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 51180
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'KcsA WT pH 7.4, 100 mM K+ assignments'
_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 '3D HNCO' . . . 51180 1
2 '3D HNCA' . . . 51180 1
3 '2D CC' . . . 51180 1
4 '2D NH' . . . 51180 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 . . 51180 1
2 $software_2 . . 51180 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 41 41 LEU C C 13 180.64 0.3 . . . . . . . 41 LEU C . 51180 1
2 . 1 . 1 42 42 ALA H H 1 9.37 0.03 . . . . . . . 42 ALA H . 51180 1
3 . 1 . 1 42 42 ALA C C 13 179.83 0.3 . . . . . . . 42 ALA C . 51180 1
4 . 1 . 1 42 42 ALA CA C 13 54.86 0.3 . . . . . . . 42 ALA CA . 51180 1
5 . 1 . 1 42 42 ALA N N 15 121.1 0.5 . . . . . . . 42 ALA N . 51180 1
6 . 1 . 1 43 43 GLY H H 1 9.26 0.03 . . . . . . . 43 GLY H . 51180 1
7 . 1 . 1 43 43 GLY C C 13 175.78 0.3 . . . . . . . 43 GLY C . 51180 1
8 . 1 . 1 43 43 GLY CA C 13 47.68 0.3 . . . . . . . 43 GLY CA . 51180 1
9 . 1 . 1 43 43 GLY N N 15 109.86 0.5 . . . . . . . 43 GLY N . 51180 1
10 . 1 . 1 44 44 SER H H 1 7.65 0.03 . . . . . . . 44 SER H . 51180 1
11 . 1 . 1 44 44 SER C C 13 174.53 0.3 . . . . . . . 44 SER C . 51180 1
12 . 1 . 1 44 44 SER CA C 13 64.86 0.3 . . . . . . . 44 SER CA . 51180 1
13 . 1 . 1 44 44 SER CB C 13 63.10 0.3 . . . . . . . 44 SER CB . 51180 1
14 . 1 . 1 44 44 SER N N 15 115.58 0.5 . . . . . . . 44 SER N . 51180 1
15 . 1 . 1 45 45 TYR H H 1 7.05 0.03 . . . . . . . 45 TYR H . 51180 1
16 . 1 . 1 45 45 TYR CA C 13 61.80 0.3 . . . . . . . 45 TYR CA . 51180 1
17 . 1 . 1 45 45 TYR N N 15 120.30 0.5 . . . . . . . 45 TYR N . 51180 1
18 . 1 . 1 47 47 ALA C C 13 178.25 0.3 . . . . . . . 47 ALA C . 51180 1
19 . 1 . 1 48 48 VAL H H 1 7.09 0.03 . . . . . . . 48 VAL H . 51180 1
20 . 1 . 1 48 48 VAL C C 13 178.31 0.3 . . . . . . . 48 VAL C . 51180 1
21 . 1 . 1 48 48 VAL CA C 13 65.89 0.3 . . . . . . . 48 VAL CA . 51180 1
22 . 1 . 1 48 48 VAL CB C 13 31.43 0.3 . . . . . . . 48 VAL CB . 51180 1
23 . 1 . 1 48 48 VAL N N 15 117.01 0.5 . . . . . . . 48 VAL N . 51180 1
24 . 1 . 1 54 54 ALA H H 1 7.94 0.03 . . . . . . . 54 ALA H . 51180 1
25 . 1 . 1 54 54 ALA C C 13 176.63 0.3 . . . . . . . 54 ALA C . 51180 1
26 . 1 . 1 54 54 ALA CA C 13 50.57 0.3 . . . . . . . 54 ALA CA . 51180 1
27 . 1 . 1 54 54 ALA CB C 13 18.37 0.3 . . . . . . . 54 ALA CB . 51180 1
28 . 1 . 1 54 54 ALA N N 15 126.31 0.5 . . . . . . . 54 ALA N . 51180 1
29 . 1 . 1 55 55 PRO C C 13 178.18 0.3 . . . . . . . 55 PRO C . 51180 1
30 . 1 . 1 55 55 PRO CA C 13 64.20 0.3 . . . . . . . 55 PRO CA . 51180 1
31 . 1 . 1 55 55 PRO CB C 13 31.52 0.3 . . . . . . . 55 PRO CB . 51180 1
32 . 1 . 1 56 56 GLY H H 1 8.81 0.03 . . . . . . . 56 GLY H . 51180 1
33 . 1 . 1 56 56 GLY C C 13 174.32 0.3 . . . . . . . 56 GLY C . 51180 1
34 . 1 . 1 56 56 GLY CA C 13 45.31 0.3 . . . . . . . 56 GLY CA . 51180 1
35 . 1 . 1 56 56 GLY N N 15 112.67 0.5 . . . . . . . 56 GLY N . 51180 1
36 . 1 . 1 57 57 ALA H H 1 7.52 0.03 . . . . . . . 57 ALA H . 51180 1
37 . 1 . 1 57 57 ALA C C 13 178.40 0.3 . . . . . . . 57 ALA C . 51180 1
38 . 1 . 1 57 57 ALA CA C 13 53.70 0.3 . . . . . . . 57 ALA CA . 51180 1
39 . 1 . 1 57 57 ALA CB C 13 21.37 0.3 . . . . . . . 57 ALA CB . 51180 1
40 . 1 . 1 57 57 ALA N N 15 121.92 0.5 . . . . . . . 57 ALA N . 51180 1
41 . 1 . 1 59 59 LEU C C 13 174.9 0.3 . . . . . . . 59 LEU C . 51180 1
42 . 1 . 1 59 59 LEU CA C 13 53.57 0.3 . . . . . . . 59 LEU CA . 51180 1
43 . 1 . 1 59 59 LEU CB C 13 39.63 0.3 . . . . . . . 59 LEU CB . 51180 1
44 . 1 . 1 60 60 ILE H H 1 7.04 0.03 . . . . . . . 60 ILE H . 51180 1
45 . 1 . 1 60 60 ILE C C 13 174.87 0.3 . . . . . . . 60 ILE C . 51180 1
46 . 1 . 1 60 60 ILE CA C 13 62.00 0.3 . . . . . . . 60 ILE CA . 51180 1
47 . 1 . 1 60 60 ILE N N 15 106.80 0.5 . . . . . . . 60 ILE N . 51180 1
48 . 1 . 1 61 61 THR H H 1 7.40 0.03 . . . . . . . 61 THR H . 51180 1
49 . 1 . 1 61 61 THR C C 13 173.67 0.3 . . . . . . . 61 THR C . 51180 1
50 . 1 . 1 61 61 THR CA C 13 59.15 0.3 . . . . . . . 61 THR CA . 51180 1
51 . 1 . 1 61 61 THR CB C 13 72.07 0.3 . . . . . . . 61 THR CB . 51180 1
52 . 1 . 1 61 61 THR N N 15 110.42 0.5 . . . . . . . 61 THR N . 51180 1
53 . 1 . 1 62 62 TYR H H 1 10.25 0.03 . . . . . . . 62 TYR H . 51180 1
54 . 1 . 1 62 62 TYR C C 13 173.93 0.3 . . . . . . . 62 TYR C . 51180 1
55 . 1 . 1 62 62 TYR CA C 13 64.15 0.3 . . . . . . . 62 TYR CA . 51180 1
56 . 1 . 1 62 62 TYR CB C 13 36.57 0.3 . . . . . . . 62 TYR CB . 51180 1
57 . 1 . 1 62 62 TYR N N 15 124.08 0.5 . . . . . . . 62 TYR N . 51180 1
58 . 1 . 1 63 63 PRO C C 13 178.88 0.3 . . . . . . . 63 PRO C . 51180 1
59 . 1 . 1 64 64 ARG H H 1 7.09 0.03 . . . . . . . 64 ARG H . 51180 1
60 . 1 . 1 64 64 ARG CA C 13 60.61 0.3 . . . . . . . 64 ARG CA . 51180 1
61 . 1 . 1 64 64 ARG CB C 13 31.40 0.3 . . . . . . . 64 ARG CB . 51180 1
62 . 1 . 1 64 64 ARG N N 15 113.38 0.5 . . . . . . . 64 ARG N . 51180 1
63 . 1 . 1 65 65 ALA C C 13 178.49 0.3 . . . . . . . 65 ALA C . 51180 1
64 . 1 . 1 66 66 LEU H H 1 8.85 0.03 . . . . . . . 66 LEU H . 51180 1
65 . 1 . 1 66 66 LEU CA C 13 57.81 0.3 . . . . . . . 66 LEU CA . 51180 1
66 . 1 . 1 66 66 LEU N N 15 121.48 0.5 . . . . . . . 66 LEU N . 51180 1
67 . 1 . 1 67 67 TRP H H 1 7.55 0.03 . . . . . . . 67 TRP H . 51180 1
68 . 1 . 1 67 67 TRP HE1 H 1 11.19 0.03 . . . . . . . 67 TRP HE1 . 51180 1
69 . 1 . 1 67 67 TRP C C 13 176.30 0.3 . . . . . . . 67 TRP C . 51180 1
70 . 1 . 1 67 67 TRP CA C 13 59.56 0.3 . . . . . . . 67 TRP CA . 51180 1
71 . 1 . 1 67 67 TRP N N 15 120.30 0.5 . . . . . . . 67 TRP N . 51180 1
72 . 1 . 1 67 67 TRP NE1 N 15 133.3 0.5 . . . . . . . 67 TRP NE1 . 51180 1
73 . 1 . 1 68 68 TRP H H 1 8.55 0.03 . . . . . . . 68 TRP H . 51180 1
74 . 1 . 1 68 68 TRP HE1 H 1 10.42 0.03 . . . . . . . 68 TRP HE1 . 51180 1
75 . 1 . 1 68 68 TRP C C 13 179.55 0.3 . . . . . . . 68 TRP C . 51180 1
76 . 1 . 1 68 68 TRP CA C 13 60.52 0.3 . . . . . . . 68 TRP CA . 51180 1
77 . 1 . 1 68 68 TRP N N 15 119.62 0.5 . . . . . . . 68 TRP N . 51180 1
78 . 1 . 1 68 68 TRP NE1 N 15 130.01 0.5 . . . . . . . 68 TRP NE1 . 51180 1
79 . 1 . 1 69 69 SER H H 1 9.68 0.03 . . . . . . . 69 SER H . 51180 1
80 . 1 . 1 69 69 SER C C 13 176.27 0.3 . . . . . . . 69 SER C . 51180 1
81 . 1 . 1 69 69 SER CA C 13 63.22 0.3 . . . . . . . 69 SER CA . 51180 1
82 . 1 . 1 69 69 SER N N 15 122.35 0.5 . . . . . . . 69 SER N . 51180 1
83 . 1 . 1 70 70 VAL H H 1 7.54 0.03 . . . . . . . 70 VAL H . 51180 1
84 . 1 . 1 70 70 VAL C C 13 177.75 0.3 . . . . . . . 70 VAL C . 51180 1
85 . 1 . 1 70 70 VAL CA C 13 67.43 0.3 . . . . . . . 70 VAL CA . 51180 1
86 . 1 . 1 70 70 VAL N N 15 124.65 0.5 . . . . . . . 70 VAL N . 51180 1
87 . 1 . 1 71 71 GLU H H 1 7.31 0.03 . . . . . . . 71 GLU H . 51180 1
88 . 1 . 1 71 71 GLU C C 13 175.90 0.3 . . . . . . . 71 GLU C . 51180 1
89 . 1 . 1 71 71 GLU CA C 13 58.59 0.3 . . . . . . . 71 GLU CA . 51180 1
90 . 1 . 1 71 71 GLU CB C 13 27.01 0.3 . . . . . . . 71 GLU CB . 51180 1
91 . 1 . 1 71 71 GLU N N 15 114.01 0.5 . . . . . . . 71 GLU N . 51180 1
92 . 1 . 1 72 72 THR C C 13 174.71 0.3 . . . . . . . 72 THR C . 51180 1
93 . 1 . 1 72 72 THR CA C 13 67.24 0.3 . . . . . . . 72 THR CA . 51180 1
94 . 1 . 1 73 73 ALA H H 1 8.31 0.03 . . . . . . . 73 ALA H . 51180 1
95 . 1 . 1 73 73 ALA C C 13 176.45 0.3 . . . . . . . 73 ALA C . 51180 1
96 . 1 . 1 73 73 ALA CA C 13 55.6 0.3 . . . . . . . 73 ALA CA . 51180 1
97 . 1 . 1 73 73 ALA N N 15 125.01 0.5 . . . . . . . 73 ALA N . 51180 1
98 . 1 . 1 74 74 THR H H 1 7.08 0.03 . . . . . . . 74 THR H . 51180 1
99 . 1 . 1 74 74 THR C C 13 176.56 0.3 . . . . . . . 74 THR C . 51180 1
100 . 1 . 1 74 74 THR CA C 13 61.50 0.3 . . . . . . . 74 THR CA . 51180 1
101 . 1 . 1 74 74 THR CB C 13 69.84 0.3 . . . . . . . 74 THR CB . 51180 1
102 . 1 . 1 74 74 THR N N 15 98.13 0.5 . . . . . . . 74 THR N . 51180 1
103 . 1 . 1 75 75 THR H H 1 7.45 0.03 . . . . . . . 75 THR H . 51180 1
104 . 1 . 1 75 75 THR C C 13 172.70 0.3 . . . . . . . 75 THR C . 51180 1
105 . 1 . 1 75 75 THR CA C 13 63.50 0.3 . . . . . . . 75 THR CA . 51180 1
106 . 1 . 1 75 75 THR CB C 13 69.44 0.3 . . . . . . . 75 THR CB . 51180 1
107 . 1 . 1 75 75 THR CG2 C 13 21.79 0.3 . . . . . . . 75 THR CG . 51180 1
108 . 1 . 1 75 75 THR N N 15 111.13 0.5 . . . . . . . 75 THR N . 51180 1
109 . 1 . 1 76 76 VAL H H 1 7.07 0.03 . . . . . . . 76 VAL H . 51180 1
110 . 1 . 1 76 76 VAL C C 13 179.09 0.3 . . . . . . . 76 VAL C . 51180 1
111 . 1 . 1 76 76 VAL CA C 13 66.70 0.3 . . . . . . . 76 VAL CA . 51180 1
112 . 1 . 1 76 76 VAL N N 15 122.27 0.5 . . . . . . . 76 VAL N . 51180 1
113 . 1 . 1 77 77 GLY H H 1 7.75 0.03 . . . . . . . 77 GLY H . 51180 1
114 . 1 . 1 77 77 GLY C C 13 174.68 0.3 . . . . . . . 77 GLY C . 51180 1
115 . 1 . 1 77 77 GLY CA C 13 49.18 0.3 . . . . . . . 77 GLY CA . 51180 1
116 . 1 . 1 77 77 GLY N N 15 101.35 0.5 . . . . . . . 77 GLY N . 51180 1
117 . 1 . 1 78 78 TYR H H 1 7.39 0.03 . . . . . . . 78 TYR H . 51180 1
118 . 1 . 1 78 78 TYR C C 13 178.29 0.3 . . . . . . . 78 TYR C . 51180 1
119 . 1 . 1 78 78 TYR CA C 13 61.9 0.3 . . . . . . . 78 TYR CA . 51180 1
120 . 1 . 1 78 78 TYR CB C 13 38.3 0.3 . . . . . . . 78 TYR CB . 51180 1
121 . 1 . 1 78 78 TYR N N 15 115.95 0.5 . . . . . . . 78 TYR N . 51180 1
122 . 1 . 1 79 79 GLY H H 1 9.57 0.03 . . . . . . . 79 GLY H . 51180 1
123 . 1 . 1 79 79 GLY C C 13 174.47 0.3 . . . . . . . 79 GLY C . 51180 1
124 . 1 . 1 79 79 GLY CA C 13 45.7 0.3 . . . . . . . 79 GLY CA . 51180 1
125 . 1 . 1 79 79 GLY N N 15 101.96 0.5 . . . . . . . 79 GLY N . 51180 1
126 . 1 . 1 80 80 ASP H H 1 8.92 0.03 . . . . . . . 80 ASP H . 51180 1
127 . 1 . 1 80 80 ASP C C 13 175.65 0.3 . . . . . . . 80 ASP C . 51180 1
128 . 1 . 1 80 80 ASP CA C 13 55.70 0.3 . . . . . . . 80 ASP CA . 51180 1
129 . 1 . 1 80 80 ASP CB C 13 37.5 0.3 . . . . . . . 80 ASP CB . 51180 1
130 . 1 . 1 80 80 ASP CG C 13 179.95 0.3 . . . . . . . 80 ASP CG . 51180 1
131 . 1 . 1 80 80 ASP N N 15 119.08 0.5 . . . . . . . 80 ASP N . 51180 1
132 . 1 . 1 81 81 LEU H H 1 7.26 0.03 . . . . . . . 81 LEU H . 51180 1
133 . 1 . 1 81 81 LEU C C 13 175.86 0.3 . . . . . . . 81 LEU C . 51180 1
134 . 1 . 1 81 81 LEU CA C 13 53.30 0.3 . . . . . . . 81 LEU CA . 51180 1
135 . 1 . 1 81 81 LEU CB C 13 47.83 0.3 . . . . . . . 81 LEU CB . 51180 1
136 . 1 . 1 81 81 LEU CG C 13 27.57 0.3 . . . . . . . 81 LEU CG . 51180 1
137 . 1 . 1 81 81 LEU N N 15 118.07 0.5 . . . . . . . 81 LEU N . 51180 1
138 . 1 . 1 82 82 TYR H H 1 7.91 0.03 . . . . . . . 82 TYR H . 51180 1
139 . 1 . 1 82 82 TYR C C 13 172.17 0.3 . . . . . . . 82 TYR C . 51180 1
140 . 1 . 1 82 82 TYR CA C 13 55.65 0.3 . . . . . . . 82 TYR CA . 51180 1
141 . 1 . 1 82 82 TYR CB C 13 35.04 0.3 . . . . . . . 82 TYR CB . 51180 1
142 . 1 . 1 82 82 TYR N N 15 115.88 0.5 . . . . . . . 82 TYR N . 51180 1
143 . 1 . 1 83 83 PRO C C 13 176.54 0.3 . . . . . . . 83 PRO C . 51180 1
144 . 1 . 1 84 84 VAL H H 1 11.11 0.03 . . . . . . . 84 VAL H . 51180 1
145 . 1 . 1 84 84 VAL C C 13 176.22 0.3 . . . . . . . 84 VAL C . 51180 1
146 . 1 . 1 84 84 VAL CA C 13 61.20 0.3 . . . . . . . 84 VAL CA . 51180 1
147 . 1 . 1 84 84 VAL CB C 13 32.59 0.3 . . . . . . . 84 VAL CB . 51180 1
148 . 1 . 1 84 84 VAL N N 15 119.47 0.5 . . . . . . . 84 VAL N . 51180 1
149 . 1 . 1 85 85 THR H H 1 9.15 0.03 . . . . . . . 85 THR H . 51180 1
150 . 1 . 1 85 85 THR C C 13 175.10 0.3 . . . . . . . 85 THR C . 51180 1
151 . 1 . 1 85 85 THR CA C 13 61.11 0.3 . . . . . . . 85 THR CA . 51180 1
152 . 1 . 1 85 85 THR CB C 13 72.75 0.3 . . . . . . . 85 THR CB . 51180 1
153 . 1 . 1 85 85 THR N N 15 116.69 0.5 . . . . . . . 85 THR N . 51180 1
154 . 1 . 1 86 86 LEU H H 1 8.53 0.03 . . . . . . . 86 LEU H . 51180 1
155 . 1 . 1 86 86 LEU CA C 13 59.15 0.3 . . . . . . . 86 LEU CA . 51180 1
156 . 1 . 1 86 86 LEU CB C 13 41.0 0.3 . . . . . . . 86 LEU CB . 51180 1
157 . 1 . 1 86 86 LEU N N 15 122.69 0.5 . . . . . . . 86 LEU N . 51180 1
158 . 1 . 1 87 87 TRP H H 1 7.41 0.03 . . . . . . . 87 TRP H . 51180 1
159 . 1 . 1 87 87 TRP CA C 13 59.81 0.3 . . . . . . . 87 TRP CA . 51180 1
160 . 1 . 1 87 87 TRP N N 15 116.01 0.5 . . . . . . . 87 TRP N . 51180 1
stop_
save_