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 27516
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 $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-15N HSQC' . . . 27516 1
2 '3D HNCA' . . . 27516 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 $xwinnmr . . 27516 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 22 22 PRO CA C 13 62.931 0.00 . 1 . . . . . 2 PRO CA . 27516 1
2 . 1 . 1 23 23 THR H H 1 8.177 0.00 . 1 . . . . . 3 THR H . 27516 1
3 . 1 . 1 23 23 THR CA C 13 61.584 0.01 . 1 . . . . . 3 THR CA . 27516 1
4 . 1 . 1 23 23 THR N N 15 114.096 0.01 . 1 . . . . . 3 THR N . 27516 1
5 . 1 . 1 24 24 GLY H H 1 8.259 0.00 . 1 . . . . . 4 GLY H . 27516 1
6 . 1 . 1 24 24 GLY CA C 13 44.858 0.02 . 1 . . . . . 4 GLY CA . 27516 1
7 . 1 . 1 24 24 GLY N N 15 111.439 0.03 . 1 . . . . . 4 GLY N . 27516 1
8 . 1 . 1 25 25 THR H H 1 8.038 0.00 . 1 . . . . . 5 THR H . 27516 1
9 . 1 . 1 25 25 THR CA C 13 61.532 0.05 . 1 . . . . . 5 THR CA . 27516 1
10 . 1 . 1 25 25 THR N N 15 113.440 0.02 . 1 . . . . . 5 THR N . 27516 1
11 . 1 . 1 26 26 GLY H H 1 8.342 0.00 . 1 . . . . . 6 GLY H . 27516 1
12 . 1 . 1 26 26 GLY CA C 13 44.800 0.01 . 1 . . . . . 6 GLY CA . 27516 1
13 . 1 . 1 26 26 GLY N N 15 111.466 0.02 . 1 . . . . . 6 GLY N . 27516 1
14 . 1 . 1 27 27 GLU H H 1 8.114 0.00 . 1 . . . . . 7 GLU H . 27516 1
15 . 1 . 1 27 27 GLU CA C 13 56.078 0.01 . 1 . . . . . 7 GLU CA . 27516 1
16 . 1 . 1 27 27 GLU N N 15 121.024 0.01 . 1 . . . . . 7 GLU N . 27516 1
17 . 1 . 1 28 28 SER H H 1 8.251 0.00 . 1 . . . . . 8 SER H . 27516 1
18 . 1 . 1 28 28 SER CA C 13 58.132 0.02 . 1 . . . . . 8 SER CA . 27516 1
19 . 1 . 1 28 28 SER N N 15 117.460 0.01 . 1 . . . . . 8 SER N . 27516 1
20 . 1 . 1 29 29 LYS H H 1 8.355 0.00 . 1 . . . . . 9 LYS H . 27516 1
21 . 1 . 1 29 29 LYS CA C 13 55.285 0.07 . 1 . . . . . 9 LYS CA . 27516 1
22 . 1 . 1 29 29 LYS N N 15 123.633 0.00 . 1 . . . . . 9 LYS N . 27516 1
23 . 1 . 1 30 30 CYS H H 1 8.168 0.00 . 1 . . . . . 10 CYS H . 27516 1
24 . 1 . 1 30 30 CYS N N 15 122.610 0.03 . 1 . . . . . 10 CYS N . 27516 1
25 . 1 . 1 31 31 PRO CA C 13 63.961 0.00 . 1 . . . . . 11 PRO CA . 27516 1
26 . 1 . 1 32 32 LEU H H 1 6.863 0.00 . 1 . . . . . 12 LEU H . 27516 1
27 . 1 . 1 32 32 LEU CA C 13 53.345 0.01 . 1 . . . . . 12 LEU CA . 27516 1
28 . 1 . 1 32 32 LEU N N 15 120.809 0.00 . 1 . . . . . 12 LEU N . 27516 1
29 . 1 . 1 33 33 MET H H 1 8.628 0.00 . 1 . . . . . 13 MET H . 27516 1
30 . 1 . 1 33 33 MET CA C 13 54.255 0.02 . 1 . . . . . 13 MET CA . 27516 1
31 . 1 . 1 33 33 MET N N 15 127.041 0.02 . 1 . . . . . 13 MET N . 27516 1
32 . 1 . 1 34 34 VAL H H 1 7.356 0.01 . 1 . . . . . 14 VAL H . 27516 1
33 . 1 . 1 34 34 VAL CA C 13 59.731 0.00 . 1 . . . . . 14 VAL CA . 27516 1
34 . 1 . 1 34 34 VAL N N 15 122.603 0.02 . 1 . . . . . 14 VAL N . 27516 1
35 . 1 . 1 35 35 LYS H H 1 8.683 0.00 . 1 . . . . . 15 LYS H . 27516 1
36 . 1 . 1 35 35 LYS CA C 13 54.180 0.00 . 1 . . . . . 15 LYS CA . 27516 1
37 . 1 . 1 35 35 LYS N N 15 127.422 0.01 . 1 . . . . . 15 LYS N . 27516 1
38 . 1 . 1 36 36 VAL H H 1 8.941 0.00 . 1 . . . . . 16 VAL H . 27516 1
39 . 1 . 1 36 36 VAL CA C 13 60.467 0.00 . 1 . . . . . 16 VAL CA . 27516 1
40 . 1 . 1 36 36 VAL N N 15 124.401 0.01 . 1 . . . . . 16 VAL N . 27516 1
41 . 1 . 1 37 37 LEU H H 1 8.461 0.00 . 1 . . . . . 17 LEU H . 27516 1
42 . 1 . 1 37 37 LEU CA C 13 53.373 0.01 . 1 . . . . . 17 LEU CA . 27516 1
43 . 1 . 1 37 37 LEU N N 15 126.862 0.01 . 1 . . . . . 17 LEU N . 27516 1
44 . 1 . 1 38 38 ASP H H 1 8.576 0.00 . 1 . . . . . 18 ASP H . 27516 1
45 . 1 . 1 38 38 ASP CA C 13 52.795 0.01 . 1 . . . . . 18 ASP CA . 27516 1
46 . 1 . 1 38 38 ASP N N 15 121.901 0.02 . 1 . . . . . 18 ASP N . 27516 1
47 . 1 . 1 39 39 ALA H H 1 8.974 0.00 . 1 . . . . . 19 ALA H . 27516 1
48 . 1 . 1 39 39 ALA CA C 13 53.232 0.00 . 1 . . . . . 19 ALA CA . 27516 1
49 . 1 . 1 39 39 ALA N N 15 127.854 0.00 . 1 . . . . . 19 ALA N . 27516 1
50 . 1 . 1 40 40 VAL H H 1 9.574 0.00 . 1 . . . . . 20 VAL H . 27516 1
51 . 1 . 1 40 40 VAL CA C 13 65.134 0.01 . 1 . . . . . 20 VAL CA . 27516 1
52 . 1 . 1 40 40 VAL N N 15 120.655 0.04 . 1 . . . . . 20 VAL N . 27516 1
53 . 1 . 1 41 41 ARG H H 1 8.181 0.01 . 1 . . . . . 21 ARG H . 27516 1
54 . 1 . 1 41 41 ARG CA C 13 55.054 0.00 . 1 . . . . . 21 ARG CA . 27516 1
55 . 1 . 1 41 41 ARG N N 15 117.069 0.00 . 1 . . . . . 21 ARG N . 27516 1
56 . 1 . 1 42 42 GLY H H 1 7.398 0.01 . 1 . . . . . 22 GLY H . 27516 1
57 . 1 . 1 42 42 GLY CA C 13 46.585 0.04 . 1 . . . . . 22 GLY CA . 27516 1
58 . 1 . 1 42 42 GLY N N 15 109.908 0.03 . 1 . . . . . 22 GLY N . 27516 1
59 . 1 . 1 43 43 SER H H 1 7.337 0.00 . 1 . . . . . 23 SER H . 27516 1
60 . 1 . 1 43 43 SER CA C 13 54.874 0.00 . 1 . . . . . 23 SER CA . 27516 1
61 . 1 . 1 43 43 SER N N 15 111.830 0.01 . 1 . . . . . 23 SER N . 27516 1
62 . 1 . 1 44 44 PRO CA C 13 62.584 0.00 . 1 . . . . . 24 PRO CA . 27516 1
63 . 1 . 1 45 45 ALA H H 1 8.019 0.00 . 1 . . . . . 25 ALA H . 27516 1
64 . 1 . 1 45 45 ALA CA C 13 50.253 0.00 . 1 . . . . . 25 ALA CA . 27516 1
65 . 1 . 1 45 45 ALA N N 15 127.698 0.02 . 1 . . . . . 25 ALA N . 27516 1
66 . 1 . 1 46 46 ILE H H 1 7.843 0.00 . 1 . . . . . 26 ILE H . 27516 1
67 . 1 . 1 46 46 ILE CA C 13 61.439 0.01 . 1 . . . . . 26 ILE CA . 27516 1
68 . 1 . 1 46 46 ILE N N 15 127.438 0.00 . 1 . . . . . 26 ILE N . 27516 1
69 . 1 . 1 47 47 ASN H H 1 7.716 0.00 . 1 . . . . . 27 ASN H . 27516 1
70 . 1 . 1 47 47 ASN CA C 13 53.999 0.02 . 1 . . . . . 27 ASN CA . 27516 1
71 . 1 . 1 47 47 ASN N N 15 122.791 0.03 . 1 . . . . . 27 ASN N . 27516 1
72 . 1 . 1 48 48 VAL H H 1 8.315 0.01 . 1 . . . . . 28 VAL H . 27516 1
73 . 1 . 1 48 48 VAL CA C 13 61.405 0.01 . 1 . . . . . 28 VAL CA . 27516 1
74 . 1 . 1 48 48 VAL N N 15 120.544 0.14 . 1 . . . . . 28 VAL N . 27516 1
75 . 1 . 1 49 49 ALA H H 1 9.091 0.00 . 1 . . . . . 29 ALA H . 27516 1
76 . 1 . 1 49 49 ALA CA C 13 52.311 0.01 . 1 . . . . . 29 ALA CA . 27516 1
77 . 1 . 1 49 49 ALA N N 15 131.159 0.00 . 1 . . . . . 29 ALA N . 27516 1
78 . 1 . 1 50 50 VAL H H 1 8.290 0.00 . 1 . . . . . 30 VAL H . 27516 1
79 . 1 . 1 50 50 VAL CA C 13 60.225 0.00 . 1 . . . . . 30 VAL CA . 27516 1
80 . 1 . 1 50 50 VAL N N 15 122.593 0.01 . 1 . . . . . 30 VAL N . 27516 1
81 . 1 . 1 51 51 HIS H H 1 8.915 0.00 . 1 . . . . . 31 HIS H . 27516 1
82 . 1 . 1 51 51 HIS CA C 13 54.778 0.00 . 1 . . . . . 31 HIS CA . 27516 1
83 . 1 . 1 51 51 HIS N N 15 124.725 0.03 . 1 . . . . . 31 HIS N . 27516 1
84 . 1 . 1 52 52 VAL H H 1 9.162 0.00 . 1 . . . . . 32 VAL H . 27516 1
85 . 1 . 1 52 52 VAL CA C 13 59.609 0.02 . 1 . . . . . 32 VAL CA . 27516 1
86 . 1 . 1 52 52 VAL N N 15 122.072 0.01 . 1 . . . . . 32 VAL N . 27516 1
87 . 1 . 1 53 53 PHE H H 1 9.859 0.00 . 1 . . . . . 33 PHE H . 27516 1
88 . 1 . 1 53 53 PHE CA C 13 55.898 0.01 . 1 . . . . . 33 PHE CA . 27516 1
89 . 1 . 1 53 53 PHE N N 15 128.708 0.02 . 1 . . . . . 33 PHE N . 27516 1
90 . 1 . 1 54 54 ARG H H 1 9.412 0.00 . 1 . . . . . 34 ARG H . 27516 1
91 . 1 . 1 54 54 ARG CA C 13 53.805 0.02 . 1 . . . . . 34 ARG CA . 27516 1
92 . 1 . 1 54 54 ARG N N 15 122.887 0.00 . 1 . . . . . 34 ARG N . 27516 1
93 . 1 . 1 55 55 LYS H H 1 8.535 0.00 . 1 . . . . . 35 LYS H . 27516 1
94 . 1 . 1 55 55 LYS CA C 13 56.946 0.00 . 1 . . . . . 35 LYS CA . 27516 1
95 . 1 . 1 55 55 LYS N N 15 130.620 0.02 . 1 . . . . . 35 LYS N . 27516 1
96 . 1 . 1 56 56 ALA H H 1 8.760 0.00 . 1 . . . . . 36 ALA H . 27516 1
97 . 1 . 1 56 56 ALA CA C 13 50.566 0.01 . 1 . . . . . 36 ALA CA . 27516 1
98 . 1 . 1 56 56 ALA N N 15 131.715 0.01 . 1 . . . . . 36 ALA N . 27516 1
99 . 1 . 1 57 57 ALA H H 1 8.353 0.00 . 1 . . . . . 37 ALA H . 27516 1
100 . 1 . 1 57 57 ALA CA C 13 53.770 0.00 . 1 . . . . . 37 ALA CA . 27516 1
101 . 1 . 1 57 57 ALA N N 15 122.715 0.02 . 1 . . . . . 37 ALA N . 27516 1
102 . 1 . 1 58 58 ASP H H 1 7.618 0.00 . 1 . . . . . 38 ASP H . 27516 1
103 . 1 . 1 58 58 ASP CA C 13 52.713 0.02 . 1 . . . . . 38 ASP CA . 27516 1
104 . 1 . 1 58 58 ASP N N 15 115.986 0.01 . 1 . . . . . 38 ASP N . 27516 1
105 . 1 . 1 59 59 ASP H H 1 7.836 0.00 . 1 . . . . . 39 ASP H . 27516 1
106 . 1 . 1 59 59 ASP CA C 13 55.808 0.02 . 1 . . . . . 39 ASP CA . 27516 1
107 . 1 . 1 59 59 ASP N N 15 113.267 0.02 . 1 . . . . . 39 ASP N . 27516 1
108 . 1 . 1 60 60 THR H H 1 7.184 0.00 . 1 . . . . . 40 THR H . 27516 1
109 . 1 . 1 60 60 THR CA C 13 61.111 0.02 . 1 . . . . . 40 THR CA . 27516 1
110 . 1 . 1 60 60 THR N N 15 110.961 0.01 . 1 . . . . . 40 THR N . 27516 1
111 . 1 . 1 61 61 TRP H H 1 8.339 0.00 . 1 . . . . . 41 TRP H . 27516 1
112 . 1 . 1 61 61 TRP CA C 13 55.269 0.01 . 1 . . . . . 41 TRP CA . 27516 1
113 . 1 . 1 61 61 TRP N N 15 120.334 0.03 . 1 . . . . . 41 TRP N . 27516 1
114 . 1 . 1 62 62 GLU H H 1 9.161 0.00 . 1 . . . . . 42 GLU H . 27516 1
115 . 1 . 1 62 62 GLU CA C 13 52.783 0.00 . 1 . . . . . 42 GLU CA . 27516 1
116 . 1 . 1 62 62 GLU N N 15 127.099 0.01 . 1 . . . . . 42 GLU N . 27516 1
117 . 1 . 1 63 63 PRO CA C 13 64.528 0.00 . 1 . . . . . 43 PRO CA . 27516 1
118 . 1 . 1 64 64 PHE H H 1 8.759 0.00 . 1 . . . . . 44 PHE H . 27516 1
119 . 1 . 1 64 64 PHE CA C 13 58.796 0.01 . 1 . . . . . 44 PHE CA . 27516 1
120 . 1 . 1 64 64 PHE N N 15 125.505 0.00 . 1 . . . . . 44 PHE N . 27516 1
121 . 1 . 1 65 65 ALA H H 1 7.816 0.00 . 1 . . . . . 45 ALA H . 27516 1
122 . 1 . 1 65 65 ALA CA C 13 51.993 0.00 . 1 . . . . . 45 ALA CA . 27516 1
123 . 1 . 1 65 65 ALA N N 15 119.292 0.04 . 1 . . . . . 45 ALA N . 27516 1
124 . 1 . 1 66 66 SER H H 1 8.477 0.00 . 1 . . . . . 46 SER H . 27516 1
125 . 1 . 1 66 66 SER CA C 13 57.463 0.01 . 1 . . . . . 46 SER CA . 27516 1
126 . 1 . 1 66 66 SER N N 15 113.610 0.02 . 1 . . . . . 46 SER N . 27516 1
127 . 1 . 1 67 67 GLY H H 1 8.357 0.00 . 1 . . . . . 47 GLY H . 27516 1
128 . 1 . 1 67 67 GLY CA C 13 45.204 0.01 . 1 . . . . . 47 GLY CA . 27516 1
129 . 1 . 1 67 67 GLY N N 15 107.135 0.05 . 1 . . . . . 47 GLY N . 27516 1
130 . 1 . 1 68 68 LYS H H 1 8.411 0.00 . 1 . . . . . 48 LYS H . 27516 1
131 . 1 . 1 68 68 LYS CA C 13 53.329 0.01 . 1 . . . . . 48 LYS CA . 27516 1
132 . 1 . 1 68 68 LYS N N 15 120.510 0.02 . 1 . . . . . 48 LYS N . 27516 1
133 . 1 . 1 69 69 THR H H 1 8.600 0.00 . 1 . . . . . 49 THR H . 27516 1
134 . 1 . 1 69 69 THR CA C 13 61.849 0.01 . 1 . . . . . 49 THR CA . 27516 1
135 . 1 . 1 69 69 THR N N 15 112.090 0.01 . 1 . . . . . 49 THR N . 27516 1
136 . 1 . 1 70 70 SER H H 1 8.470 0.00 . 1 . . . . . 50 SER H . 27516 1
137 . 1 . 1 70 70 SER CA C 13 56.867 0.00 . 1 . . . . . 50 SER CA . 27516 1
138 . 1 . 1 70 70 SER N N 15 118.714 0.02 . 1 . . . . . 50 SER N . 27516 1
139 . 1 . 1 71 71 GLU H H 1 8.970 0.00 . 1 . . . . . 51 GLU H . 27516 1
140 . 1 . 1 71 71 GLU CA C 13 58.697 0.02 . 1 . . . . . 51 GLU CA . 27516 1
141 . 1 . 1 71 71 GLU N N 15 118.794 0.01 . 1 . . . . . 51 GLU N . 27516 1
142 . 1 . 1 72 72 SER H H 1 8.028 0.00 . 1 . . . . . 52 SER H . 27516 1
143 . 1 . 1 72 72 SER CA C 13 57.264 0.03 . 1 . . . . . 52 SER CA . 27516 1
144 . 1 . 1 72 72 SER N N 15 112.043 0.03 . 1 . . . . . 52 SER N . 27516 1
145 . 1 . 1 73 73 GLY H H 1 8.453 0.00 . 1 . . . . . 53 GLY H . 27516 1
146 . 1 . 1 73 73 GLY CA C 13 45.007 0.01 . 1 . . . . . 53 GLY CA . 27516 1
147 . 1 . 1 73 73 GLY N N 15 112.659 0.04 . 1 . . . . . 53 GLY N . 27516 1
148 . 1 . 1 74 74 GLU H H 1 7.080 0.00 . 1 . . . . . 54 GLU H . 27516 1
149 . 1 . 1 74 74 GLU CA C 13 54.001 0.03 . 1 . . . . . 54 GLU CA . 27516 1
150 . 1 . 1 74 74 GLU N N 15 116.061 0.01 . 1 . . . . . 54 GLU N . 27516 1
151 . 1 . 1 75 75 LEU H H 1 8.525 0.00 . 1 . . . . . 55 LEU H . 27516 1
152 . 1 . 1 75 75 LEU CA C 13 53.555 0.00 . 1 . . . . . 55 LEU CA . 27516 1
153 . 1 . 1 75 75 LEU N N 15 123.903 0.00 . 1 . . . . . 55 LEU N . 27516 1
154 . 1 . 1 76 76 HIS CA C 13 55.524 0.00 . 1 . . . . . 56 HIS CA . 27516 1
155 . 1 . 1 77 77 GLY H H 1 8.133 0.01 . 1 . . . . . 57 GLY H . 27516 1
156 . 1 . 1 77 77 GLY CA C 13 46.224 0.07 . 1 . . . . . 57 GLY CA . 27516 1
157 . 1 . 1 77 77 GLY N N 15 108.874 0.01 . 1 . . . . . 57 GLY N . 27516 1
158 . 1 . 1 78 78 LEU H H 1 8.322 0.00 . 1 . . . . . 58 LEU H . 27516 1
159 . 1 . 1 78 78 LEU N N 15 120.340 0.00 . 1 . . . . . 58 LEU N . 27516 1
160 . 1 . 1 79 79 THR H H 1 7.154 0.01 . 1 . . . . . 59 THR H . 27516 1
161 . 1 . 1 79 79 THR CA C 13 59.112 0.04 . 1 . . . . . 59 THR CA . 27516 1
162 . 1 . 1 79 79 THR N N 15 107.820 0.05 . 1 . . . . . 59 THR N . 27516 1
163 . 1 . 1 80 80 THR H H 1 8.416 0.00 . 1 . . . . . 60 THR H . 27516 1
164 . 1 . 1 80 80 THR CA C 13 59.172 0.02 . 1 . . . . . 60 THR CA . 27516 1
165 . 1 . 1 80 80 THR N N 15 112.137 0.02 . 1 . . . . . 60 THR N . 27516 1
166 . 1 . 1 81 81 GLU H H 1 8.957 0.00 . 1 . . . . . 61 GLU H . 27516 1
167 . 1 . 1 81 81 GLU CA C 13 59.572 0.02 . 1 . . . . . 61 GLU CA . 27516 1
168 . 1 . 1 81 81 GLU N N 15 121.223 0.01 . 1 . . . . . 61 GLU N . 27516 1
169 . 1 . 1 82 82 GLU H H 1 8.568 0.00 . 1 . . . . . 62 GLU H . 27516 1
170 . 1 . 1 82 82 GLU CA C 13 58.755 0.02 . 1 . . . . . 62 GLU CA . 27516 1
171 . 1 . 1 82 82 GLU N N 15 116.415 0.01 . 1 . . . . . 62 GLU N . 27516 1
172 . 1 . 1 83 83 GLU H H 1 7.208 0.00 . 1 . . . . . 63 GLU H . 27516 1
173 . 1 . 1 83 83 GLU CA C 13 56.738 0.02 . 1 . . . . . 63 GLU CA . 27516 1
174 . 1 . 1 83 83 GLU N N 15 115.913 0.07 . 1 . . . . . 63 GLU N . 27516 1
175 . 1 . 1 84 84 PHE H H 1 7.761 0.00 . 1 . . . . . 64 PHE H . 27516 1
176 . 1 . 1 84 84 PHE CA C 13 54.913 0.01 . 1 . . . . . 64 PHE CA . 27516 1
177 . 1 . 1 84 84 PHE N N 15 124.063 0.02 . 1 . . . . . 64 PHE N . 27516 1
178 . 1 . 1 85 85 VAL H H 1 7.040 0.00 . 1 . . . . . 65 VAL H . 27516 1
179 . 1 . 1 85 85 VAL CA C 13 59.754 0.01 . 1 . . . . . 65 VAL CA . 27516 1
180 . 1 . 1 85 85 VAL N N 15 115.727 0.03 . 1 . . . . . 65 VAL N . 27516 1
181 . 1 . 1 86 86 GLU H H 1 8.505 0.00 . 1 . . . . . 66 GLU H . 27516 1
182 . 1 . 1 86 86 GLU CA C 13 56.549 0.01 . 1 . . . . . 66 GLU CA . 27516 1
183 . 1 . 1 86 86 GLU N N 15 121.981 0.03 . 1 . . . . . 66 GLU N . 27516 1
184 . 1 . 1 87 87 GLY H H 1 7.844 0.00 . 1 . . . . . 67 GLY H . 27516 1
185 . 1 . 1 87 87 GLY CA C 13 44.204 0.02 . 1 . . . . . 67 GLY CA . 27516 1
186 . 1 . 1 87 87 GLY N N 15 111.473 0.01 . 1 . . . . . 67 GLY N . 27516 1
187 . 1 . 1 88 88 ILE H H 1 8.228 0.00 . 1 . . . . . 68 ILE H . 27516 1
188 . 1 . 1 88 88 ILE CA C 13 60.529 0.02 . 1 . . . . . 68 ILE CA . 27516 1
189 . 1 . 1 88 88 ILE N N 15 120.864 0.01 . 1 . . . . . 68 ILE N . 27516 1
190 . 1 . 1 89 89 TYR H H 1 8.557 0.00 . 1 . . . . . 69 TYR H . 27516 1
191 . 1 . 1 89 89 TYR CA C 13 56.091 0.02 . 1 . . . . . 69 TYR CA . 27516 1
192 . 1 . 1 89 89 TYR N N 15 125.209 0.02 . 1 . . . . . 69 TYR N . 27516 1
193 . 1 . 1 90 90 LYS H H 1 8.581 0.00 . 1 . . . . . 70 LYS H . 27516 1
194 . 1 . 1 90 90 LYS CA C 13 53.176 0.00 . 1 . . . . . 70 LYS CA . 27516 1
195 . 1 . 1 90 90 LYS N N 15 118.864 0.01 . 1 . . . . . 70 LYS N . 27516 1
196 . 1 . 1 91 91 VAL H H 1 9.558 0.00 . 1 . . . . . 71 VAL H . 27516 1
197 . 1 . 1 91 91 VAL CA C 13 60.745 0.00 . 1 . . . . . 71 VAL CA . 27516 1
198 . 1 . 1 91 91 VAL N N 15 127.758 0.00 . 1 . . . . . 71 VAL N . 27516 1
199 . 1 . 1 92 92 GLU H H 1 9.668 0.00 . 1 . . . . . 72 GLU H . 27516 1
200 . 1 . 1 92 92 GLU CA C 13 54.794 0.05 . 1 . . . . . 72 GLU CA . 27516 1
201 . 1 . 1 92 92 GLU N N 15 128.737 0.01 . 1 . . . . . 72 GLU N . 27516 1
202 . 1 . 1 93 93 ILE H H 1 9.134 0.00 . 1 . . . . . 73 ILE H . 27516 1
203 . 1 . 1 93 93 ILE CA C 13 60.006 0.00 . 1 . . . . . 73 ILE CA . 27516 1
204 . 1 . 1 93 93 ILE N N 15 126.539 0.03 . 1 . . . . . 73 ILE N . 27516 1
205 . 1 . 1 94 94 ASP H H 1 8.839 0.00 . 1 . . . . . 74 ASP H . 27516 1
206 . 1 . 1 94 94 ASP CA C 13 52.900 0.03 . 1 . . . . . 74 ASP CA . 27516 1
207 . 1 . 1 94 94 ASP N N 15 128.426 0.01 . 1 . . . . . 74 ASP N . 27516 1
208 . 1 . 1 95 95 THR H H 1 8.163 0.00 . 1 . . . . . 75 THR H . 27516 1
209 . 1 . 1 95 95 THR CA C 13 64.376 0.11 . 1 . . . . . 75 THR CA . 27516 1
210 . 1 . 1 95 95 THR N N 15 117.949 0.01 . 1 . . . . . 75 THR N . 27516 1
211 . 1 . 1 96 96 LYS H H 1 7.589 0.00 . 1 . . . . . 76 LYS H . 27516 1
212 . 1 . 1 96 96 LYS CA C 13 60.021 0.02 . 1 . . . . . 76 LYS CA . 27516 1
213 . 1 . 1 96 96 LYS N N 15 124.886 0.04 . 1 . . . . . 76 LYS N . 27516 1
214 . 1 . 1 97 97 SER H H 1 8.077 0.00 . 1 . . . . . 77 SER H . 27516 1
215 . 1 . 1 97 97 SER CA C 13 61.501 0.01 . 1 . . . . . 77 SER CA . 27516 1
216 . 1 . 1 97 97 SER N N 15 113.424 0.02 . 1 . . . . . 77 SER N . 27516 1
217 . 1 . 1 98 98 TYR H H 1 6.680 0.00 . 1 . . . . . 78 TYR H . 27516 1
218 . 1 . 1 98 98 TYR CA C 13 60.802 0.02 . 1 . . . . . 78 TYR CA . 27516 1
219 . 1 . 1 98 98 TYR N N 15 121.570 0.01 . 1 . . . . . 78 TYR N . 27516 1
220 . 1 . 1 99 99 TRP H H 1 7.735 0.01 . 1 . . . . . 79 TRP H . 27516 1
221 . 1 . 1 99 99 TRP CA C 13 58.971 0.02 . 1 . . . . . 79 TRP CA . 27516 1
222 . 1 . 1 99 99 TRP N N 15 117.833 0.03 . 1 . . . . . 79 TRP N . 27516 1
223 . 1 . 1 100 100 LYS H H 1 8.687 0.00 . 1 . . . . . 80 LYS H . 27516 1
224 . 1 . 1 100 100 LYS CA C 13 59.222 0.00 . 1 . . . . . 80 LYS CA . 27516 1
225 . 1 . 1 100 100 LYS N N 15 118.914 0.00 . 1 . . . . . 80 LYS N . 27516 1
226 . 1 . 1 101 101 ALA H H 1 7.465 0.00 . 1 . . . . . 81 ALA H . 27516 1
227 . 1 . 1 101 101 ALA CA C 13 54.048 0.02 . 1 . . . . . 81 ALA CA . 27516 1
228 . 1 . 1 101 101 ALA N N 15 122.477 0.02 . 1 . . . . . 81 ALA N . 27516 1
229 . 1 . 1 102 102 LEU H H 1 7.196 0.00 . 1 . . . . . 82 LEU H . 27516 1
230 . 1 . 1 102 102 LEU CA C 13 54.073 0.00 . 1 . . . . . 82 LEU CA . 27516 1
231 . 1 . 1 102 102 LEU N N 15 117.957 0.02 . 1 . . . . . 82 LEU N . 27516 1
232 . 1 . 1 103 103 GLY H H 1 7.868 0.00 . 1 . . . . . 83 GLY H . 27516 1
233 . 1 . 1 103 103 GLY CA C 13 45.099 0.01 . 1 . . . . . 83 GLY CA . 27516 1
234 . 1 . 1 103 103 GLY N N 15 107.990 0.01 . 1 . . . . . 83 GLY N . 27516 1
235 . 1 . 1 104 104 ILE H H 1 7.859 0.00 . 1 . . . . . 84 ILE H . 27516 1
236 . 1 . 1 104 104 ILE CA C 13 59.340 0.01 . 1 . . . . . 84 ILE CA . 27516 1
237 . 1 . 1 104 104 ILE N N 15 123.365 0.00 . 1 . . . . . 84 ILE N . 27516 1
238 . 1 . 1 105 105 SER H H 1 8.384 0.00 . 1 . . . . . 85 SER H . 27516 1
239 . 1 . 1 105 105 SER CA C 13 54.451 0.00 . 1 . . . . . 85 SER CA . 27516 1
240 . 1 . 1 105 105 SER N N 15 122.304 0.01 . 1 . . . . . 85 SER N . 27516 1
241 . 1 . 1 106 106 PRO CA C 13 61.024 0.00 . 1 . . . . . 86 PRO CA . 27516 1
242 . 1 . 1 107 107 PHE H H 1 7.190 0.00 . 1 . . . . . 87 PHE H . 27516 1
243 . 1 . 1 107 107 PHE CA C 13 59.852 0.02 . 1 . . . . . 87 PHE CA . 27516 1
244 . 1 . 1 107 107 PHE N N 15 116.150 0.02 . 1 . . . . . 87 PHE N . 27516 1
245 . 1 . 1 108 108 HIS H H 1 7.652 0.00 . 1 . . . . . 88 HIS H . 27516 1
246 . 1 . 1 108 108 HIS CA C 13 57.640 0.00 . 1 . . . . . 88 HIS CA . 27516 1
247 . 1 . 1 108 108 HIS N N 15 113.854 0.00 . 1 . . . . . 88 HIS N . 27516 1
248 . 1 . 1 109 109 GLU H H 1 8.848 0.00 . 1 . . . . . 89 GLU H . 27516 1
249 . 1 . 1 109 109 GLU CA C 13 57.748 0.00 . 1 . . . . . 89 GLU CA . 27516 1
250 . 1 . 1 109 109 GLU N N 15 121.591 0.01 . 1 . . . . . 89 GLU N . 27516 1
251 . 1 . 1 110 110 HIS H H 1 7.243 0.00 . 1 . . . . . 90 HIS H . 27516 1
252 . 1 . 1 110 110 HIS CA C 13 54.431 0.01 . 1 . . . . . 90 HIS CA . 27516 1
253 . 1 . 1 110 110 HIS N N 15 107.196 0.03 . 1 . . . . . 90 HIS N . 27516 1
254 . 1 . 1 111 111 ALA H H 1 8.331 0.00 . 1 . . . . . 91 ALA H . 27516 1
255 . 1 . 1 111 111 ALA CA C 13 51.439 0.00 . 1 . . . . . 91 ALA CA . 27516 1
256 . 1 . 1 111 111 ALA N N 15 120.008 0.02 . 1 . . . . . 91 ALA N . 27516 1
257 . 1 . 1 112 112 GLU H H 1 8.336 0.01 . 1 . . . . . 92 GLU H . 27516 1
258 . 1 . 1 112 112 GLU CA C 13 53.984 0.02 . 1 . . . . . 92 GLU CA . 27516 1
259 . 1 . 1 112 112 GLU N N 15 122.019 0.04 . 1 . . . . . 92 GLU N . 27516 1
260 . 1 . 1 113 113 VAL H H 1 8.817 0.00 . 1 . . . . . 93 VAL H . 27516 1
261 . 1 . 1 113 113 VAL CA C 13 61.196 0.01 . 1 . . . . . 93 VAL CA . 27516 1
262 . 1 . 1 113 113 VAL N N 15 122.289 0.04 . 1 . . . . . 93 VAL N . 27516 1
263 . 1 . 1 114 114 VAL H H 1 9.120 0.00 . 1 . . . . . 94 VAL H . 27516 1
264 . 1 . 1 114 114 VAL CA C 13 60.877 0.06 . 1 . . . . . 94 VAL CA . 27516 1
265 . 1 . 1 114 114 VAL N N 15 128.316 0.00 . 1 . . . . . 94 VAL N . 27516 1
266 . 1 . 1 115 115 PHE H H 1 8.897 0.00 . 1 . . . . . 95 PHE H . 27516 1
267 . 1 . 1 115 115 PHE CA C 13 55.639 0.00 . 1 . . . . . 95 PHE CA . 27516 1
268 . 1 . 1 115 115 PHE N N 15 124.811 0.04 . 1 . . . . . 95 PHE N . 27516 1
269 . 1 . 1 116 116 THR H H 1 8.554 0.00 . 1 . . . . . 96 THR H . 27516 1
270 . 1 . 1 116 116 THR CA C 13 62.532 0.03 . 1 . . . . . 96 THR CA . 27516 1
271 . 1 . 1 116 116 THR N N 15 118.407 0.05 . 1 . . . . . 96 THR N . 27516 1
272 . 1 . 1 117 117 ALA H H 1 9.057 0.00 . 1 . . . . . 97 ALA H . 27516 1
273 . 1 . 1 117 117 ALA CA C 13 49.736 0.00 . 1 . . . . . 97 ALA CA . 27516 1
274 . 1 . 1 117 117 ALA N N 15 129.861 0.02 . 1 . . . . . 97 ALA N . 27516 1
275 . 1 . 1 118 118 ASN CA C 13 53.646 0.00 . 1 . . . . . 98 ASN CA . 27516 1
276 . 1 . 1 119 119 ASP H H 1 8.854 0.00 . 1 . . . . . 99 ASP H . 27516 1
277 . 1 . 1 119 119 ASP CA C 13 54.803 0.02 . 1 . . . . . 99 ASP CA . 27516 1
278 . 1 . 1 119 119 ASP N N 15 118.247 0.02 . 1 . . . . . 99 ASP N . 27516 1
279 . 1 . 1 120 120 SER H H 1 8.714 0.00 . 1 . . . . . 100 SER H . 27516 1
280 . 1 . 1 120 120 SER CA C 13 56.984 0.00 . 1 . . . . . 100 SER CA . 27516 1
281 . 1 . 1 120 120 SER N N 15 117.755 0.08 . 1 . . . . . 100 SER N . 27516 1
282 . 1 . 1 122 122 PRO CA C 13 63.297 0.00 . 1 . . . . . 102 PRO CA . 27516 1
283 . 1 . 1 123 123 ARG H H 1 8.243 0.00 . 1 . . . . . 103 ARG H . 27516 1
284 . 1 . 1 123 123 ARG CA C 13 53.565 0.07 . 1 . . . . . 103 ARG CA . 27516 1
285 . 1 . 1 123 123 ARG N N 15 122.942 0.02 . 1 . . . . . 103 ARG N . 27516 1
286 . 1 . 1 124 124 ARG H H 1 8.017 0.00 . 1 . . . . . 104 ARG H . 27516 1
287 . 1 . 1 124 124 ARG CA C 13 54.238 0.02 . 1 . . . . . 104 ARG CA . 27516 1
288 . 1 . 1 124 124 ARG N N 15 118.005 0.04 . 1 . . . . . 104 ARG N . 27516 1
289 . 1 . 1 125 125 TYR H H 1 8.800 0.00 . 1 . . . . . 105 TYR H . 27516 1
290 . 1 . 1 125 125 TYR CA C 13 57.125 0.00 . 1 . . . . . 105 TYR CA . 27516 1
291 . 1 . 1 125 125 TYR N N 15 121.998 0.07 . 1 . . . . . 105 TYR N . 27516 1
292 . 1 . 1 126 126 THR H H 1 8.648 0.00 . 1 . . . . . 106 THR H . 27516 1
293 . 1 . 1 126 126 THR CA C 13 61.570 0.00 . 1 . . . . . 106 THR CA . 27516 1
294 . 1 . 1 126 126 THR N N 15 120.792 0.01 . 1 . . . . . 106 THR N . 27516 1
295 . 1 . 1 127 127 ILE H H 1 8.740 0.00 . 1 . . . . . 107 ILE H . 27516 1
296 . 1 . 1 127 127 ILE CA C 13 58.127 0.02 . 1 . . . . . 107 ILE CA . 27516 1
297 . 1 . 1 127 127 ILE N N 15 127.772 0.01 . 1 . . . . . 107 ILE N . 27516 1
298 . 1 . 1 128 128 ALA H H 1 8.700 0.00 . 1 . . . . . 108 ALA H . 27516 1
299 . 1 . 1 128 128 ALA CA C 13 48.906 0.02 . 1 . . . . . 108 ALA CA . 27516 1
300 . 1 . 1 128 128 ALA N N 15 129.130 0.03 . 1 . . . . . 108 ALA N . 27516 1
301 . 1 . 1 129 129 ALA H H 1 8.991 0.00 . 1 . . . . . 109 ALA H . 27516 1
302 . 1 . 1 129 129 ALA CA C 13 49.925 0.02 . 1 . . . . . 109 ALA CA . 27516 1
303 . 1 . 1 129 129 ALA N N 15 126.307 0.04 . 1 . . . . . 109 ALA N . 27516 1
304 . 1 . 1 130 130 LEU H H 1 8.707 0.00 . 1 . . . . . 110 LEU H . 27516 1
305 . 1 . 1 130 130 LEU CA C 13 53.585 0.02 . 1 . . . . . 110 LEU CA . 27516 1
306 . 1 . 1 130 130 LEU N N 15 126.605 0.04 . 1 . . . . . 110 LEU N . 27516 1
307 . 1 . 1 131 131 LEU H H 1 9.004 0.00 . 1 . . . . . 111 LEU H . 27516 1
308 . 1 . 1 131 131 LEU CA C 13 55.220 0.00 . 1 . . . . . 111 LEU CA . 27516 1
309 . 1 . 1 131 131 LEU N N 15 124.416 0.01 . 1 . . . . . 111 LEU N . 27516 1
310 . 1 . 1 132 132 SER H H 1 8.955 0.00 . 1 . . . . . 112 SER H . 27516 1
311 . 1 . 1 132 132 SER CA C 13 57.776 0.00 . 1 . . . . . 112 SER CA . 27516 1
312 . 1 . 1 132 132 SER N N 15 117.090 0.01 . 1 . . . . . 112 SER N . 27516 1
313 . 1 . 1 134 134 TYR H H 1 8.050 0.00 . 1 . . . . . 114 TYR H . 27516 1
314 . 1 . 1 134 134 TYR CA C 13 57.867 0.03 . 1 . . . . . 114 TYR CA . 27516 1
315 . 1 . 1 134 134 TYR N N 15 113.655 0.06 . 1 . . . . . 114 TYR N . 27516 1
316 . 1 . 1 135 135 SER H H 1 7.333 0.00 . 1 . . . . . 115 SER H . 27516 1
317 . 1 . 1 135 135 SER CA C 13 57.052 0.02 . 1 . . . . . 115 SER CA . 27516 1
318 . 1 . 1 135 135 SER N N 15 112.344 0.01 . 1 . . . . . 115 SER N . 27516 1
319 . 1 . 1 136 136 TYR H H 1 8.312 0.00 . 1 . . . . . 116 TYR H . 27516 1
320 . 1 . 1 136 136 TYR CA C 13 56.798 0.02 . 1 . . . . . 116 TYR CA . 27516 1
321 . 1 . 1 136 136 TYR N N 15 120.251 0.02 . 1 . . . . . 116 TYR N . 27516 1
322 . 1 . 1 137 137 SER H H 1 8.341 0.00 . 1 . . . . . 117 SER H . 27516 1
323 . 1 . 1 137 137 SER CA C 13 54.904 0.02 . 1 . . . . . 117 SER CA . 27516 1
324 . 1 . 1 137 137 SER N N 15 114.181 0.02 . 1 . . . . . 117 SER N . 27516 1
325 . 1 . 1 138 138 THR H H 1 8.764 0.00 . 1 . . . . . 118 THR H . 27516 1
326 . 1 . 1 138 138 THR CA C 13 58.465 0.03 . 1 . . . . . 118 THR CA . 27516 1
327 . 1 . 1 138 138 THR N N 15 116.435 0.01 . 1 . . . . . 118 THR N . 27516 1
328 . 1 . 1 139 139 THR H H 1 8.264 0.00 . 1 . . . . . 119 THR H . 27516 1
329 . 1 . 1 139 139 THR CA C 13 60.919 0.02 . 1 . . . . . 119 THR CA . 27516 1
330 . 1 . 1 139 139 THR N N 15 122.457 0.03 . 1 . . . . . 119 THR N . 27516 1
331 . 1 . 1 140 140 ALA H H 1 8.229 0.01 . 1 . . . . . 120 ALA H . 27516 1
332 . 1 . 1 140 140 ALA CA C 13 49.529 0.00 . 1 . . . . . 120 ALA CA . 27516 1
333 . 1 . 1 140 140 ALA N N 15 129.224 0.05 . 1 . . . . . 120 ALA N . 27516 1
334 . 1 . 1 141 141 VAL H H 1 8.148 0.00 . 1 . . . . . 121 VAL H . 27516 1
335 . 1 . 1 141 141 VAL CA C 13 60.054 0.00 . 1 . . . . . 121 VAL CA . 27516 1
336 . 1 . 1 141 141 VAL N N 15 118.766 0.03 . 1 . . . . . 121 VAL N . 27516 1
337 . 1 . 1 142 142 ILE H H 1 8.260 0.00 . 1 . . . . . 122 ILE H . 27516 1
338 . 1 . 1 142 142 ILE CA C 13 59.584 0.01 . 1 . . . . . 122 ILE CA . 27516 1
339 . 1 . 1 142 142 ILE N N 15 129.227 0.02 . 1 . . . . . 122 ILE N . 27516 1
340 . 1 . 1 143 143 THR H H 1 8.538 0.00 . 1 . . . . . 123 THR H . 27516 1
341 . 1 . 1 143 143 THR CA C 13 59.808 0.02 . 1 . . . . . 123 THR CA . 27516 1
342 . 1 . 1 143 143 THR N N 15 119.187 0.03 . 1 . . . . . 123 THR N . 27516 1
343 . 1 . 1 144 144 ASN H H 1 8.631 0.00 . 1 . . . . . 124 ASN H . 27516 1
344 . 1 . 1 144 144 ASN CA C 13 50.133 0.00 . 1 . . . . . 124 ASN CA . 27516 1
345 . 1 . 1 144 144 ASN N N 15 121.397 0.01 . 1 . . . . . 124 ASN N . 27516 1
346 . 1 . 1 145 145 PRO CA C 13 63.007 0.00 . 1 . . . . . 125 PRO CA . 27516 1
347 . 1 . 1 146 146 LYS H H 1 8.032 0.00 . 1 . . . . . 126 LYS H . 27516 1
348 . 1 . 1 146 146 LYS CA C 13 55.722 0.01 . 1 . . . . . 126 LYS CA . 27516 1
349 . 1 . 1 146 146 LYS N N 15 121.105 0.00 . 1 . . . . . 126 LYS N . 27516 1
350 . 1 . 1 147 147 GLU H H 1 7.661 0.00 . 1 . . . . . 127 GLU H . 27516 1
351 . 1 . 1 147 147 GLU CA C 13 57.575 0.00 . 1 . . . . . 127 GLU CA . 27516 1
352 . 1 . 1 147 147 GLU N N 15 127.209 0.01 . 1 . . . . . 127 GLU N . 27516 1
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