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 25066
_Assigned_chem_shift_list.ID 1
_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' . . . 25066 1
2 '2D 1H-1H TOCSY' . . . 25066 1
5 '3D 1H-15N TOCSY' . . . 25066 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 $CARA . . 25066 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_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.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 4 4 THR H H 1 7.699 0.020 . 1 . . . A 389 THR H . 25066 1
2 . 1 1 4 4 THR HA H 1 3.996 0.020 . 1 . . . A 389 THR HA . 25066 1
3 . 1 1 4 4 THR HB H 1 3.815 0.020 . 1 . . . A 389 THR HB . 25066 1
4 . 1 1 4 4 THR HG21 H 1 0.890 0.020 . 1 . . . A 389 THR HG2 . 25066 1
5 . 1 1 4 4 THR HG22 H 1 0.890 0.020 . 1 . . . A 389 THR HG2 . 25066 1
6 . 1 1 4 4 THR HG23 H 1 0.890 0.020 . 1 . . . A 389 THR HG2 . 25066 1
7 . 1 1 4 4 THR N N 15 113.481 0.3 . 1 . . . A 389 THR N . 25066 1
8 . 1 1 5 5 PHE H H 1 8.034 0.020 . 1 . . . A 390 PHE H . 25066 1
9 . 1 1 5 5 PHE HA H 1 4.887 0.020 . 1 . . . A 390 PHE HA . 25066 1
10 . 1 1 5 5 PHE HB2 H 1 3.009 0.020 . 2 . . . A 390 PHE HB2 . 25066 1
11 . 1 1 5 5 PHE HB3 H 1 2.379 0.020 . 2 . . . A 390 PHE HB3 . 25066 1
12 . 1 1 5 5 PHE HD1 H 1 7.120 0.020 . 1 . . . A 390 PHE HD1 . 25066 1
13 . 1 1 5 5 PHE HD2 H 1 7.120 0.020 . 1 . . . A 390 PHE HD2 . 25066 1
14 . 1 1 5 5 PHE HE1 H 1 7.009 0.020 . 1 . . . A 390 PHE HE1 . 25066 1
15 . 1 1 5 5 PHE HE2 H 1 7.009 0.020 . 1 . . . A 390 PHE HE2 . 25066 1
16 . 1 1 5 5 PHE HZ H 1 6.925 0.020 . 1 . . . A 390 PHE HZ . 25066 1
17 . 1 1 5 5 PHE N N 15 121.531 0.3 . 1 . . . A 390 PHE N . 25066 1
18 . 1 1 6 6 PRO HA H 1 4.375 0.020 . 1 . . . A 391 PRO HA . 25066 1
19 . 1 1 6 6 PRO HB2 H 1 2.434 0.020 . 2 . . . A 391 PRO HB2 . 25066 1
20 . 1 1 6 6 PRO HB3 H 1 2.175 0.020 . 2 . . . A 391 PRO HB3 . 25066 1
21 . 1 1 6 6 PRO HG2 H 1 2.021 0.020 . 2 . . . A 391 PRO HG2 . 25066 1
22 . 1 1 6 6 PRO HG3 H 1 1.954 0.020 . 2 . . . A 391 PRO HG3 . 25066 1
23 . 1 1 6 6 PRO HD2 H 1 3.614 0.020 . 2 . . . A 391 PRO HD2 . 25066 1
24 . 1 1 6 6 PRO HD3 H 1 4.035 0.020 . 2 . . . A 391 PRO HD3 . 25066 1
25 . 1 1 7 7 GLU H H 1 8.967 0.020 . 1 . . . A 392 GLU H . 25066 1
26 . 1 1 7 7 GLU HA H 1 3.928 0.020 . 1 . . . A 392 GLU HA . 25066 1
27 . 1 1 7 7 GLU HB2 H 1 1.996 0.020 . 2 . . . A 392 GLU HB2 . 25066 1
28 . 1 1 7 7 GLU HB3 H 1 1.884 0.020 . 2 . . . A 392 GLU HB3 . 25066 1
29 . 1 1 7 7 GLU HG2 H 1 2.310 0.020 . 1 . . . A 392 GLU HG2 . 25066 1
30 . 1 1 7 7 GLU HG3 H 1 2.310 0.020 . 1 . . . A 392 GLU HG3 . 25066 1
31 . 1 1 7 7 GLU N N 15 126.390 0.3 . 1 . . . A 392 GLU N . 25066 1
32 . 1 1 8 8 GLN H H 1 9.046 0.020 . 1 . . . A 393 GLN H . 25066 1
33 . 1 1 8 8 GLN HA H 1 3.995 0.020 . 1 . . . A 393 GLN HA . 25066 1
34 . 1 1 8 8 GLN HB2 H 1 1.929 0.020 . 2 . . . A 393 GLN HB2 . 25066 1
35 . 1 1 8 8 GLN HB3 H 1 2.019 0.020 . 2 . . . A 393 GLN HB3 . 25066 1
36 . 1 1 8 8 GLN HG2 H 1 2.356 0.020 . 1 . . . A 393 GLN HG2 . 25066 1
37 . 1 1 8 8 GLN HG3 H 1 2.356 0.020 . 1 . . . A 393 GLN HG3 . 25066 1
38 . 1 1 8 8 GLN HE21 H 1 7.475 0.020 . 1 . . . A 393 GLN HE21 . 25066 1
39 . 1 1 8 8 GLN HE22 H 1 6.831 0.020 . 1 . . . A 393 GLN HE22 . 25066 1
40 . 1 1 8 8 GLN N N 15 116.282 0.3 . 1 . . . A 393 GLN N . 25066 1
41 . 1 1 8 8 GLN NE2 N 15 111.717 0.3 . 1 . . . A 393 GLN NE2 . 25066 1
42 . 1 1 9 9 THR H H 1 7.072 0.020 . 1 . . . A 394 THR H . 25066 1
43 . 1 1 9 9 THR HA H 1 4.126 0.020 . 1 . . . A 394 THR HA . 25066 1
44 . 1 1 9 9 THR HB H 1 3.883 0.020 . 1 . . . A 394 THR HB . 25066 1
45 . 1 1 9 9 THR HG21 H 1 1.091 0.020 . 1 . . . A 394 THR HG2 . 25066 1
46 . 1 1 9 9 THR HG22 H 1 1.091 0.020 . 1 . . . A 394 THR HG2 . 25066 1
47 . 1 1 9 9 THR HG23 H 1 1.091 0.020 . 1 . . . A 394 THR HG2 . 25066 1
48 . 1 1 9 9 THR N N 15 116.775 0.3 . 1 . . . A 394 THR N . 25066 1
49 . 1 1 10 10 ILE H H 1 7.342 0.020 . 1 . . . A 395 ILE H . 25066 1
50 . 1 1 10 10 ILE HA H 1 3.276 0.020 . 1 . . . A 395 ILE HA . 25066 1
51 . 1 1 10 10 ILE HB H 1 1.772 0.020 . 1 . . . A 395 ILE HB . 25066 1
52 . 1 1 10 10 ILE HG12 H 1 1.456 0.020 . 1 . . . A 395 ILE HG12 . 25066 1
53 . 1 1 10 10 ILE HG13 H 1 1.456 0.020 . 1 . . . A 395 ILE HG13 . 25066 1
54 . 1 1 10 10 ILE HG21 H 1 0.761 0.020 . 1 . . . A 395 ILE HG2 . 25066 1
55 . 1 1 10 10 ILE HG22 H 1 0.761 0.020 . 1 . . . A 395 ILE HG2 . 25066 1
56 . 1 1 10 10 ILE HG23 H 1 0.761 0.020 . 1 . . . A 395 ILE HG2 . 25066 1
57 . 1 1 10 10 ILE HD11 H 1 0.508 0.020 . 1 . . . A 395 ILE HD1 . 25066 1
58 . 1 1 10 10 ILE HD12 H 1 0.508 0.020 . 1 . . . A 395 ILE HD1 . 25066 1
59 . 1 1 10 10 ILE HD13 H 1 0.508 0.020 . 1 . . . A 395 ILE HD1 . 25066 1
60 . 1 1 10 10 ILE N N 15 120.842 0.3 . 1 . . . A 395 ILE N . 25066 1
61 . 1 1 11 11 LYS H H 1 8.586 0.020 . 1 . . . A 396 LYS H . 25066 1
62 . 1 1 11 11 LYS HA H 1 3.906 0.020 . 1 . . . A 396 LYS HA . 25066 1
63 . 1 1 11 11 LYS HB2 H 1 1.804 0.020 . 1 . . . A 396 LYS HB2 . 25066 1
64 . 1 1 11 11 LYS HB3 H 1 1.804 0.020 . 1 . . . A 396 LYS HB3 . 25066 1
65 . 1 1 11 11 LYS HG2 H 1 1.383 0.020 . 1 . . . A 396 LYS HG2 . 25066 1
66 . 1 1 11 11 LYS HG3 H 1 1.383 0.020 . 1 . . . A 396 LYS HG3 . 25066 1
67 . 1 1 11 11 LYS HD2 H 1 1.526 0.020 . 2 . . . A 396 LYS HD2 . 25066 1
68 . 1 1 11 11 LYS HD3 H 1 1.697 0.020 . 2 . . . A 396 LYS HD3 . 25066 1
69 . 1 1 11 11 LYS HE2 H 1 2.932 0.020 . 1 . . . A 396 LYS HE2 . 25066 1
70 . 1 1 11 11 LYS HE3 H 1 2.932 0.020 . 1 . . . A 396 LYS HE3 . 25066 1
71 . 1 1 11 11 LYS N N 15 119.216 0.3 . 1 . . . A 396 LYS N . 25066 1
72 . 1 1 12 12 GLN H H 1 7.589 0.020 . 1 . . . A 397 GLN H . 25066 1
73 . 1 1 12 12 GLN HA H 1 3.973 0.020 . 1 . . . A 397 GLN HA . 25066 1
74 . 1 1 12 12 GLN HB2 H 1 2.176 0.020 . 2 . . . A 397 GLN HB2 . 25066 1
75 . 1 1 12 12 GLN HB3 H 1 2.087 0.020 . 2 . . . A 397 GLN HB3 . 25066 1
76 . 1 1 12 12 GLN HG2 H 1 2.469 0.020 . 2 . . . A 397 GLN HG2 . 25066 1
77 . 1 1 12 12 GLN HG3 H 1 2.279 0.020 . 2 . . . A 397 GLN HG3 . 25066 1
78 . 1 1 12 12 GLN HE21 H 1 7.298 0.020 . 1 . . . A 397 GLN HE21 . 25066 1
79 . 1 1 12 12 GLN HE22 H 1 6.679 0.020 . 1 . . . A 397 GLN HE22 . 25066 1
80 . 1 1 12 12 GLN N N 15 117.046 0.3 . 1 . . . A 397 GLN N . 25066 1
81 . 1 1 12 12 GLN NE2 N 15 110.124 0.3 . 1 . . . A 397 GLN NE2 . 25066 1
82 . 1 1 13 13 LEU H H 1 7.219 0.020 . 1 . . . A 398 LEU H . 25066 1
83 . 1 1 13 13 LEU HA H 1 4.197 0.020 . 1 . . . A 398 LEU HA . 25066 1
84 . 1 1 13 13 LEU HB2 H 1 1.839 0.020 . 2 . . . A 398 LEU HB2 . 25066 1
85 . 1 1 13 13 LEU HB3 H 1 1.725 0.020 . 2 . . . A 398 LEU HB3 . 25066 1
86 . 1 1 13 13 LEU HG H 1 1.054 0.020 . 1 . . . A 398 LEU HG . 25066 1
87 . 1 1 13 13 LEU HD11 H 1 0.627 0.020 . 1 . . . A 398 LEU HD1 . 25066 1
88 . 1 1 13 13 LEU HD12 H 1 0.627 0.020 . 1 . . . A 398 LEU HD1 . 25066 1
89 . 1 1 13 13 LEU HD13 H 1 0.627 0.020 . 1 . . . A 398 LEU HD1 . 25066 1
90 . 1 1 13 13 LEU HD21 H 1 0.740 0.020 . 1 . . . A 398 LEU HD2 . 25066 1
91 . 1 1 13 13 LEU HD22 H 1 0.740 0.020 . 1 . . . A 398 LEU HD2 . 25066 1
92 . 1 1 13 13 LEU HD23 H 1 0.740 0.020 . 1 . . . A 398 LEU HD2 . 25066 1
93 . 1 1 13 13 LEU N N 15 117.234 0.3 . 1 . . . A 398 LEU N . 25066 1
94 . 1 1 14 14 MET H H 1 8.777 0.020 . 1 . . . A 399 MET H . 25066 1
95 . 1 1 14 14 MET HA H 1 4.468 0.020 . 1 . . . A 399 MET HA . 25066 1
96 . 1 1 14 14 MET HB2 H 1 2.311 0.020 . 2 . . . A 399 MET HB2 . 25066 1
97 . 1 1 14 14 MET HB3 H 1 2.109 0.020 . 2 . . . A 399 MET HB3 . 25066 1
98 . 1 1 14 14 MET HG2 H 1 2.603 0.020 . 2 . . . A 399 MET HG2 . 25066 1
99 . 1 1 14 14 MET HG3 H 1 2.423 0.020 . 2 . . . A 399 MET HG3 . 25066 1
100 . 1 1 14 14 MET HE1 H 1 0.777 0.020 . 1 . . . A 399 MET HE . 25066 1
101 . 1 1 14 14 MET HE2 H 1 0.777 0.020 . 1 . . . A 399 MET HE . 25066 1
102 . 1 1 14 14 MET HE3 H 1 0.777 0.020 . 1 . . . A 399 MET HE . 25066 1
103 . 1 1 14 14 MET N N 15 120.717 0.3 . 1 . . . A 399 MET N . 25066 1
104 . 1 1 15 15 ASP H H 1 8.542 0.020 . 1 . . . A 400 ASP H . 25066 1
105 . 1 1 15 15 ASP HA H 1 4.398 0.020 . 1 . . . A 400 ASP HA . 25066 1
106 . 1 1 15 15 ASP HB2 H 1 2.759 0.020 . 2 . . . A 400 ASP HB2 . 25066 1
107 . 1 1 15 15 ASP HB3 H 1 2.625 0.020 . 2 . . . A 400 ASP HB3 . 25066 1
108 . 1 1 15 15 ASP N N 15 119.445 0.3 . 1 . . . A 400 ASP N . 25066 1
109 . 1 1 16 16 LEU H H 1 7.398 0.020 . 1 . . . A 401 LEU H . 25066 1
110 . 1 1 16 16 LEU HA H 1 4.265 0.020 . 1 . . . A 401 LEU HA . 25066 1
111 . 1 1 16 16 LEU HB2 H 1 2.334 0.020 . 2 . . . A 401 LEU HB2 . 25066 1
112 . 1 1 16 16 LEU HB3 H 1 2.063 0.020 . 2 . . . A 401 LEU HB3 . 25066 1
113 . 1 1 16 16 LEU HG H 1 1.750 0.020 . 1 . . . A 401 LEU HG . 25066 1
114 . 1 1 16 16 LEU HD11 H 1 0.941 0.020 . 1 . . . A 401 LEU HD1 . 25066 1
115 . 1 1 16 16 LEU HD12 H 1 0.941 0.020 . 1 . . . A 401 LEU HD1 . 25066 1
116 . 1 1 16 16 LEU HD13 H 1 0.941 0.020 . 1 . . . A 401 LEU HD1 . 25066 1
117 . 1 1 16 16 LEU HD21 H 1 1.075 0.020 . 1 . . . A 401 LEU HD2 . 25066 1
118 . 1 1 16 16 LEU HD22 H 1 1.075 0.020 . 1 . . . A 401 LEU HD2 . 25066 1
119 . 1 1 16 16 LEU HD23 H 1 1.075 0.020 . 1 . . . A 401 LEU HD2 . 25066 1
120 . 1 1 16 16 LEU N N 15 118.590 0.3 . 1 . . . A 401 LEU N . 25066 1
121 . 1 1 17 17 GLY H H 1 8.261 0.020 . 1 . . . A 402 GLY H . 25066 1
122 . 1 1 17 17 GLY HA2 H 1 3.870 0.020 . 2 . . . A 402 GLY HA2 . 25066 1
123 . 1 1 17 17 GLY HA3 H 1 3.479 0.020 . 2 . . . A 402 GLY HA3 . 25066 1
124 . 1 1 17 17 GLY N N 15 105.555 0.3 . 1 . . . A 402 GLY N . 25066 1
125 . 1 1 18 18 PHE H H 1 7.298 0.020 . 1 . . . A 403 PHE H . 25066 1
126 . 1 1 18 18 PHE HA H 1 4.894 0.020 . 1 . . . A 403 PHE HA . 25066 1
127 . 1 1 18 18 PHE HB2 H 1 2.802 0.020 . 2 . . . A 403 PHE HB2 . 25066 1
128 . 1 1 18 18 PHE HB3 H 1 2.198 0.020 . 2 . . . A 403 PHE HB3 . 25066 1
129 . 1 1 18 18 PHE HD1 H 1 7.033 0.020 . 1 . . . A 403 PHE HD1 . 25066 1
130 . 1 1 18 18 PHE HD2 H 1 7.033 0.020 . 1 . . . A 403 PHE HD2 . 25066 1
131 . 1 1 18 18 PHE HE1 H 1 6.715 0.020 . 1 . . . A 403 PHE HE1 . 25066 1
132 . 1 1 18 18 PHE HE2 H 1 6.715 0.020 . 1 . . . A 403 PHE HE2 . 25066 1
133 . 1 1 18 18 PHE HZ H 1 6.151 0.020 . 1 . . . A 403 PHE HZ . 25066 1
134 . 1 1 18 18 PHE N N 15 117.881 0.3 . 1 . . . A 403 PHE N . 25066 1
135 . 1 1 19 19 PRO HA H 1 4.557 0.020 . 1 . . . A 404 PRO HA . 25066 1
136 . 1 1 19 19 PRO HB2 H 1 2.332 0.020 . 2 . . . A 404 PRO HB2 . 25066 1
137 . 1 1 19 19 PRO HB3 H 1 2.144 0.020 . 2 . . . A 404 PRO HB3 . 25066 1
138 . 1 1 19 19 PRO HG2 H 1 2.042 0.020 . 1 . . . A 404 PRO HG2 . 25066 1
139 . 1 1 19 19 PRO HG3 H 1 2.042 0.020 . 1 . . . A 404 PRO HG3 . 25066 1
140 . 1 1 19 19 PRO HD2 H 1 3.735 0.020 . 2 . . . A 404 PRO HD2 . 25066 1
141 . 1 1 19 19 PRO HD3 H 1 3.896 0.020 . 2 . . . A 404 PRO HD3 . 25066 1
142 . 1 1 20 20 ARG H H 1 8.874 0.020 . 1 . . . A 405 ARG H . 25066 1
143 . 1 1 20 20 ARG HA H 1 3.565 0.020 . 1 . . . A 405 ARG HA . 25066 1
144 . 1 1 20 20 ARG HB2 H 1 1.635 0.020 . 2 . . . A 405 ARG HB2 . 25066 1
145 . 1 1 20 20 ARG HB3 H 1 1.929 0.020 . 2 . . . A 405 ARG HB3 . 25066 1
146 . 1 1 20 20 ARG HG2 H 1 1.377 0.020 . 2 . . . A 405 ARG HG2 . 25066 1
147 . 1 1 20 20 ARG HG3 H 1 1.447 0.020 . 2 . . . A 405 ARG HG3 . 25066 1
148 . 1 1 20 20 ARG HD2 H 1 3.131 0.020 . 2 . . . A 405 ARG HD2 . 25066 1
149 . 1 1 20 20 ARG HD3 H 1 3.047 0.020 . 2 . . . A 405 ARG HD3 . 25066 1
150 . 1 1 20 20 ARG HE H 1 7.253 0.020 . 1 . . . A 405 ARG HE . 25066 1
151 . 1 1 20 20 ARG N N 15 121.656 0.3 . 1 . . . A 405 ARG N . 25066 1
152 . 1 1 21 21 ASP H H 1 8.723 0.020 . 1 . . . A 406 ASP H . 25066 1
153 . 1 1 21 21 ASP HA H 1 4.176 0.020 . 1 . . . A 406 ASP HA . 25066 1
154 . 1 1 21 21 ASP HB2 H 1 2.536 0.020 . 1 . . . A 406 ASP HB2 . 25066 1
155 . 1 1 21 21 ASP HB3 H 1 2.536 0.020 . 1 . . . A 406 ASP HB3 . 25066 1
156 . 1 1 21 21 ASP N N 15 114.415 0.3 . 1 . . . A 406 ASP N . 25066 1
157 . 1 1 22 22 ALA H H 1 6.960 0.020 . 1 . . . A 407 ALA H . 25066 1
158 . 1 1 22 22 ALA HA H 1 3.995 0.020 . 1 . . . A 407 ALA HA . 25066 1
159 . 1 1 22 22 ALA HB1 H 1 1.389 0.020 . 1 . . . A 407 ALA HB . 25066 1
160 . 1 1 22 22 ALA HB2 H 1 1.389 0.020 . 1 . . . A 407 ALA HB . 25066 1
161 . 1 1 22 22 ALA HB3 H 1 1.389 0.020 . 1 . . . A 407 ALA HB . 25066 1
162 . 1 1 22 22 ALA N N 15 121.426 0.3 . 1 . . . A 407 ALA N . 25066 1
163 . 1 1 23 23 VAL H H 1 7.756 0.020 . 1 . . . A 408 VAL H . 25066 1
164 . 1 1 23 23 VAL HA H 1 3.277 0.020 . 1 . . . A 408 VAL HA . 25066 1
165 . 1 1 23 23 VAL HB H 1 2.151 0.020 . 1 . . . A 408 VAL HB . 25066 1
166 . 1 1 23 23 VAL HG11 H 1 0.783 0.020 . 1 . . . A 408 VAL HG1 . 25066 1
167 . 1 1 23 23 VAL HG12 H 1 0.783 0.020 . 1 . . . A 408 VAL HG1 . 25066 1
168 . 1 1 23 23 VAL HG13 H 1 0.783 0.020 . 1 . . . A 408 VAL HG1 . 25066 1
169 . 1 1 23 23 VAL HG21 H 1 0.898 0.020 . 1 . . . A 408 VAL HG2 . 25066 1
170 . 1 1 23 23 VAL HG22 H 1 0.898 0.020 . 1 . . . A 408 VAL HG2 . 25066 1
171 . 1 1 23 23 VAL HG23 H 1 0.898 0.020 . 1 . . . A 408 VAL HG2 . 25066 1
172 . 1 1 23 23 VAL N N 15 119.445 0.3 . 1 . . . A 408 VAL N . 25066 1
173 . 1 1 24 24 VAL H H 1 8.520 0.020 . 1 . . . A 409 VAL H . 25066 1
174 . 1 1 24 24 VAL HA H 1 3.300 0.020 . 1 . . . A 409 VAL HA . 25066 1
175 . 1 1 24 24 VAL HB H 1 2.038 0.020 . 1 . . . A 409 VAL HB . 25066 1
176 . 1 1 24 24 VAL HG11 H 1 1.010 0.020 . 1 . . . A 409 VAL HG1 . 25066 1
177 . 1 1 24 24 VAL HG12 H 1 1.010 0.020 . 1 . . . A 409 VAL HG1 . 25066 1
178 . 1 1 24 24 VAL HG13 H 1 1.010 0.020 . 1 . . . A 409 VAL HG1 . 25066 1
179 . 1 1 24 24 VAL HG21 H 1 1.010 0.020 . 1 . . . A 409 VAL HG2 . 25066 1
180 . 1 1 24 24 VAL HG22 H 1 1.010 0.020 . 1 . . . A 409 VAL HG2 . 25066 1
181 . 1 1 24 24 VAL HG23 H 1 1.010 0.020 . 1 . . . A 409 VAL HG2 . 25066 1
182 . 1 1 24 24 VAL N N 15 118.736 0.3 . 1 . . . A 409 VAL N . 25066 1
183 . 1 1 25 25 LYS H H 1 7.488 0.020 . 1 . . . A 410 LYS H . 25066 1
184 . 1 1 25 25 LYS HA H 1 3.815 0.020 . 1 . . . A 410 LYS HA . 25066 1
185 . 1 1 25 25 LYS HB2 H 1 1.766 0.020 . 1 . . . A 410 LYS HB2 . 25066 1
186 . 1 1 25 25 LYS HB3 H 1 1.766 0.020 . 1 . . . A 410 LYS HB3 . 25066 1
187 . 1 1 25 25 LYS HG2 H 1 1.461 0.020 . 2 . . . A 410 LYS HG2 . 25066 1
188 . 1 1 25 25 LYS HG3 H 1 1.186 0.020 . 2 . . . A 410 LYS HG3 . 25066 1
189 . 1 1 25 25 LYS HD2 H 1 1.561 0.020 . 1 . . . A 410 LYS HD2 . 25066 1
190 . 1 1 25 25 LYS HE2 H 1 2.852 0.020 . 1 . . . A 410 LYS HE2 . 25066 1
191 . 1 1 25 25 LYS N N 15 118.632 0.3 . 1 . . . A 410 LYS N . 25066 1
192 . 1 1 26 26 ALA H H 1 7.702 0.020 . 1 . . . A 411 ALA H . 25066 1
193 . 1 1 26 26 ALA HA H 1 3.928 0.020 . 1 . . . A 411 ALA HA . 25066 1
194 . 1 1 26 26 ALA HB1 H 1 1.189 0.020 . 1 . . . A 411 ALA HB . 25066 1
195 . 1 1 26 26 ALA HB2 H 1 1.189 0.020 . 1 . . . A 411 ALA HB . 25066 1
196 . 1 1 26 26 ALA HB3 H 1 1.189 0.020 . 1 . . . A 411 ALA HB . 25066 1
197 . 1 1 26 26 ALA N N 15 121.697 0.3 . 1 . . . A 411 ALA N . 25066 1
198 . 1 1 27 27 LEU H H 1 8.094 0.020 . 1 . . . A 412 LEU H . 25066 1
199 . 1 1 27 27 LEU HA H 1 3.523 0.020 . 1 . . . A 412 LEU HA . 25066 1
200 . 1 1 27 27 LEU HB2 H 1 1.009 0.020 . 1 . . . A 412 LEU HB2 . 25066 1
201 . 1 1 27 27 LEU HB3 H 1 1.009 0.020 . 1 . . . A 412 LEU HB3 . 25066 1
202 . 1 1 27 27 LEU HG H 1 0.155 0.020 . 1 . . . A 412 LEU HG . 25066 1
203 . 1 1 27 27 LEU HD11 H 1 0.020 0.020 . 1 . . . A 412 LEU HD1 . 25066 1
204 . 1 1 27 27 LEU HD12 H 1 0.020 0.020 . 1 . . . A 412 LEU HD1 . 25066 1
205 . 1 1 27 27 LEU HD13 H 1 0.020 0.020 . 1 . . . A 412 LEU HD1 . 25066 1
206 . 1 1 27 27 LEU HD21 H 1 -0.497 0.020 . 1 . . . A 412 LEU HD2 . 25066 1
207 . 1 1 27 27 LEU HD22 H 1 -0.497 0.020 . 1 . . . A 412 LEU HD2 . 25066 1
208 . 1 1 27 27 LEU HD23 H 1 -0.497 0.020 . 1 . . . A 412 LEU HD2 . 25066 1
209 . 1 1 27 27 LEU N N 15 117.308 0.3 . 1 . . . A 412 LEU N . 25066 1
210 . 1 1 28 28 LYS H H 1 8.206 0.020 . 1 . . . A 413 LYS H . 25066 1
211 . 1 1 28 28 LYS HA H 1 4.129 0.020 . 1 . . . A 413 LYS HA . 25066 1
212 . 1 1 28 28 LYS HB2 H 1 1.950 0.020 . 1 . . . A 413 LYS HB2 . 25066 1
213 . 1 1 28 28 LYS HB3 H 1 1.950 0.020 . 1 . . . A 413 LYS HB3 . 25066 1
214 . 1 1 28 28 LYS HG2 H 1 1.492 0.020 . 1 . . . A 413 LYS HG2 . 25066 1
215 . 1 1 28 28 LYS HG3 H 1 1.492 0.020 . 1 . . . A 413 LYS HG3 . 25066 1
216 . 1 1 28 28 LYS HD2 H 1 1.750 0.020 . 1 . . . A 413 LYS HD2 . 25066 1
217 . 1 1 28 28 LYS HD3 H 1 1.750 0.020 . 1 . . . A 413 LYS HD3 . 25066 1
218 . 1 1 28 28 LYS N N 15 119.362 0.3 . 1 . . . A 413 LYS N . 25066 1
219 . 1 1 29 29 GLN H H 1 7.701 0.020 . 1 . . . A 414 GLN H . 25066 1
220 . 1 1 29 29 GLN HA H 1 4.018 0.020 . 1 . . . A 414 GLN HA . 25066 1
221 . 1 1 29 29 GLN HB2 H 1 2.153 0.020 . 2 . . . A 414 GLN HB2 . 25066 1
222 . 1 1 29 29 GLN HB3 H 1 1.997 0.020 . 2 . . . A 414 GLN HB3 . 25066 1
223 . 1 1 29 29 GLN HG2 H 1 2.376 0.020 . 2 . . . A 414 GLN HG2 . 25066 1
224 . 1 1 29 29 GLN HG3 H 1 2.265 0.020 . 2 . . . A 414 GLN HG3 . 25066 1
225 . 1 1 29 29 GLN HE21 H 1 7.253 0.020 . 1 . . . A 414 GLN HE21 . 25066 1
226 . 1 1 29 29 GLN HE22 H 1 6.771 0.020 . 1 . . . A 414 GLN HE22 . 25066 1
227 . 1 1 29 29 GLN N N 15 118.652 0.3 . 1 . . . A 414 GLN N . 25066 1
228 . 1 1 29 29 GLN NE2 N 15 111.333 0.3 . 1 . . . A 414 GLN NE2 . 25066 1
229 . 1 1 30 30 THR H H 1 7.668 0.020 . 1 . . . A 415 THR H . 25066 1
230 . 1 1 30 30 THR HA H 1 4.467 0.020 . 1 . . . A 415 THR HA . 25066 1
231 . 1 1 30 30 THR HB H 1 3.927 0.020 . 1 . . . A 415 THR HB . 25066 1
232 . 1 1 30 30 THR HG21 H 1 0.829 0.020 . 1 . . . A 415 THR HG2 . 25066 1
233 . 1 1 30 30 THR HG22 H 1 0.829 0.020 . 1 . . . A 415 THR HG2 . 25066 1
234 . 1 1 30 30 THR HG23 H 1 0.829 0.020 . 1 . . . A 415 THR HG2 . 25066 1
235 . 1 1 30 30 THR N N 15 106.842 0.3 . 1 . . . A 415 THR N . 25066 1
236 . 1 1 31 31 ASN H H 1 7.824 0.020 . 1 . . . A 416 ASN H . 25066 1
237 . 1 1 31 31 ASN HA H 1 4.445 0.020 . 1 . . . A 416 ASN HA . 25066 1
238 . 1 1 31 31 ASN HB2 H 1 3.118 0.020 . 2 . . . A 416 ASN HB2 . 25066 1
239 . 1 1 31 31 ASN HB3 H 1 2.693 0.020 . 2 . . . A 416 ASN HB3 . 25066 1
240 . 1 1 31 31 ASN HD21 H 1 7.544 0.020 . 1 . . . A 416 ASN HD21 . 25066 1
241 . 1 1 31 31 ASN HD22 H 1 6.805 0.020 . 1 . . . A 416 ASN HD22 . 25066 1
242 . 1 1 31 31 ASN N N 15 119.987 0.3 . 1 . . . A 416 ASN N . 25066 1
243 . 1 1 31 31 ASN ND2 N 15 112.206 0.3 . 1 . . . A 416 ASN ND2 . 25066 1
244 . 1 1 32 32 GLY H H 1 9.195 0.020 . 1 . . . A 417 GLY H . 25066 1
245 . 1 1 32 32 GLY HA2 H 1 4.153 0.020 . 2 . . . A 417 GLY HA2 . 25066 1
246 . 1 1 32 32 GLY HA3 H 1 2.980 0.020 . 2 . . . A 417 GLY HA3 . 25066 1
247 . 1 1 32 32 GLY N N 15 103.111 0.3 . 1 . . . A 417 GLY N . 25066 1
248 . 1 1 33 33 ASN H H 1 7.217 0.020 . 1 . . . A 418 ASN H . 25066 1
249 . 1 1 33 33 ASN HA H 1 4.506 0.020 . 1 . . . A 418 ASN HA . 25066 1
250 . 1 1 33 33 ASN HB2 H 1 2.805 0.020 . 2 . . . A 418 ASN HB2 . 25066 1
251 . 1 1 33 33 ASN HB3 H 1 2.635 0.020 . 2 . . . A 418 ASN HB3 . 25066 1
252 . 1 1 33 33 ASN HD21 H 1 7.423 0.020 . 1 . . . A 418 ASN HD21 . 25066 1
253 . 1 1 33 33 ASN HD22 H 1 6.585 0.020 . 1 . . . A 418 ASN HD22 . 25066 1
254 . 1 1 33 33 ASN N N 15 118.444 0.3 . 1 . . . A 418 ASN N . 25066 1
255 . 1 1 33 33 ASN ND2 N 15 113.603 0.3 . 1 . . . A 418 ASN ND2 . 25066 1
256 . 1 1 34 34 ALA H H 1 8.945 0.020 . 1 . . . A 419 ALA H . 25066 1
257 . 1 1 34 34 ALA HA H 1 3.680 0.020 . 1 . . . A 419 ALA HA . 25066 1
258 . 1 1 34 34 ALA HB1 H 1 1.278 0.020 . 1 . . . A 419 ALA HB . 25066 1
259 . 1 1 34 34 ALA HB2 H 1 1.278 0.020 . 1 . . . A 419 ALA HB . 25066 1
260 . 1 1 34 34 ALA HB3 H 1 1.278 0.020 . 1 . . . A 419 ALA HB . 25066 1
261 . 1 1 34 34 ALA N N 15 131.993 0.3 . 1 . . . A 419 ALA N . 25066 1
262 . 1 1 35 35 GLU H H 1 8.083 0.020 . 1 . . . A 420 GLU H . 25066 1
263 . 1 1 35 35 GLU HA H 1 3.928 0.020 . 1 . . . A 420 GLU HA . 25066 1
264 . 1 1 35 35 GLU HB2 H 1 1.996 0.020 . 2 . . . A 420 GLU HB2 . 25066 1
265 . 1 1 35 35 GLU HB3 H 1 1.930 0.020 . 2 . . . A 420 GLU HB3 . 25066 1
266 . 1 1 35 35 GLU HG2 H 1 2.154 0.020 . 2 . . . A 420 GLU HG2 . 25066 1
267 . 1 1 35 35 GLU HG3 H 1 2.089 0.020 . 2 . . . A 420 GLU HG3 . 25066 1
268 . 1 1 35 35 GLU N N 15 120.237 0.3 . 1 . . . A 420 GLU N . 25066 1
269 . 1 1 36 36 PHE H H 1 8.091 0.020 . 1 . . . A 421 PHE H . 25066 1
270 . 1 1 36 36 PHE HA H 1 4.538 0.020 . 1 . . . A 421 PHE HA . 25066 1
271 . 1 1 36 36 PHE HB2 H 1 3.146 0.020 . 2 . . . A 421 PHE HB2 . 25066 1
272 . 1 1 36 36 PHE HB3 H 1 2.875 0.020 . 2 . . . A 421 PHE HB3 . 25066 1
273 . 1 1 36 36 PHE HD1 H 1 7.120 0.020 . 1 . . . A 421 PHE HD1 . 25066 1
274 . 1 1 36 36 PHE HD2 H 1 7.120 0.020 . 1 . . . A 421 PHE HD2 . 25066 1
275 . 1 1 36 36 PHE HE1 H 1 7.257 0.020 . 1 . . . A 421 PHE HE1 . 25066 1
276 . 1 1 36 36 PHE HE2 H 1 7.257 0.020 . 1 . . . A 421 PHE HE2 . 25066 1
277 . 1 1 36 36 PHE N N 15 118.840 0.3 . 1 . . . A 421 PHE N . 25066 1
278 . 1 1 37 37 ALA H H 1 8.317 0.020 . 1 . . . A 422 ALA H . 25066 1
279 . 1 1 37 37 ALA HA H 1 3.659 0.020 . 1 . . . A 422 ALA HA . 25066 1
280 . 1 1 37 37 ALA HB1 H 1 1.053 0.020 . 1 . . . A 422 ALA HB . 25066 1
281 . 1 1 37 37 ALA HB2 H 1 1.053 0.020 . 1 . . . A 422 ALA HB . 25066 1
282 . 1 1 37 37 ALA HB3 H 1 1.053 0.020 . 1 . . . A 422 ALA HB . 25066 1
283 . 1 1 37 37 ALA N N 15 123.283 0.3 . 1 . . . A 422 ALA N . 25066 1
284 . 1 1 38 38 ALA H H 1 7.925 0.020 . 1 . . . A 423 ALA H . 25066 1
285 . 1 1 38 38 ALA HA H 1 3.568 0.020 . 1 . . . A 423 ALA HA . 25066 1
286 . 1 1 38 38 ALA HB1 H 1 1.345 0.020 . 1 . . . A 423 ALA HB . 25066 1
287 . 1 1 38 38 ALA HB2 H 1 1.345 0.020 . 1 . . . A 423 ALA HB . 25066 1
288 . 1 1 38 38 ALA HB3 H 1 1.345 0.020 . 1 . . . A 423 ALA HB . 25066 1
289 . 1 1 38 38 ALA N N 15 118.986 0.3 . 1 . . . A 423 ALA N . 25066 1
290 . 1 1 39 39 SER H H 1 7.174 0.020 . 1 . . . A 424 SER H . 25066 1
291 . 1 1 39 39 SER HA H 1 4.188 0.020 . 1 . . . A 424 SER HA . 25066 1
292 . 1 1 39 39 SER HB2 H 1 3.883 0.020 . 1 . . . A 424 SER HB2 . 25066 1
293 . 1 1 39 39 SER HB3 H 1 3.883 0.020 . 1 . . . A 424 SER HB3 . 25066 1
294 . 1 1 39 39 SER N N 15 110.058 0.3 . 1 . . . A 424 SER N . 25066 1
295 . 1 1 40 40 LEU H H 1 7.489 0.020 . 1 . . . A 425 LEU H . 25066 1
296 . 1 1 40 40 LEU HA H 1 3.928 0.020 . 1 . . . A 425 LEU HA . 25066 1
297 . 1 1 40 40 LEU HB2 H 1 1.594 0.020 . 2 . . . A 425 LEU HB2 . 25066 1
298 . 1 1 40 40 LEU HB3 H 1 1.458 0.020 . 2 . . . A 425 LEU HB3 . 25066 1
299 . 1 1 40 40 LEU HD11 H 1 0.647 0.020 . 1 . . . A 425 LEU HD1 . 25066 1
300 . 1 1 40 40 LEU HD12 H 1 0.647 0.020 . 1 . . . A 425 LEU HD1 . 25066 1
301 . 1 1 40 40 LEU HD13 H 1 0.647 0.020 . 1 . . . A 425 LEU HD1 . 25066 1
302 . 1 1 40 40 LEU HD21 H 1 0.647 0.020 . 1 . . . A 425 LEU HD2 . 25066 1
303 . 1 1 40 40 LEU HD22 H 1 0.647 0.020 . 1 . . . A 425 LEU HD2 . 25066 1
304 . 1 1 40 40 LEU HD23 H 1 0.647 0.020 . 1 . . . A 425 LEU HD2 . 25066 1
305 . 1 1 40 40 LEU N N 15 120.821 0.3 . 1 . . . A 425 LEU N . 25066 1
306 . 1 1 41 41 LEU H H 1 7.836 0.020 . 1 . . . A 426 LEU H . 25066 1
307 . 1 1 41 41 LEU HA H 1 3.389 0.020 . 1 . . . A 426 LEU HA . 25066 1
308 . 1 1 41 41 LEU HB2 H 1 1.121 0.020 . 1 . . . A 426 LEU HB2 . 25066 1
309 . 1 1 41 41 LEU HB3 H 1 1.121 0.020 . 1 . . . A 426 LEU HB3 . 25066 1
310 . 1 1 41 41 LEU HG H 1 0.895 0.020 . 1 . . . A 426 LEU HG . 25066 1
311 . 1 1 41 41 LEU HD11 H 1 0.132 0.020 . 1 . . . A 426 LEU HD1 . 25066 1
312 . 1 1 41 41 LEU HD12 H 1 0.132 0.020 . 1 . . . A 426 LEU HD1 . 25066 1
313 . 1 1 41 41 LEU HD13 H 1 0.132 0.020 . 1 . . . A 426 LEU HD1 . 25066 1
314 . 1 1 41 41 LEU HD21 H 1 -0.766 0.020 . 1 . . . A 426 LEU HD2 . 25066 1
315 . 1 1 41 41 LEU HD22 H 1 -0.766 0.020 . 1 . . . A 426 LEU HD2 . 25066 1
316 . 1 1 41 41 LEU HD23 H 1 -0.766 0.020 . 1 . . . A 426 LEU HD2 . 25066 1
317 . 1 1 41 41 LEU N N 15 121.218 0.3 . 1 . . . A 426 LEU N . 25066 1
318 . 1 1 42 42 PHE H H 1 7.690 0.020 . 1 . . . A 427 PHE H . 25066 1
319 . 1 1 42 42 PHE HA H 1 4.506 0.020 . 1 . . . A 427 PHE HA . 25066 1
320 . 1 1 42 42 PHE HB2 H 1 3.321 0.020 . 2 . . . A 427 PHE HB2 . 25066 1
321 . 1 1 42 42 PHE HB3 H 1 2.892 0.020 . 2 . . . A 427 PHE HB3 . 25066 1
322 . 1 1 42 42 PHE HD1 H 1 7.419 0.020 . 1 . . . A 427 PHE HD1 . 25066 1
323 . 1 1 42 42 PHE HD2 H 1 7.419 0.020 . 1 . . . A 427 PHE HD2 . 25066 1
324 . 1 1 42 42 PHE HE1 H 1 7.391 0.020 . 1 . . . A 427 PHE HE1 . 25066 1
325 . 1 1 42 42 PHE HE2 H 1 7.391 0.020 . 1 . . . A 427 PHE HE2 . 25066 1
326 . 1 1 42 42 PHE N N 15 115.079 0.3 . 1 . . . A 427 PHE N . 25066 1
327 . 1 1 43 43 GLN H H 1 7.544 0.020 . 1 . . . A 428 GLN H . 25066 1
328 . 1 1 43 43 GLN HA H 1 4.308 0.020 . 1 . . . A 428 GLN HA . 25066 1
329 . 1 1 43 43 GLN HB2 H 1 2.154 0.020 . 2 . . . A 428 GLN HB2 . 25066 1
330 . 1 1 43 43 GLN HB3 H 1 2.041 0.020 . 2 . . . A 428 GLN HB3 . 25066 1
331 . 1 1 43 43 GLN HG2 H 1 2.440 0.020 . 2 . . . A 428 GLN HG2 . 25066 1
332 . 1 1 43 43 GLN HG3 H 1 2.388 0.020 . 2 . . . A 428 GLN HG3 . 25066 1
333 . 1 1 43 43 GLN HE21 H 1 7.347 0.020 . 1 . . . A 428 GLN HE21 . 25066 1
334 . 1 1 43 43 GLN HE22 H 1 6.703 0.020 . 1 . . . A 428 GLN HE22 . 25066 1
335 . 1 1 43 43 GLN N N 15 118.402 0.3 . 1 . . . A 428 GLN N . 25066 1
336 . 1 1 43 43 GLN NE2 N 15 111.578 0.3 . 1 . . . A 428 GLN NE2 . 25066 1
337 . 1 1 44 44 SER H H 1 7.625 0.020 . 1 . . . A 429 SER H . 25066 1
338 . 1 1 44 44 SER HA H 1 4.176 0.020 . 1 . . . A 429 SER HA . 25066 1
339 . 1 1 44 44 SER HB2 H 1 3.816 0.020 . 1 . . . A 429 SER HB2 . 25066 1
340 . 1 1 44 44 SER HB3 H 1 3.816 0.020 . 1 . . . A 429 SER HB3 . 25066 1
341 . 1 1 44 44 SER N N 15 121.572 0.3 . 1 . . . A 429 SER N . 25066 1
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