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 51071
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'ILV 13C-methyl, K 15N-amide'
_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-15N HSQC' . . . 51071 1
2 '2D 1H-13C HMQC' . . . 51071 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 . . 51071 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 5 5 LYS H H 1 123.6322 . . 1 . . . . . 5 LYS HN . 51071 1
2 . 1 . 1 5 5 LYS N N 15 8.9808 . . 1 . . . . . 5 LYS N . 51071 1
3 . 1 . 1 6 6 LEU HD11 H 1 0.7520 . . 2 . . . . . 6 LEU HD11 . 51071 1
4 . 1 . 1 6 6 LEU HD12 H 1 0.7520 . . 2 . . . . . 6 LEU HD11 . 51071 1
5 . 1 . 1 6 6 LEU HD13 H 1 0.7520 . . 2 . . . . . 6 LEU HD11 . 51071 1
6 . 1 . 1 6 6 LEU CD1 C 13 23.6149 . . 2 . . . . . 6 LEU CD1 . 51071 1
7 . 1 . 1 8 8 VAL HG21 H 1 0.7473 . . 2 . . . . . 8 VAL HG21 . 51071 1
8 . 1 . 1 8 8 VAL HG22 H 1 0.7473 . . 2 . . . . . 8 VAL HG21 . 51071 1
9 . 1 . 1 8 8 VAL HG23 H 1 0.7473 . . 2 . . . . . 8 VAL HG21 . 51071 1
10 . 1 . 1 8 8 VAL CG1 C 13 17.3490 . . 2 . . . . . 8 VAL CG1 . 51071 1
11 . 1 . 1 19 19 LEU HD11 H 1 0.4046 . . 2 . . . . . 19 LEU HD11 . 51071 1
12 . 1 . 1 19 19 LEU HD12 H 1 0.4046 . . 2 . . . . . 19 LEU HD11 . 51071 1
13 . 1 . 1 19 19 LEU HD13 H 1 0.4046 . . 2 . . . . . 19 LEU HD11 . 51071 1
14 . 1 . 1 19 19 LEU HD21 H 1 0.5739 . . 2 . . . . . 19 LEU HD21 . 51071 1
15 . 1 . 1 19 19 LEU HD22 H 1 0.5739 . . 2 . . . . . 19 LEU HD21 . 51071 1
16 . 1 . 1 19 19 LEU HD23 H 1 0.5739 . . 2 . . . . . 19 LEU HD21 . 51071 1
17 . 1 . 1 19 19 LEU CD1 C 13 23.6557 . . 2 . . . . . 19 LEU CD1 . 51071 1
18 . 1 . 1 19 19 LEU CD2 C 13 22.3908 . . 2 . . . . . 19 LEU CD2 . 51071 1
19 . 1 . 1 21 21 ILE HD11 H 1 0.4129 . . 1 . . . . . 21 ILE HD11 . 51071 1
20 . 1 . 1 21 21 ILE HD12 H 1 0.4129 . . 1 . . . . . 21 ILE HD11 . 51071 1
21 . 1 . 1 21 21 ILE HD13 H 1 0.4129 . . 1 . . . . . 21 ILE HD11 . 51071 1
22 . 1 . 1 21 21 ILE CD1 C 13 8.2961 . . 1 . . . . . 21 ILE CD1 . 51071 1
23 . 1 . 1 23 23 LEU HD11 H 1 -0.4914 . . 2 . . . . . 23 LEU HD11 . 51071 1
24 . 1 . 1 23 23 LEU HD12 H 1 -0.4914 . . 2 . . . . . 23 LEU HD11 . 51071 1
25 . 1 . 1 23 23 LEU HD13 H 1 -0.4914 . . 2 . . . . . 23 LEU HD11 . 51071 1
26 . 1 . 1 23 23 LEU CD1 C 13 21.1251 . . 2 . . . . . 23 LEU CD1 . 51071 1
27 . 1 . 1 24 24 ILE HD11 H 1 0.2614 . . 1 . . . . . 24 ILE HD11 . 51071 1
28 . 1 . 1 24 24 ILE HD12 H 1 0.2614 . . 1 . . . . . 24 ILE HD11 . 51071 1
29 . 1 . 1 24 24 ILE HD13 H 1 0.2614 . . 1 . . . . . 24 ILE HD11 . 51071 1
30 . 1 . 1 24 24 ILE CD1 C 13 7.7731 . . 1 . . . . . 24 ILE CD1 . 51071 1
31 . 1 . 1 36 36 ILE HD11 H 1 0.5067 . . 1 . . . . . 36 ILE HD11 . 51071 1
32 . 1 . 1 36 36 ILE HD12 H 1 0.5067 . . 1 . . . . . 36 ILE HD11 . 51071 1
33 . 1 . 1 36 36 ILE HD13 H 1 0.5067 . . 1 . . . . . 36 ILE HD11 . 51071 1
34 . 1 . 1 36 36 ILE CD1 C 13 9.8531 . . 1 . . . . . 36 ILE CD1 . 51071 1
35 . 1 . 1 42 42 LYS H H 1 122.8939 . . 1 . . . . . 42 LYS HN . 51071 1
36 . 1 . 1 42 42 LYS N N 15 8.5516 . . 1 . . . . . 42 LYS N . 51071 1
37 . 1 . 1 44 44 VAL HG11 H 1 0.5299 . . 2 . . . . . 44 VAL HG11 . 51071 1
38 . 1 . 1 44 44 VAL HG12 H 1 0.5299 . . 2 . . . . . 44 VAL HG11 . 51071 1
39 . 1 . 1 44 44 VAL HG13 H 1 0.5299 . . 2 . . . . . 44 VAL HG11 . 51071 1
40 . 1 . 1 44 44 VAL CG1 C 13 16.9600 . . 2 . . . . . 44 VAL CG1 . 51071 1
41 . 1 . 1 45 45 VAL HG11 H 1 0.4280 . . 2 . . . . . 45 VAL HG11 . 51071 1
42 . 1 . 1 45 45 VAL HG12 H 1 0.4280 . . 2 . . . . . 45 VAL HG11 . 51071 1
43 . 1 . 1 45 45 VAL HG13 H 1 0.4280 . . 2 . . . . . 45 VAL HG11 . 51071 1
44 . 1 . 1 45 45 VAL CG1 C 13 17.8153 . . 2 . . . . . 45 VAL CG1 . 51071 1
45 . 1 . 1 46 46 ILE HD11 H 1 0.2438 . . 1 . . . . . 46 ILE HD11 . 51071 1
46 . 1 . 1 46 46 ILE HD12 H 1 0.2438 . . 1 . . . . . 46 ILE HD11 . 51071 1
47 . 1 . 1 46 46 ILE HD13 H 1 0.2438 . . 1 . . . . . 46 ILE HD11 . 51071 1
48 . 1 . 1 46 46 ILE CD1 C 13 12.2809 . . 1 . . . . . 46 ILE CD1 . 51071 1
49 . 1 . 1 55 55 ILE HD11 H 1 0.3297 . . 1 . . . . . 55 ILE HD11 . 51071 1
50 . 1 . 1 55 55 ILE HD12 H 1 0.3297 . . 1 . . . . . 55 ILE HD11 . 51071 1
51 . 1 . 1 55 55 ILE HD13 H 1 0.3297 . . 1 . . . . . 55 ILE HD11 . 51071 1
52 . 1 . 1 55 55 ILE CD1 C 13 12.3176 . . 1 . . . . . 55 ILE CD1 . 51071 1
53 . 1 . 1 56 56 LEU HD11 H 1 0.5383 . . 2 . . . . . 56 LEU HD11 . 51071 1
54 . 1 . 1 56 56 LEU HD12 H 1 0.5383 . . 2 . . . . . 56 LEU HD11 . 51071 1
55 . 1 . 1 56 56 LEU HD13 H 1 0.5383 . . 2 . . . . . 56 LEU HD11 . 51071 1
56 . 1 . 1 56 56 LEU CD1 C 13 23.5615 . . 2 . . . . . 56 LEU CD1 . 51071 1
57 . 1 . 1 79 79 LEU HD11 H 1 -0.1464 . . 2 . . . . . 79 LEU HD11 . 51071 1
58 . 1 . 1 79 79 LEU HD12 H 1 -0.1464 . . 2 . . . . . 79 LEU HD11 . 51071 1
59 . 1 . 1 79 79 LEU HD13 H 1 -0.1464 . . 2 . . . . . 79 LEU HD11 . 51071 1
60 . 1 . 1 79 79 LEU HD21 H 1 -0.0178 . . 2 . . . . . 79 LEU HD21 . 51071 1
61 . 1 . 1 79 79 LEU HD22 H 1 -0.0178 . . 2 . . . . . 79 LEU HD21 . 51071 1
62 . 1 . 1 79 79 LEU HD23 H 1 -0.0178 . . 2 . . . . . 79 LEU HD21 . 51071 1
63 . 1 . 1 79 79 LEU CD1 C 13 21.8022 . . 2 . . . . . 79 LEU CD1 . 51071 1
64 . 1 . 1 79 79 LEU CD2 C 13 22.4620 . . 2 . . . . . 79 LEU CD2 . 51071 1
65 . 1 . 1 81 81 VAL HG21 H 1 0.4467 . . 2 . . . . . 81 VAL HG21 . 51071 1
66 . 1 . 1 81 81 VAL HG22 H 1 0.4467 . . 2 . . . . . 81 VAL HG21 . 51071 1
67 . 1 . 1 81 81 VAL HG23 H 1 0.4467 . . 2 . . . . . 81 VAL HG21 . 51071 1
68 . 1 . 1 81 81 VAL CG2 C 13 18.7908 . . 2 . . . . . 81 VAL CG2 . 51071 1
69 . 1 . 1 84 84 ILE HD11 H 1 0.5772 . . 1 . . . . . 84 ILE HD11 . 51071 1
70 . 1 . 1 84 84 ILE HD12 H 1 0.5772 . . 1 . . . . . 84 ILE HD11 . 51071 1
71 . 1 . 1 84 84 ILE HD13 H 1 0.5772 . . 1 . . . . . 84 ILE HD11 . 51071 1
72 . 1 . 1 84 84 ILE CD1 C 13 12.3987 . . 1 . . . . . 84 ILE CD1 . 51071 1
73 . 1 . 1 93 93 ILE HD11 H 1 0.5833 . . 1 . . . . . 93 ILE HD11 . 51071 1
74 . 1 . 1 93 93 ILE HD12 H 1 0.5833 . . 1 . . . . . 93 ILE HD11 . 51071 1
75 . 1 . 1 93 93 ILE HD13 H 1 0.5833 . . 1 . . . . . 93 ILE HD11 . 51071 1
76 . 1 . 1 93 93 ILE CD1 C 13 6.1670 . . 1 . . . . . 93 ILE CD1 . 51071 1
77 . 1 . 1 100 100 ILE HD11 H 1 0.0755 . . 1 . . . . . 100 ILE HD11 . 51071 1
78 . 1 . 1 100 100 ILE HD12 H 1 0.0755 . . 1 . . . . . 100 ILE HD11 . 51071 1
79 . 1 . 1 100 100 ILE HD13 H 1 0.0755 . . 1 . . . . . 100 ILE HD11 . 51071 1
80 . 1 . 1 100 100 ILE CD1 C 13 12.1808 . . 1 . . . . . 100 ILE CD1 . 51071 1
81 . 1 . 1 101 101 LYS H H 1 116.3231 . . 1 . . . . . 101 LYS HN . 51071 1
82 . 1 . 1 101 101 LYS N N 15 7.6295 . . 1 . . . . . 101 LYS N . 51071 1
83 . 1 . 1 103 103 VAL HG11 H 1 0.8190 . . 2 . . . . . 103 VAL HG11 . 51071 1
84 . 1 . 1 103 103 VAL HG12 H 1 0.8190 . . 2 . . . . . 103 VAL HG11 . 51071 1
85 . 1 . 1 103 103 VAL HG13 H 1 0.8190 . . 2 . . . . . 103 VAL HG11 . 51071 1
86 . 1 . 1 103 103 VAL CG1 C 13 20.3751 . . 2 . . . . . 103 VAL CG1 . 51071 1
87 . 1 . 1 104 104 LYS H H 1 115.7780 . . 1 . . . . . 104 LYS HN . 51071 1
88 . 1 . 1 104 104 LYS N N 15 8.0582 . . 1 . . . . . 104 LYS N . 51071 1
89 . 1 . 1 112 112 VAL HG11 H 1 0.5812 . . 2 . . . . . 112 VAL HG11 . 51071 1
90 . 1 . 1 112 112 VAL HG12 H 1 0.5812 . . 2 . . . . . 112 VAL HG11 . 51071 1
91 . 1 . 1 112 112 VAL HG13 H 1 0.5812 . . 2 . . . . . 112 VAL HG11 . 51071 1
92 . 1 . 1 112 112 VAL CG1 C 13 19.9544 . . 2 . . . . . 112 VAL CG1 . 51071 1
93 . 1 . 1 113 113 LEU HD11 H 1 0.8729 . . 2 . . . . . 113 LEU HD11 . 51071 1
94 . 1 . 1 113 113 LEU HD12 H 1 0.8729 . . 2 . . . . . 113 LEU HD11 . 51071 1
95 . 1 . 1 113 113 LEU HD13 H 1 0.8729 . . 2 . . . . . 113 LEU HD11 . 51071 1
96 . 1 . 1 113 113 LEU CD1 C 13 24.4024 . . 2 . . . . . 113 LEU CD1 . 51071 1
97 . 1 . 1 120 120 LEU HD11 H 1 0.6858 . . 2 . . . . . 120 LEU HD11 . 51071 1
98 . 1 . 1 120 120 LEU HD12 H 1 0.6858 . . 2 . . . . . 120 LEU HD11 . 51071 1
99 . 1 . 1 120 120 LEU HD13 H 1 0.6858 . . 2 . . . . . 120 LEU HD11 . 51071 1
100 . 1 . 1 120 120 LEU CD1 C 13 24.2082 . . 2 . . . . . 120 LEU CD1 . 51071 1
101 . 1 . 1 125 125 VAL HG11 H 1 -0.3487 . . 2 . . . . . 125 VAL HG11 . 51071 1
102 . 1 . 1 125 125 VAL HG12 H 1 -0.3487 . . 2 . . . . . 125 VAL HG11 . 51071 1
103 . 1 . 1 125 125 VAL HG13 H 1 -0.3487 . . 2 . . . . . 125 VAL HG11 . 51071 1
104 . 1 . 1 125 125 VAL CG1 C 13 16.1473 . . 2 . . . . . 125 VAL CG1 . 51071 1
105 . 1 . 1 128 128 LYS H H 1 120.3154 . . 1 . . . . . 128 LYS HN . 51071 1
106 . 1 . 1 128 128 LYS N N 15 8.3124 . . 1 . . . . . 128 LYS N . 51071 1
107 . 1 . 1 133 133 LEU HD11 H 1 0.1976 . . 2 . . . . . 133 LEU HD11 . 51071 1
108 . 1 . 1 133 133 LEU HD12 H 1 0.1976 . . 2 . . . . . 133 LEU HD11 . 51071 1
109 . 1 . 1 133 133 LEU HD13 H 1 0.1976 . . 2 . . . . . 133 LEU HD11 . 51071 1
110 . 1 . 1 133 133 LEU CD1 C 13 22.9576 . . 2 . . . . . 133 LEU CD1 . 51071 1
111 . 1 . 1 139 139 ILE HD11 H 1 0.6944 . . 1 . . . . . 139 ILE HD11 . 51071 1
112 . 1 . 1 139 139 ILE HD12 H 1 0.6944 . . 1 . . . . . 139 ILE HD11 . 51071 1
113 . 1 . 1 139 139 ILE HD13 H 1 0.6944 . . 1 . . . . . 139 ILE HD11 . 51071 1
114 . 1 . 1 139 139 ILE CD1 C 13 12.3709 . . 1 . . . . . 139 ILE CD1 . 51071 1
115 . 1 . 1 142 142 ILE HD11 H 1 0.4990 . . 1 . . . . . 142 ILE HD11 . 51071 1
116 . 1 . 1 142 142 ILE HD12 H 1 0.4990 . . 1 . . . . . 142 ILE HD11 . 51071 1
117 . 1 . 1 142 142 ILE HD13 H 1 0.4990 . . 1 . . . . . 142 ILE HD11 . 51071 1
118 . 1 . 1 142 142 ILE CD1 C 13 10.8695 . . 1 . . . . . 142 ILE CD1 . 51071 1
119 . 1 . 1 147 147 LYS H H 1 116.1084 . . 1 . . . . . 147 LYS HN . 51071 1
120 . 1 . 1 147 147 LYS N N 15 6.7691 . . 1 . . . . . 147 LYS N . 51071 1
121 . 1 . 1 159 159 LEU HD11 H 1 0.4933 . . 2 . . . . . 159 LEU HD11 . 51071 1
122 . 1 . 1 159 159 LEU HD12 H 1 0.4933 . . 2 . . . . . 159 LEU HD11 . 51071 1
123 . 1 . 1 159 159 LEU HD13 H 1 0.4933 . . 2 . . . . . 159 LEU HD11 . 51071 1
124 . 1 . 1 159 159 LEU CD1 C 13 24.3933 . . 2 . . . . . 159 LEU CD1 . 51071 1
125 . 1 . 1 160 160 VAL HG11 H 1 -0.2136 . . 2 . . . . . 160 VAL HG11 . 51071 1
126 . 1 . 1 160 160 VAL HG12 H 1 -0.2136 . . 2 . . . . . 160 VAL HG11 . 51071 1
127 . 1 . 1 160 160 VAL HG13 H 1 -0.2136 . . 2 . . . . . 160 VAL HG11 . 51071 1
128 . 1 . 1 160 160 VAL CG1 C 13 16.3303 . . 2 . . . . . 160 VAL CG1 . 51071 1
129 . 1 . 1 163 163 ILE HD11 H 1 0.5297 . . 1 . . . . . 163 ILE HD11 . 51071 1
130 . 1 . 1 163 163 ILE HD12 H 1 0.5297 . . 1 . . . . . 163 ILE HD11 . 51071 1
131 . 1 . 1 163 163 ILE HD13 H 1 0.5297 . . 1 . . . . . 163 ILE HD11 . 51071 1
132 . 1 . 1 163 163 ILE CD1 C 13 12.5612 . . 1 . . . . . 163 ILE CD1 . 51071 1
133 . 1 . 1 165 165 LYS H H 1 118.3656 . . 1 . . . . . 165 LYS HN . 51071 1
134 . 1 . 1 165 165 LYS N N 15 7.8847 . . 1 . . . . . 165 LYS N . 51071 1
135 . 1 . 1 167 167 LYS H H 1 119.0148 . . 1 . . . . . 167 LYS HN . 51071 1
136 . 1 . 1 167 167 LYS N N 15 8.5945 . . 1 . . . . . 167 LYS N . 51071 1
137 . 1 . 1 169 169 LYS H H 1 120.5339 . . 1 . . . . . 169 LYS HN . 51071 1
138 . 1 . 1 169 169 LYS N N 15 7.7070 . . 1 . . . . . 169 LYS N . 51071 1
139 . 1 . 1 172 172 LYS H H 1 122.2651 . . 1 . . . . . 172 LYS HN . 51071 1
140 . 1 . 1 172 172 LYS N N 15 7.9932 . . 1 . . . . . 172 LYS N . 51071 1
141 . 1 . 1 175 175 LYS H H 1 120.2734 . . 1 . . . . . 175 LYS HN . 51071 1
142 . 1 . 1 175 175 LYS N N 15 7.9449 . . 1 . . . . . 175 LYS N . 51071 1
143 . 1 . 1 176 176 LYS H H 1 121.3678 . . 1 . . . . . 176 LYS HN . 51071 1
144 . 1 . 1 176 176 LYS N N 15 8.0093 . . 1 . . . . . 176 LYS N . 51071 1
145 . 1 . 1 177 177 LYS H H 1 122.5422 . . 1 . . . . . 177 LYS HN . 51071 1
146 . 1 . 1 177 177 LYS N N 15 8.1172 . . 1 . . . . . 177 LYS N . 51071 1
147 . 1 . 1 178 178 LYS H H 1 123.2571 . . 1 . . . . . 178 LYS HN . 51071 1
148 . 1 . 1 178 178 LYS N N 15 8.2027 . . 1 . . . . . 178 LYS N . 51071 1
149 . 1 . 1 179 179 LYS H H 1 123.7085 . . 1 . . . . . 179 LYS HN . 51071 1
150 . 1 . 1 179 179 LYS N N 15 8.2754 . . 1 . . . . . 179 LYS N . 51071 1
stop_
save_