD2 . 34380 1
55 . 1 . 1 8 8 ARG HD3 H 1 2.645 0.006 . 2 . . . . A 8 ARG HD3 . 34380 1
56 . 1 . 1 8 8 ARG HE H 1 7.410 0.003 . 1 . . . . A 8 ARG HE . 34380 1
57 . 1 . 1 9 9 PRO HA H 1 4.178 0.003 . 1 . . . . A 9 PRO HA . 34380 1
58 . 1 . 1 9 9 PRO HB2 H 1 2.138 0.002 . 2 . . . . A 9 PRO HB2 . 34380 1
59 . 1 . 1 9 9 PRO HB3 H 1 1.836 0.004 . 2 . . . . A 9 PRO HB3 . 34380 1
60 . 1 . 1 9 9 PRO HG2 H 1 1.865 0.003 . 1 . . . . A 9 PRO HG2 . 34380 1
61 . 1 . 1 9 9 PRO HD2 H 1 3.542 0.003 . 2 . . . . A 9 PRO HD2 . 34380 1
62 . 1 . 1 9 9 PRO HD3 H 1 3.484 0.006 . 2 . . . . A 9 PRO HD3 . 34380 1
63 . 1 . 1 10 10 ASP H H 1 8.607 0.001 . 1 . . . . A 10 ASP H . 34380 1
64 . 1 . 1 10 10 ASP HA H 1 4.387 0.004 . 1 . . . . A 10 ASP HA . 34380 1
65 . 1 . 1 10 10 ASP HB2 H 1 2.671 0.002 . 2 . . . . A 10 ASP HB2 . 34380 1
66 . 1 . 1 10 10 ASP HB3 H 1 2.532 0.001 . 2 . . . . A 10 ASP HB3 . 34380 1
67 . 1 . 1 11 11 TRP H H 1 7.672 0.001 . 1 . . . . A 11 TRP H . 34380 1
68 . 1 . 1 11 11 TRP HA H 1 4.914 0.002 . 1 . . . . A 11 TRP HA . 34380 1
69 . 1 . 1 11 11 TRP HB2 H 1 2.991 0.009 . 2 . . . . A 11 TRP HB2 . 34380 1
70 . 1 . 1 11 11 TRP HB3 H 1 3.108 0.006 . 2 . . . . A 11 TRP HB3 . 34380 1
71 . 1 . 1 11 11 TRP HD1 H 1 6.951 0.001 . 1 . . . . A 11 TRP HD1 . 34380 1
72 . 1 . 1 11 11 TRP HE1 H 1 9.831 0.001 . 1 . . . . A 11 TRP HE1 . 34380 1
73 . 1 . 1 11 11 TRP HE3 H 1 7.342 0.003 . 1 . . . . A 11 TRP HE3 . 34380 1
74 . 1 . 1 11 11 TRP HZ2 H 1 7.322 0.003 . 1 . . . . A 11 TRP HZ2 . 34380 1
75 . 1 . 1 11 11 TRP HZ3 H 1 6.951 0.001 . 1 . . . . A 11 TRP HZ3 . 34380 1
76 . 1 . 1 11 11 TRP HH2 H 1 7.089 0.002 . 1 . . . . A 11 TRP HH2 . 34380 1
77 . 1 . 1 12 12 PRO HA H 1 4.252 0.002 . 1 . . . . A 12 PRO HA . 34380 1
78 . 1 . 1 12 12 PRO HB2 H 1 1.828 0.004 . 2 . . . . A 12 PRO HB2 . 34380 1
79 . 1 . 1 12 12 PRO HB3 H 1 1.170 0.004 . 2 . . . . A 12 PRO HB3 . 34380 1
80 . 1 . 1 12 12 PRO HG2 H 1 1.505 0.004 . 2 . . . . A 12 PRO HG2 . 34380 1
81 . 1 . 1 12 12 PRO HG3 H 1 1.645 0.004 . 2 . . . . A 12 PRO HG3 . 34380 1
82 . 1 . 1 12 12 PRO HD2 H 1 3.025 0.004 . 2 . . . . A 12 PRO HD2 . 34380 1
83 . 1 . 1 12 12 PRO HD3 H 1 3.454 0.002 . 2 . . . . A 12 PRO HD3 . 34380 1
84 . 1 . 1 13 13 CYS H H 1 8.519 0.001 . 1 . . . . A 13 CYS H . 34380 1
85 . 1 . 1 13 13 CYS HA H 1 4.478 0.003 . 1 . . . . A 13 CYS HA . 34380 1
86 . 1 . 1 13 13 CYS HB2 H 1 2.859 0.002 . 1 . . . . A 13 CYS HB2 . 34380 1
87 . 1 . 1 13 13 CYS HB3 H 1 2.859 0.002 . 1 . . . . A 13 CYS HB3 . 34380 1
88 . 1 . 1 14 14 TRP H H 1 7.729 0.002 . 1 . . . . A 14 TRP H . 34380 1
89 . 1 . 1 14 14 TRP HA H 1 4.627 0.002 . 1 . . . . A 14 TRP HA . 34380 1
90 . 1 . 1 14 14 TRP HB2 H 1 3.138 0.004 . 2 . . . . A 14 TRP HB2 . 34380 1
91 . 1 . 1 14 14 TRP HB3 H 1 3.225 0.004 . 2 . . . . A 14 TRP HB3 . 34380 1
92 . 1 . 1 14 14 TRP HD1 H 1 7.108 0.003 . 1 . . . . A 14 TRP HD1 . 34380 1
93 . 1 . 1 14 14 TRP HE1 H 1 10.117 0.001 . 1 . . . . A 14 TRP HE1 . 34380 1
94 . 1 . 1 14 14 TRP HE3 H 1 7.442 0.002 . 1 . . . . A 14 TRP HE3 . 34380 1
95 . 1 . 1 14 14 TRP HZ2 H 1 7.350 0.003 . 1 . . . . A 14 TRP HZ2 . 34380 1
96 . 1 . 1 14 14 TRP HZ3 H 1 7.027 0.002 . 1 . . . . A 14 TRP HZ3 . 34380 1
97 . 1 . 1 14 14 TRP HH2 H 1 7.088 0.002 . 1 . . . . A 14 TRP HH2 . 34380 1
98 . 1 . 1 15 15 TYR H H 1 7.634 0.002 . 1 . . . . A 15 TYR H . 34380 1
99 . 1 . 1 15 15 TYR HA H 1 4.351 0.002 . 1 . . . . A 15 TYR HA . 34380 1
100 . 1 . 1 15 15 TYR HB2 H 1 2.538 0.005 . 2 . . . . A 15 TYR HB2 . 34380 1
101 . 1 . 1 15 15 TYR HB3 H 1 2.654 0.004 . 2 . . . . A 15 TYR HB3 . 34380 1
102 . 1 . 1 15 15 TYR HD1 H 1 6.714 0.003 . 1 . . . . A 15 TYR HD1 . 34380 1
103 . 1 . 1 15 15 TYR HD2 H 1 6.714 0.003 . 1 . . . . A 15 TYR HD2 . 34380 1
104 . 1 . 1 15 15 TYR HE1 H 1 6.538 0.002 . 1 . . . . A 15 TYR HE1 . 34380 1
105 . 1 . 1 15 15 TYR HE2 H 1 6.538 0.002 . 1 . . . . A 15 TYR HE2 . 34380 1
106 . 1 . 1 16 16 ARG H H 1 7.957 0.002 . 1 . . . . A 16 ARG H . 34380 1
107 . 1 . 1 16 16 ARG HA H 1 4.048 0.002 . 1 . . . . A 16 ARG HA . 34380 1
108 . 1 . 1 16 16 ARG HB2 H 1 1.659 0.002 . 2 . . . . A 16 ARG HB2 . 34380 1
109 . 1 . 1 16 16 ARG HB3 H 1 1.466 0.003 . 2 . . . . A 16 ARG HB3 . 34380 1
110 . 1 . 1 16 16 ARG HG2 H 1 1.371 0.010 . 2 . . . . A 16 ARG HG2 . 34380 1
111 . 1 . 1 16 16 ARG HG3 H 1 1.394 0.002 . 2 . . . . A 16 ARG HG3 . 34380 1
112 . 1 . 1 16 16 ARG HD2 H 1 2.987 0.001 . 1 . . . . A 16 ARG HD2 . 34380 1
stop_
save_