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 51118
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'BB shifts'
_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' . . . 51118 1
2 '3D HNCACB' . . . 51118 1
3 '3D CBCACONH' . . . 51118 1
4 '3D HNCO' . . . 51118 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
3 $software_3 . . 51118 1
4 $software_4 . . 51118 1
5 $software_5 . . 51118 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 2 2 ALA H H 1 8.308 0.020 . 1 . . . . . 2 ALA H . 51118 1
2 . 1 . 1 2 2 ALA C C 13 177.157 0.3 . 1 . . . . . 2 ALA C . 51118 1
3 . 1 . 1 2 2 ALA CA C 13 52.235 0.3 . 1 . . . . . 2 ALA CA . 51118 1
4 . 1 . 1 2 2 ALA CB C 13 19.128 0.3 . 1 . . . . . 2 ALA CB . 51118 1
5 . 1 . 1 2 2 ALA N N 15 125.788 0.3 . 1 . . . . . 2 ALA N . 51118 1
6 . 1 . 1 3 3 ALA H H 1 8.261 0.020 . 1 . . . . . 3 ALA H . 51118 1
7 . 1 . 1 3 3 ALA C C 13 177.558 0.3 . 1 . . . . . 3 ALA C . 51118 1
8 . 1 . 1 3 3 ALA CA C 13 52.159 0.3 . 1 . . . . . 3 ALA CA . 51118 1
9 . 1 . 1 3 3 ALA CB C 13 19.036 0.3 . 1 . . . . . 3 ALA CB . 51118 1
10 . 1 . 1 3 3 ALA N N 15 123.768 0.3 . 1 . . . . . 3 ALA N . 51118 1
11 . 1 . 1 4 4 VAL H H 1 8.059 0.020 . 1 . . . . . 4 VAL H . 51118 1
12 . 1 . 1 4 4 VAL C C 13 175.939 0.3 . 1 . . . . . 4 VAL C . 51118 1
13 . 1 . 1 4 4 VAL CA C 13 62.098 0.3 . 1 . . . . . 4 VAL CA . 51118 1
14 . 1 . 1 4 4 VAL CB C 13 32.814 0.3 . 1 . . . . . 4 VAL CB . 51118 1
15 . 1 . 1 4 4 VAL N N 15 119.351 0.3 . 1 . . . . . 4 VAL N . 51118 1
16 . 1 . 1 5 5 GLU H H 1 8.441 0.020 . 1 . . . . . 5 GLU H . 51118 1
17 . 1 . 1 5 5 GLU C C 13 176.071 0.3 . 1 . . . . . 5 GLU C . 51118 1
18 . 1 . 1 5 5 GLU CA C 13 56.339 0.3 . 1 . . . . . 5 GLU CA . 51118 1
19 . 1 . 1 5 5 GLU CB C 13 30.369 0.3 . 1 . . . . . 5 GLU CB . 51118 1
20 . 1 . 1 5 5 GLU N N 15 124.794 0.3 . 1 . . . . . 5 GLU N . 51118 1
21 . 1 . 1 6 6 THR H H 1 8.154 0.020 . 1 . . . . . 6 THR H . 51118 1
22 . 1 . 1 6 6 THR C C 13 173.831 0.3 . 1 . . . . . 6 THR C . 51118 1
23 . 1 . 1 6 6 THR CA C 13 61.869 0.3 . 1 . . . . . 6 THR CA . 51118 1
24 . 1 . 1 6 6 THR CB C 13 69.744 0.3 . 1 . . . . . 6 THR CB . 51118 1
25 . 1 . 1 6 6 THR N N 15 117.431 0.3 . 1 . . . . . 6 THR N . 51118 1
26 . 1 . 1 7 7 ARG H H 1 8.675 0.020 . 1 . . . . . 7 ARG H . 51118 1
27 . 1 . 1 7 7 ARG C C 13 175.084 0.3 . 1 . . . . . 7 ARG C . 51118 1
28 . 1 . 1 7 7 ARG CA C 13 54.682 0.3 . 1 . . . . . 7 ARG CA . 51118 1
29 . 1 . 1 7 7 ARG CB C 13 31.047 0.3 . 1 . . . . . 7 ARG CB . 51118 1
30 . 1 . 1 7 7 ARG N N 15 125.300 0.3 . 1 . . . . . 7 ARG N . 51118 1
31 . 1 . 1 8 8 VAL H H 1 8.343 0.020 . 1 . . . . . 8 VAL H . 51118 1
32 . 1 . 1 8 8 VAL C C 13 174.311 0.3 . 1 . . . . . 8 VAL C . 51118 1
33 . 1 . 1 8 8 VAL CA C 13 61.355 0.3 . 1 . . . . . 8 VAL CA . 51118 1
34 . 1 . 1 8 8 VAL CB C 13 33.350 0.3 . 1 . . . . . 8 VAL CB . 51118 1
35 . 1 . 1 8 8 VAL N N 15 123.850 0.3 . 1 . . . . . 8 VAL N . 51118 1
36 . 1 . 1 9 9 CYS H H 1 8.242 0.020 . 1 . . . . . 9 CYS H . 51118 1
37 . 1 . 1 9 9 CYS C C 13 175.256 0.3 . 1 . . . . . 9 CYS C . 51118 1
38 . 1 . 1 9 9 CYS CA C 13 61.181 0.3 . 1 . . . . . 9 CYS CA . 51118 1
39 . 1 . 1 9 9 CYS CB C 13 31.438 0.3 . 1 . . . . . 9 CYS CB . 51118 1
40 . 1 . 1 9 9 CYS N N 15 128.034 0.3 . 1 . . . . . 9 CYS N . 51118 1
41 . 1 . 1 10 10 GLU H H 1 8.269 0.020 . 1 . . . . . 10 GLU H . 51118 1
42 . 1 . 1 10 10 GLU C C 13 178.044 0.3 . 1 . . . . . 10 GLU C . 51118 1
43 . 1 . 1 10 10 GLU CA C 13 57.118 0.3 . 1 . . . . . 10 GLU CA . 51118 1
44 . 1 . 1 10 10 GLU CB C 13 29.297 0.3 . 1 . . . . . 10 GLU CB . 51118 1
45 . 1 . 1 10 10 GLU N N 15 126.781 0.3 . 1 . . . . . 10 GLU N . 51118 1
46 . 1 . 1 11 11 THR H H 1 9.193 0.020 . 1 . . . . . 11 THR H . 51118 1
47 . 1 . 1 11 11 THR C C 13 175.942 0.3 . 1 . . . . . 11 THR C . 51118 1
48 . 1 . 1 11 11 THR CA C 13 64.163 0.3 . 1 . . . . . 11 THR CA . 51118 1
49 . 1 . 1 11 11 THR CB C 13 68.062 0.3 . 1 . . . . . 11 THR CB . 51118 1
50 . 1 . 1 11 11 THR N N 15 124.943 0.3 . 1 . . . . . 11 THR N . 51118 1
51 . 1 . 1 12 12 ASP H H 1 9.135 0.020 . 1 . . . . . 12 ASP H . 51118 1
52 . 1 . 1 12 12 ASP C C 13 176.507 0.3 . 1 . . . . . 12 ASP C . 51118 1
53 . 1 . 1 12 12 ASP CA C 13 56.134 0.3 . 1 . . . . . 12 ASP CA . 51118 1
54 . 1 . 1 12 12 ASP CB C 13 40.537 0.3 . 1 . . . . . 12 ASP CB . 51118 1
55 . 1 . 1 12 12 ASP N N 15 131.993 0.3 . 1 . . . . . 12 ASP N . 51118 1
56 . 1 . 1 13 13 GLY H H 1 8.889 0.020 . 1 . . . . . 13 GLY H . 51118 1
57 . 1 . 1 13 13 GLY C C 13 172.984 0.3 . 1 . . . . . 13 GLY C . 51118 1
58 . 1 . 1 13 13 GLY CA C 13 45.124 0.3 . 1 . . . . . 13 GLY CA . 51118 1
59 . 1 . 1 13 13 GLY N N 15 115.522 0.3 . 1 . . . . . 13 GLY N . 51118 1
60 . 1 . 1 14 14 CYS H H 1 7.747 0.020 . 1 . . . . . 14 CYS H . 51118 1
61 . 1 . 1 14 14 CYS C C 13 175.345 0.3 . 1 . . . . . 14 CYS C . 51118 1
62 . 1 . 1 14 14 CYS CA C 13 59.040 0.3 . 1 . . . . . 14 CYS CA . 51118 1
63 . 1 . 1 14 14 CYS CB C 13 31.285 0.3 . 1 . . . . . 14 CYS CB . 51118 1
64 . 1 . 1 14 14 CYS N N 15 124.319 0.3 . 1 . . . . . 14 CYS N . 51118 1
65 . 1 . 1 15 15 SER H H 1 8.764 0.020 . 1 . . . . . 15 SER H . 51118 1
66 . 1 . 1 15 15 SER C C 13 174.330 0.3 . 1 . . . . . 15 SER C . 51118 1
67 . 1 . 1 15 15 SER CA C 13 56.899 0.3 . 1 . . . . . 15 SER CA . 51118 1
68 . 1 . 1 15 15 SER CB C 13 63.704 0.3 . 1 . . . . . 15 SER CB . 51118 1
69 . 1 . 1 15 15 SER N N 15 122.291 0.3 . 1 . . . . . 15 SER N . 51118 1
70 . 1 . 1 16 16 SER H H 1 8.870 0.020 . 1 . . . . . 16 SER H . 51118 1
71 . 1 . 1 16 16 SER C C 13 172.531 0.3 . 1 . . . . . 16 SER C . 51118 1
72 . 1 . 1 16 16 SER CA C 13 59.652 0.3 . 1 . . . . . 16 SER CA . 51118 1
73 . 1 . 1 16 16 SER CB C 13 63.933 0.3 . 1 . . . . . 16 SER CB . 51118 1
74 . 1 . 1 16 16 SER N N 15 121.792 0.3 . 1 . . . . . 16 SER N . 51118 1
75 . 1 . 1 17 17 GLU H H 1 8.543 0.020 . 1 . . . . . 17 GLU H . 51118 1
76 . 1 . 1 17 17 GLU C C 13 175.969 0.3 . 1 . . . . . 17 GLU C . 51118 1
77 . 1 . 1 17 17 GLU CA C 13 57.128 0.3 . 1 . . . . . 17 GLU CA . 51118 1
78 . 1 . 1 17 17 GLU CB C 13 29.756 0.3 . 1 . . . . . 17 GLU CB . 51118 1
79 . 1 . 1 17 17 GLU N N 15 123.212 0.3 . 1 . . . . . 17 GLU N . 51118 1
80 . 1 . 1 18 18 ALA H H 1 8.418 0.020 . 1 . . . . . 18 ALA H . 51118 1
81 . 1 . 1 18 18 ALA C C 13 176.103 0.3 . 1 . . . . . 18 ALA C . 51118 1
82 . 1 . 1 18 18 ALA CA C 13 52.235 0.3 . 1 . . . . . 18 ALA CA . 51118 1
83 . 1 . 1 18 18 ALA CB C 13 20.734 0.3 . 1 . . . . . 18 ALA CB . 51118 1
84 . 1 . 1 18 18 ALA N N 15 127.059 0.3 . 1 . . . . . 18 ALA N . 51118 1
85 . 1 . 1 19 19 LYS H H 1 8.069 0.020 . 1 . . . . . 19 LYS H . 51118 1
86 . 1 . 1 19 19 LYS C C 13 174.983 0.3 . 1 . . . . . 19 LYS C . 51118 1
87 . 1 . 1 19 19 LYS CA C 13 55.676 0.3 . 1 . . . . . 19 LYS CA . 51118 1
88 . 1 . 1 19 19 LYS CB C 13 34.938 0.3 . 1 . . . . . 19 LYS CB . 51118 1
89 . 1 . 1 19 19 LYS N N 15 119.334 0.3 . 1 . . . . . 19 LYS N . 51118 1
90 . 1 . 1 20 20 LEU H H 1 7.977 0.020 . 1 . . . . . 20 LEU H . 51118 1
91 . 1 . 1 20 20 LEU C C 13 175.124 0.3 . 1 . . . . . 20 LEU C . 51118 1
92 . 1 . 1 20 20 LEU CA C 13 53.763 0.3 . 1 . . . . . 20 LEU CA . 51118 1
93 . 1 . 1 20 20 LEU CB C 13 48.058 0.3 . 1 . . . . . 20 LEU CB . 51118 1
94 . 1 . 1 20 20 LEU N N 15 121.120 0.3 . 1 . . . . . 20 LEU N . 51118 1
95 . 1 . 1 21 21 GLN H H 1 9.752 0.020 . 1 . . . . . 21 GLN H . 51118 1
96 . 1 . 1 21 21 GLN C C 13 173.614 0.3 . 1 . . . . . 21 GLN C . 51118 1
97 . 1 . 1 21 21 GLN CA C 13 53.458 0.3 . 1 . . . . . 21 GLN CA . 51118 1
98 . 1 . 1 21 21 GLN CB C 13 33.563 0.3 . 1 . . . . . 21 GLN CB . 51118 1
99 . 1 . 1 21 21 GLN N N 15 118.689 0.3 . 1 . . . . . 21 GLN N . 51118 1
100 . 1 . 1 22 22 CYS H H 1 7.739 0.020 . 1 . . . . . 22 CYS H . 51118 1
101 . 1 . 1 22 22 CYS N N 15 124.646 0.3 . 1 . . . . . 22 CYS N . 51118 1
102 . 1 . 1 23 23 PRO C C 13 178.753 0.3 . 1 . . . . . 23 PRO C . 51118 1
103 . 1 . 1 23 23 PRO CA C 13 64.021 0.3 . 1 . . . . . 23 PRO CA . 51118 1
104 . 1 . 1 23 23 PRO CB C 13 31.645 0.3 . 1 . . . . . 23 PRO CB . 51118 1
105 . 1 . 1 24 24 THR H H 1 8.186 0.020 . 1 . . . . . 24 THR H . 51118 1
106 . 1 . 1 24 24 THR C C 13 175.627 0.3 . 1 . . . . . 24 THR C . 51118 1
107 . 1 . 1 24 24 THR CA C 13 66.118 0.3 . 1 . . . . . 24 THR CA . 51118 1
108 . 1 . 1 24 24 THR CB C 13 68.394 0.3 . 1 . . . . . 24 THR CB . 51118 1
109 . 1 . 1 24 24 THR N N 15 124.117 0.3 . 1 . . . . . 24 THR N . 51118 1
110 . 1 . 1 25 25 CYS H H 1 8.712 0.020 . 1 . . . . . 25 CYS H . 51118 1
111 . 1 . 1 25 25 CYS C C 13 177.514 0.3 . 1 . . . . . 25 CYS C . 51118 1
112 . 1 . 1 25 25 CYS CA C 13 67.528 0.3 . 1 . . . . . 25 CYS CA . 51118 1
113 . 1 . 1 25 25 CYS CB C 13 27.845 0.3 . 1 . . . . . 25 CYS CB . 51118 1
114 . 1 . 1 25 25 CYS N N 15 126.176 0.3 . 1 . . . . . 25 CYS N . 51118 1
115 . 1 . 1 26 26 ILE H H 1 7.074 0.020 . 1 . . . . . 26 ILE H . 51118 1
116 . 1 . 1 26 26 ILE C C 13 179.957 0.3 . 1 . . . . . 26 ILE C . 51118 1
117 . 1 . 1 26 26 ILE CA C 13 64.989 0.3 . 1 . . . . . 26 ILE CA . 51118 1
118 . 1 . 1 26 26 ILE CB C 13 37.937 0.3 . 1 . . . . . 26 ILE CB . 51118 1
119 . 1 . 1 26 26 ILE N N 15 116.545 0.3 . 1 . . . . . 26 ILE N . 51118 1
120 . 1 . 1 27 27 LYS H H 1 7.292 0.020 . 1 . . . . . 27 LYS H . 51118 1
121 . 1 . 1 27 27 LYS C C 13 178.376 0.3 . 1 . . . . . 27 LYS C . 51118 1
122 . 1 . 1 27 27 LYS CA C 13 59.116 0.3 . 1 . . . . . 27 LYS CA . 51118 1
123 . 1 . 1 27 27 LYS CB C 13 32.126 0.3 . 1 . . . . . 27 LYS CB . 51118 1
124 . 1 . 1 27 27 LYS N N 15 120.753 0.3 . 1 . . . . . 27 LYS N . 51118 1
125 . 1 . 1 28 28 LEU H H 1 7.855 0.020 . 1 . . . . . 28 LEU H . 51118 1
126 . 1 . 1 28 28 LEU C C 13 177.055 0.3 . 1 . . . . . 28 LEU C . 51118 1
127 . 1 . 1 28 28 LEU CA C 13 54.911 0.3 . 1 . . . . . 28 LEU CA . 51118 1
128 . 1 . 1 28 28 LEU CB C 13 43.060 0.3 . 1 . . . . . 28 LEU CB . 51118 1
129 . 1 . 1 28 28 LEU N N 15 116.769 0.3 . 1 . . . . . 28 LEU N . 51118 1
130 . 1 . 1 29 29 GLY H H 1 7.848 0.020 . 1 . . . . . 29 GLY H . 51118 1
131 . 1 . 1 29 29 GLY C C 13 174.539 0.3 . 1 . . . . . 29 GLY C . 51118 1
132 . 1 . 1 29 29 GLY CA C 13 46.118 0.3 . 1 . . . . . 29 GLY CA . 51118 1
133 . 1 . 1 29 29 GLY N N 15 109.048 0.3 . 1 . . . . . 29 GLY N . 51118 1
134 . 1 . 1 30 30 ILE H H 1 8.181 0.020 . 1 . . . . . 30 ILE H . 51118 1
135 . 1 . 1 30 30 ILE C C 13 176.022 0.3 . 1 . . . . . 30 ILE C . 51118 1
136 . 1 . 1 30 30 ILE CA C 13 61.334 0.3 . 1 . . . . . 30 ILE CA . 51118 1
137 . 1 . 1 30 30 ILE CB C 13 38.855 0.3 . 1 . . . . . 30 ILE CB . 51118 1
138 . 1 . 1 30 30 ILE N N 15 122.518 0.3 . 1 . . . . . 30 ILE N . 51118 1
139 . 1 . 1 31 31 GLN H H 1 8.653 0.020 . 1 . . . . . 31 GLN H . 51118 1
140 . 1 . 1 31 31 GLN C C 13 176.616 0.3 . 1 . . . . . 31 GLN C . 51118 1
141 . 1 . 1 31 31 GLN CA C 13 55.446 0.3 . 1 . . . . . 31 GLN CA . 51118 1
142 . 1 . 1 31 31 GLN CB C 13 29.221 0.3 . 1 . . . . . 31 GLN CB . 51118 1
143 . 1 . 1 31 31 GLN N N 15 126.936 0.3 . 1 . . . . . 31 GLN N . 51118 1
144 . 1 . 1 32 32 GLY H H 1 8.119 0.020 . 1 . . . . . 32 GLY H . 51118 1
145 . 1 . 1 32 32 GLY C C 13 174.047 0.3 . 1 . . . . . 32 GLY C . 51118 1
146 . 1 . 1 32 32 GLY CA C 13 45.583 0.3 . 1 . . . . . 32 GLY CA . 51118 1
147 . 1 . 1 32 32 GLY N N 15 109.005 0.3 . 1 . . . . . 32 GLY N . 51118 1
148 . 1 . 1 33 33 SER H H 1 8.742 0.020 . 1 . . . . . 33 SER H . 51118 1
149 . 1 . 1 33 33 SER C C 13 172.348 0.3 . 1 . . . . . 33 SER C . 51118 1
150 . 1 . 1 33 33 SER CA C 13 56.345 0.3 . 1 . . . . . 33 SER CA . 51118 1
151 . 1 . 1 33 33 SER CB C 13 61.568 0.3 . 1 . . . . . 33 SER CB . 51118 1
152 . 1 . 1 33 33 SER N N 15 119.503 0.3 . 1 . . . . . 33 SER N . 51118 1
153 . 1 . 1 34 34 TYR H H 1 7.182 0.020 . 1 . . . . . 34 TYR H . 51118 1
154 . 1 . 1 34 34 TYR C C 13 173.938 0.3 . 1 . . . . . 34 TYR C . 51118 1
155 . 1 . 1 34 34 TYR CA C 13 54.247 0.3 . 1 . . . . . 34 TYR CA . 51118 1
156 . 1 . 1 34 34 TYR CB C 13 39.157 0.3 . 1 . . . . . 34 TYR CB . 51118 1
157 . 1 . 1 34 34 TYR N N 15 123.226 0.3 . 1 . . . . . 34 TYR N . 51118 1
158 . 1 . 1 35 35 PHE H H 1 8.634 0.020 . 1 . . . . . 35 PHE H . 51118 1
159 . 1 . 1 35 35 PHE C C 13 176.345 0.3 . 1 . . . . . 35 PHE C . 51118 1
160 . 1 . 1 35 35 PHE CA C 13 56.106 0.3 . 1 . . . . . 35 PHE CA . 51118 1
161 . 1 . 1 35 35 PHE CB C 13 45.777 0.3 . 1 . . . . . 35 PHE CB . 51118 1
162 . 1 . 1 35 35 PHE N N 15 116.806 0.3 . 1 . . . . . 35 PHE N . 51118 1
163 . 1 . 1 36 36 CYS H H 1 10.366 0.020 . 1 . . . . . 36 CYS H . 51118 1
164 . 1 . 1 36 36 CYS C C 13 175.789 0.3 . 1 . . . . . 36 CYS C . 51118 1
165 . 1 . 1 36 36 CYS CA C 13 59.967 0.3 . 1 . . . . . 36 CYS CA . 51118 1
166 . 1 . 1 36 36 CYS CB C 13 31.264 0.3 . 1 . . . . . 36 CYS CB . 51118 1
167 . 1 . 1 36 36 CYS N N 15 121.979 0.3 . 1 . . . . . 36 CYS N . 51118 1
168 . 1 . 1 37 37 SER H H 1 7.322 0.020 . 1 . . . . . 37 SER H . 51118 1
169 . 1 . 1 37 37 SER C C 13 172.925 0.3 . 1 . . . . . 37 SER C . 51118 1
170 . 1 . 1 37 37 SER CA C 13 57.052 0.3 . 1 . . . . . 37 SER CA . 51118 1
171 . 1 . 1 37 37 SER CB C 13 65.233 0.3 . 1 . . . . . 37 SER CB . 51118 1
172 . 1 . 1 37 37 SER N N 15 113.309 0.3 . 1 . . . . . 37 SER N . 51118 1
173 . 1 . 1 38 38 GLN H H 1 9.325 0.020 . 1 . . . . . 38 GLN H . 51118 1
174 . 1 . 1 38 38 GLN C C 13 177.759 0.3 . 1 . . . . . 38 GLN C . 51118 1
175 . 1 . 1 38 38 GLN CA C 13 58.569 0.3 . 1 . . . . . 38 GLN CA . 51118 1
176 . 1 . 1 38 38 GLN CB C 13 27.615 0.3 . 1 . . . . . 38 GLN CB . 51118 1
177 . 1 . 1 38 38 GLN N N 15 123.720 0.3 . 1 . . . . . 38 GLN N . 51118 1
178 . 1 . 1 39 39 GLU H H 1 9.072 0.020 . 1 . . . . . 39 GLU H . 51118 1
179 . 1 . 1 39 39 GLU C C 13 178.364 0.3 . 1 . . . . . 39 GLU C . 51118 1
180 . 1 . 1 39 39 GLU CA C 13 60.201 0.3 . 1 . . . . . 39 GLU CA . 51118 1
181 . 1 . 1 39 39 GLU CB C 13 29.055 0.3 . 1 . . . . . 39 GLU CB . 51118 1
182 . 1 . 1 39 39 GLU N N 15 117.486 0.3 . 1 . . . . . 39 GLU N . 51118 1
183 . 1 . 1 40 40 CYS H H 1 7.528 0.020 . 1 . . . . . 40 CYS H . 51118 1
184 . 1 . 1 40 40 CYS C C 13 178.480 0.3 . 1 . . . . . 40 CYS C . 51118 1
185 . 1 . 1 40 40 CYS CA C 13 62.808 0.3 . 1 . . . . . 40 CYS CA . 51118 1
186 . 1 . 1 40 40 CYS CB C 13 31.270 0.3 . 1 . . . . . 40 CYS CB . 51118 1
187 . 1 . 1 40 40 CYS N N 15 123.337 0.3 . 1 . . . . . 40 CYS N . 51118 1
188 . 1 . 1 41 41 PHE H H 1 7.677 0.020 . 1 . . . . . 41 PHE H . 51118 1
189 . 1 . 1 41 41 PHE C C 13 177.112 0.3 . 1 . . . . . 41 PHE C . 51118 1
190 . 1 . 1 41 41 PHE CA C 13 59.376 0.3 . 1 . . . . . 41 PHE CA . 51118 1
191 . 1 . 1 41 41 PHE CB C 13 40.694 0.3 . 1 . . . . . 41 PHE CB . 51118 1
192 . 1 . 1 41 41 PHE N N 15 118.645 0.3 . 1 . . . . . 41 PHE N . 51118 1
193 . 1 . 1 42 42 LYS H H 1 8.783 0.020 . 1 . . . . . 42 LYS H . 51118 1
194 . 1 . 1 42 42 LYS C C 13 180.281 0.3 . 1 . . . . . 42 LYS C . 51118 1
195 . 1 . 1 42 42 LYS CA C 13 59.572 0.3 . 1 . . . . . 42 LYS CA . 51118 1
196 . 1 . 1 42 42 LYS CB C 13 32.062 0.3 . 1 . . . . . 42 LYS CB . 51118 1
197 . 1 . 1 42 42 LYS N N 15 118.524 0.3 . 1 . . . . . 42 LYS N . 51118 1
198 . 1 . 1 43 43 GLY H H 1 7.765 0.020 . 1 . . . . . 43 GLY H . 51118 1
199 . 1 . 1 43 43 GLY C C 13 175.851 0.3 . 1 . . . . . 43 GLY C . 51118 1
200 . 1 . 1 43 43 GLY CA C 13 46.730 0.3 . 1 . . . . . 43 GLY CA . 51118 1
201 . 1 . 1 43 43 GLY N N 15 105.754 0.3 . 1 . . . . . 43 GLY N . 51118 1
202 . 1 . 1 44 44 SER H H 1 7.661 0.020 . 1 . . . . . 44 SER H . 51118 1
203 . 1 . 1 44 44 SER C C 13 174.749 0.3 . 1 . . . . . 44 SER C . 51118 1
204 . 1 . 1 44 44 SER CA C 13 58.442 0.3 . 1 . . . . . 44 SER CA . 51118 1
205 . 1 . 1 44 44 SER CB C 13 64.316 0.3 . 1 . . . . . 44 SER CB . 51118 1
206 . 1 . 1 44 44 SER N N 15 116.645 0.3 . 1 . . . . . 44 SER N . 51118 1
207 . 1 . 1 45 45 TRP H H 1 7.743 0.020 . 1 . . . . . 45 TRP H . 51118 1
208 . 1 . 1 45 45 TRP C C 13 175.049 0.3 . 1 . . . . . 45 TRP C . 51118 1
209 . 1 . 1 45 45 TRP CA C 13 59.572 0.3 . 1 . . . . . 45 TRP CA . 51118 1
210 . 1 . 1 45 45 TRP CB C 13 30.515 0.3 . 1 . . . . . 45 TRP CB . 51118 1
211 . 1 . 1 45 45 TRP N N 15 125.774 0.3 . 1 . . . . . 45 TRP N . 51118 1
212 . 1 . 1 46 46 ALA H H 1 8.573 0.020 . 1 . . . . . 46 ALA H . 51118 1
213 . 1 . 1 46 46 ALA C C 13 179.299 0.3 . 1 . . . . . 46 ALA C . 51118 1
214 . 1 . 1 46 46 ALA CA C 13 55.446 0.3 . 1 . . . . . 46 ALA CA . 51118 1
215 . 1 . 1 46 46 ALA CB C 13 18.058 0.3 . 1 . . . . . 46 ALA CB . 51118 1
216 . 1 . 1 46 46 ALA N N 15 116.771 0.3 . 1 . . . . . 46 ALA N . 51118 1
217 . 1 . 1 47 47 THR H H 1 7.375 0.020 . 1 . . . . . 47 THR H . 51118 1
218 . 1 . 1 47 47 THR C C 13 176.731 0.3 . 1 . . . . . 47 THR C . 51118 1
219 . 1 . 1 47 47 THR CA C 13 63.579 0.3 . 1 . . . . . 47 THR CA . 51118 1
220 . 1 . 1 47 47 THR CB C 13 68.903 0.3 . 1 . . . . . 47 THR CB . 51118 1
221 . 1 . 1 47 47 THR N N 15 107.243 0.3 . 1 . . . . . 47 THR N . 51118 1
222 . 1 . 1 48 48 HIS H H 1 8.868 0.020 . 1 . . . . . 48 HIS H . 51118 1
223 . 1 . 1 48 48 HIS C C 13 176.333 0.3 . 1 . . . . . 48 HIS C . 51118 1
224 . 1 . 1 48 48 HIS CA C 13 60.300 0.3 . 1 . . . . . 48 HIS CA . 51118 1
225 . 1 . 1 48 48 HIS CB C 13 28.915 0.3 . 1 . . . . . 48 HIS CB . 51118 1
226 . 1 . 1 48 48 HIS N N 15 124.745 0.3 . 1 . . . . . 48 HIS N . 51118 1
227 . 1 . 1 49 49 LYS H H 1 8.165 0.020 . 1 . . . . . 49 LYS H . 51118 1
228 . 1 . 1 49 49 LYS C C 13 177.429 0.3 . 1 . . . . . 49 LYS C . 51118 1
229 . 1 . 1 49 49 LYS CA C 13 57.924 0.3 . 1 . . . . . 49 LYS CA . 51118 1
230 . 1 . 1 49 49 LYS CB C 13 29.333 0.3 . 1 . . . . . 49 LYS CB . 51118 1
231 . 1 . 1 49 49 LYS N N 15 112.934 0.3 . 1 . . . . . 49 LYS N . 51118 1
232 . 1 . 1 50 50 LEU H H 1 6.774 0.020 . 1 . . . . . 50 LEU H . 51118 1
233 . 1 . 1 50 50 LEU C C 13 179.625 0.3 . 1 . . . . . 50 LEU C . 51118 1
234 . 1 . 1 50 50 LEU CA C 13 56.823 0.3 . 1 . . . . . 50 LEU CA . 51118 1
235 . 1 . 1 50 50 LEU CB C 13 40.537 0.3 . 1 . . . . . 50 LEU CB . 51118 1
236 . 1 . 1 50 50 LEU N N 15 120.378 0.3 . 1 . . . . . 50 LEU N . 51118 1
237 . 1 . 1 51 51 LEU H H 1 7.722 0.020 . 1 . . . . . 51 LEU H . 51118 1
238 . 1 . 1 51 51 LEU C C 13 178.934 0.3 . 1 . . . . . 51 LEU C . 51118 1
239 . 1 . 1 51 51 LEU CA C 13 56.670 0.3 . 1 . . . . . 51 LEU CA . 51118 1
240 . 1 . 1 51 51 LEU CB C 13 41.378 0.3 . 1 . . . . . 51 LEU CB . 51118 1
241 . 1 . 1 51 51 LEU N N 15 118.701 0.3 . 1 . . . . . 51 LEU N . 51118 1
242 . 1 . 1 52 52 HIS H H 1 6.894 0.020 . 1 . . . . . 52 HIS H . 51118 1
243 . 1 . 1 52 52 HIS C C 13 175.421 0.3 . 1 . . . . . 52 HIS C . 51118 1
244 . 1 . 1 52 52 HIS CA C 13 54.570 0.3 . 1 . . . . . 52 HIS CA . 51118 1
245 . 1 . 1 52 52 HIS CB C 13 28.232 0.3 . 1 . . . . . 52 HIS CB . 51118 1
246 . 1 . 1 52 52 HIS N N 15 115.160 0.3 . 1 . . . . . 52 HIS N . 51118 1
247 . 1 . 1 53 53 LYS H H 1 7.157 0.020 . 1 . . . . . 53 LYS H . 51118 1
248 . 1 . 1 53 53 LYS C C 13 176.698 0.3 . 1 . . . . . 53 LYS C . 51118 1
249 . 1 . 1 53 53 LYS CA C 13 57.461 0.3 . 1 . . . . . 53 LYS CA . 51118 1
250 . 1 . 1 53 53 LYS CB C 13 32.774 0.3 . 1 . . . . . 53 LYS CB . 51118 1
251 . 1 . 1 53 53 LYS N N 15 118.801 0.3 . 1 . . . . . 53 LYS N . 51118 1
252 . 1 . 1 54 54 LYS H H 1 7.836 0.020 . 1 . . . . . 54 LYS H . 51118 1
253 . 1 . 1 54 54 LYS C C 13 177.142 0.3 . 1 . . . . . 54 LYS C . 51118 1
254 . 1 . 1 54 54 LYS CA C 13 57.474 0.3 . 1 . . . . . 54 LYS CA . 51118 1
255 . 1 . 1 54 54 LYS CB C 13 32.627 0.3 . 1 . . . . . 54 LYS CB . 51118 1
256 . 1 . 1 54 54 LYS N N 15 120.097 0.3 . 1 . . . . . 54 LYS N . 51118 1
257 . 1 . 1 55 55 ALA H H 1 7.900 0.020 . 1 . . . . . 55 ALA H . 51118 1
258 . 1 . 1 55 55 ALA C C 13 177.813 0.3 . 1 . . . . . 55 ALA C . 51118 1
259 . 1 . 1 55 55 ALA CA C 13 53.198 0.3 . 1 . . . . . 55 ALA CA . 51118 1
260 . 1 . 1 55 55 ALA CB C 13 19.434 0.3 . 1 . . . . . 55 ALA CB . 51118 1
261 . 1 . 1 55 55 ALA N N 15 122.790 0.3 . 1 . . . . . 55 ALA N . 51118 1
262 . 1 . 1 56 56 LYS H H 1 8.047 0.020 . 1 . . . . . 56 LYS H . 51118 1
263 . 1 . 1 56 56 LYS C C 13 176.816 0.3 . 1 . . . . . 56 LYS C . 51118 1
264 . 1 . 1 56 56 LYS CA C 13 57.166 0.3 . 1 . . . . . 56 LYS CA . 51118 1
265 . 1 . 1 56 56 LYS CB C 13 32.891 0.3 . 1 . . . . . 56 LYS CB . 51118 1
266 . 1 . 1 56 56 LYS N N 15 119.086 0.3 . 1 . . . . . 56 LYS N . 51118 1
267 . 1 . 1 57 57 ASP H H 1 8.191 0.020 . 1 . . . . . 57 ASP H . 51118 1
268 . 1 . 1 57 57 ASP C C 13 176.255 0.3 . 1 . . . . . 57 ASP C . 51118 1
269 . 1 . 1 57 57 ASP CA C 13 54.652 0.3 . 1 . . . . . 57 ASP CA . 51118 1
270 . 1 . 1 57 57 ASP CB C 13 40.919 0.3 . 1 . . . . . 57 ASP CB . 51118 1
271 . 1 . 1 57 57 ASP N N 15 120.580 0.3 . 1 . . . . . 57 ASP N . 51118 1
272 . 1 . 1 58 58 GLU H H 1 8.040 0.020 . 1 . . . . . 58 GLU H . 51118 1
273 . 1 . 1 58 58 GLU C C 13 175.495 0.3 . 1 . . . . . 58 GLU C . 51118 1
274 . 1 . 1 58 58 GLU CA C 13 56.517 0.3 . 1 . . . . . 58 GLU CA . 51118 1
275 . 1 . 1 58 58 GLU CB C 13 30.314 0.3 . 1 . . . . . 58 GLU CB . 51118 1
276 . 1 . 1 58 58 GLU N N 15 120.842 0.3 . 1 . . . . . 58 GLU N . 51118 1
277 . 1 . 1 59 59 LYS H H 1 7.865 0.020 . 1 . . . . . 59 LYS H . 51118 1
278 . 1 . 1 59 59 LYS CA C 13 57.664 0.3 . 1 . . . . . 59 LYS CA . 51118 1
279 . 1 . 1 59 59 LYS CB C 13 33.502 0.3 . 1 . . . . . 59 LYS CB . 51118 1
280 . 1 . 1 59 59 LYS N N 15 127.346 0.3 . 1 . . . . . 59 LYS N . 51118 1
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