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 15957
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $2_mM_in_H2O_at_pH_3.3_-_200_eq._DPC
_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' . . . 15957 1
2 '2D DQF-COSY' . . . 15957 1
3 '2D 1H-1H NOESY' . . . 15957 1
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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 $X-PLOR_NIH_2.16 . . 15957 1
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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 ASP HA H 1 4.345 0.002 . . . . . . 32 D HA . 15957 1
2 . 1 1 1 1 ASP HB2 H 1 2.94 0.044 . . . . . . 32 D HB2 . 15957 1
3 . 1 1 1 1 ASP HB3 H 1 2.89 0.044 . . . . . . 32 D HB3 . 15957 1
4 . 1 1 2 2 LYS H H 1 8.943 0.001 . . . . . . 33 K HN . 15957 1
5 . 1 1 2 2 LYS HA H 1 4.329 0.004 . . . . . . 33 K HA . 15957 1
6 . 1 1 2 2 LYS HB2 H 1 1.852 0.003 . . . . . . 33 K HB* . 15957 1
7 . 1 1 2 2 LYS HB3 H 1 1.852 0.003 . . . . . . 33 K HB* . 15957 1
8 . 1 1 2 2 LYS HD2 H 1 1.741 0.001 . . . . . . 33 K HD* . 15957 1
9 . 1 1 2 2 LYS HD3 H 1 1.741 0.001 . . . . . . 33 K HD* . 15957 1
10 . 1 1 2 2 LYS HE2 H 1 3.037 0.002 . . . . . . 33 K HE* . 15957 1
11 . 1 1 2 2 LYS HE3 H 1 3.037 0.002 . . . . . . 33 K HE* . 15957 1
12 . 1 1 2 2 LYS HG2 H 1 1.494 0.001 . . . . . . 33 K HG* . 15957 1
13 . 1 1 2 2 LYS HG3 H 1 1.494 0.001 . . . . . . 33 K HG* . 15957 1
14 . 1 1 2 2 LYS HZ1 H 1 7.724 0 . . . . . . 33 K HZ* . 15957 1
15 . 1 1 2 2 LYS HZ2 H 1 7.724 0 . . . . . . 33 K HZ* . 15957 1
16 . 1 1 2 2 LYS HZ3 H 1 7.724 0 . . . . . . 33 K HZ* . 15957 1
17 . 1 1 3 3 GLU H H 1 8.549 0.002 . . . . . . 34 E HN . 15957 1
18 . 1 1 3 3 GLU HA H 1 4.352 0.004 . . . . . . 34 E HA . 15957 1
19 . 1 1 3 3 GLU HB2 H 1 2.043 0.003 . . . . . . 34 E HB* . 15957 1
20 . 1 1 3 3 GLU HB3 H 1 2.043 0.003 . . . . . . 34 E HB* . 15957 1
21 . 1 1 3 3 GLU HG2 H 1 2.438 0.002 . . . . . . 34 E HG* . 15957 1
22 . 1 1 3 3 GLU HG3 H 1 2.438 0.002 . . . . . . 34 E HG* . 15957 1
23 . 1 1 4 4 LEU H H 1 8.406 0.001 . . . . . . 35 L HN . 15957 1
24 . 1 1 4 4 LEU HA H 1 4.188 0.24 . . . . . . 35 L HA . 15957 1
25 . 1 1 4 4 LEU HB2 H 1 1.643 0.002 . . . . . . 35 L HB* . 15957 1
26 . 1 1 4 4 LEU HB3 H 1 1.643 0.002 . . . . . . 35 L HB* . 15957 1
27 . 1 1 4 4 LEU HD11 H 1 0.985 0.004 . . . . . . 35 L HD1* . 15957 1
28 . 1 1 4 4 LEU HD12 H 1 0.985 0.004 . . . . . . 35 L HD1* . 15957 1
29 . 1 1 4 4 LEU HD13 H 1 0.985 0.004 . . . . . . 35 L HD1* . 15957 1
30 . 1 1 4 4 LEU HD21 H 1 0.912 0.001 . . . . . . 35 L HD2* . 15957 1
31 . 1 1 4 4 LEU HD22 H 1 0.912 0.001 . . . . . . 35 L HD2* . 15957 1
32 . 1 1 4 4 LEU HD23 H 1 0.912 0.001 . . . . . . 35 L HD2* . 15957 1
33 . 1 1 4 4 LEU HG H 1 1.493 0.002 . . . . . . 35 L HG . 15957 1
34 . 1 1 5 5 TYR H H 1 8.151 0.002 . . . . . . 36 Y HN . 15957 1
35 . 1 1 5 5 TYR HA H 1 4.828 0.002 . . . . . . 36 Y HA . 15957 1
36 . 1 1 5 5 TYR HB2 H 1 3.099 0.003 . . . . . . 36 Y HB2 . 15957 1
37 . 1 1 5 5 TYR HB3 H 1 3.01 0.006 . . . . . . 36 Y HB3 . 15957 1
38 . 1 1 5 5 TYR HD1 H 1 7.171 0.003 . . . . . . 36 Y HD* . 15957 1
39 . 1 1 5 5 TYR HD2 H 1 7.171 0.003 . . . . . . 36 Y HD* . 15957 1
40 . 1 1 5 5 TYR HE1 H 1 6.856 0.003 . . . . . . 36 Y HE* . 15957 1
41 . 1 1 5 5 TYR HE2 H 1 6.856 0.003 . . . . . . 36 Y HE* . 15957 1
42 . 1 1 6 6 PRO HA H 1 4.579 0.003 . . . . . . 37 P HA . 15957 1
43 . 1 1 6 6 PRO HB2 H 1 2.295 0.002 . . . . . . 37 P HB* . 15957 1
44 . 1 1 6 6 PRO HB3 H 1 2.295 0.002 . . . . . . 37 P HB* . 15957 1
45 . 1 1 6 6 PRO HD2 H 1 3.834 0.137 . . . . . . 37 P HD2 . 15957 1
46 . 1 1 6 6 PRO HD3 H 1 3.686 0.179 . . . . . . 37 P HD3 . 15957 1
47 . 1 1 6 6 PRO HG2 H 1 2.067 0.003 . . . . . . 37 P HG* . 15957 1
48 . 1 1 6 6 PRO HG3 H 1 2.067 0.003 . . . . . . 37 P HG* . 15957 1
49 . 1 1 7 7 LEU H H 1 8.456 0.002 . . . . . . 38 L HN . 15957 1
50 . 1 1 7 7 LEU HA H 1 4.185 0.005 . . . . . . 38 L HA . 15957 1
51 . 1 1 7 7 LEU HB2 H 1 1.885 0.033 . . . . . . 38 L HB1 . 15957 1
52 . 1 1 7 7 LEU HB3 H 1 1.835 0.033 . . . . . . 38 L HB2 . 15957 1
53 . 1 1 7 7 LEU HD11 H 1 1.067 0.003 . . . . . . 38 L HD1* . 15957 1
54 . 1 1 7 7 LEU HD12 H 1 1.067 0.003 . . . . . . 38 L HD1* . 15957 1
55 . 1 1 7 7 LEU HD13 H 1 1.067 0.003 . . . . . . 38 L HD1* . 15957 1
56 . 1 1 7 7 LEU HD21 H 1 0.991 0.002 . . . . . . 38 L HD2* . 15957 1
57 . 1 1 7 7 LEU HD22 H 1 0.991 0.002 . . . . . . 38 L HD2* . 15957 1
58 . 1 1 7 7 LEU HD23 H 1 0.991 0.002 . . . . . . 38 L HD2* . 15957 1
59 . 1 1 7 7 LEU HG H 1 1.74 0.001 . . . . . . 38 L HG . 15957 1
60 . 1 1 8 8 ALA H H 1 8.489 0.001 . . . . . . 39 A HN . 15957 1
61 . 1 1 8 8 ALA HA H 1 4.16 0.057 . . . . . . 39 A HA . 15957 1
62 . 1 1 8 8 ALA HB1 H 1 1.548 0.002 . . . . . . 39 A HB . 15957 1
63 . 1 1 8 8 ALA HB2 H 1 1.548 0.002 . . . . . . 39 A HB . 15957 1
64 . 1 1 8 8 ALA HB3 H 1 1.548 0.002 . . . . . . 39 A HB . 15957 1
65 . 1 1 9 9 SER H H 1 8.247 0.002 . . . . . . 40 S HN . 15957 1
66 . 1 1 9 9 SER HA H 1 4.372 0.004 . . . . . . 40 S HA . 15957 1
67 . 1 1 9 9 SER HB2 H 1 4.024 0.004 . . . . . . 40 S HB2 . 15957 1
68 . 1 1 9 9 SER HB3 H 1 3.961 0.003 . . . . . . 40 S HB3 . 15957 1
69 . 1 1 10 10 LEU H H 1 8.065 0.002 . . . . . . 41 L HN . 15957 1
70 . 1 1 10 10 LEU HA H 1 4.204 0.002 . . . . . . 41 L HA . 15957 1
71 . 1 1 10 10 LEU HB2 H 1 1.995 0.002 . . . . . . 41 L HB2 . 15957 1
72 . 1 1 10 10 LEU HB3 H 1 1.918 0.001 . . . . . . 41 L HB3 . 15957 1
73 . 1 1 10 10 LEU HD11 H 1 1.06 0.004 . . . . . . 41 L HD1* . 15957 1
74 . 1 1 10 10 LEU HD12 H 1 1.06 0.004 . . . . . . 41 L HD1* . 15957 1
75 . 1 1 10 10 LEU HD13 H 1 1.06 0.004 . . . . . . 41 L HD1* . 15957 1
76 . 1 1 10 10 LEU HD21 H 1 0.989 0.002 . . . . . . 41 L HD2* . 15957 1
77 . 1 1 10 10 LEU HD22 H 1 0.989 0.002 . . . . . . 41 L HD2* . 15957 1
78 . 1 1 10 10 LEU HD23 H 1 0.989 0.002 . . . . . . 41 L HD2* . 15957 1
79 . 1 1 10 10 LEU HG H 1 1.749 0.001 . . . . . . 41 L HG . 15957 1
80 . 1 1 11 11 ARG H H 1 8.262 0.002 . . . . . . 42 R HN . 15957 1
81 . 1 1 11 11 ARG HA H 1 4.046 0.004 . . . . . . 42 R HA . 15957 1
82 . 1 1 11 11 ARG HB2 H 1 2.06 0.002 . . . . . . 42 R HB2 . 15957 1
83 . 1 1 11 11 ARG HB3 H 1 1.97 0.003 . . . . . . 42 R HB3 . 15957 1
84 . 1 1 11 11 ARG HD2 H 1 3.272 0.002 . . . . . . 42 R HD* . 15957 1
85 . 1 1 11 11 ARG HD3 H 1 3.272 0.002 . . . . . . 42 R HD* . 15957 1
86 . 1 1 11 11 ARG HE H 1 7.721 0.001 . . . . . . 42 R HE . 15957 1
87 . 1 1 11 11 ARG HG2 H 1 1.747 0.001 . . . . . . 42 R HG2 . 15957 1
88 . 1 1 11 11 ARG HG3 H 1 1.876 0.005 . . . . . . 42 R HG3 . 15957 1
89 . 1 1 12 12 SER H H 1 7.948 0.001 . . . . . . 43 S HN . 15957 1
90 . 1 1 12 12 SER HA H 1 4.388 0.002 . . . . . . 43 S HA . 15957 1
91 . 1 1 12 12 SER HB2 H 1 4.051 0.004 . . . . . . 43 S HB* . 15957 1
92 . 1 1 12 12 SER HB3 H 1 4.051 0.004 . . . . . . 43 S HB* . 15957 1
93 . 1 1 13 13 LEU H H 1 7.713 0.003 . . . . . . 44 L HN . 15957 1
94 . 1 1 13 13 LEU HA H 1 4.107 0.005 . . . . . . 44 L HA . 15957 1
95 . 1 1 13 13 LEU HB2 H 1 1.689 0.004 . . . . . . 44 L HB* . 15957 1
96 . 1 1 13 13 LEU HB3 H 1 1.689 0.004 . . . . . . 44 L HB* . 15957 1
97 . 1 1 13 13 LEU HD11 H 1 0.921 0.002 . . . . . . 44 L HD1* . 15957 1
98 . 1 1 13 13 LEU HD12 H 1 0.921 0.002 . . . . . . 44 L HD1* . 15957 1
99 . 1 1 13 13 LEU HD13 H 1 0.921 0.002 . . . . . . 44 L HD1* . 15957 1
100 . 1 1 13 13 LEU HD21 H 1 0.827 0.001 . . . . . . 44 L HD2* . 15957 1
101 . 1 1 13 13 LEU HD22 H 1 0.827 0.001 . . . . . . 44 L HD2* . 15957 1
102 . 1 1 13 13 LEU HD23 H 1 0.827 0.001 . . . . . . 44 L HD2* . 15957 1
103 . 1 1 13 13 LEU HG H 1 1.292 0.001 . . . . . . 44 L HG . 15957 1
104 . 1 1 14 14 PHE H H 1 7.731 0.141 . . . . . . 45 F HN . 15957 1
105 . 1 1 14 14 PHE HA H 1 4.651 0.001 . . . . . . 45 F HA . 15957 1
106 . 1 1 14 14 PHE HB2 H 1 3.415 0.002 . . . . . . 45 F HB2 . 15957 1
107 . 1 1 14 14 PHE HB3 H 1 2.982 0.003 . . . . . . 45 F HB3 . 15957 1
108 . 1 1 14 14 PHE HD1 H 1 7.422 0.002 . . . . . . 45 F HD* . 15957 1
109 . 1 1 14 14 PHE HD2 H 1 7.422 0.002 . . . . . . 45 F HD* . 15957 1
110 . 1 1 14 14 PHE HE1 H 1 7.259 0.003 . . . . . . 45 F HE* . 15957 1
111 . 1 1 14 14 PHE HE2 H 1 7.259 0.003 . . . . . . 45 F HE* . 15957 1
112 . 1 1 14 14 PHE HZ H 1 7.15 0.003 . . . . . . 45 F HZ . 15957 1
113 . 1 1 15 15 GLY H H 1 8.067 0.002 . . . . . . 46 G HN . 15957 1
114 . 1 1 15 15 GLY HA2 H 1 4.119 0.004 . . . . . . 46 G HA* . 15957 1
115 . 1 1 15 15 GLY HA3 H 1 4.119 0.004 . . . . . . 46 G HA* . 15957 1
116 . 1 1 16 16 SER H H 1 8.334 0.002 . . . . . . 47 S HN . 15957 1
117 . 1 1 16 16 SER HA H 1 4.541 0.002 . . . . . . 47 S HA . 15957 1
118 . 1 1 16 16 SER HB2 H 1 3.895 0.003 . . . . . . 47 S HB* . 15957 1
119 . 1 1 16 16 SER HB3 H 1 3.895 0.003 . . . . . . 47 S HB* . 15957 1
120 . 1 1 17 17 ASP H H 1 8.741 0.001 . . . . . . 48 D HN . 15957 1
121 . 1 1 17 17 ASP HA H 1 5.002 0.001 . . . . . . 48 D HA . 15957 1
122 . 1 1 17 17 ASP HB2 H 1 2.967 0.005 . . . . . . 48 D HB2 . 15957 1
123 . 1 1 17 17 ASP HB3 H 1 2.736 0.003 . . . . . . 48 D HB3 . 15957 1
124 . 1 1 18 18 PRO HA H 1 4.512 0.001 . . . . . . 49 P HA . 15957 1
125 . 1 1 18 18 PRO HB2 H 1 2.365 0.005 . . . . . . 49 P HB* . 15957 1
126 . 1 1 18 18 PRO HB3 H 1 2.365 0.005 . . . . . . 49 P HB* . 15957 1
127 . 1 1 18 18 PRO HD2 H 1 3.893 0.004 . . . . . . 49 P HD2 . 15957 1
128 . 1 1 18 18 PRO HD3 H 1 3.837 0.003 . . . . . . 49 P HD3 . 15957 1
129 . 1 1 18 18 PRO HG2 H 1 2.061 0.003 . . . . . . 49 P HG* . 15957 1
130 . 1 1 18 18 PRO HG3 H 1 2.061 0.003 . . . . . . 49 P HG* . 15957 1
131 . 1 1 19 19 SER H H 1 8.483 0.001 . . . . . . 50 S HN . 15957 1
132 . 1 1 19 19 SER HA H 1 4.499 0.004 . . . . . . 50 S HA . 15957 1
133 . 1 1 19 19 SER HB2 H 1 3.961 0 . . . . . . 50 S HB* . 15957 1
134 . 1 1 19 19 SER HB3 H 1 3.961 0 . . . . . . 50 S HB* . 15957 1
135 . 1 1 20 20 SER H H 1 8.306 0.003 . . . . . . 51 S HN . 15957 1
136 . 1 1 20 20 SER HA H 1 4.526 0.003 . . . . . . 51 S HA . 15957 1
137 . 1 1 20 20 SER HB2 H 1 3.955 0.001 . . . . . . 51 S HB* . 15957 1
138 . 1 1 20 20 SER HB3 H 1 3.955 0.001 . . . . . . 51 S HB* . 15957 1
139 . 1 1 21 21 GLN H H 1 8.143 0.002 . . . . . . 52 Q HN . 15957 1
140 . 1 1 21 21 GLN HA H 1 4.298 0.005 . . . . . . 52 Q HA . 15957 1
141 . 1 1 21 21 GLN HB2 H 1 2.212 0.001 . . . . . . 52 Q HB2 . 15957 1
142 . 1 1 21 21 GLN HB3 H 1 2.005 0.002 . . . . . . 52 Q HB3 . 15957 1
143 . 1 1 21 21 GLN HE21 H 1 7.479 0.194 . . . . . . 52 Q HE21 . 15957 1
144 . 1 1 21 21 GLN HE22 H 1 6.92 0 . . . . . . 52 Q HE22 . 15957 1
145 . 1 1 21 21 GLN HG2 H 1 2.375 0 . . . . . . 52 Q HG1 . 15957 1
146 . 1 1 21 21 GLN HG3 H 1 2.376 0.004 . . . . . . 52 Q HG2 . 15957 1
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