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 31013
_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 $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' . . . 31013 1
2 '3D HNCA' . . . 31013 1
3 '3D HNCACB' . . . 31013 1
4 '3D CBCA(CO)NH' . . . 31013 1
5 '2D 1H-13C HSQC aliphatic' . . . 31013 1
6 '2D 1H-13C HSQC aromatic' . . . 31013 1
7 '3D C(CO)NH' . . . 31013 1
8 '3D H(CCO)NH' . . . 31013 1
9 '3D 1H-13C NOESY' . . . 31013 1
10 '3D 1H-15N NOESY' . . . 31013 1
stop_
loop_
_Systematic_chem_shift_offset.Type
_Systematic_chem_shift_offset.Atom_type
_Systematic_chem_shift_offset.Atom_isotope_number
_Systematic_chem_shift_offset.Val
_Systematic_chem_shift_offset.Val_err
_Systematic_chem_shift_offset.Entry_ID
_Systematic_chem_shift_offset.Assigned_chem_shift_list_ID
'TROSY offset' 'all 1H' 1 -0.0875 0.01 31013 1
'TROSY offset' 'all 15N' 15 0.4 0.04 31013 1
'TROSY offset' 'all 13C' 13 0.4 0.04 31013 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 5 5 ALA HA H 1 4.2797 0.0000 . 1 . . . . A 5 ALA HA . 31013 1
2 . 1 . 1 5 5 ALA HB1 H 1 1.3909 0.0000 . 1 . . . . A 5 ALA HB1 . 31013 1
3 . 1 . 1 5 5 ALA HB2 H 1 1.3909 0.0000 . 1 . . . . A 5 ALA HB2 . 31013 1
4 . 1 . 1 5 5 ALA HB3 H 1 1.3909 0.0000 . 1 . . . . A 5 ALA HB3 . 31013 1
5 . 1 . 1 5 5 ALA CA C 13 52.4611 0.0000 . 1 . . 4643 . A 5 ALA CA . 31013 1
6 . 1 . 1 5 5 ALA CB C 13 19.2055 0.0000 . 1 . . 4667 . A 5 ALA CB . 31013 1
7 . 1 . 1 6 6 LEU H H 1 8.0243 0.0000 . 1 . . 5242 . A 6 LEU H . 31013 1
8 . 1 . 1 6 6 LEU HA H 1 4.2914 0.0000 . 1 . . . . A 6 LEU HA . 31013 1
9 . 1 . 1 6 6 LEU HB2 H 1 1.6697 0.0000 . 2 . . . . A 6 LEU HB2 . 31013 1
10 . 1 . 1 6 6 LEU HB3 H 1 1.5864 0.0000 . 2 . . . . A 6 LEU HB3 . 31013 1
11 . 1 . 1 6 6 LEU HG H 1 1.5992 0.0000 . 1 . . . . A 6 LEU HG . 31013 1
12 . 1 . 1 6 6 LEU HD11 H 1 1.3218 0.0000 . 2 . . . . A 6 LEU HD11 . 31013 1
13 . 1 . 1 6 6 LEU HD12 H 1 1.3218 0.0000 . 2 . . . . A 6 LEU HD12 . 31013 1
14 . 1 . 1 6 6 LEU HD13 H 1 1.3218 0.0000 . 2 . . . . A 6 LEU HD13 . 31013 1
15 . 1 . 1 6 6 LEU CA C 13 55.1427 0.0000 . 1 . . 5240 . A 6 LEU CA . 31013 1
16 . 1 . 1 6 6 LEU CB C 13 42.3068 0.0000 . 1 . . 9543 . A 6 LEU CB . 31013 1
17 . 1 . 1 6 6 LEU CG C 13 26.8990 0.0000 . 1 . . . . A 6 LEU CG . 31013 1
18 . 1 . 1 6 6 LEU CD1 C 13 24.8718 0.0000 . 2 . . . . A 6 LEU CD1 . 31013 1
19 . 1 . 1 6 6 LEU N N 15 121.8867 0.0000 . 1 . . 5244 . A 6 LEU N . 31013 1
20 . 1 . 1 7 7 ALA H H 1 8.1101 0.0000 . 1 . . 5161 . A 7 ALA H . 31013 1
21 . 1 . 1 7 7 ALA HA H 1 4.2202 0.0000 . 1 . . . . A 7 ALA HA . 31013 1
22 . 1 . 1 7 7 ALA HB1 H 1 1.4697 0.0000 . 1 . . . . A 7 ALA HB1 . 31013 1
23 . 1 . 1 7 7 ALA HB2 H 1 1.4697 0.0000 . 1 . . . . A 7 ALA HB2 . 31013 1
24 . 1 . 1 7 7 ALA HB3 H 1 1.4697 0.0000 . 1 . . . . A 7 ALA HB3 . 31013 1
25 . 1 . 1 7 7 ALA CA C 13 52.4967 0.0000 . 1 . . 14214 . A 7 ALA CA . 31013 1
26 . 1 . 1 7 7 ALA CB C 13 19.1913 0.0000 . 1 . . 7446 . A 7 ALA CB . 31013 1
27 . 1 . 1 7 7 ALA N N 15 125.0569 0.0000 . 1 . . 5163 . A 7 ALA N . 31013 1
28 . 1 . 1 8 8 LYS H H 1 8.2400 0.0000 . 1 . . . . A 8 LYS H . 31013 1
29 . 1 . 1 8 8 LYS HA H 1 4.3066 0.0000 . 1 . . . . A 8 LYS HA . 31013 1
30 . 1 . 1 8 8 LYS HB2 H 1 1.7492 0.0000 . 2 . . . . A 8 LYS HB2 . 31013 1
31 . 1 . 1 8 8 LYS HB3 H 1 1.8240 0.0000 . 2 . . . . A 8 LYS HB3 . 31013 1
32 . 1 . 1 8 8 LYS HG2 H 1 1.4075 0.0000 . 2 . . . . A 8 LYS HG2 . 31013 1
33 . 1 . 1 8 8 LYS HE2 H 1 3.1854 0.0000 . 2 . . . . A 8 LYS HE2 . 31013 1
34 . 1 . 1 8 8 LYS CA C 13 56.2555 0.0000 . 1 . . 5228 . A 8 LYS CA . 31013 1
35 . 1 . 1 8 8 LYS CB C 13 32.9965 0.0000 . 1 . . 4625 . A 8 LYS CB . 31013 1
36 . 1 . 1 8 8 LYS CG C 13 24.6955 0.0000 . 1 . . . . A 8 LYS CG . 31013 1
37 . 1 . 1 8 8 LYS CE C 13 43.4081 0.0000 . 1 . . . . A 8 LYS CE . 31013 1
38 . 1 . 1 8 8 LYS N N 15 122.0847 0.0000 . 1 . . . . A 8 LYS N . 31013 1
39 . 1 . 1 9 9 ILE H H 1 7.9726 0.0000 . 1 . . 5227 . A 9 ILE H . 31013 1
40 . 1 . 1 9 9 ILE HA H 1 4.1753 0.0000 . 1 . . . . A 9 ILE HA . 31013 1
41 . 1 . 1 9 9 ILE HB H 1 1.8292 0.0000 . 1 . . . . A 9 ILE HB . 31013 1
42 . 1 . 1 9 9 ILE HG12 H 1 1.2046 0.0000 . 2 . . . . A 9 ILE HG12 . 31013 1
43 . 1 . 1 9 9 ILE HG13 H 1 1.4849 0.0000 . 2 . . . . A 9 ILE HG13 . 31013 1
44 . 1 . 1 9 9 ILE HD11 H 1 0.8763 0.0000 . 1 . . . . A 9 ILE HD11 . 31013 1
45 . 1 . 1 9 9 ILE HD12 H 1 0.8763 0.0000 . 1 . . . . A 9 ILE HD12 . 31013 1
46 . 1 . 1 9 9 ILE HD13 H 1 0.8763 0.0000 . 1 . . . . A 9 ILE HD13 . 31013 1
47 . 1 . 1 9 9 ILE CA C 13 60.4261 0.0000 . 1 . . 8714 . A 9 ILE CA . 31013 1
48 . 1 . 1 9 9 ILE CB C 13 38.8992 0.0000 . 1 . . 8699 . A 9 ILE CB . 31013 1
49 . 1 . 1 9 9 ILE CG1 C 13 27.2588 0.0000 . 1 . . . . A 9 ILE CG1 . 31013 1
50 . 1 . 1 9 9 ILE CG2 C 13 17.3870 0.0000 . 1 . . . . A 9 ILE CG2 . 31013 1
51 . 1 . 1 9 9 ILE CD1 C 13 17.3870 0.0000 . 1 . . . . A 9 ILE CD1 . 31013 1
52 . 1 . 1 9 9 ILE N N 15 122.0635 0.0000 . 1 . . 5229 . A 9 ILE N . 31013 1
53 . 1 . 1 10 10 ASP CA C 13 52.3140 0.0000 . 1 . . . . A 10 ASP CA . 31013 1
54 . 1 . 1 10 10 ASP CB C 13 41.1597 0.0000 . 1 . . . . A 10 ASP CB . 31013 1
55 . 1 . 1 11 11 PRO HA H 1 4.4109 0.0000 . 1 . . . . A 11 PRO HA . 31013 1
56 . 1 . 1 11 11 PRO HB2 H 1 2.2745 0.0000 . 2 . . . . A 11 PRO HB2 . 31013 1
57 . 1 . 1 11 11 PRO HB3 H 1 2.0008 0.0000 . 2 . . . . A 11 PRO HB3 . 31013 1
58 . 1 . 1 11 11 PRO HG2 H 1 1.8154 0.0000 . 2 . . . . A 11 PRO HG2 . 31013 1
59 . 1 . 1 11 11 PRO HD2 H 1 3.5987 0.0000 . 2 . . . . A 11 PRO HD2 . 31013 1
60 . 1 . 1 11 11 PRO HD3 H 1 3.7665 0.0000 . 2 . . . . A 11 PRO HD3 . 31013 1
61 . 1 . 1 11 11 PRO CA C 13 62.9500 0.0000 . 1 . . 11924 . A 11 PRO CA . 31013 1
62 . 1 . 1 11 11 PRO CB C 13 32.0623 0.0000 . 1 . . 11927 . A 11 PRO CB . 31013 1
63 . 1 . 1 11 11 PRO CG C 13 27.1635 0.0000 . 1 . . . . A 11 PRO CG . 31013 1
64 . 1 . 1 11 11 PRO CD C 13 50.3446 0.0000 . 1 . . . . A 11 PRO CD . 31013 1
65 . 1 . 1 12 12 GLU H H 1 8.3613 0.0000 . 1 . . 11917 . A 12 GLU H . 31013 1
66 . 1 . 1 12 12 GLU HA H 1 4.0401 0.0000 . 1 . . . . A 12 GLU HA . 31013 1
67 . 1 . 1 12 12 GLU HB2 H 1 2.0270 0.0000 . 2 . . . . A 12 GLU HB2 . 31013 1
68 . 1 . 1 12 12 GLU HG2 H 1 2.3230 0.0000 . 2 . . . . A 12 GLU HG2 . 31013 1
69 . 1 . 1 12 12 GLU CA C 13 59.3232 0.0000 . 1 . . 11918 . A 12 GLU CA . 31013 1
70 . 1 . 1 12 12 GLU CB C 13 29.2413 0.0000 . 1 . . 11963 . A 12 GLU CB . 31013 1
71 . 1 . 1 12 12 GLU CG C 13 37.0353 0.0000 . 1 . . . . A 12 GLU CG . 31013 1
72 . 1 . 1 12 12 GLU N N 15 119.7661 0.0000 . 1 . . 11919 . A 12 GLU N . 31013 1
73 . 1 . 1 13 13 LEU H H 1 7.5934 0.0000 . 1 . . 4546 . A 13 LEU H . 31013 1
74 . 1 . 1 13 13 LEU HA H 1 3.8710 0.0000 . 1 . . . . A 13 LEU HA . 31013 1
75 . 1 . 1 13 13 LEU HB2 H 1 1.8532 0.0000 . 2 . . . . A 13 LEU HB2 . 31013 1
76 . 1 . 1 13 13 LEU HB3 H 1 1.1391 0.0000 . 2 . . . . A 13 LEU HB3 . 31013 1
77 . 1 . 1 13 13 LEU HG H 1 1.5200 0.0000 . 1 . . . . A 13 LEU HG . 31013 1
78 . 1 . 1 13 13 LEU HD11 H 1 1.5810 0.0000 . 2 . . . . A 13 LEU HD11 . 31013 1
79 . 1 . 1 13 13 LEU HD12 H 1 1.5810 0.0000 . 2 . . . . A 13 LEU HD12 . 31013 1
80 . 1 . 1 13 13 LEU HD13 H 1 1.5810 0.0000 . 2 . . . . A 13 LEU HD13 . 31013 1
81 . 1 . 1 13 13 LEU HD21 H 1 1.3648 0.0000 . 2 . . . . A 13 LEU HD21 . 31013 1
82 . 1 . 1 13 13 LEU HD22 H 1 1.3648 0.0000 . 2 . . . . A 13 LEU HD22 . 31013 1
83 . 1 . 1 13 13 LEU HD23 H 1 1.3648 0.0000 . 2 . . . . A 13 LEU HD23 . 31013 1
84 . 1 . 1 13 13 LEU CA C 13 57.7289 0.0000 . 1 . . 5165 . A 13 LEU CA . 31013 1
85 . 1 . 1 13 13 LEU CB C 13 40.9132 0.0000 . 1 . . 7546 . A 13 LEU CB . 31013 1
86 . 1 . 1 13 13 LEU CG C 13 32.2160 0.0000 . 1 . . . . A 13 LEU CG . 31013 1
87 . 1 . 1 13 13 LEU CD1 C 13 24.9600 0.0000 . 2 . . . . A 13 LEU CD1 . 31013 1
88 . 1 . 1 13 13 LEU CD2 C 13 24.9600 0.0000 . 2 . . . . A 13 LEU CD2 . 31013 1
89 . 1 . 1 13 13 LEU N N 15 123.6965 0.0000 . 1 . . 4548 . A 13 LEU N . 31013 1
90 . 1 . 1 14 14 LYS H H 1 7.8806 0.0000 . 1 . . 5395 . A 14 LYS H . 31013 1
91 . 1 . 1 14 14 LYS HA H 1 3.8630 0.0000 . 1 . . . . A 14 LYS HA . 31013 1
92 . 1 . 1 14 14 LYS HB2 H 1 1.5877 0.0000 . 2 . . . . A 14 LYS HB2 . 31013 1
93 . 1 . 1 14 14 LYS HG2 H 1 1.3642 0.0000 . 2 . . . . A 14 LYS HG2 . 31013 1
94 . 1 . 1 14 14 LYS HG3 H 1 1.5207 0.0000 . 2 . . . . A 14 LYS HG3 . 31013 1
95 . 1 . 1 14 14 LYS HD2 H 1 1.6443 0.0000 . 2 . . . . A 14 LYS HD2 . 31013 1
96 . 1 . 1 14 14 LYS HE2 H 1 2.9437 0.0000 . 2 . . . . A 14 LYS HE2 . 31013 1
97 . 1 . 1 14 14 LYS CA C 13 60.0564 0.0000 . 1 . . 5390 . A 14 LYS CA . 31013 1
98 . 1 . 1 14 14 LYS CB C 13 32.5106 0.0000 . 1 . . 5396 . A 14 LYS CB . 31013 1
99 . 1 . 1 14 14 LYS CG C 13 25.0000 0.0000 . 1 . . . . A 14 LYS CG . 31013 1
100 . 1 . 1 14 14 LYS CD C 13 29.6412 0.0000 . 1 . . . . A 14 LYS CD . 31013 1
101 . 1 . 1 14 14 LYS CE C 13 40.8013 0.0000 . 1 . . . . A 14 LYS CE . 31013 1
102 . 1 . 1 14 14 LYS N N 15 119.3942 0.0000 . 1 . . 5397 . A 14 LYS N . 31013 1
103 . 1 . 1 15 15 GLN H H 1 7.8870 0.0000 . 1 . . 5392 . A 15 GLN H . 31013 1
104 . 1 . 1 15 15 GLN HA H 1 4.2153 0.0000 . 1 . . . . A 15 GLN HA . 31013 1
105 . 1 . 1 15 15 GLN HB2 H 1 2.1500 0.0000 . 2 . . . . A 15 GLN HB2 . 31013 1
106 . 1 . 1 15 15 GLN HG2 H 1 2.4858 0.0000 . 2 . . . . A 15 GLN HG2 . 31013 1
107 . 1 . 1 15 15 GLN CA C 13 58.5751 0.0000 . 1 . . 5393 . A 15 GLN CA . 31013 1
108 . 1 . 1 15 15 GLN CB C 13 28.0750 0.0000 . 1 . . 5399 . A 15 GLN CB . 31013 1
109 . 1 . 1 15 15 GLN CG C 13 33.3333 0.0000 . 1 . . . . A 15 GLN CG . 31013 1
110 . 1 . 1 15 15 GLN N N 15 119.5389 0.0000 . 1 . . 5394 . A 15 GLN N . 31013 1
111 . 1 . 1 16 16 CYS H H 1 8.0453 0.0000 . 1 . . 4693 . A 16 CYS H . 31013 1
112 . 1 . 1 16 16 CYS HB2 H 1 3.2464 0.0000 . 2 . . . . A 16 CYS HB2 . 31013 1
113 . 1 . 1 16 16 CYS HB3 H 1 3.5347 0.0000 . 2 . . . . A 16 CYS HB3 . 31013 1
114 . 1 . 1 16 16 CYS CA C 13 60.7433 0.0000 . 1 . . 9724 . A 16 CYS CA . 31013 1
115 . 1 . 1 16 16 CYS CB C 13 36.8914 0.0000 . 1 . . 5276 . A 16 CYS CB . 31013 1
116 . 1 . 1 16 16 CYS N N 15 121.5511 0.0000 . 1 . . 4695 . A 16 CYS N . 31013 1
117 . 1 . 1 17 17 LYS H H 1 8.2590 0.0000 . 1 . . 12824 . A 17 LYS H . 31013 1
118 . 1 . 1 17 17 LYS HA H 1 3.7665 0.0000 . 1 . . . . A 17 LYS HA . 31013 1
119 . 1 . 1 17 17 LYS HB2 H 1 1.9302 0.0000 . 2 . . . . A 17 LYS HB2 . 31013 1
120 . 1 . 1 17 17 LYS HG2 H 1 1.3963 0.0000 . 2 . . . . A 17 LYS HG2 . 31013 1
121 . 1 . 1 17 17 LYS HD2 H 1 1.7825 0.0000 . 2 . . . . A 17 LYS HD2 . 31013 1
122 . 1 . 1 17 17 LYS HE2 H 1 2.8535 0.0000 . 2 . . . . A 17 LYS HE2 . 31013 1
123 . 1 . 1 17 17 LYS CA C 13 60.9310 0.0000 . 1 . . 12825 . A 17 LYS CA . 31013 1
124 . 1 . 1 17 17 LYS CB C 13 32.3364 0.0000 . 1 . . 12828 . A 17 LYS CB . 31013 1
125 . 1 . 1 17 17 LYS CG C 13 24.7682 0.0000 . 1 . . . . A 17 LYS CG . 31013 1
126 . 1 . 1 17 17 LYS CD C 13 30.1280 0.0000 . 1 . . . . A 17 LYS CD . 31013 1
127 . 1 . 1 17 17 LYS CE C 13 41.5304 0.0000 . 1 . . . . A 17 LYS CE . 31013 1
128 . 1 . 1 17 17 LYS N N 15 118.1891 0.0000 . 1 . . 12826 . A 17 LYS N . 31013 1
129 . 1 . 1 18 18 HIS H H 1 8.1528 0.0000 . 1 . . 5332 . A 18 HIS H . 31013 1
130 . 1 . 1 18 18 HIS HA H 1 4.2233 0.0000 . 1 . . . . A 18 HIS HA . 31013 1
131 . 1 . 1 18 18 HIS HB2 H 1 3.1962 0.0000 . 2 . . . . A 18 HIS HB2 . 31013 1
132 . 1 . 1 18 18 HIS HB3 H 1 3.2987 0.0000 . 2 . . . . A 18 HIS HB3 . 31013 1
133 . 1 . 1 18 18 HIS HD2 H 1 7.0158 0.0000 . 1 . . . . A 18 HIS HD2 . 31013 1
134 . 1 . 1 18 18 HIS CA C 13 60.2510 0.0000 . 1 . . 11250 . A 18 HIS CA . 31013 1
135 . 1 . 1 18 18 HIS CB C 13 30.2197 0.0000 . 1 . . 5333 . A 18 HIS CB . 31013 1
136 . 1 . 1 18 18 HIS CD2 C 13 119.3927 0.0000 . 1 . . . . A 18 HIS CD2 . 31013 1
137 . 1 . 1 18 18 HIS N N 15 120.6126 0.0000 . 1 . . 5334 . A 18 HIS N . 31013 1
138 . 1 . 1 19 19 GLN H H 1 8.1903 0.0000 . 1 . . 5428 . A 19 GLN H . 31013 1
139 . 1 . 1 19 19 GLN HA H 1 3.9671 0.0000 . 1 . . . . A 19 GLN HA . 31013 1
140 . 1 . 1 19 19 GLN HB2 H 1 2.1815 0.0000 . 2 . . . . A 19 GLN HB2 . 31013 1
141 . 1 . 1 19 19 GLN HB3 H 1 2.3416 0.0000 . 2 . . . . A 19 GLN HB3 . 31013 1
142 . 1 . 1 19 19 GLN HG2 H 1 2.5680 0.0000 . 2 . . . . A 19 GLN HG2 . 31013 1
143 . 1 . 1 19 19 GLN HG3 H 1 2.5204 0.0000 . 2 . . . . A 19 GLN HG3 . 31013 1
144 . 1 . 1 19 19 GLN CA C 13 58.5386 0.0000 . 1 . . 5423 . A 19 GLN CA . 31013 1
145 . 1 . 1 19 19 GLN CB C 13 27.8445 0.0000 . 1 . . 5429 . A 19 GLN CB . 31013 1
146 . 1 . 1 19 19 GLN CG C 13 34.3386 0.0000 . 1 . . . . A 19 GLN CG . 31013 1
147 . 1 . 1 19 19 GLN N N 15 117.0272 0.0000 . 1 . . 5430 . A 19 GLN N . 31013 1
148 . 1 . 1 20 20 CYS H H 1 7.6545 0.0000 . 1 . . 6349 . A 20 CYS H . 31013 1
149 . 1 . 1 20 20 CYS HA H 1 4.4715 0.0000 . 1 . . . . A 20 CYS HA . 31013 1
150 . 1 . 1 20 20 CYS HB2 H 1 3.0943 0.0000 . 2 . . . . A 20 CYS HB2 . 31013 1
151 . 1 . 1 20 20 CYS HB3 H 1 3.4066 0.0000 . 2 . . . . A 20 CYS HB3 . 31013 1
152 . 1 . 1 20 20 CYS CA C 13 57.2238 0.0000 . 1 . . 5432 . A 20 CYS CA . 31013 1
153 . 1 . 1 20 20 CYS CB C 13 37.6706 0.0000 . 1 . . 5435 . A 20 CYS CB . 31013 1
154 . 1 . 1 20 20 CYS N N 15 116.6675 0.0000 . 1 . . 6351 . A 20 CYS N . 31013 1
155 . 1 . 1 21 21 LYS H H 1 7.4206 0.0000 . 1 . . 13188 . A 21 LYS H . 31013 1
156 . 1 . 1 21 21 LYS HA H 1 3.9240 0.0000 . 1 . . . . A 21 LYS HA . 31013 1
157 . 1 . 1 21 21 LYS HB2 H 1 1.9366 0.0000 . 2 . . . . A 21 LYS HB2 . 31013 1
158 . 1 . 1 21 21 LYS HB3 H 1 1.8507 0.0000 . 2 . . . . A 21 LYS HB3 . 31013 1
159 . 1 . 1 21 21 LYS HG2 H 1 1.3850 0.0000 . 2 . . . . A 21 LYS HG2 . 31013 1
160 . 1 . 1 21 21 LYS HD2 H 1 1.7121 0.0000 . 2 . . . . A 21 LYS HD2 . 31013 1
161 . 1 . 1 21 21 LYS CA C 13 58.7727 0.0000 . 1 . . 13189 . A 21 LYS CA . 31013 1
162 . 1 . 1 21 21 LYS CB C 13 32.5025 0.0000 . 1 . . 13192 . A 21 LYS CB . 31013 1
163 . 1 . 1 21 21 LYS CG C 13 24.7000 0.0000 . 1 . . . . A 21 LYS CG . 31013 1
164 . 1 . 1 21 21 LYS CD C 13 31.3168 0.0000 . 1 . . . . A 21 LYS CD . 31013 1
165 . 1 . 1 21 21 LYS N N 15 116.5381 0.0000 . 1 . . 13190 . A 21 LYS N . 31013 1
166 . 1 . 1 22 22 VAL H H 1 7.4293 0.0000 . 1 . . . . A 22 VAL H . 31013 1
167 . 1 . 1 22 22 VAL HA H 1 4.2914 0.0000 . 1 . . . . A 22 VAL HA . 31013 1
168 . 1 . 1 22 22 VAL HB H 1 2.2670 0.0000 . 1 . . . . A 22 VAL HB . 31013 1
169 . 1 . 1 22 22 VAL HG11 H 1 0.7528 0.0000 . 2 . . . . A 22 VAL HG11 . 31013 1
170 . 1 . 1 22 22 VAL HG12 H 1 0.7528 0.0000 . 2 . . . . A 22 VAL HG12 . 31013 1
171 . 1 . 1 22 22 VAL HG13 H 1 0.7528 0.0000 . 2 . . . . A 22 VAL HG13 . 31013 1
172 . 1 . 1 22 22 VAL HG21 H 1 0.7022 0.0000 . 2 . . . . A 22 VAL HG21 . 31013 1
173 . 1 . 1 22 22 VAL HG22 H 1 0.7022 0.0000 . 2 . . . . A 22 VAL HG22 . 31013 1
174 . 1 . 1 22 22 VAL HG23 H 1 0.7022 0.0000 . 2 . . . . A 22 VAL HG23 . 31013 1
175 . 1 . 1 22 22 VAL CA C 13 61.4286 0.0000 . 1 . . . . A 22 VAL CA . 31013 1
176 . 1 . 1 22 22 VAL CB C 13 31.4077 0.0000 . 1 . . . . A 22 VAL CB . 31013 1
177 . 1 . 1 22 22 VAL CG1 C 13 20.7292 0.0000 . 2 . . . . A 22 VAL CG1 . 31013 1
178 . 1 . 1 22 22 VAL CG2 C 13 20.7292 0.0000 . 2 . . . . A 22 VAL CG2 . 31013 1
179 . 1 . 1 23 23 GLN H H 1 6.9766 0.0000 . 1 . . . . A 23 GLN H . 31013 1
180 . 1 . 1 23 23 GLN C C 13 176.4628 0.0000 . 1 . . . . A 23 GLN C . 31013 1
181 . 1 . 1 23 23 GLN CA C 13 55.8834 0.0000 . 1 . . . . A 23 GLN CA . 31013 1
182 . 1 . 1 23 23 GLN CB C 13 27.7746 0.0000 . 1 . . . . A 23 GLN CB . 31013 1
183 . 1 . 1 23 23 GLN N N 15 122.0000 0.0000 . 1 . . . . A 23 GLN N . 31013 1
184 . 1 . 1 25 25 GLN HA H 1 4.2794 0.0000 . 1 . . . . A 25 GLN HA . 31013 1
185 . 1 . 1 25 25 GLN HB2 H 1 2.2135 0.0000 . 2 . . . . A 25 GLN HB2 . 31013 1
186 . 1 . 1 25 25 GLN HB3 H 1 2.3096 0.0000 . 2 . . . . A 25 GLN HB3 . 31013 1
187 . 1 . 1 25 25 GLN HG2 H 1 2.3096 0.0000 . 2 . . . . A 25 GLN HG2 . 31013 1
188 . 1 . 1 25 25 GLN CA C 13 56.3133 0.0000 . 1 . . 4841 . A 25 GLN CA . 31013 1
189 . 1 . 1 25 25 GLN CB C 13 28.1036 0.0000 . 1 . . 15876 . A 25 GLN CB . 31013 1
190 . 1 . 1 25 25 GLN CG C 13 33.6860 0.0000 . 1 . . . . A 25 GLN CG . 31013 1
191 . 1 . 1 26 26 TYR H H 1 7.1647 0.0000 . 1 . . 5773 . A 26 TYR H . 31013 1
192 . 1 . 1 26 26 TYR HA H 1 4.6015 0.0000 . 1 . . . . A 26 TYR HA . 31013 1
193 . 1 . 1 26 26 TYR HB2 H 1 3.1023 0.0000 . 2 . . . . A 26 TYR HB2 . 31013 1
194 . 1 . 1 26 26 TYR HB3 H 1 3.2945 0.0000 . 2 . . . . A 26 TYR HB3 . 31013 1
195 . 1 . 1 26 26 TYR HD1 H 1 7.2440 0.0000 . 3 . . . . A 26 TYR HD1 . 31013 1
196 . 1 . 1 26 26 TYR HE1 H 1 6.9426 0.0000 . 3 . . . . A 26 TYR HE1 . 31013 1
197 . 1 . 1 26 26 TYR CA C 13 53.8400 0.0000 . 1 . . . . A 26 TYR CA . 31013 1
198 . 1 . 1 26 26 TYR CB C 13 39.4059 0.0000 . 1 . . 5354 . A 26 TYR CB . 31013 1
199 . 1 . 1 26 26 TYR CD1 C 13 132.0020 0.0000 . 3 . . . . A 26 TYR CD1 . 31013 1
200 . 1 . 1 26 26 TYR CE1 C 13 118.1715 0.0000 . 3 . . . . A 26 TYR CE1 . 31013 1
201 . 1 . 1 26 26 TYR N N 15 119.8493 0.0000 . 1 . . 5775 . A 26 TYR N . 31013 1
202 . 1 . 1 27 27 ASP H H 1 8.5025 0.0000 . 1 . . 4603 . A 27 ASP H . 31013 1
203 . 1 . 1 27 27 ASP HB2 H 1 2.7940 0.0000 . 2 . . . . A 27 ASP HB2 . 31013 1
204 . 1 . 1 27 27 ASP HB3 H 1 3.2103 0.0000 . 2 . . . . A 27 ASP HB3 . 31013 1
205 . 1 . 1 27 27 ASP CA C 13 52.3448 0.0000 . 1 . . 5207 . A 27 ASP CA . 31013 1
206 . 1 . 1 27 27 ASP CB C 13 40.8533 0.0000 . 1 . . 5210 . A 27 ASP CB . 31013 1
207 . 1 . 1 27 27 ASP N N 15 122.5724 0.0000 . 1 . . 4605 . A 27 ASP N . 31013 1
208 . 1 . 1 28 28 GLU H H 1 8.4766 0.0000 . 1 . . 5842 . A 28 GLU H . 31013 1
209 . 1 . 1 28 28 GLU HA H 1 3.9431 0.0000 . 1 . . . . A 28 GLU HA . 31013 1
210 . 1 . 1 28 28 GLU HB2 H 1 2.0854 0.0000 . 2 . . . . A 28 GLU HB2 . 31013 1
211 . 1 . 1 28 28 GLU HG2 H 1 2.4137 0.0000 . 2 . . . . A 28 GLU HG2 . 31013 1
212 . 1 . 1 28 28 GLU CA C 13 60.2603 0.0000 . 1 . . 5414 . A 28 GLU CA . 31013 1
213 . 1 . 1 28 28 GLU CB C 13 29.3695 0.0000 . 1 . . 12917 . A 28 GLU CB . 31013 1
214 . 1 . 1 28 28 GLU CG C 13 36.1538 0.0000 . 1 . . . . A 28 GLU CG . 31013 1
215 . 1 . 1 28 28 GLU N N 15 118.1391 0.0000 . 1 . . 5844 . A 28 GLU N . 31013 1
216 . 1 . 1 29 29 GLN H H 1 8.0536 0.0000 . 1 . . 11525 . A 29 GLN H . 31013 1
217 . 1 . 1 29 29 GLN HA H 1 4.1352 0.0000 . 1 . . . . A 29 GLN HA . 31013 1
218 . 1 . 1 29 29 GLN HB2 H 1 2.1655 0.0000 . 2 . . . . A 29 GLN HB2 . 31013 1
219 . 1 . 1 29 29 GLN HG2 H 1 2.4217 0.0000 . 2 . . . . A 29 GLN HG2 . 31013 1
220 . 1 . 1 29 29 GLN CA C 13 59.2600 0.0000 . 1 . . 11529 . A 29 GLN CA . 31013 1
221 . 1 . 1 29 29 GLN CB C 13 28.0533 0.0000 . 1 . . 11535 . A 29 GLN CB . 31013 1
222 . 1 . 1 29 29 GLN CG C 13 34.3910 0.0000 . 1 . . . . A 29 GLN CG . 31013 1
223 . 1 . 1 29 29 GLN N N 15 120.2278 0.0000 . 1 . . 11527 . A 29 GLN N . 31013 1
224 . 1 . 1 30 30 GLN H H 1 8.7332 0.0000 . 1 . . 9200 . A 30 GLN H . 31013 1
225 . 1 . 1 30 30 GLN HA H 1 3.8710 0.0000 . 1 . . . . A 30 GLN HA . 31013 1
226 . 1 . 1 30 30 GLN HB2 H 1 2.0934 0.0000 . 2 . . . . A 30 GLN HB2 . 31013 1
227 . 1 . 1 30 30 GLN HG2 H 1 2.5330 0.0000 . 2 . . . . A 30 GLN HG2 . 31013 1
228 . 1 . 1 30 30 GLN CA C 13 58.8312 0.0000 . 1 . . 9462 . A 30 GLN CA . 31013 1
229 . 1 . 1 30 30 GLN CB C 13 28.2165 0.0000 . 1 . . 9204 . A 30 GLN CB . 31013 1
230 . 1 . 1 30 30 GLN CG C 13 34.4790 0.0000 . 1 . . . . A 30 GLN CG . 31013 1
231 . 1 . 1 30 30 GLN N N 15 122.0184 0.0000 . 1 . . 9202 . A 30 GLN N . 31013 1
232 . 1 . 1 31 31 LYS H H 1 8.5266 0.0000 . 1 . . 9323 . A 31 LYS H . 31013 1
233 . 1 . 1 31 31 LYS HA H 1 3.8630 0.0000 . 1 . . . . A 31 LYS HA . 31013 1
234 . 1 . 1 31 31 LYS HB2 H 1 1.8359 0.0000 . 2 . . . . A 31 LYS HB2 . 31013 1
235 . 1 . 1 31 31 LYS HG2 H 1 1.6850 0.0000 . 2 . . . . A 31 LYS HG2 . 31013 1
236 . 1 . 1 31 31 LYS HD2 H 1 1.6376 0.0000 . 2 . . . . A 31 LYS HD2 . 31013 1
237 . 1 . 1 31 31 LYS HE2 H 1 3.0000 0.0000 . 2 . . . . A 31 LYS HE2 . 31013 1
238 . 1 . 1 31 31 LYS CA C 13 61.3870 0.0000 . 1 . . 15913 . A 31 LYS CA . 31013 1
239 . 1 . 1 31 31 LYS CB C 13 32.7608 0.0000 . 1 . . 15917 . A 31 LYS CB . 31013 1
240 . 1 . 1 31 31 LYS CG C 13 27.1413 0.0000 . 1 . . . . A 31 LYS CG . 31013 1
241 . 1 . 1 31 31 LYS CD C 13 27.1413 0.0000 . 1 . . . . A 31 LYS CD . 31013 1
242 . 1 . 1 31 31 LYS CE C 13 42.2360 0.0000 . 1 . . . . A 31 LYS CE . 31013 1
243 . 1 . 1 31 31 LYS N N 15 121.9728 0.0000 . 1 . . 9325 . A 31 LYS N . 31013 1
244 . 1 . 1 32 32 GLU H H 1 7.8043 0.0000 . 1 . . 5359 . A 32 GLU H . 31013 1
245 . 1 . 1 32 32 GLU HA H 1 4.0872 0.0000 . 1 . . . . A 32 GLU HA . 31013 1
246 . 1 . 1 32 32 GLU HB2 H 1 2.1895 0.0000 . 2 . . . . A 32 GLU HB2 . 31013 1
247 . 1 . 1 32 32 GLU HB3 H 1 2.2700 0.0000 . 2 . . . . A 32 GLU HB3 . 31013 1
248 . 1 . 1 32 32 GLU HG2 H 1 2.4057 0.0000 . 2 . . . . A 32 GLU HG2 . 31013 1
249 . 1 . 1 32 32 GLU HG3 H 1 2.2700 0.0000 . 2 . . . . A 32 GLU HG3 . 31013 1
250 . 1 . 1 32 32 GLU CA C 13 59.2812 0.0000 . 1 . . 5369 . A 32 GLU CA . 31013 1
251 . 1 . 1 32 32 GLU CB C 13 29.3781 0.0000 . 1 . . 5387 . A 32 GLU CB . 31013 1
252 . 1 . 1 32 32 GLU CG C 13 36.0657 0.0000 . 1 . . . . A 32 GLU CG . 31013 1
253 . 1 . 1 32 32 GLU N N 15 119.7047 0.0000 . 1 . . 5361 . A 32 GLU N . 31013 1
254 . 1 . 1 33 33 GLN H H 1 8.0738 0.0000 . 1 . . 5341 . A 33 GLN H . 31013 1
255 . 1 . 1 33 33 GLN HA H 1 3.9831 0.0000 . 1 . . . . A 33 GLN HA . 31013 1
256 . 1 . 1 33 33 GLN HB2 H 1 2.0854 0.0000 . 2 . . . . A 33 GLN HB2 . 31013 1
257 . 1 . 1 33 33 GLN HG2 H 1 2.4377 0.0000 . 2 . . . . A 33 GLN HG2 . 31013 1
258 . 1 . 1 33 33 GLN CA C 13 58.7425 0.0000 . 1 . . 5342 . A 33 GLN CA . 31013 1
259 . 1 . 1 33 33 GLN CB C 13 27.9097 0.0000 . 1 . . 11365 . A 33 GLN CB . 31013 1
260 . 1 . 1 33 33 GLN CG C 13 33.1570 0.0000 . 1 . . . . A 33 GLN CG . 31013 1
261 . 1 . 1 33 33 GLN N N 15 120.1675 0.0000 . 1 . . 5343 . A 33 GLN N . 31013 1
262 . 1 . 1 34 34 CYS H H 1 7.9139 0.0000 . 1 . . 10354 . A 34 CYS H . 31013 1
263 . 1 . 1 34 34 CYS HA H 1 4.2954 0.0000 . 1 . . . . A 34 CYS HA . 31013 1
264 . 1 . 1 34 34 CYS HB2 H 1 2.9181 0.0000 . 2 . . . . A 34 CYS HB2 . 31013 1
265 . 1 . 1 34 34 CYS HB3 H 1 3.7109 0.0000 . 2 . . . . A 34 CYS HB3 . 31013 1
266 . 1 . 1 34 34 CYS CA C 13 59.8629 0.0000 . 1 . . 10364 . A 34 CYS CA . 31013 1
267 . 1 . 1 34 34 CYS CB C 13 34.1071 0.0000 . 1 . . 10358 . A 34 CYS CB . 31013 1
268 . 1 . 1 34 34 CYS N N 15 120.9810 0.0000 . 1 . . 10356 . A 34 CYS N . 31013 1
269 . 1 . 1 35 35 VAL H H 1 8.2712 0.0000 . 1 . . 8004 . A 35 VAL H . 31013 1
270 . 1 . 1 35 35 VAL HA H 1 4.0391 0.0000 . 1 . . . . A 35 VAL HA . 31013 1
271 . 1 . 1 35 35 VAL HB H 1 2.2872 0.0000 . 1 . . . . A 35 VAL HB . 31013 1
272 . 1 . 1 35 35 VAL HG11 H 1 1.1026 0.0000 . 2 . . . . A 35 VAL HG11 . 31013 1
273 . 1 . 1 35 35 VAL HG12 H 1 1.1026 0.0000 . 2 . . . . A 35 VAL HG12 . 31013 1
274 . 1 . 1 35 35 VAL HG13 H 1 1.1026 0.0000 . 2 . . . . A 35 VAL HG13 . 31013 1
275 . 1 . 1 35 35 VAL HG21 H 1 0.9762 0.0000 . 2 . . . . A 35 VAL HG21 . 31013 1
276 . 1 . 1 35 35 VAL HG22 H 1 0.9762 0.0000 . 2 . . . . A 35 VAL HG22 . 31013 1
277 . 1 . 1 35 35 VAL HG23 H 1 0.9762 0.0000 . 2 . . . . A 35 VAL HG23 . 31013 1
278 . 1 . 1 35 35 VAL CA C 13 67.8229 0.0000 . 1 . . 8005 . A 35 VAL CA . 31013 1
279 . 1 . 1 35 35 VAL CB C 13 31.5197 0.0000 . 1 . . 8008 . A 35 VAL CB . 31013 1
280 . 1 . 1 35 35 VAL CG1 C 13 23.7900 0.0000 . 2 . . . . A 35 VAL CG1 . 31013 1
281 . 1 . 1 35 35 VAL CG2 C 13 21.8000 0.0000 . 2 . . . . A 35 VAL CG2 . 31013 1
282 . 1 . 1 35 35 VAL N N 15 122.7854 0.0000 . 1 . . 8006 . A 35 VAL N . 31013 1
283 . 1 . 1 36 36 LYS H H 1 8.0251 0.0000 . 1 . . 10663 . A 36 LYS H . 31013 1
284 . 1 . 1 36 36 LYS HA H 1 4.0872 0.0000 . 1 . . . . A 36 LYS HA . 31013 1
285 . 1 . 1 36 36 LYS HB2 H 1 2.0133 0.0000 . 2 . . . . A 36 LYS HB2 . 31013 1
286 . 1 . 1 36 36 LYS HB3 H 1 1.9493 0.0000 . 2 . . . . A 36 LYS HB3 . 31013 1
287 . 1 . 1 36 36 LYS HG2 H 1 1.4929 0.0000 . 2 . . . . A 36 LYS HG2 . 31013 1
288 . 1 . 1 36 36 LYS HD2 H 1 1.6770 0.0000 . 2 . . . . A 36 LYS HD2 . 31013 1
289 . 1 . 1 36 36 LYS HE2 H 1 3.0000 0.0000 . 2 . . . . A 36 LYS HE2 . 31013 1
290 . 1 . 1 36 36 LYS CA C 13 59.5832 0.0000 . 1 . . 10664 . A 36 LYS CA . 31013 1
291 . 1 . 1 36 36 LYS CB C 13 32.0569 0.0000 . 1 . . 10667 . A 36 LYS CB . 31013 1
292 . 1 . 1 36 36 LYS CG C 13 25.3300 0.0000 . 1 . . . . A 36 LYS CG . 31013 1
293 . 1 . 1 36 36 LYS CD C 13 30.6000 0.0000 . 1 . . . . A 36 LYS CD . 31013 1
294 . 1 . 1 36 36 LYS CE C 13 42.1474 0.0000 . 1 . . . . A 36 LYS CE . 31013 1
295 . 1 . 1 36 36 LYS N N 15 120.8344 0.0000 . 1 . . 10665 . A 36 LYS N . 31013 1
296 . 1 . 1 37 37 GLU H H 1 8.3255 0.0000 . 1 . . 9253 . A 37 GLU H . 31013 1
297 . 1 . 1 37 37 GLU HA H 1 4.1352 0.0000 . 1 . . . . A 37 GLU HA . 31013 1
298 . 1 . 1 37 37 GLU HB2 H 1 2.1815 0.0000 . 2 . . . . A 37 GLU HB2 . 31013 1
299 . 1 . 1 37 37 GLU HG2 H 1 2.4217 0.0000 . 2 . . . . A 37 GLU HG2 . 31013 1
300 . 1 . 1 37 37 GLU CA C 13 59.5921 0.0000 . 1 . . 9254 . A 37 GLU CA . 31013 1
301 . 1 . 1 37 37 GLU CB C 13 28.6856 0.0000 . 1 . . 9257 . A 37 GLU CB . 31013 1
302 . 1 . 1 37 37 GLU CG C 13 36.3141 0.0000 . 1 . . . . A 37 GLU CG . 31013 1
303 . 1 . 1 37 37 GLU N N 15 121.9681 0.0000 . 1 . . 9255 . A 37 GLU N . 31013 1
304 . 1 . 1 38 38 CYS H H 1 8.2890 0.0000 . 1 . . 5371 . A 38 CYS H . 31013 1
305 . 1 . 1 38 38 CYS HA H 1 4.5756 0.0000 . 1 . . . . A 38 CYS HA . 31013 1
306 . 1 . 1 38 38 CYS HB2 H 1 3.0302 0.0000 . 2 . . . . A 38 CYS HB2 . 31013 1
307 . 1 . 1 38 38 CYS HB3 H 1 3.6708 0.0000 . 2 . . . . A 38 CYS HB3 . 31013 1
308 . 1 . 1 38 38 CYS CA C 13 58.5899 0.0000 . 1 . . 5372 . A 38 CYS CA . 31013 1
309 . 1 . 1 38 38 CYS CB C 13 38.7359 0.0000 . 1 . . 5357 . A 38 CYS CB . 31013 1
310 . 1 . 1 38 38 CYS N N 15 119.7987 0.0000 . 1 . . 5373 . A 38 CYS N . 31013 1
311 . 1 . 1 39 39 GLU H H 1 8.0459 0.0000 . 1 . . 5404 . A 39 GLU H . 31013 1
312 . 1 . 1 39 39 GLU HA H 1 4.0231 0.0000 . 1 . . . . A 39 GLU HA . 31013 1
313 . 1 . 1 39 39 GLU HB2 H 1 2.2536 0.0000 . 2 . . . . A 39 GLU HB2 . 31013 1
314 . 1 . 1 39 39 GLU HG2 H 1 2.5980 0.0000 . 2 . . . . A 39 GLU HG2 . 31013 1
315 . 1 . 1 39 39 GLU CA C 13 59.6087 0.0000 . 1 . . 5402 . A 39 GLU CA . 31013 1
316 . 1 . 1 39 39 GLU CB C 13 29.4173 0.0000 . 1 . . 5408 . A 39 GLU CB . 31013 1
317 . 1 . 1 39 39 GLU CG C 13 36.8750 0.0000 . 1 . . . . A 39 GLU CG . 31013 1
318 . 1 . 1 39 39 GLU N N 15 119.2344 0.0000 . 1 . . 5406 . A 39 GLU N . 31013 1
319 . 1 . 1 40 40 LYS H H 1 8.0792 0.0000 . 1 . . 10060 . A 40 LYS H . 31013 1
320 . 1 . 1 40 40 LYS HA H 1 4.0552 0.0000 . 1 . . . . A 40 LYS HA . 31013 1
321 . 1 . 1 40 40 LYS HB2 H 1 1.9173 0.0000 . 2 . . . . A 40 LYS HB2 . 31013 1
322 . 1 . 1 40 40 LYS HG2 H 1 1.2927 0.0000 . 2 . . . . A 40 LYS HG2 . 31013 1
323 . 1 . 1 40 40 LYS HD2 H 1 1.5207 0.0000 . 2 . . . . A 40 LYS HD2 . 31013 1
324 . 1 . 1 40 40 LYS HE2 H 1 3.0454 0.0000 . 2 . . . . A 40 LYS HE2 . 31013 1
325 . 1 . 1 40 40 LYS CA C 13 59.3910 0.0000 . 1 . . . . A 40 LYS CA . 31013 1
326 . 1 . 1 40 40 LYS CB C 13 32.9150 0.0000 . 1 . . 10064 . A 40 LYS CB . 31013 1
327 . 1 . 1 40 40 LYS CG C 13 24.6955 0.0000 . 1 . . . . A 40 LYS CG . 31013 1
328 . 1 . 1 40 40 LYS CD C 13 29.8200 0.0000 . 1 . . . . A 40 LYS CD . 31013 1
329 . 1 . 1 40 40 LYS CE C 13 41.8429 0.0000 . 1 . . . . A 40 LYS CE . 31013 1
330 . 1 . 1 40 40 LYS N N 15 120.9838 0.0000 . 1 . . 10062 . A 40 LYS N . 31013 1
331 . 1 . 1 41 41 TYR H H 1 8.2251 0.0000 . 1 . . 12104 . A 41 TYR H . 31013 1
332 . 1 . 1 41 41 TYR HA H 1 4.1757 0.0000 . 1 . . . . A 41 TYR HA . 31013 1
333 . 1 . 1 41 41 TYR HB2 H 1 3.0480 0.0000 . 2 . . . . A 41 TYR HB2 . 31013 1
334 . 1 . 1 41 41 TYR HB3 H 1 3.1002 0.0000 . 2 . . . . A 41 TYR HB3 . 31013 1
335 . 1 . 1 41 41 TYR HD1 H 1 6.6371 0.0000 . 3 . . . . A 41 TYR HD1 . 31013 1
336 . 1 . 1 41 41 TYR HE1 H 1 6.7972 0.0000 . 3 . . . . A 41 TYR HE1 . 31013 1
337 . 1 . 1 41 41 TYR CA C 13 61.0085 0.0000 . 1 . . 12105 . A 41 TYR CA . 31013 1
338 . 1 . 1 41 41 TYR CB C 13 38.3500 0.0000 . 1 . . 12114 . A 41 TYR CB . 31013 1
339 . 1 . 1 41 41 TYR CD1 C 13 133.2155 0.0000 . 3 . . . . A 41 TYR CD1 . 31013 1
340 . 1 . 1 41 41 TYR CE1 C 13 118.2396 0.0000 . 3 . . . . A 41 TYR CE1 . 31013 1
341 . 1 . 1 41 41 TYR N N 15 119.7047 0.0000 . 1 . . 12106 . A 41 TYR N . 31013 1
342 . 1 . 1 42 42 TYR H H 1 7.9963 0.0000 . 1 . . 5419 . A 42 TYR H . 31013 1
343 . 1 . 1 42 42 TYR HA H 1 3.9570 0.0000 . 1 . . . . A 42 TYR HA . 31013 1
344 . 1 . 1 42 42 TYR HB2 H 1 3.0331 0.0000 . 2 . . . . A 42 TYR HB2 . 31013 1
345 . 1 . 1 42 42 TYR HB3 H 1 3.2790 0.0000 . 2 . . . . A 42 TYR HB3 . 31013 1
346 . 1 . 1 42 42 TYR HD1 H 1 7.2109 0.0000 . 3 . . . . A 42 TYR HD1 . 31013 1
347 . 1 . 1 42 42 TYR HE1 H 1 6.9873 0.0000 . 3 . . . . A 42 TYR HE1 . 31013 1
348 . 1 . 1 42 42 TYR CA C 13 61.7480 0.0000 . 1 . . 5420 . A 42 TYR CA . 31013 1
349 . 1 . 1 42 42 TYR CB C 13 38.5979 0.0000 . 1 . . 5426 . A 42 TYR CB . 31013 1
350 . 1 . 1 42 42 TYR CG C 13 133.3167 0.0000 . 1 . . . . A 42 TYR CG . 31013 1
351 . 1 . 1 42 42 TYR CE1 C 13 118.5573 0.0000 . 3 . . . . A 42 TYR CE1 . 31013 1
352 . 1 . 1 42 42 TYR N N 15 117.1187 0.0000 . 1 . . 5421 . A 42 TYR N . 31013 1
353 . 1 . 1 43 43 LYS H H 1 7.9795 0.0000 . 1 . . 5674 . A 43 LYS H . 31013 1
354 . 1 . 1 43 43 LYS HA H 1 4.1060 0.0000 . 1 . . . . A 43 LYS HA . 31013 1
355 . 1 . 1 43 43 LYS HB2 H 1 1.9826 0.0000 . 2 . . . . A 43 LYS HB2 . 31013 1
356 . 1 . 1 43 43 LYS HG2 H 1 1.5207 0.0000 . 2 . . . . A 43 LYS HG2 . 31013 1
357 . 1 . 1 43 43 LYS HD2 H 1 1.7219 0.0000 . 2 . . . . A 43 LYS HD2 . 31013 1
358 . 1 . 1 43 43 LYS HE2 H 1 2.9440 0.0000 . 2 . . . . A 43 LYS HE2 . 31013 1
359 . 1 . 1 43 43 LYS CA C 13 58.9813 0.0000 . 1 . . 14354 . A 43 LYS CA . 31013 1
360 . 1 . 1 43 43 LYS CB C 13 32.7365 0.0000 . 1 . . 14350 . A 43 LYS CB . 31013 1
361 . 1 . 1 43 43 LYS CG C 13 25.3365 0.0000 . 1 . . . . A 43 LYS CG . 31013 1
362 . 1 . 1 43 43 LYS CD C 13 29.2628 0.0000 . 1 . . . . A 43 LYS CD . 31013 1
363 . 1 . 1 43 43 LYS CE C 13 42.0833 0.0000 . 1 . . . . A 43 LYS CE . 31013 1
364 . 1 . 1 43 43 LYS N N 15 121.1652 0.0000 . 1 . . 5676 . A 43 LYS N . 31013 1
365 . 1 . 1 44 44 GLU H H 1 7.9757 0.0000 . 1 . . 11863 . A 44 GLU H . 31013 1
366 . 1 . 1 44 44 GLU HA H 1 4.1432 0.0000 . 1 . . . . A 44 GLU HA . 31013 1
367 . 1 . 1 44 44 GLU HB2 H 1 2.0273 0.0000 . 2 . . . . A 44 GLU HB2 . 31013 1
368 . 1 . 1 44 44 GLU HB3 H 1 2.2210 0.0000 . 2 . . . . A 44 GLU HB3 . 31013 1
369 . 1 . 1 44 44 GLU HG2 H 1 2.4147 0.0000 . 2 . . . . A 44 GLU HG2 . 31013 1
370 . 1 . 1 44 44 GLU HG3 H 1 2.2210 0.0000 . 2 . . . . A 44 GLU HG3 . 31013 1
371 . 1 . 1 44 44 GLU CA C 13 57.8634 0.0000 . 1 . . 12032 . A 44 GLU CA . 31013 1
372 . 1 . 1 44 44 GLU CB C 13 29.4395 0.0000 . 1 . . 11867 . A 44 GLU CB . 31013 1
373 . 1 . 1 44 44 GLU CG C 13 36.3942 0.0000 . 1 . . . . A 44 GLU CG . 31013 1
374 . 1 . 1 44 44 GLU N N 15 119.7676 0.0000 . 1 . . 11865 . A 44 GLU N . 31013 1
375 . 1 . 1 45 45 LYS H H 1 7.8518 0.0000 . 1 . . 5290 . A 45 LYS H . 31013 1
376 . 1 . 1 45 45 LYS HA H 1 4.0389 0.0000 . 1 . . . . A 45 LYS HA . 31013 1
377 . 1 . 1 45 45 LYS HB2 H 1 1.7368 0.0000 . 2 . . . . A 45 LYS HB2 . 31013 1
378 . 1 . 1 45 45 LYS HG2 H 1 1.3270 0.0000 . 2 . . . . A 45 LYS HG2 . 31013 1
379 . 1 . 1 45 45 LYS HD2 H 1 1.6474 0.0000 . 2 . . . . A 45 LYS HD2 . 31013 1
380 . 1 . 1 45 45 LYS CA C 13 57.9230 0.0000 . 1 . . . . A 45 LYS CA . 31013 1
381 . 1 . 1 45 45 LYS CB C 13 32.5671 0.0000 . 1 . . 5297 . A 45 LYS CB . 31013 1
382 . 1 . 1 45 45 LYS CG C 13 24.6955 0.0000 . 1 . . . . A 45 LYS CG . 31013 1
383 . 1 . 1 45 45 LYS CE C 13 41.9231 0.0000 . 1 . . . . A 45 LYS CE . 31013 1
384 . 1 . 1 45 45 LYS N N 15 121.3019 0.0000 . 1 . . 5292 . A 45 LYS N . 31013 1
385 . 1 . 1 46 46 LYS H H 1 8.0008 0.0000 . 1 . . 5320 . A 46 LYS H . 31013 1
386 . 1 . 1 46 46 LYS HA H 1 4.2028 0.0000 . 1 . . . . A 46 LYS HA . 31013 1
387 . 1 . 1 46 46 LYS HB2 H 1 1.7815 0.0000 . 2 . . . . A 46 LYS HB2 . 31013 1
388 . 1 . 1 46 46 LYS HB3 H 1 1.7070 0.0000 . 2 . . . . A 46 LYS HB3 . 31013 1
389 . 1 . 1 46 46 LYS HG2 H 1 1.4164 0.0000 . 2 . . . . A 46 LYS HG2 . 31013 1
390 . 1 . 1 46 46 LYS HE2 H 1 2.8561 0.0000 . 2 . . . . A 46 LYS HE2 . 31013 1
391 . 1 . 1 46 46 LYS HE3 H 1 2.8741 0.0000 . 2 . . . . A 46 LYS HE3 . 31013 1
392 . 1 . 1 46 46 LYS CA C 13 57.0910 0.0000 . 1 . . 5321 . A 46 LYS CA . 31013 1
393 . 1 . 1 46 46 LYS CB C 13 32.3664 0.0000 . 1 . . 11000 . A 46 LYS CB . 31013 1
394 . 1 . 1 46 46 LYS CG C 13 24.5353 0.0000 . 1 . . . . A 46 LYS CG . 31013 1
395 . 1 . 1 46 46 LYS CE C 13 41.6830 0.0000 . 1 . . . . A 46 LYS CE . 31013 1
396 . 1 . 1 46 46 LYS N N 15 120.7542 0.0000 . 1 . . 5322 . A 46 LYS N . 31013 1
397 . 1 . 1 47 47 GLY H H 1 8.1332 0.0000 . 1 . . 5137 . A 47 GLY H . 31013 1
398 . 1 . 1 47 47 GLY HA2 H 1 3.9570 0.0000 . 2 . . . . A 47 GLY HA2 . 31013 1
399 . 1 . 1 47 47 GLY CA C 13 45.9526 0.0000 . 1 . . 14258 . A 47 GLY CA . 31013 1
400 . 1 . 1 47 47 GLY N N 15 109.0468 0.0000 . 1 . . 5139 . A 47 GLY N . 31013 1
401 . 1 . 1 48 48 ARG H H 1 7.9600 0.0000 . 1 . . 10471 . A 48 ARG H . 31013 1
402 . 1 . 1 48 48 ARG HA H 1 4.3220 0.0000 . 1 . . . . A 48 ARG HA . 31013 1
403 . 1 . 1 48 48 ARG HB2 H 1 1.8709 0.0000 . 2 . . . . A 48 ARG HB2 . 31013 1
404 . 1 . 1 48 48 ARG HG2 H 1 1.6772 0.0000 . 2 . . . . A 48 ARG HG2 . 31013 1
405 . 1 . 1 48 48 ARG HD2 H 1 3.1970 0.0000 . 2 . . . . A 48 ARG HD2 . 31013 1
406 . 1 . 1 48 48 ARG CA C 13 56.7055 0.0000 . 1 . . 14374 . A 48 ARG CA . 31013 1
407 . 1 . 1 48 48 ARG CB C 13 30.4839 0.0000 . 1 . . 10597 . A 48 ARG CB . 31013 1
408 . 1 . 1 48 48 ARG CG C 13 27.0994 0.0000 . 1 . . . . A 48 ARG CG . 31013 1
409 . 1 . 1 48 48 ARG CD C 13 43.3660 0.0000 . 1 . . . . A 48 ARG CD . 31013 1
410 . 1 . 1 48 48 ARG N N 15 120.8557 0.0000 . 1 . . 10473 . A 48 ARG N . 31013 1
411 . 1 . 1 49 49 GLU H H 1 8.3184 0.0000 . 1 . . 5644 . A 49 GLU H . 31013 1
412 . 1 . 1 49 49 GLU HA H 1 4.2252 0.0000 . 1 . . . . A 49 GLU HA . 31013 1
413 . 1 . 1 49 49 GLU HB2 H 1 2.0646 0.0000 . 2 . . . . A 49 GLU HB2 . 31013 1
414 . 1 . 1 49 49 GLU HG2 H 1 2.3551 0.0000 . 2 . . . . A 49 GLU HG2 . 31013 1
415 . 1 . 1 49 49 GLU CA C 13 57.4169 0.0000 . 1 . . 15893 . A 49 GLU CA . 31013 1
416 . 1 . 1 49 49 GLU CB C 13 29.9240 0.0000 . 1 . . 15895 . A 49 GLU CB . 31013 1
417 . 1 . 1 49 49 GLU CG C 13 36.3414 0.0000 . 1 . . . . A 49 GLU CG . 31013 1
418 . 1 . 1 49 49 GLU N N 15 121.7357 0.0000 . 1 . . 5646 . A 49 GLU N . 31013 1
419 . 1 . 1 50 50 ARG H H 1 8.1601 0.0000 . 1 . . 10514 . A 50 ARG H . 31013 1
420 . 1 . 1 50 50 ARG HA H 1 4.2922 0.0000 . 1 . . . . A 50 ARG HA . 31013 1
421 . 1 . 1 50 50 ARG HB2 H 1 1.8634 0.0000 . 2 . . . . A 50 ARG HB2 . 31013 1
422 . 1 . 1 50 50 ARG HG2 H 1 1.6548 0.0000 . 2 . . . . A 50 ARG HG2 . 31013 1
423 . 1 . 1 50 50 ARG HD2 H 1 3.2119 0.0000 . 2 . . . . A 50 ARG HD2 . 31013 1
424 . 1 . 1 50 50 ARG CA C 13 56.4372 0.0000 . 1 . . 15909 . A 50 ARG CA . 31013 1
425 . 1 . 1 50 50 ARG CB C 13 30.3846 0.0000 . 1 . . . . A 50 ARG CB . 31013 1
426 . 1 . 1 50 50 ARG CG C 13 26.9391 0.0000 . 1 . . . . A 50 ARG CG . 31013 1
427 . 1 . 1 50 50 ARG CD C 13 43.3904 0.0000 . 1 . . . . A 50 ARG CD . 31013 1
428 . 1 . 1 50 50 ARG N N 15 120.9749 0.0000 . 1 . . 10516 . A 50 ARG N . 31013 1
429 . 1 . 1 51 51 GLU H H 1 8.2596 0.0000 . 1 . . 6142 . A 51 GLU H . 31013 1
430 . 1 . 1 51 51 GLU CA C 13 57.4620 0.0000 . 1 . . 15905 . A 51 GLU CA . 31013 1
431 . 1 . 1 51 51 GLU CB C 13 30.0278 0.0000 . 1 . . 15907 . A 51 GLU CB . 31013 1
432 . 1 . 1 51 51 GLU N N 15 121.5892 0.0000 . 1 . . 6144 . A 51 GLU N . 31013 1
433 . 1 . 1 55 55 ARG H H 1 7.9560 0.0000 . 1 . . 8216 . A 55 ARG H . 31013 1
434 . 1 . 1 55 55 ARG HA H 1 4.3891 0.0000 . 1 . . . . A 55 ARG HA . 31013 1
435 . 1 . 1 55 55 ARG HB2 H 1 1.3856 0.0000 . 2 . . . . A 55 ARG HB2 . 31013 1
436 . 1 . 1 55 55 ARG HG2 H 1 1.6175 0.0000 . 2 . . . . A 55 ARG HG2 . 31013 1
437 . 1 . 1 55 55 ARG HD2 H 1 3.1896 0.0000 . 2 . . . . A 55 ARG HD2 . 31013 1
438 . 1 . 1 55 55 ARG CA C 13 55.6385 0.0000 . 1 . . 14154 . A 55 ARG CA . 31013 1
439 . 1 . 1 55 55 ARG CB C 13 31.3221 0.0000 . 1 . . 14158 . A 55 ARG CB . 31013 1
440 . 1 . 1 55 55 ARG CG C 13 26.6987 0.0000 . 1 . . . . A 55 ARG CG . 31013 1
441 . 1 . 1 55 55 ARG CD C 13 43.2051 0.0000 . 1 . . . . A 55 ARG CD . 31013 1
442 . 1 . 1 55 55 ARG N N 15 122.6800 0.0000 . 1 . . 8218 . A 55 ARG N . 31013 1
443 . 1 . 1 56 56 ASP H H 1 7.9838 0.0000 . 1 . . 5977 . A 56 ASP H . 31013 1
444 . 1 . 1 56 56 ASP HB2 H 1 3.0000 0.0000 . 2 . . . . A 56 ASP HB2 . 31013 1
445 . 1 . 1 56 56 ASP CA C 13 55.9017 0.0000 . 1 . . 7080 . A 56 ASP CA . 31013 1
446 . 1 . 1 56 56 ASP CB C 13 42.4273 0.0000 . 1 . . 7122 . A 56 ASP CB . 31013 1
447 . 1 . 1 56 56 ASP N N 15 127.8815 0.0000 . 1 . . 5979 . A 56 ASP N . 31013 1
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