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 16550
_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 $chemical_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' . . . 16550 1
2 '2D 1H-1H NOESY' . . . 16550 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 $SPARKY . . 16550 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 VAL HB H 1 2.267 0.002 . 1 . . . . 1 V HB . 16550 1
2 . 1 1 1 1 VAL HG11 H 1 1.081 0.002 . 2 . . . . 1 V HG1 . 16550 1
3 . 1 1 1 1 VAL HG12 H 1 1.081 0.002 . 2 . . . . 1 V HG1 . 16550 1
4 . 1 1 1 1 VAL HG13 H 1 1.081 0.002 . 2 . . . . 1 V HG1 . 16550 1
5 . 1 1 1 1 VAL HG21 H 1 0.976 0.002 . 2 . . . . 1 V HG2 . 16550 1
6 . 1 1 1 1 VAL HG22 H 1 0.976 0.002 . 2 . . . . 1 V HG2 . 16550 1
7 . 1 1 1 1 VAL HG23 H 1 0.976 0.002 . 2 . . . . 1 V HG2 . 16550 1
8 . 1 1 2 2 SER H H 1 8.533 0.002 . 1 . . . . 2 S H . 16550 1
9 . 1 1 2 2 SER HA H 1 4.708 0.002 . 1 . . . . 2 S HA . 16550 1
10 . 1 1 2 2 SER HB3 H 1 3.883 0.002 . 2 . . . . 2 S HB3 . 16550 1
11 . 1 1 3 3 VAL H H 1 8.126 0.011 . 1 . . . . 3 V H . 16550 1
12 . 1 1 3 3 VAL HA H 1 4.266 0.011 . 1 . . . . 3 V HA . 16550 1
13 . 1 1 3 3 VAL HB H 1 2.133 0.001 . 1 . . . . 3 V HB . 16550 1
14 . 1 1 3 3 VAL HG11 H 1 0.98 0.001 . 2 . . . . 3 V HG1 . 16550 1
15 . 1 1 3 3 VAL HG12 H 1 0.98 0.001 . 2 . . . . 3 V HG1 . 16550 1
16 . 1 1 3 3 VAL HG13 H 1 0.98 0.001 . 2 . . . . 3 V HG1 . 16550 1
17 . 1 1 4 4 ASP H H 1 8.289 0.003 . 1 . . . . 4 D H . 16550 1
18 . 1 1 4 4 ASP HA H 1 5.056 0.004 . 1 . . . . 4 D HA . 16550 1
19 . 1 1 4 4 ASP HB2 H 1 2.918 0.005 . 2 . . . . 4 D HB2 . 16550 1
20 . 1 1 4 4 ASP HB3 H 1 3.088 0.001 . 2 . . . . 4 D HB3 . 16550 1
21 . 1 1 5 5 PRO HB2 H 1 2.342 0.004 . 2 . . . . 5 P HB2 . 16550 1
22 . 1 1 5 5 PRO HB3 H 1 2.223 0.006 . 2 . . . . 5 P HB3 . 16550 1
23 . 1 1 5 5 PRO HD2 H 1 3.968 0.002 . 2 . . . . 5 P HD2 . 16550 1
24 . 1 1 5 5 PRO HD3 H 1 3.862 0.004 . 2 . . . . 5 P HD3 . 16550 1
25 . 1 1 5 5 PRO HG2 H 1 1.98 0.005 . 2 . . . . 5 P HG2 . 16550 1
26 . 1 1 5 5 PRO HG3 H 1 1.862 0.006 . 2 . . . . 5 P HG3 . 16550 1
27 . 1 1 6 6 PHE H H 1 7.789 0.013 . 1 . . . . 6 F H . 16550 1
28 . 1 1 6 6 PHE HA H 1 4.373 0.011 . 1 . . . . 6 F HA . 16550 1
29 . 1 1 6 6 PHE HB2 H 1 3.18 0.011 . 2 . . . . 6 F HB2 . 16550 1
30 . 1 1 6 6 PHE HB3 H 1 3.059 0.004 . 2 . . . . 6 F HB3 . 16550 1
31 . 1 1 6 6 PHE HD1 H 1 7.325 0.002 . 1 . . . . 6 F HD1 . 16550 1
32 . 1 1 6 6 PHE HE1 H 1 7.165 0.011 . 1 . . . . 6 F HE1 . 16550 1
33 . 1 1 6 6 PHE HZ H 1 6.944 0.002 . 1 . . . . 6 F HZ . 16550 1
34 . 1 1 7 7 TYR H H 1 7.568 0.016 . 1 . . . . 7 Y H . 16550 1
35 . 1 1 7 7 TYR HA H 1 4.2 0.012 . 1 . . . . 7 Y HA . 16550 1
36 . 1 1 7 7 TYR HB2 H 1 3.19 0.008 . 2 . . . . 7 Y HB2 . 16550 1
37 . 1 1 7 7 TYR HB3 H 1 3.139 0.003 . 2 . . . . 7 Y HB3 . 16550 1
38 . 1 1 7 7 TYR HD1 H 1 7.189 0.013 . 1 . . . . 7 Y HD1 . 16550 1
39 . 1 1 7 7 TYR HE1 H 1 6.94 0.003 . 1 . . . . 7 Y HE1 . 16550 1
40 . 1 1 8 8 GLU H H 1 7.979 0.015 . 1 . . . . 8 E H . 16550 1
41 . 1 1 8 8 GLU HA H 1 4.085 0.016 . 1 . . . . 8 E HA . 16550 1
42 . 1 1 8 8 GLU HB2 H 1 2.23 0.002 . 2 . . . . 8 E HB2 . 16550 1
43 . 1 1 8 8 GLU HG2 H 1 2.558 0.001 . 2 . . . . 8 E HG2 . 16550 1
44 . 1 1 9 9 MET H H 1 8.09 0.002 . 1 . . . . 9 M H . 16550 1
45 . 1 1 9 9 MET HA H 1 4.184 0.011 . 1 . . . . 9 M HA . 16550 1
46 . 1 1 9 9 MET HB2 H 1 2.246 0.009 . 2 . . . . 9 M HB2 . 16550 1
47 . 1 1 9 9 MET HB3 H 1 2.168 0.016 . 2 . . . . 9 M HB3 . 16550 1
48 . 1 1 9 9 MET HG2 H 1 2.744 0.002 . 2 . . . . 9 M HG2 . 16550 1
49 . 1 1 9 9 MET HG3 H 1 2.559 0.004 . 2 . . . . 9 M HG3 . 16550 1
50 . 1 1 10 10 LEU H H 1 8.035 0.007 . 1 . . . . 10 L H . 16550 1
51 . 1 1 10 10 LEU HA H 1 4.017 0.002 . 1 . . . . 10 L HA . 16550 1
52 . 1 1 10 10 LEU HB2 H 1 1.713 0.005 . 2 . . . . 10 L HB2 . 16550 1
53 . 1 1 10 10 LEU HD11 H 1 0.868 0.007 . 1 . . . . 10 L HD1 . 16550 1
54 . 1 1 10 10 LEU HD12 H 1 0.868 0.007 . 1 . . . . 10 L HD1 . 16550 1
55 . 1 1 10 10 LEU HD13 H 1 0.868 0.007 . 1 . . . . 10 L HD1 . 16550 1
56 . 1 1 10 10 LEU HG H 1 1.584 0.002 . 1 . . . . 10 L HG . 16550 1
57 . 1 1 11 11 ALA H H 1 8.323 0.001 . 1 . . . . 11 A H . 16550 1
58 . 1 1 11 11 ALA HA H 1 4.008 0.015 . 1 . . . . 11 A HA . 16550 1
59 . 1 1 11 11 ALA HB1 H 1 1.436 0.002 . 1 . . . . 11 A HB . 16550 1
60 . 1 1 11 11 ALA HB2 H 1 1.436 0.002 . 1 . . . . 11 A HB . 16550 1
61 . 1 1 11 11 ALA HB3 H 1 1.436 0.002 . 1 . . . . 11 A HB . 16550 1
62 . 1 1 12 12 ALA H H 1 8.149 0.002 . 1 . . . . 12 A H . 16550 1
63 . 1 1 12 12 ALA HA H 1 4.141 0.016 . 1 . . . . 12 A HA . 16550 1
64 . 1 1 12 12 ALA HB1 H 1 1.591 0.001 . 1 . . . . 12 A HB . 16550 1
65 . 1 1 12 12 ALA HB2 H 1 1.591 0.001 . 1 . . . . 12 A HB . 16550 1
66 . 1 1 12 12 ALA HB3 H 1 1.591 0.001 . 1 . . . . 12 A HB . 16550 1
67 . 1 1 13 13 ARG H H 1 8.137 0.005 . 1 . . . . 13 R H . 16550 1
68 . 1 1 13 13 ARG HA H 1 4.024 0.011 . 1 . . . . 13 R HA . 16550 1
69 . 1 1 13 13 ARG HB2 H 1 2.037 0.003 . 2 . . . . 13 R HB2 . 16550 1
70 . 1 1 13 13 ARG HB3 H 1 1.898 0.002 . 2 . . . . 13 R HB3 . 16550 1
71 . 1 1 13 13 ARG HD2 H 1 3.187 0.001 . 2 . . . . 13 R HD2 . 16550 1
72 . 1 1 13 13 ARG HG2 H 1 1.699 0.001 . 2 . . . . 13 R HG2 . 16550 1
73 . 1 1 13 13 ARG HH11 H 1 7.181 0.010 . 2 . . . . 13 R HH11 . 16550 1
74 . 1 1 14 14 LYS H H 1 8.384 0.006 . 1 . . . . 14 K H . 16550 1
75 . 1 1 14 14 LYS HA H 1 4.031 0.023 . 1 . . . . 14 K HA . 16550 1
76 . 1 1 14 14 LYS HB2 H 1 1.694 0.006 . 2 . . . . 14 K HB2 . 16550 1
77 . 1 1 14 14 LYS HD2 H 1 1.618 0.002 . 2 . . . . 14 K HD2 . 16550 1
78 . 1 1 14 14 LYS HE2 H 1 2.966 0.002 . 2 . . . . 14 K HE2 . 16550 1
79 . 1 1 14 14 LYS HG2 H 1 1.434 0.002 . 2 . . . . 14 K HG2 . 16550 1
80 . 1 1 15 15 LYS H H 1 8.248 0.008 . 1 . . . . 15 K H . 16550 1
81 . 1 1 15 15 LYS HA H 1 4.096 0.006 . 1 . . . . 15 K HA . 16550 1
82 . 1 1 15 15 LYS HB2 H 1 2.027 0.009 . 2 . . . . 15 K HB2 . 16550 1
83 . 1 1 15 15 LYS HB3 H 1 1.889 0.002 . 2 . . . . 15 K HB3 . 16550 1
84 . 1 1 15 15 LYS HD2 H 1 1.728 0.001 . 2 . . . . 15 K HD2 . 16550 1
85 . 1 1 15 15 LYS HD3 H 1 1.591 0.002 . 2 . . . . 15 K HD3 . 16550 1
86 . 1 1 15 15 LYS HE2 H 1 2.96 0.003 . 2 . . . . 15 K HE2 . 16550 1
87 . 1 1 15 15 LYS HG2 H 1 1.488 0.002 . 2 . . . . 15 K HG2 . 16550 1
88 . 1 1 15 15 LYS HG3 H 1 1.432 0.002 . 2 . . . . 15 K HG3 . 16550 1
89 . 1 1 16 16 ARG H H 1 8.089 0.009 . 1 . . . . 16 R H . 16550 1
90 . 1 1 16 16 ARG HA H 1 4.074 0.015 . 1 . . . . 16 R HA . 16550 1
91 . 1 1 16 16 ARG HB2 H 1 2.031 0.002 . 2 . . . . 16 R HB2 . 16550 1
92 . 1 1 16 16 ARG HB3 H 1 1.892 0.005 . 2 . . . . 16 R HB3 . 16550 1
93 . 1 1 16 16 ARG HD2 H 1 3.222 0.006 . 2 . . . . 16 R HD2 . 16550 1
94 . 1 1 16 16 ARG HG2 H 1 1.794 0.005 . 2 . . . . 16 R HG2 . 16550 1
95 . 1 1 16 16 ARG HG3 H 1 1.716 0.002 . 2 . . . . 16 R HG3 . 16550 1
96 . 1 1 16 16 ARG HH11 H 1 7.305 0.001 . 2 . . . . 16 R HH11 . 16550 1
97 . 1 1 17 17 ILE H H 1 8.363 0.005 . 1 . . . . 17 I H . 16550 1
98 . 1 1 17 17 ILE HA H 1 3.868 0.014 . 1 . . . . 17 I HA . 16550 1
99 . 1 1 17 17 ILE HB H 1 2 0.013 . 1 . . . . 17 I HB . 16550 1
100 . 1 1 17 17 ILE HD11 H 1 0.892 0.002 . 1 . . . . 17 I HD1 . 16550 1
101 . 1 1 17 17 ILE HD12 H 1 0.892 0.002 . 1 . . . . 17 I HD1 . 16550 1
102 . 1 1 17 17 ILE HD13 H 1 0.892 0.002 . 1 . . . . 17 I HD1 . 16550 1
103 . 1 1 17 17 ILE HG12 H 1 1.227 0.001 . 2 . . . . 17 I HG12 . 16550 1
104 . 1 1 17 17 ILE HG21 H 1 0.985 0.002 . 1 . . . . 17 I HG2 . 16550 1
105 . 1 1 17 17 ILE HG22 H 1 0.985 0.002 . 1 . . . . 17 I HG2 . 16550 1
106 . 1 1 17 17 ILE HG23 H 1 0.985 0.002 . 1 . . . . 17 I HG2 . 16550 1
107 . 1 1 18 18 SER H H 1 7.996 0.008 . 1 . . . . 18 S H . 16550 1
108 . 1 1 18 18 SER HA H 1 4.393 0.007 . 1 . . . . 18 S HA . 16550 1
109 . 1 1 18 18 SER HB2 H 1 3.858 0.002 . 2 . . . . 18 S HB2 . 16550 1
110 . 1 1 19 19 VAL H H 1 8.001 0.002 . 1 . . . . 19 V H . 16550 1
111 . 1 1 19 19 VAL HA H 1 3.867 0.004 . 1 . . . . 19 V HA . 16550 1
112 . 1 1 19 19 VAL HB H 1 2.232 0.004 . 1 . . . . 19 V HB . 16550 1
113 . 1 1 19 19 VAL HG11 H 1 1.108 0.002 . 2 . . . . 19 V HG1 . 16550 1
114 . 1 1 19 19 VAL HG12 H 1 1.108 0.002 . 2 . . . . 19 V HG1 . 16550 1
115 . 1 1 19 19 VAL HG13 H 1 1.108 0.002 . 2 . . . . 19 V HG1 . 16550 1
116 . 1 1 19 19 VAL HG21 H 1 0.993 0.003 . 2 . . . . 19 V HG2 . 16550 1
117 . 1 1 19 19 VAL HG22 H 1 0.993 0.003 . 2 . . . . 19 V HG2 . 16550 1
118 . 1 1 19 19 VAL HG23 H 1 0.993 0.003 . 2 . . . . 19 V HG2 . 16550 1
119 . 1 1 20 20 LYS H H 1 8.407 0.001 . 1 . . . . 20 K H . 16550 1
120 . 1 1 20 20 LYS HA H 1 4.176 0.013 . 1 . . . . 20 K HA . 16550 1
121 . 1 1 20 20 LYS HB2 H 1 1.946 0.01 . 2 . . . . 20 K HB2 . 16550 1
122 . 1 1 20 20 LYS HB3 H 1 1.735 0.003 . 2 . . . . 20 K HB3 . 16550 1
123 . 1 1 20 20 LYS HD2 H 1 1.621 0.002 . 2 . . . . 20 K HD2 . 16550 1
124 . 1 1 20 20 LYS HE2 H 1 3.011 0.004 . 2 . . . . 20 K HE2 . 16550 1
125 . 1 1 20 20 LYS HG2 H 1 1.537 0.003 . 2 . . . . 20 K HG2 . 16550 1
126 . 1 1 21 21 LYS H H 1 8.054 0.007 . 1 . . . . 21 K H . 16550 1
127 . 1 1 21 21 LYS HA H 1 4.244 0.011 . 1 . . . . 21 K HA . 16550 1
128 . 1 1 21 21 LYS HB2 H 1 2.019 0.004 . 2 . . . . 21 K HB2 . 16550 1
129 . 1 1 21 21 LYS HB3 H 1 1.967 0.003 . 2 . . . . 21 K HB3 . 16550 1
130 . 1 1 21 21 LYS HD2 H 1 1.785 0.002 . 2 . . . . 21 K HD2 . 16550 1
131 . 1 1 21 21 LYS HE2 H 1 3.03 0.002 . 2 . . . . 21 K HE2 . 16550 1
132 . 1 1 21 21 LYS HG2 H 1 1.559 0.002 . 2 . . . . 21 K HG2 . 16550 1
133 . 1 1 22 22 LYS H H 1 7.99 0.015 . 1 . . . . 22 K H . 16550 1
134 . 1 1 22 22 LYS HA H 1 4.282 0.014 . 1 . . . . 22 K HA . 16550 1
135 . 1 1 22 22 LYS HB2 H 1 1.978 0.003 . 2 . . . . 22 K HB2 . 16550 1
136 . 1 1 22 22 LYS HD2 H 1 1.777 0.002 . 2 . . . . 22 K HD2 . 16550 1
137 . 1 1 22 22 LYS HE2 H 1 3.067 0.011 . 2 . . . . 22 K HE2 . 16550 1
138 . 1 1 22 22 LYS HG2 H 1 1.581 0.002 . 2 . . . . 22 K HG2 . 16550 1
139 . 1 1 23 23 GLN H H 1 8.206 0.007 . 1 . . . . 23 Q H . 16550 1
140 . 1 1 23 23 GLN HA H 1 4.298 0.016 . 1 . . . . 23 Q HA . 16550 1
141 . 1 1 23 23 GLN HB2 H 1 2.226 0.002 . 2 . . . . 23 Q HB2 . 16550 1
142 . 1 1 23 23 GLN HE21 H 1 7.337 0.002 . 2 . . . . 23 Q HE21 . 16550 1
143 . 1 1 23 23 GLN HE22 H 1 6.668 0.001 . 2 . . . . 23 Q HE22 . 16550 1
144 . 1 1 23 23 GLN HG2 H 1 2.605 0.004 . 2 . . . . 23 Q HG2 . 16550 1
145 . 1 1 23 23 GLN HG3 H 1 2.454 0.003 . 2 . . . . 23 Q HG3 . 16550 1
146 . 1 1 24 24 GLU H H 1 8.008 0.002 . 1 . . . . 24 E H . 16550 1
147 . 1 1 24 24 GLU HA H 1 4.402 0.007 . 1 . . . . 24 E HA . 16550 1
148 . 1 1 24 24 GLU HB2 H 1 2.231 0.004 . 2 . . . . 24 E HB2 . 16550 1
149 . 1 1 24 24 GLU HB3 H 1 2.119 0.008 . 2 . . . . 24 E HB3 . 16550 1
150 . 1 1 24 24 GLU HG2 H 1 2.63 0.002 . 2 . . . . 24 E HG2 . 16550 1
151 . 1 1 24 24 GLU HG3 H 1 2.563 0.002 . 2 . . . . 24 E HG3 . 16550 1
152 . 1 1 25 25 GLN H H 1 8.001 0.016 . 1 . . . . 25 Q H . 16550 1
153 . 1 1 25 25 GLN HA H 1 4.727 0.002 . 1 . . . . 25 Q HA . 16550 1
154 . 1 1 25 25 GLN HB2 H 1 2.203 0.001 . 2 . . . . 25 Q HB2 . 16550 1
155 . 1 1 25 25 GLN HB3 H 1 2.085 0.002 . 2 . . . . 25 Q HB3 . 16550 1
156 . 1 1 25 25 GLN HG2 H 1 2.497 0.002 . 2 . . . . 25 Q HG2 . 16550 1
stop_
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