Content for NMR-STAR saveframe, "assigned_chemical_shifts_2"
save_assigned_chemical_shifts_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 52127
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name assigned_chem_shift_list_2
_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
2 '2D 1H-15N HSQC' . . . 52127 2
4 '3D 1H-15N NOESY' . . . 52127 2
6 '3D 1H-15N TOCSY' . . . 52127 2
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 . . 52127 2
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 . 2 . 2 2 2 GLN H H 1 8.879 . . 1 . . . B . 2 GLN H . 52127 2
2 . 2 . 2 2 2 GLN N N 15 123.005 . . 1 . . . B . 2 GLN N . 52127 2
3 . 2 . 2 3 3 ILE H H 1 8.216 . . 1 . . . B . 3 ILE H . 52127 2
4 . 2 . 2 3 3 ILE N N 15 115.132 . . 1 . . . B . 3 ILE N . 52127 2
5 . 2 . 2 4 4 PHE H H 1 8.507 . . 1 . . . B . 4 PHE H . 52127 2
6 . 2 . 2 4 4 PHE N N 15 118.621 . . 1 . . . B . 4 PHE N . 52127 2
7 . 2 . 2 5 5 VAL H H 1 9.213 . . 1 . . . B . 5 VAL H . 52127 2
8 . 2 . 2 5 5 VAL N N 15 121.492 . . 1 . . . B . 5 VAL N . 52127 2
9 . 2 . 2 6 6 LYS H H 1 8.907 . . 1 . . . B . 6 LYS H . 52127 2
10 . 2 . 2 6 6 LYS N N 15 128.05 . . 1 . . . B . 6 LYS N . 52127 2
11 . 2 . 2 7 7 THR H H 1 8.666 . . 1 . . . B . 7 THR H . 52127 2
12 . 2 . 2 7 7 THR N N 15 115.004 . . 1 . . . B . 7 THR N . 52127 2
13 . 2 . 2 8 8 LEU H H 1 9.037 . . 1 . . . B . 8 LEU H . 52127 2
14 . 2 . 2 8 8 LEU N N 15 121.069 . . 1 . . . B . 8 LEU N . 52127 2
15 . 2 . 2 9 9 THR H H 1 7.52 . . 1 . . . B . 9 THR H . 52127 2
16 . 2 . 2 9 9 THR N N 15 105.717 . . 1 . . . B . 9 THR N . 52127 2
17 . 2 . 2 10 10 GLY H H 1 7.667 . . 1 . . . B . 10 GLY H . 52127 2
18 . 2 . 2 10 10 GLY N N 15 109.14 . . 1 . . . B . 10 GLY N . 52127 2
19 . 2 . 2 11 11 LYS H H 1 7.209 . . 1 . . . B . 11 LYS H . 52127 2
20 . 2 . 2 11 11 LYS N N 15 122.002 . . 1 . . . B . 11 LYS N . 52127 2
21 . 2 . 2 12 12 THR H H 1 8.573 . . 1 . . . B . 12 THR H . 52127 2
22 . 2 . 2 12 12 THR N N 15 120.769 . . 1 . . . B . 12 THR N . 52127 2
23 . 2 . 2 13 13 ILE H H 1 9.484 . . 1 . . . B . 13 ILE H . 52127 2
24 . 2 . 2 13 13 ILE N N 15 127.891 . . 1 . . . B . 13 ILE N . 52127 2
25 . 2 . 2 14 14 THR H H 1 8.654 . . 1 . . . B . 14 THR H . 52127 2
26 . 2 . 2 14 14 THR N N 15 121.695 . . 1 . . . B . 14 THR N . 52127 2
27 . 2 . 2 15 15 LEU H H 1 8.627 . . 1 . . . B . 15 LEU H . 52127 2
28 . 2 . 2 15 15 LEU N N 15 125.182 . . 1 . . . B . 15 LEU N . 52127 2
29 . 2 . 2 16 16 GLU H H 1 8.029 . . 1 . . . B . 16 GLU H . 52127 2
30 . 2 . 2 16 16 GLU N N 15 122.401 . . 1 . . . B . 16 GLU N . 52127 2
31 . 2 . 2 17 17 VAL H H 1 8.857 . . 1 . . . B . 17 VAL H . 52127 2
32 . 2 . 2 17 17 VAL N N 15 117.582 . . 1 . . . B . 17 VAL N . 52127 2
33 . 2 . 2 18 18 GLU H H 1 8.56 . . 1 . . . B . 18 GLU H . 52127 2
34 . 2 . 2 18 18 GLU N N 15 119.309 . . 1 . . . B . 18 GLU N . 52127 2
35 . 2 . 2 20 20 SER H H 1 6.937 . . 1 . . . B . 20 SER H . 52127 2
36 . 2 . 2 20 20 SER N N 15 103.449 . . 1 . . . B . 20 SER N . 52127 2
37 . 2 . 2 21 21 ASP H H 1 7.962 . . 1 . . . B . 21 ASP H . 52127 2
38 . 2 . 2 21 21 ASP N N 15 124.006 . . 1 . . . B . 21 ASP N . 52127 2
39 . 2 . 2 22 22 THR H H 1 7.802 . . 1 . . . B . 22 THR H . 52127 2
40 . 2 . 2 22 22 THR N N 15 109.121 . . 1 . . . B . 22 THR N . 52127 2
41 . 2 . 2 23 23 ILE H H 1 8.417 . . 1 . . . B . 23 ILE H . 52127 2
42 . 2 . 2 23 23 ILE N N 15 121.248 . . 1 . . . B . 23 ILE N . 52127 2
43 . 2 . 2 25 25 ASN H H 1 7.849 . . 1 . . . B . 25 ASN H . 52127 2
44 . 2 . 2 25 25 ASN N N 15 121.494 . . 1 . . . B . 25 ASN N . 52127 2
45 . 2 . 2 26 26 VAL H H 1 8.029 . . 1 . . . B . 26 VAL H . 52127 2
46 . 2 . 2 26 26 VAL N N 15 122.401 . . 1 . . . B . 26 VAL N . 52127 2
47 . 2 . 2 27 27 LYS H H 1 8.473 . . 1 . . . B . 27 LYS H . 52127 2
48 . 2 . 2 27 27 LYS N N 15 118.967 . . 1 . . . B . 27 LYS N . 52127 2
49 . 2 . 2 28 28 ALA H H 1 7.873 . . 1 . . . B . 28 ALA H . 52127 2
50 . 2 . 2 28 28 ALA N N 15 123.465 . . 1 . . . B . 28 ALA N . 52127 2
51 . 2 . 2 29 29 LYS H H 1 7.763 . . 1 . . . B . 29 LYS H . 52127 2
52 . 2 . 2 29 29 LYS N N 15 120.296 . . 1 . . . B . 29 LYS N . 52127 2
53 . 2 . 2 30 30 ILE H H 1 8.185 . . 1 . . . B . 30 ILE H . 52127 2
54 . 2 . 2 30 30 ILE N N 15 121.431 . . 1 . . . B . 30 ILE N . 52127 2
55 . 2 . 2 31 31 GLN H H 1 8.466 . . 1 . . . B . 31 GLN H . 52127 2
56 . 2 . 2 31 31 GLN N N 15 123.627 . . 1 . . . B . 31 GLN N . 52127 2
57 . 2 . 2 32 32 ASP H H 1 7.945 . . 1 . . . B . 32 ASP H . 52127 2
58 . 2 . 2 32 32 ASP N N 15 119.839 . . 1 . . . B . 32 ASP N . 52127 2
59 . 2 . 2 33 33 LYS H H 1 7.341 . . 1 . . . B . 33 LYS H . 52127 2
60 . 2 . 2 33 33 LYS N N 15 115.581 . . 1 . . . B . 33 LYS N . 52127 2
61 . 2 . 2 34 34 GLU H H 1 8.628 . . 1 . . . B . 34 GLU H . 52127 2
62 . 2 . 2 34 34 GLU N N 15 114.329 . . 1 . . . B . 34 GLU N . 52127 2
63 . 2 . 2 35 35 GLY H H 1 8.404 . . 1 . . . B . 35 GLY H . 52127 2
64 . 2 . 2 35 35 GLY N N 15 108.926 . . 1 . . . B . 35 GLY N . 52127 2
65 . 2 . 2 36 36 ILE H H 1 6.059 . . 1 . . . B . 36 ILE H . 52127 2
66 . 2 . 2 36 36 ILE N N 15 120.353 . . 1 . . . B . 36 ILE N . 52127 2
67 . 2 . 2 39 39 ASP H H 1 8.456 . . 1 . . . B . 39 ASP H . 52127 2
68 . 2 . 2 39 39 ASP N N 15 113.724 . . 1 . . . B . 39 ASP N . 52127 2
69 . 2 . 2 40 40 GLN H H 1 7.722 . . 1 . . . B . 40 GLN H . 52127 2
70 . 2 . 2 40 40 GLN N N 15 117.018 . . 1 . . . B . 40 GLN N . 52127 2
71 . 2 . 2 41 41 GLN H H 1 7.395 . . 1 . . . B . 41 GLN H . 52127 2
72 . 2 . 2 41 41 GLN N N 15 117.986 . . 1 . . . B . 41 GLN N . 52127 2
73 . 2 . 2 42 42 ARG H H 1 8.411 . . 1 . . . B . 42 ARG H . 52127 2
74 . 2 . 2 42 42 ARG N N 15 122.977 . . 1 . . . B . 42 ARG N . 52127 2
75 . 2 . 2 43 43 LEU H H 1 8.759 . . 1 . . . B . 43 LEU H . 52127 2
76 . 2 . 2 43 43 LEU N N 15 124.406 . . 1 . . . B . 43 LEU N . 52127 2
77 . 2 . 2 44 44 ILE H H 1 9.044 . . 1 . . . B . 44 ILE H . 52127 2
78 . 2 . 2 44 44 ILE N N 15 122.333 . . 1 . . . B . 44 ILE N . 52127 2
79 . 2 . 2 45 45 PHE H H 1 8.773 . . 1 . . . B . 45 PHE H . 52127 2
80 . 2 . 2 45 45 PHE N N 15 124.931 . . 1 . . . B . 45 PHE N . 52127 2
81 . 2 . 2 46 46 ALA H H 1 8.949 . . 1 . . . B . 46 ALA H . 52127 2
82 . 2 . 2 46 46 ALA N N 15 133.487 . . 1 . . . B . 46 ALA N . 52127 2
83 . 2 . 2 47 47 GLY H H 1 8.079 . . 1 . . . B . 47 GLY H . 52127 2
84 . 2 . 2 47 47 GLY N N 15 102.336 . . 1 . . . B . 47 GLY N . 52127 2
85 . 2 . 2 48 48 ARG H H 1 7.87 . . 1 . . . B . 48 ARG H . 52127 2
86 . 2 . 2 48 48 ARG N N 15 121.292 . . 1 . . . B . 48 ARG N . 52127 2
87 . 2 . 2 49 49 GLN H H 1 8.674 . . 1 . . . B . 49 GLN H . 52127 2
88 . 2 . 2 49 49 GLN N N 15 123.613 . . 1 . . . B . 49 GLN N . 52127 2
89 . 2 . 2 50 50 LEU H H 1 8.499 . . 1 . . . B . 50 LEU H . 52127 2
90 . 2 . 2 50 50 LEU N N 15 125.795 . . 1 . . . B . 50 LEU N . 52127 2
91 . 2 . 2 51 51 GLU H H 1 8.295 . . 1 . . . B . 51 GLU H . 52127 2
92 . 2 . 2 51 51 GLU N N 15 123.019 . . 1 . . . B . 51 GLU N . 52127 2
93 . 2 . 2 52 52 ASP H H 1 8.103 . . 1 . . . B . 52 ASP H . 52127 2
94 . 2 . 2 52 52 ASP N N 15 120.447 . . 1 . . . B . 52 ASP N . 52127 2
95 . 2 . 2 54 54 ARG H H 1 7.361 . . 1 . . . B . 54 ARG H . 52127 2
96 . 2 . 2 54 54 ARG N N 15 119.41 . . 1 . . . B . 54 ARG N . 52127 2
97 . 2 . 2 55 55 THR H H 1 8.749 . . 1 . . . B . 55 THR H . 52127 2
98 . 2 . 2 55 55 THR N N 15 108.901 . . 1 . . . B . 55 THR N . 52127 2
99 . 2 . 2 56 56 LEU H H 1 8.06 . . 1 . . . B . 56 LEU H . 52127 2
100 . 2 . 2 56 56 LEU N N 15 118.044 . . 1 . . . B . 56 LEU N . 52127 2
101 . 2 . 2 57 57 SER H H 1 8.4 . . 1 . . . B . 57 SER H . 52127 2
102 . 2 . 2 57 57 SER N N 15 113.59 . . 1 . . . B . 57 SER N . 52127 2
103 . 2 . 2 58 58 ASP H H 1 7.847 . . 1 . . . B . 58 ASP H . 52127 2
104 . 2 . 2 58 58 ASP N N 15 124.61 . . 1 . . . B . 58 ASP N . 52127 2
105 . 2 . 2 59 59 TYR H H 1 7.166 . . 1 . . . B . 59 TYR H . 52127 2
106 . 2 . 2 59 59 TYR N N 15 115.826 . . 1 . . . B . 59 TYR N . 52127 2
107 . 2 . 2 60 60 ASN H H 1 8.062 . . 1 . . . B . 60 ASN H . 52127 2
108 . 2 . 2 60 60 ASN N N 15 115.97 . . 1 . . . B . 60 ASN N . 52127 2
109 . 2 . 2 61 61 ILE H H 1 7.149 . . 1 . . . B . 61 ILE H . 52127 2
110 . 2 . 2 61 61 ILE N N 15 119.008 . . 1 . . . B . 61 ILE N . 52127 2
111 . 2 . 2 62 62 GLN H H 1 7.535 . . 1 . . . B . 62 GLN H . 52127 2
112 . 2 . 2 62 62 GLN N N 15 125 . . 1 . . . B . 62 GLN N . 52127 2
113 . 2 . 2 63 63 LYS H H 1 8.415 . . 1 . . . B . 63 LYS H . 52127 2
114 . 2 . 2 63 63 LYS N N 15 120.694 . . 1 . . . B . 63 LYS N . 52127 2
115 . 2 . 2 64 64 GLU H H 1 9.235 . . 1 . . . B . 64 GLU H . 52127 2
116 . 2 . 2 64 64 GLU N N 15 114.761 . . 1 . . . B . 64 GLU N . 52127 2
117 . 2 . 2 65 65 SER H H 1 7.583 . . 1 . . . B . 65 SER H . 52127 2
118 . 2 . 2 65 65 SER N N 15 115.039 . . 1 . . . B . 65 SER N . 52127 2
119 . 2 . 2 66 66 THR H H 1 8.627 . . 1 . . . B . 66 THR H . 52127 2
120 . 2 . 2 66 66 THR N N 15 117.507 . . 1 . . . B . 66 THR N . 52127 2
121 . 2 . 2 67 67 LEU H H 1 9.31 . . 1 . . . B . 67 LEU H . 52127 2
122 . 2 . 2 67 67 LEU N N 15 127.999 . . 1 . . . B . 67 LEU N . 52127 2
123 . 2 . 2 68 68 HIS H H 1 9.109 . . 1 . . . B . 68 HIS H . 52127 2
124 . 2 . 2 68 68 HIS N N 15 119.379 . . 1 . . . B . 68 HIS N . 52127 2
125 . 2 . 2 69 69 LEU H H 1 8.205 . . 1 . . . B . 69 LEU H . 52127 2
126 . 2 . 2 69 69 LEU N N 15 123.788 . . 1 . . . B . 69 LEU N . 52127 2
127 . 2 . 2 70 70 VAL H H 1 9.033 . . 1 . . . B . 70 VAL H . 52127 2
128 . 2 . 2 70 70 VAL N N 15 126.044 . . 1 . . . B . 70 VAL N . 52127 2
129 . 2 . 2 71 71 LEU H H 1 8.022 . . 1 . . . B . 71 LEU H . 52127 2
130 . 2 . 2 71 71 LEU N N 15 123.116 . . 1 . . . B . 71 LEU N . 52127 2
131 . 2 . 2 72 72 ARG H H 1 8.53 . . 1 . . . B . 72 ARG H . 52127 2
132 . 2 . 2 72 72 ARG N N 15 123.791 . . 1 . . . B . 72 ARG N . 52127 2
133 . 2 . 2 73 73 LEU H H 1 8.262 . . 1 . . . B . 73 LEU H . 52127 2
134 . 2 . 2 73 73 LEU N N 15 124.874 . . 1 . . . B . 73 LEU N . 52127 2
135 . 2 . 2 74 74 ARG H H 1 8.505 . . 1 . . . B . 74 ARG H . 52127 2
136 . 2 . 2 74 74 ARG N N 15 122.994 . . 1 . . . B . 74 ARG N . 52127 2
137 . 2 . 2 75 75 GLY H H 1 8.622 . . 1 . . . B . 75 GLY H . 52127 2
138 . 2 . 2 75 75 GLY N N 15 111.733 . . 1 . . . B . 75 GLY N . 52127 2
139 . 2 . 2 76 76 GLY H H 1 8.197 . . 1 . . . B . 76 GLY H . 52127 2
140 . 2 . 2 76 76 GLY N N 15 109.019 . . 1 . . . B . 76 GLY N . 52127 2
stop_
save_