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 15161
_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' . . . 15161 1
2 '3D CBCA(CO)NH' . . . 15161 1
3 '3D HNCACB' . . . 15161 1
4 '3D HNCO' . . . 15161 1
5 '3D HCCH-TOCSY' . . . 15161 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 1 1 ASP H H 1 8.372 0.006 . 1 . . . . 658 ASP H . 15161 1
2 . 1 1 1 1 ASP HA H 1 4.719 0.023 . 1 . . . . 658 ASP HA . 15161 1
3 . 1 1 1 1 ASP HB2 H 1 2.762 0.014 . 2 . . . . 658 ASP HB2 . 15161 1
4 . 1 1 1 1 ASP C C 13 176.598 0.000 . 1 . . . . 658 ASP C . 15161 1
5 . 1 1 1 1 ASP CA C 13 54.738 0.231 . 1 . . . . 658 ASP CA . 15161 1
6 . 1 1 1 1 ASP CB C 13 41.471 0.168 . 1 . . . . 658 ASP CB . 15161 1
7 . 1 1 1 1 ASP N N 15 122.398 0.060 . 1 . . . . 658 ASP N . 15161 1
8 . 1 1 2 2 SER H H 1 8.278 0.012 . 1 . . . . 659 SER H . 15161 1
9 . 1 1 2 2 SER HA H 1 4.556 0.010 . 1 . . . . 659 SER HA . 15161 1
10 . 1 1 2 2 SER HB2 H 1 3.945 0.013 . 2 . . . . 659 SER HB2 . 15161 1
11 . 1 1 2 2 SER HB3 H 1 4.002 0.000 . 2 . . . . 659 SER HB3 . 15161 1
12 . 1 1 2 2 SER C C 13 175.339 0.000 . 1 . . . . 659 SER C . 15161 1
13 . 1 1 2 2 SER CA C 13 58.846 0.137 . 1 . . . . 659 SER CA . 15161 1
14 . 1 1 2 2 SER CB C 13 64.026 0.155 . 1 . . . . 659 SER CB . 15161 1
15 . 1 1 2 2 SER N N 15 116.385 0.058 . 1 . . . . 659 SER N . 15161 1
16 . 1 1 3 3 SER H H 1 8.445 0.018 . 1 . . . . 660 SER H . 15161 1
17 . 1 1 3 3 SER HA H 1 4.568 0.009 . 1 . . . . 660 SER HA . 15161 1
18 . 1 1 3 3 SER HB2 H 1 4.001 0.010 . 2 . . . . 660 SER HB2 . 15161 1
19 . 1 1 3 3 SER C C 13 175.038 0.000 . 1 . . . . 660 SER C . 15161 1
20 . 1 1 3 3 SER CA C 13 59.389 0.252 . 1 . . . . 660 SER CA . 15161 1
21 . 1 1 3 3 SER CB C 13 64.109 0.230 . 1 . . . . 660 SER CB . 15161 1
22 . 1 1 3 3 SER N N 15 118.020 0.098 . 1 . . . . 660 SER N . 15161 1
23 . 1 1 4 4 GLU H H 1 8.323 0.005 . 1 . . . . 661 GLU H . 15161 1
24 . 1 1 4 4 GLU HA H 1 4.480 0.024 . 1 . . . . 661 GLU HA . 15161 1
25 . 1 1 4 4 GLU HB2 H 1 2.006 0.019 . 2 . . . . 661 GLU HB2 . 15161 1
26 . 1 1 4 4 GLU HB3 H 1 2.186 0.019 . 2 . . . . 661 GLU HB3 . 15161 1
27 . 1 1 4 4 GLU HG2 H 1 2.346 0.008 . 2 . . . . 661 GLU HG2 . 15161 1
28 . 1 1 4 4 GLU C C 13 176.093 0.000 . 1 . . . . 661 GLU C . 15161 1
29 . 1 1 4 4 GLU CA C 13 56.453 0.198 . 1 . . . . 661 GLU CA . 15161 1
30 . 1 1 4 4 GLU CB C 13 30.787 0.263 . 1 . . . . 661 GLU CB . 15161 1
31 . 1 1 4 4 GLU CG C 13 36.487 0.142 . 1 . . . . 661 GLU CG . 15161 1
32 . 1 1 4 4 GLU N N 15 121.038 0.164 . 1 . . . . 661 GLU N . 15161 1
33 . 1 1 5 5 SER H H 1 7.859 0.009 . 1 . . . . 662 SER H . 15161 1
34 . 1 1 5 5 SER HA H 1 4.615 0.008 . 1 . . . . 662 SER HA . 15161 1
35 . 1 1 5 5 SER HB2 H 1 3.703 0.013 . 2 . . . . 662 SER HB2 . 15161 1
36 . 1 1 5 5 SER C C 13 172.868 0.000 . 1 . . . . 662 SER C . 15161 1
37 . 1 1 5 5 SER CA C 13 58.092 0.246 . 1 . . . . 662 SER CA . 15161 1
38 . 1 1 5 5 SER CB C 13 65.228 0.188 . 1 . . . . 662 SER CB . 15161 1
39 . 1 1 5 5 SER N N 15 116.012 0.067 . 1 . . . . 662 SER N . 15161 1
40 . 1 1 6 6 CYS H H 1 9.565 0.013 . 1 . . . . 663 CYS H . 15161 1
41 . 1 1 6 6 CYS HA H 1 4.107 0.007 . 1 . . . . 663 CYS HA . 15161 1
42 . 1 1 6 6 CYS HB2 H 1 2.944 0.012 . 2 . . . . 663 CYS HB2 . 15161 1
43 . 1 1 6 6 CYS HB3 H 1 3.524 0.008 . 2 . . . . 663 CYS HB3 . 15161 1
44 . 1 1 6 6 CYS C C 13 178.171 0.000 . 1 . . . . 663 CYS C . 15161 1
45 . 1 1 6 6 CYS CA C 13 59.493 0.157 . 1 . . . . 663 CYS CA . 15161 1
46 . 1 1 6 6 CYS CB C 13 30.861 0.148 . 1 . . . . 663 CYS CB . 15161 1
47 . 1 1 6 6 CYS N N 15 123.233 0.087 . 1 . . . . 663 CYS N . 15161 1
48 . 1 1 7 7 TRP H H 1 9.816 0.009 . 1 . . . . 664 TRP H . 15161 1
49 . 1 1 7 7 TRP HA H 1 4.493 0.008 . 1 . . . . 664 TRP HA . 15161 1
50 . 1 1 7 7 TRP HB2 H 1 2.905 0.013 . 2 . . . . 664 TRP HB2 . 15161 1
51 . 1 1 7 7 TRP HB3 H 1 3.548 0.009 . 2 . . . . 664 TRP HB3 . 15161 1
52 . 1 1 7 7 TRP HD1 H 1 7.841 0.011 . 1 . . . . 664 TRP HD1 . 15161 1
53 . 1 1 7 7 TRP HE1 H 1 10.479 0.033 . 1 . . . . 664 TRP HE1 . 15161 1
54 . 1 1 7 7 TRP HE3 H 1 7.944 0.006 . 1 . . . . 664 TRP HE3 . 15161 1
55 . 1 1 7 7 TRP HZ2 H 1 7.466 0.009 . 1 . . . . 664 TRP HZ2 . 15161 1
56 . 1 1 7 7 TRP HZ3 H 1 7.331 0.016 . 1 . . . . 664 TRP HZ3 . 15161 1
57 . 1 1 7 7 TRP HH2 H 1 7.332 0.008 . 1 . . . . 664 TRP HH2 . 15161 1
58 . 1 1 7 7 TRP C C 13 176.097 0.000 . 1 . . . . 664 TRP C . 15161 1
59 . 1 1 7 7 TRP CA C 13 60.325 0.241 . 1 . . . . 664 TRP CA . 15161 1
60 . 1 1 7 7 TRP CB C 13 28.648 0.152 . 1 . . . . 664 TRP CB . 15161 1
61 . 1 1 7 7 TRP CD1 C 13 125.835 0.082 . 1 . . . . 664 TRP CD1 . 15161 1
62 . 1 1 7 7 TRP CE3 C 13 122.195 0.061 . 1 . . . . 664 TRP CE3 . 15161 1
63 . 1 1 7 7 TRP CZ2 C 13 115.118 0.050 . 1 . . . . 664 TRP CZ2 . 15161 1
64 . 1 1 7 7 TRP CZ3 C 13 122.209 0.101 . 1 . . . . 664 TRP CZ3 . 15161 1
65 . 1 1 7 7 TRP CH2 C 13 125.269 0.087 . 1 . . . . 664 TRP CH2 . 15161 1
66 . 1 1 7 7 TRP N N 15 133.155 0.056 . 1 . . . . 664 TRP N . 15161 1
67 . 1 1 7 7 TRP NE1 N 15 129.132 0.010 . 1 . . . . 664 TRP NE1 . 15161 1
68 . 1 1 8 8 ASN H H 1 9.541 0.014 . 1 . . . . 665 ASN H . 15161 1
69 . 1 1 8 8 ASN HA H 1 5.329 0.012 . 1 . . . . 665 ASN HA . 15161 1
70 . 1 1 8 8 ASN HB2 H 1 2.655 0.011 . 2 . . . . 665 ASN HB2 . 15161 1
71 . 1 1 8 8 ASN HB3 H 1 3.683 0.011 . 2 . . . . 665 ASN HB3 . 15161 1
72 . 1 1 8 8 ASN HD21 H 1 9.197 0.017 . 2 . . . . 665 ASN HD21 . 15161 1
73 . 1 1 8 8 ASN HD22 H 1 7.006 0.009 . 2 . . . . 665 ASN HD22 . 15161 1
74 . 1 1 8 8 ASN C C 13 175.369 0.000 . 1 . . . . 665 ASN C . 15161 1
75 . 1 1 8 8 ASN CA C 13 56.495 0.182 . 1 . . . . 665 ASN CA . 15161 1
76 . 1 1 8 8 ASN CB C 13 41.786 0.150 . 1 . . . . 665 ASN CB . 15161 1
77 . 1 1 8 8 ASN N N 15 118.529 0.074 . 1 . . . . 665 ASN N . 15161 1
78 . 1 1 8 8 ASN ND2 N 15 118.964 0.023 . 1 . . . . 665 ASN ND2 . 15161 1
79 . 1 1 9 9 CYS H H 1 8.429 0.011 . 1 . . . . 666 CYS H . 15161 1
80 . 1 1 9 9 CYS HA H 1 5.221 0.012 . 1 . . . . 666 CYS HA . 15161 1
81 . 1 1 9 9 CYS HB2 H 1 2.861 0.014 . 2 . . . . 666 CYS HB2 . 15161 1
82 . 1 1 9 9 CYS HB3 H 1 3.444 0.009 . 2 . . . . 666 CYS HB3 . 15161 1
83 . 1 1 9 9 CYS C C 13 176.829 0.000 . 1 . . . . 666 CYS C . 15161 1
84 . 1 1 9 9 CYS CA C 13 59.667 0.169 . 1 . . . . 666 CYS CA . 15161 1
85 . 1 1 9 9 CYS CB C 13 34.436 0.125 . 1 . . . . 666 CYS CB . 15161 1
86 . 1 1 9 9 CYS N N 15 116.785 0.162 . 1 . . . . 666 CYS N . 15161 1
87 . 1 1 10 10 GLY H H 1 8.280 0.013 . 1 . . . . 667 GLY H . 15161 1
88 . 1 1 10 10 GLY HA2 H 1 3.845 0.026 . 2 . . . . 667 GLY HA2 . 15161 1
89 . 1 1 10 10 GLY HA3 H 1 4.216 0.059 . 2 . . . . 667 GLY HA3 . 15161 1
90 . 1 1 10 10 GLY C C 13 174.112 0.000 . 1 . . . . 667 GLY C . 15161 1
91 . 1 1 10 10 GLY CA C 13 46.668 0.129 . 1 . . . . 667 GLY CA . 15161 1
92 . 1 1 10 10 GLY N N 15 112.778 0.070 . 1 . . . . 667 GLY N . 15161 1
93 . 1 1 11 11 ARG H H 1 8.599 0.026 . 1 . . . . 668 ARG H . 15161 1
94 . 1 1 11 11 ARG HA H 1 4.484 0.014 . 1 . . . . 668 ARG HA . 15161 1
95 . 1 1 11 11 ARG HB2 H 1 1.911 0.006 . 2 . . . . 668 ARG HB2 . 15161 1
96 . 1 1 11 11 ARG HB3 H 1 2.055 0.005 . 2 . . . . 668 ARG HB3 . 15161 1
97 . 1 1 11 11 ARG HG2 H 1 1.803 0.017 . 2 . . . . 668 ARG HG2 . 15161 1
98 . 1 1 11 11 ARG HG3 H 1 2.069 0.010 . 2 . . . . 668 ARG HG3 . 15161 1
99 . 1 1 11 11 ARG HD2 H 1 3.373 0.015 . 2 . . . . 668 ARG HD2 . 15161 1
100 . 1 1 11 11 ARG C C 13 175.377 0.000 . 1 . . . . 668 ARG C . 15161 1
101 . 1 1 11 11 ARG CA C 13 56.962 0.267 . 1 . . . . 668 ARG CA . 15161 1
102 . 1 1 11 11 ARG CB C 13 31.333 0.208 . 1 . . . . 668 ARG CB . 15161 1
103 . 1 1 11 11 ARG CG C 13 28.986 0.129 . 1 . . . . 668 ARG CG . 15161 1
104 . 1 1 11 11 ARG CD C 13 43.837 0.215 . 1 . . . . 668 ARG CD . 15161 1
105 . 1 1 11 11 ARG N N 15 122.941 0.116 . 1 . . . . 668 ARG N . 15161 1
106 . 1 1 12 12 LYS H H 1 8.299 0.010 . 1 . . . . 669 LYS H . 15161 1
107 . 1 1 12 12 LYS HA H 1 4.148 0.006 . 1 . . . . 669 LYS HA . 15161 1
108 . 1 1 12 12 LYS HB2 H 1 1.799 0.008 . 2 . . . . 669 LYS HB2 . 15161 1
109 . 1 1 12 12 LYS HB3 H 1 1.873 0.017 . 2 . . . . 669 LYS HB3 . 15161 1
110 . 1 1 12 12 LYS HG2 H 1 1.528 0.012 . 2 . . . . 669 LYS HG2 . 15161 1
111 . 1 1 12 12 LYS HD2 H 1 1.776 0.005 . 2 . . . . 669 LYS HD2 . 15161 1
112 . 1 1 12 12 LYS HE2 H 1 3.103 0.016 . 2 . . . . 669 LYS HE2 . 15161 1
113 . 1 1 12 12 LYS C C 13 176.552 0.000 . 1 . . . . 669 LYS C . 15161 1
114 . 1 1 12 12 LYS CA C 13 58.716 0.180 . 1 . . . . 669 LYS CA . 15161 1
115 . 1 1 12 12 LYS CB C 13 32.559 0.143 . 1 . . . . 669 LYS CB . 15161 1
116 . 1 1 12 12 LYS CG C 13 24.899 0.255 . 1 . . . . 669 LYS CG . 15161 1
117 . 1 1 12 12 LYS CD C 13 29.434 0.182 . 1 . . . . 669 LYS CD . 15161 1
118 . 1 1 12 12 LYS CE C 13 42.627 0.108 . 1 . . . . 669 LYS CE . 15161 1
119 . 1 1 12 12 LYS N N 15 121.177 0.079 . 1 . . . . 669 LYS N . 15161 1
120 . 1 1 13 13 ALA H H 1 8.397 0.010 . 1 . . . . 670 ALA H . 15161 1
121 . 1 1 13 13 ALA HA H 1 4.164 0.014 . 1 . . . . 670 ALA HA . 15161 1
122 . 1 1 13 13 ALA HB1 H 1 1.124 0.008 . 1 . . . . 670 ALA HB . 15161 1
123 . 1 1 13 13 ALA HB2 H 1 1.124 0.008 . 1 . . . . 670 ALA HB . 15161 1
124 . 1 1 13 13 ALA HB3 H 1 1.124 0.008 . 1 . . . . 670 ALA HB . 15161 1
125 . 1 1 13 13 ALA C C 13 176.542 0.000 . 1 . . . . 670 ALA C . 15161 1
126 . 1 1 13 13 ALA CA C 13 52.063 0.147 . 1 . . . . 670 ALA CA . 15161 1
127 . 1 1 13 13 ALA CB C 13 21.436 0.154 . 1 . . . . 670 ALA CB . 15161 1
128 . 1 1 13 13 ALA N N 15 126.268 0.087 . 1 . . . . 670 ALA N . 15161 1
129 . 1 1 14 14 SER H H 1 8.333 0.011 . 1 . . . . 671 SER H . 15161 1
130 . 1 1 14 14 SER HA H 1 4.673 0.011 . 1 . . . . 671 SER HA . 15161 1
131 . 1 1 14 14 SER HB2 H 1 3.864 0.008 . 2 . . . . 671 SER HB2 . 15161 1
132 . 1 1 14 14 SER HB3 H 1 4.010 0.006 . 2 . . . . 671 SER HB3 . 15161 1
133 . 1 1 14 14 SER C C 13 173.494 0.000 . 1 . . . . 671 SER C . 15161 1
134 . 1 1 14 14 SER CA C 13 58.799 0.228 . 1 . . . . 671 SER CA . 15161 1
135 . 1 1 14 14 SER CB C 13 65.559 0.226 . 1 . . . . 671 SER CB . 15161 1
136 . 1 1 14 14 SER N N 15 112.750 0.058 . 1 . . . . 671 SER N . 15161 1
137 . 1 1 15 15 GLU H H 1 8.285 0.007 . 1 . . . . 672 GLU H . 15161 1
138 . 1 1 15 15 GLU HA H 1 4.855 0.008 . 1 . . . . 672 GLU HA . 15161 1
139 . 1 1 15 15 GLU HB2 H 1 1.886 0.010 . 2 . . . . 672 GLU HB2 . 15161 1
140 . 1 1 15 15 GLU HB3 H 1 2.166 0.015 . 2 . . . . 672 GLU HB3 . 15161 1
141 . 1 1 15 15 GLU HG2 H 1 2.206 0.013 . 2 . . . . 672 GLU HG2 . 15161 1
142 . 1 1 15 15 GLU C C 13 175.908 0.000 . 1 . . . . 672 GLU C . 15161 1
143 . 1 1 15 15 GLU CA C 13 55.234 0.235 . 1 . . . . 672 GLU CA . 15161 1
144 . 1 1 15 15 GLU CB C 13 32.455 0.165 . 1 . . . . 672 GLU CB . 15161 1
145 . 1 1 15 15 GLU CG C 13 35.501 0.159 . 1 . . . . 672 GLU CG . 15161 1
146 . 1 1 15 15 GLU N N 15 121.138 0.061 . 1 . . . . 672 GLU N . 15161 1
147 . 1 1 16 16 THR H H 1 8.664 0.011 . 1 . . . . 673 THR H . 15161 1
148 . 1 1 16 16 THR HA H 1 4.917 0.009 . 1 . . . . 673 THR HA . 15161 1
149 . 1 1 16 16 THR HB H 1 3.821 0.011 . 1 . . . . 673 THR HB . 15161 1
150 . 1 1 16 16 THR HG21 H 1 1.014 0.008 . 1 . . . . 673 THR HG2 . 15161 1
151 . 1 1 16 16 THR HG22 H 1 1.014 0.008 . 1 . . . . 673 THR HG2 . 15161 1
152 . 1 1 16 16 THR HG23 H 1 1.014 0.008 . 1 . . . . 673 THR HG2 . 15161 1
153 . 1 1 16 16 THR C C 13 174.242 0.000 . 1 . . . . 673 THR C . 15161 1
154 . 1 1 16 16 THR CA C 13 60.711 0.225 . 1 . . . . 673 THR CA . 15161 1
155 . 1 1 16 16 THR CB C 13 71.130 0.231 . 1 . . . . 673 THR CB . 15161 1
156 . 1 1 16 16 THR CG2 C 13 21.563 0.207 . 1 . . . . 673 THR CG2 . 15161 1
157 . 1 1 16 16 THR N N 15 117.740 0.074 . 1 . . . . 673 THR N . 15161 1
158 . 1 1 17 17 CYS H H 1 8.466 0.011 . 1 . . . . 674 CYS H . 15161 1
159 . 1 1 17 17 CYS HA H 1 4.270 0.014 . 1 . . . . 674 CYS HA . 15161 1
160 . 1 1 17 17 CYS HB2 H 1 2.757 0.008 . 2 . . . . 674 CYS HB2 . 15161 1
161 . 1 1 17 17 CYS HB3 H 1 3.292 0.005 . 2 . . . . 674 CYS HB3 . 15161 1
162 . 1 1 17 17 CYS C C 13 176.967 0.000 . 1 . . . . 674 CYS C . 15161 1
163 . 1 1 17 17 CYS CA C 13 60.298 0.178 . 1 . . . . 674 CYS CA . 15161 1
164 . 1 1 17 17 CYS CB C 13 31.947 0.160 . 1 . . . . 674 CYS CB . 15161 1
165 . 1 1 17 17 CYS N N 15 127.995 0.060 . 1 . . . . 674 CYS N . 15161 1
166 . 1 1 18 18 SER H H 1 9.113 0.012 . 1 . . . . 675 SER H . 15161 1
167 . 1 1 18 18 SER HA H 1 4.398 0.009 . 1 . . . . 675 SER HA . 15161 1
168 . 1 1 18 18 SER HB2 H 1 4.050 0.007 . 2 . . . . 675 SER HB2 . 15161 1
169 . 1 1 18 18 SER HB3 H 1 4.105 0.013 . 2 . . . . 675 SER HB3 . 15161 1
170 . 1 1 18 18 SER C C 13 175.432 0.000 . 1 . . . . 675 SER C . 15161 1
171 . 1 1 18 18 SER CA C 13 60.349 0.228 . 1 . . . . 675 SER CA . 15161 1
172 . 1 1 18 18 SER CB C 13 63.464 0.216 . 1 . . . . 675 SER CB . 15161 1
173 . 1 1 18 18 SER N N 15 126.809 0.071 . 1 . . . . 675 SER N . 15161 1
174 . 1 1 19 19 GLY H H 1 9.314 0.010 . 1 . . . . 676 GLY H . 15161 1
175 . 1 1 19 19 GLY HA2 H 1 3.862 0.010 . 2 . . . . 676 GLY HA2 . 15161 1
176 . 1 1 19 19 GLY HA3 H 1 4.072 0.009 . 2 . . . . 676 GLY HA3 . 15161 1
177 . 1 1 19 19 GLY C C 13 174.545 0.000 . 1 . . . . 676 GLY C . 15161 1
178 . 1 1 19 19 GLY CA C 13 46.862 0.212 . 1 . . . . 676 GLY CA . 15161 1
179 . 1 1 19 19 GLY N N 15 114.709 0.072 . 1 . . . . 676 GLY N . 15161 1
180 . 1 1 20 20 CYS H H 1 7.149 0.010 . 1 . . . . 677 CYS H . 15161 1
181 . 1 1 20 20 CYS HA H 1 5.048 0.009 . 1 . . . . 677 CYS HA . 15161 1
182 . 1 1 20 20 CYS HB2 H 1 3.330 0.016 . 2 . . . . 677 CYS HB2 . 15161 1
183 . 1 1 20 20 CYS HB3 H 1 3.742 0.006 . 2 . . . . 677 CYS HB3 . 15161 1
184 . 1 1 20 20 CYS C C 13 176.966 0.000 . 1 . . . . 677 CYS C . 15161 1
185 . 1 1 20 20 CYS CA C 13 56.833 0.163 . 1 . . . . 677 CYS CA . 15161 1
186 . 1 1 20 20 CYS CB C 13 33.450 0.146 . 1 . . . . 677 CYS CB . 15161 1
187 . 1 1 20 20 CYS N N 15 113.638 0.075 . 1 . . . . 677 CYS N . 15161 1
188 . 1 1 21 21 ASN H H 1 8.732 0.009 . 1 . . . . 678 ASN H . 15161 1
189 . 1 1 21 21 ASN HA H 1 4.548 0.010 . 1 . . . . 678 ASN HA . 15161 1
190 . 1 1 21 21 ASN HB2 H 1 2.817 0.009 . 2 . . . . 678 ASN HB2 . 15161 1
191 . 1 1 21 21 ASN HB3 H 1 3.139 0.007 . 2 . . . . 678 ASN HB3 . 15161 1
192 . 1 1 21 21 ASN C C 13 173.937 0.000 . 1 . . . . 678 ASN C . 15161 1
193 . 1 1 21 21 ASN CA C 13 55.194 0.218 . 1 . . . . 678 ASN CA . 15161 1
194 . 1 1 21 21 ASN CB C 13 38.599 0.108 . 1 . . . . 678 ASN CB . 15161 1
195 . 1 1 21 21 ASN N N 15 123.508 0.073 . 1 . . . . 678 ASN N . 15161 1
196 . 1 1 22 22 THR H H 1 8.008 0.009 . 1 . . . . 679 THR H . 15161 1
197 . 1 1 22 22 THR HA H 1 4.372 0.012 . 1 . . . . 679 THR HA . 15161 1
198 . 1 1 22 22 THR HB H 1 4.297 0.018 . 1 . . . . 679 THR HB . 15161 1
199 . 1 1 22 22 THR HG21 H 1 1.449 0.012 . 1 . . . . 679 THR HG2 . 15161 1
200 . 1 1 22 22 THR HG22 H 1 1.449 0.012 . 1 . . . . 679 THR HG2 . 15161 1
201 . 1 1 22 22 THR HG23 H 1 1.449 0.012 . 1 . . . . 679 THR HG2 . 15161 1
202 . 1 1 22 22 THR C C 13 172.566 0.000 . 1 . . . . 679 THR C . 15161 1
203 . 1 1 22 22 THR CA C 13 65.166 0.182 . 1 . . . . 679 THR CA . 15161 1
204 . 1 1 22 22 THR CB C 13 71.983 0.262 . 1 . . . . 679 THR CB . 15161 1
205 . 1 1 22 22 THR CG2 C 13 20.883 0.088 . 1 . . . . 679 THR CG2 . 15161 1
206 . 1 1 22 22 THR N N 15 113.975 0.093 . 1 . . . . 679 THR N . 15161 1
207 . 1 1 23 23 ALA H H 1 6.874 0.008 . 1 . . . . 680 ALA H . 15161 1
208 . 1 1 23 23 ALA HA H 1 1.347 0.008 . 1 . . . . 680 ALA HA . 15161 1
209 . 1 1 23 23 ALA HB1 H 1 0.055 0.008 . 1 . . . . 680 ALA HB . 15161 1
210 . 1 1 23 23 ALA HB2 H 1 0.055 0.008 . 1 . . . . 680 ALA HB . 15161 1
211 . 1 1 23 23 ALA HB3 H 1 0.055 0.008 . 1 . . . . 680 ALA HB . 15161 1
212 . 1 1 23 23 ALA C C 13 174.516 0.000 . 1 . . . . 680 ALA C . 15161 1
213 . 1 1 23 23 ALA CA C 13 52.446 0.154 . 1 . . . . 680 ALA CA . 15161 1
214 . 1 1 23 23 ALA CB C 13 19.592 0.135 . 1 . . . . 680 ALA CB . 15161 1
215 . 1 1 23 23 ALA N N 15 125.738 0.070 . 1 . . . . 680 ALA N . 15161 1
216 . 1 1 24 24 ARG H H 1 4.262 0.011 . 1 . . . . 681 ARG H . 15161 1
217 . 1 1 24 24 ARG HA H 1 4.743 0.008 . 1 . . . . 681 ARG HA . 15161 1
218 . 1 1 24 24 ARG HB2 H 1 1.355 0.011 . 2 . . . . 681 ARG HB2 . 15161 1
219 . 1 1 24 24 ARG HB3 H 1 1.482 0.006 . 2 . . . . 681 ARG HB3 . 15161 1
220 . 1 1 24 24 ARG HG2 H 1 1.505 0.002 . 2 . . . . 681 ARG HG2 . 15161 1
221 . 1 1 24 24 ARG HG3 H 1 1.600 0.010 . 2 . . . . 681 ARG HG3 . 15161 1
222 . 1 1 24 24 ARG HD2 H 1 3.006 0.009 . 2 . . . . 681 ARG HD2 . 15161 1
223 . 1 1 24 24 ARG HE H 1 6.817 0.006 . 1 . . . . 681 ARG HE . 15161 1
224 . 1 1 24 24 ARG C C 13 173.879 0.000 . 1 . . . . 681 ARG C . 15161 1
225 . 1 1 24 24 ARG CA C 13 52.505 0.197 . 1 . . . . 681 ARG CA . 15161 1
226 . 1 1 24 24 ARG CB C 13 32.549 0.138 . 1 . . . . 681 ARG CB . 15161 1
227 . 1 1 24 24 ARG CG C 13 26.229 0.170 . 1 . . . . 681 ARG CG . 15161 1
228 . 1 1 24 24 ARG CD C 13 43.000 0.231 . 1 . . . . 681 ARG CD . 15161 1
229 . 1 1 24 24 ARG N N 15 116.852 0.128 . 1 . . . . 681 ARG N . 15161 1
230 . 1 1 24 24 ARG NE N 15 75.145 27.988 . 1 . . . . 681 ARG NE . 15161 1
231 . 1 1 25 25 TYR H H 1 8.406 0.010 . 1 . . . . 682 TYR H . 15161 1
232 . 1 1 25 25 TYR HA H 1 6.420 0.010 . 1 . . . . 682 TYR HA . 15161 1
233 . 1 1 25 25 TYR HB2 H 1 2.384 0.007 . 2 . . . . 682 TYR HB2 . 15161 1
234 . 1 1 25 25 TYR HB3 H 1 3.414 0.010 . 2 . . . . 682 TYR HB3 . 15161 1
235 . 1 1 25 25 TYR HD1 H 1 7.178 0.002 . 3 . . . . 682 TYR HD1 . 15161 1
236 . 1 1 25 25 TYR HD2 H 1 7.192 0.001 . 3 . . . . 682 TYR HD2 . 15161 1
237 . 1 1 25 25 TYR HE1 H 1 6.866 0.003 . 3 . . . . 682 TYR HE1 . 15161 1
238 . 1 1 25 25 TYR HE2 H 1 6.886 0.001 . 3 . . . . 682 TYR HE2 . 15161 1
239 . 1 1 25 25 TYR C C 13 176.259 0.000 . 1 . . . . 682 TYR C . 15161 1
240 . 1 1 25 25 TYR CA C 13 56.327 0.175 . 1 . . . . 682 TYR CA . 15161 1
241 . 1 1 25 25 TYR CB C 13 44.661 0.136 . 1 . . . . 682 TYR CB . 15161 1
242 . 1 1 25 25 TYR CD1 C 13 133.434 0.046 . 3 . . . . 682 TYR CD1 . 15161 1
243 . 1 1 25 25 TYR CD2 C 13 133.559 0.184 . 3 . . . . 682 TYR CD2 . 15161 1
244 . 1 1 25 25 TYR CE1 C 13 118.510 0.012 . 3 . . . . 682 TYR CE1 . 15161 1
245 . 1 1 25 25 TYR CE2 C 13 118.457 0.019 . 3 . . . . 682 TYR CE2 . 15161 1
246 . 1 1 25 25 TYR N N 15 115.401 0.083 . 1 . . . . 682 TYR N . 15161 1
247 . 1 1 26 26 CYS H H 1 9.631 0.011 . 1 . . . . 683 CYS H . 15161 1
248 . 1 1 26 26 CYS HA H 1 4.884 0.007 . 1 . . . . 683 CYS HA . 15161 1
249 . 1 1 26 26 CYS HB2 H 1 2.833 0.010 . 2 . . . . 683 CYS HB2 . 15161 1
250 . 1 1 26 26 CYS HB3 H 1 3.359 0.010 . 2 . . . . 683 CYS HB3 . 15161 1
251 . 1 1 26 26 CYS C C 13 174.693 0.000 . 1 . . . . 683 CYS C . 15161 1
252 . 1 1 26 26 CYS CA C 13 60.525 0.188 . 1 . . . . 683 CYS CA . 15161 1
253 . 1 1 26 26 CYS CB C 13 30.649 0.167 . 1 . . . . 683 CYS CB . 15161 1
254 . 1 1 26 26 CYS N N 15 120.650 0.083 . 1 . . . . 683 CYS N . 15161 1
255 . 1 1 27 27 GLY H H 1 7.299 0.012 . 1 . . . . 684 GLY H . 15161 1
256 . 1 1 27 27 GLY HA2 H 1 4.089 0.011 . 2 . . . . 684 GLY HA2 . 15161 1
257 . 1 1 27 27 GLY HA3 H 1 4.463 0.013 . 2 . . . . 684 GLY HA3 . 15161 1
258 . 1 1 27 27 GLY C C 13 173.142 0.000 . 1 . . . . 684 GLY C . 15161 1
259 . 1 1 27 27 GLY CA C 13 45.060 0.197 . 1 . . . . 684 GLY CA . 15161 1
260 . 1 1 27 27 GLY N N 15 108.096 0.053 . 1 . . . . 684 GLY N . 15161 1
261 . 1 1 28 28 SER H H 1 8.657 0.006 . 1 . . . . 685 SER H . 15161 1
262 . 1 1 28 28 SER HA H 1 4.199 0.005 . 1 . . . . 685 SER HA . 15161 1
263 . 1 1 28 28 SER HB2 H 1 3.922 0.002 . 2 . . . . 685 SER HB2 . 15161 1
264 . 1 1 28 28 SER HB3 H 1 3.953 0.009 . 2 . . . . 685 SER HB3 . 15161 1
265 . 1 1 28 28 SER C C 13 176.677 0.000 . 1 . . . . 685 SER C . 15161 1
266 . 1 1 28 28 SER CA C 13 61.262 0.214 . 1 . . . . 685 SER CA . 15161 1
267 . 1 1 28 28 SER CB C 13 63.306 0.078 . 1 . . . . 685 SER CB . 15161 1
268 . 1 1 28 28 SER N N 15 114.890 0.087 . 1 . . . . 685 SER N . 15161 1
269 . 1 1 29 29 PHE H H 1 8.568 0.008 . 1 . . . . 686 PHE H . 15161 1
270 . 1 1 29 29 PHE HA H 1 4.275 0.019 . 1 . . . . 686 PHE HA . 15161 1
271 . 1 1 29 29 PHE HB2 H 1 3.278 0.010 . 2 . . . . 686 PHE HB2 . 15161 1
272 . 1 1 29 29 PHE HD1 H 1 7.380 0.012 . 3 . . . . 686 PHE HD1 . 15161 1
273 . 1 1 29 29 PHE HE1 H 1 7.382 0.015 . 3 . . . . 686 PHE HE1 . 15161 1
274 . 1 1 29 29 PHE HZ H 1 7.280 0.004 . 1 . . . . 686 PHE HZ . 15161 1
275 . 1 1 29 29 PHE C C 13 178.805 0.000 . 1 . . . . 686 PHE C . 15161 1
276 . 1 1 29 29 PHE CA C 13 62.287 0.115 . 1 . . . . 686 PHE CA . 15161 1
277 . 1 1 29 29 PHE CB C 13 38.479 0.134 . 1 . . . . 686 PHE CB . 15161 1
278 . 1 1 29 29 PHE CD1 C 13 132.260 0.048 . 3 . . . . 686 PHE CD1 . 15161 1
279 . 1 1 29 29 PHE CD2 C 13 132.246 0.000 . 3 . . . . 686 PHE CD2 . 15161 1
280 . 1 1 29 29 PHE CE1 C 13 130.015 0.000 . 3 . . . . 686 PHE CE1 . 15161 1
281 . 1 1 29 29 PHE CE2 C 13 130.015 0.000 . 3 . . . . 686 PHE CE2 . 15161 1
282 . 1 1 29 29 PHE CZ C 13 132.076 0.080 . 1 . . . . 686 PHE CZ . 15161 1
283 . 1 1 29 29 PHE N N 15 124.478 0.036 . 1 . . . . 686 PHE N . 15161 1
284 . 1 1 30 30 CYS H H 1 8.742 0.011 . 1 . . . . 687 CYS H . 15161 1
285 . 1 1 30 30 CYS HA H 1 4.005 0.007 . 1 . . . . 687 CYS HA . 15161 1
286 . 1 1 30 30 CYS HB2 H 1 3.068 0.010 . 2 . . . . 687 CYS HB2 . 15161 1
287 . 1 1 30 30 CYS HB3 H 1 3.159 0.013 . 2 . . . . 687 CYS HB3 . 15161 1
288 . 1 1 30 30 CYS C C 13 176.809 0.000 . 1 . . . . 687 CYS C . 15161 1
289 . 1 1 30 30 CYS CA C 13 65.948 0.194 . 1 . . . . 687 CYS CA . 15161 1
290 . 1 1 30 30 CYS CB C 13 32.098 0.150 . 1 . . . . 687 CYS CB . 15161 1
291 . 1 1 30 30 CYS N N 15 121.037 0.124 . 1 . . . . 687 CYS N . 15161 1
292 . 1 1 31 31 GLN H H 1 7.499 0.013 . 1 . . . . 688 GLN H . 15161 1
293 . 1 1 31 31 GLN HA H 1 1.895 0.011 . 1 . . . . 688 GLN HA . 15161 1
294 . 1 1 31 31 GLN HB2 H 1 1.382 0.008 . 2 . . . . 688 GLN HB2 . 15161 1
295 . 1 1 31 31 GLN HB3 H 1 1.897 0.007 . 2 . . . . 688 GLN HB3 . 15161 1
296 . 1 1 31 31 GLN HG2 H 1 2.043 0.012 . 2 . . . . 688 GLN HG2 . 15161 1
297 . 1 1 31 31 GLN HE21 H 1 7.641 0.005 . 2 . . . . 688 GLN HE21 . 15161 1
298 . 1 1 31 31 GLN HE22 H 1 6.845 0.005 . 2 . . . . 688 GLN HE22 . 15161 1
299 . 1 1 31 31 GLN C C 13 178.753 0.000 . 1 . . . . 688 GLN C . 15161 1
300 . 1 1 31 31 GLN CA C 13 59.041 0.190 . 1 . . . . 688 GLN CA . 15161 1
301 . 1 1 31 31 GLN CB C 13 28.040 0.183 . 1 . . . . 688 GLN CB . 15161 1
302 . 1 1 31 31 GLN CG C 13 33.003 0.322 . 1 . . . . 688 GLN CG . 15161 1
303 . 1 1 31 31 GLN N N 15 118.492 0.068 . 1 . . . . 688 GLN N . 15161 1
304 . 1 1 31 31 GLN NE2 N 15 109.887 0.042 . 1 . . . . 688 GLN NE2 . 15161 1
305 . 1 1 32 32 HIS H H 1 8.237 0.173 . 1 . . . . 689 HIS H . 15161 1
306 . 1 1 32 32 HIS HA H 1 4.337 0.014 . 1 . . . . 689 HIS HA . 15161 1
307 . 1 1 32 32 HIS HB2 H 1 3.215 0.018 . 2 . . . . 689 HIS HB2 . 15161 1
308 . 1 1 32 32 HIS HD2 H 1 7.082 0.002 . 1 . . . . 689 HIS HD2 . 15161 1
309 . 1 1 32 32 HIS HE1 H 1 8.204 0.001 . 1 . . . . 689 HIS HE1 . 15161 1
310 . 1 1 32 32 HIS C C 13 178.143 0.000 . 1 . . . . 689 HIS C . 15161 1
311 . 1 1 32 32 HIS CA C 13 58.941 0.168 . 1 . . . . 689 HIS CA . 15161 1
312 . 1 1 32 32 HIS CB C 13 28.511 0.170 . 1 . . . . 689 HIS CB . 15161 1
313 . 1 1 32 32 HIS CD2 C 13 120.168 0.168 . 1 . . . . 689 HIS CD2 . 15161 1
314 . 1 1 32 32 HIS CE1 C 13 137.133 0.029 . 1 . . . . 689 HIS CE1 . 15161 1
315 . 1 1 32 32 HIS N N 15 116.768 0.326 . 1 . . . . 689 HIS N . 15161 1
316 . 1 1 33 33 LYS H H 1 8.403 0.010 . 1 . . . . 690 LYS H . 15161 1
317 . 1 1 33 33 LYS HA H 1 4.034 0.015 . 1 . . . . 690 LYS HA . 15161 1
318 . 1 1 33 33 LYS HB2 H 1 1.721 0.007 . 2 . . . . 690 LYS HB2 . 15161 1
319 . 1 1 33 33 LYS HB3 H 1 1.849 0.013 . 2 . . . . 690 LYS HB3 . 15161 1
320 . 1 1 33 33 LYS HG2 H 1 1.490 0.018 . 2 . . . . 690 LYS HG2 . 15161 1
321 . 1 1 33 33 LYS HD2 H 1 1.716 0.005 . 2 . . . . 690 LYS HD2 . 15161 1
322 . 1 1 33 33 LYS HE2 H 1 3.035 0.006 . 2 . . . . 690 LYS HE2 . 15161 1
323 . 1 1 33 33 LYS HE3 H 1 3.090 0.016 . 2 . . . . 690 LYS HE3 . 15161 1
324 . 1 1 33 33 LYS C C 13 178.547 0.000 . 1 . . . . 690 LYS C . 15161 1
325 . 1 1 33 33 LYS CA C 13 58.452 0.197 . 1 . . . . 690 LYS CA . 15161 1
326 . 1 1 33 33 LYS CB C 13 32.079 0.156 . 1 . . . . 690 LYS CB . 15161 1
327 . 1 1 33 33 LYS CG C 13 24.702 0.126 . 1 . . . . 690 LYS CG . 15161 1
328 . 1 1 33 33 LYS CD C 13 28.872 0.212 . 1 . . . . 690 LYS CD . 15161 1
329 . 1 1 33 33 LYS CE C 13 42.552 0.193 . 1 . . . . 690 LYS CE . 15161 1
330 . 1 1 33 33 LYS N N 15 122.300 0.093 . 1 . . . . 690 LYS N . 15161 1
331 . 1 1 34 34 ASP H H 1 7.795 0.009 . 1 . . . . 691 ASP H . 15161 1
332 . 1 1 34 34 ASP HA H 1 5.085 0.011 . 1 . . . . 691 ASP HA . 15161 1
333 . 1 1 34 34 ASP HB2 H 1 2.638 0.009 . 2 . . . . 691 ASP HB2 . 15161 1
334 . 1 1 34 34 ASP HB3 H 1 2.781 0.005 . 2 . . . . 691 ASP HB3 . 15161 1
335 . 1 1 34 34 ASP C C 13 176.501 0.000 . 1 . . . . 691 ASP C . 15161 1
336 . 1 1 34 34 ASP CA C 13 54.760 0.183 . 1 . . . . 691 ASP CA . 15161 1
337 . 1 1 34 34 ASP CB C 13 43.948 0.144 . 1 . . . . 691 ASP CB . 15161 1
338 . 1 1 34 34 ASP N N 15 115.742 0.088 . 1 . . . . 691 ASP N . 15161 1
339 . 1 1 35 35 TRP H H 1 7.634 0.012 . 1 . . . . 692 TRP H . 15161 1
340 . 1 1 35 35 TRP HA H 1 4.608 0.012 . 1 . . . . 692 TRP HA . 15161 1
341 . 1 1 35 35 TRP HB2 H 1 3.394 0.007 . 2 . . . . 692 TRP HB2 . 15161 1
342 . 1 1 35 35 TRP HB3 H 1 3.579 0.013 . 2 . . . . 692 TRP HB3 . 15161 1
343 . 1 1 35 35 TRP HD1 H 1 7.298 0.011 . 1 . . . . 692 TRP HD1 . 15161 1
344 . 1 1 35 35 TRP HE1 H 1 10.018 0.044 . 1 . . . . 692 TRP HE1 . 15161 1
345 . 1 1 35 35 TRP HE3 H 1 7.763 0.010 . 1 . . . . 692 TRP HE3 . 15161 1
346 . 1 1 35 35 TRP HZ2 H 1 7.231 0.006 . 1 . . . . 692 TRP HZ2 . 15161 1
347 . 1 1 35 35 TRP HZ3 H 1 7.224 0.007 . 1 . . . . 692 TRP HZ3 . 15161 1
348 . 1 1 35 35 TRP HH2 H 1 7.099 0.001 . 1 . . . . 692 TRP HH2 . 15161 1
349 . 1 1 35 35 TRP C C 13 177.913 0.000 . 1 . . . . 692 TRP C . 15161 1
350 . 1 1 35 35 TRP CA C 13 61.860 0.202 . 1 . . . . 692 TRP CA . 15161 1
351 . 1 1 35 35 TRP CB C 13 29.852 0.159 . 1 . . . . 692 TRP CB . 15161 1
352 . 1 1 35 35 TRP CD1 C 13 127.383 0.093 . 1 . . . . 692 TRP CD1 . 15161 1
353 . 1 1 35 35 TRP CE3 C 13 120.880 0.113 . 1 . . . . 692 TRP CE3 . 15161 1
354 . 1 1 35 35 TRP CZ2 C 13 114.829 0.012 . 1 . . . . 692 TRP CZ2 . 15161 1
355 . 1 1 35 35 TRP CZ3 C 13 122.559 0.154 . 1 . . . . 692 TRP CZ3 . 15161 1
356 . 1 1 35 35 TRP CH2 C 13 124.912 0.044 . 1 . . . . 692 TRP CH2 . 15161 1
357 . 1 1 35 35 TRP N N 15 121.032 0.040 . 1 . . . . 692 TRP N . 15161 1
358 . 1 1 35 35 TRP NE1 N 15 129.096 0.012 . 1 . . . . 692 TRP NE1 . 15161 1
359 . 1 1 36 36 GLU H H 1 8.576 0.018 . 1 . . . . 693 GLU H . 15161 1
360 . 1 1 36 36 GLU HA H 1 3.906 0.009 . 1 . . . . 693 GLU HA . 15161 1
361 . 1 1 36 36 GLU HB2 H 1 2.232 0.008 . 2 . . . . 693 GLU HB2 . 15161 1
362 . 1 1 36 36 GLU HB3 H 1 2.324 0.009 . 2 . . . . 693 GLU HB3 . 15161 1
363 . 1 1 36 36 GLU HG2 H 1 2.479 0.010 . 2 . . . . 693 GLU HG2 . 15161 1
364 . 1 1 36 36 GLU C C 13 177.715 0.000 . 1 . . . . 693 GLU C . 15161 1
365 . 1 1 36 36 GLU CA C 13 60.451 0.242 . 1 . . . . 693 GLU CA . 15161 1
366 . 1 1 36 36 GLU CB C 13 29.246 0.190 . 1 . . . . 693 GLU CB . 15161 1
367 . 1 1 36 36 GLU CG C 13 36.298 0.138 . 1 . . . . 693 GLU CG . 15161 1
368 . 1 1 36 36 GLU N N 15 119.371 0.112 . 1 . . . . 693 GLU N . 15161 1
369 . 1 1 37 37 LYS H H 1 7.790 0.011 . 1 . . . . 694 LYS H . 15161 1
370 . 1 1 37 37 LYS HA H 1 4.373 0.013 . 1 . . . . 694 LYS HA . 15161 1
371 . 1 1 37 37 LYS HB2 H 1 2.083 0.006 . 2 . . . . 694 LYS HB2 . 15161 1
372 . 1 1 37 37 LYS HG2 H 1 1.552 0.027 . 2 . . . . 694 LYS HG2 . 15161 1
373 . 1 1 37 37 LYS HG3 H 1 1.664 0.030 . 2 . . . . 694 LYS HG3 . 15161 1
374 . 1 1 37 37 LYS HD2 H 1 1.943 0.006 . 2 . . . . 694 LYS HD2 . 15161 1
375 . 1 1 37 37 LYS HE2 H 1 3.196 0.006 . 2 . . . . 694 LYS HE2 . 15161 1
376 . 1 1 37 37 LYS C C 13 179.450 0.000 . 1 . . . . 694 LYS C . 15161 1
377 . 1 1 37 37 LYS CA C 13 58.539 0.225 . 1 . . . . 694 LYS CA . 15161 1
378 . 1 1 37 37 LYS CB C 13 33.550 0.135 . 1 . . . . 694 LYS CB . 15161 1
379 . 1 1 37 37 LYS CG C 13 25.237 0.157 . 1 . . . . 694 LYS CG . 15161 1
380 . 1 1 37 37 LYS CD C 13 29.577 0.233 . 1 . . . . 694 LYS CD . 15161 1
381 . 1 1 37 37 LYS CE C 13 42.423 0.201 . 1 . . . . 694 LYS CE . 15161 1
382 . 1 1 37 37 LYS N N 15 116.950 0.116 . 1 . . . . 694 LYS N . 15161 1
383 . 1 1 38 38 HIS H H 1 9.267 0.009 . 1 . . . . 695 HIS H . 15161 1
384 . 1 1 38 38 HIS HA H 1 4.547 0.013 . 1 . . . . 695 HIS HA . 15161 1
385 . 1 1 38 38 HIS HB2 H 1 3.142 0.007 . 2 . . . . 695 HIS HB2 . 15161 1
386 . 1 1 38 38 HIS HB3 H 1 3.579 0.013 . 2 . . . . 695 HIS HB3 . 15161 1
387 . 1 1 38 38 HIS HD2 H 1 7.043 0.019 . 1 . . . . 695 HIS HD2 . 15161 1
388 . 1 1 38 38 HIS HE1 H 1 7.981 0.012 . 1 . . . . 695 HIS HE1 . 15161 1
389 . 1 1 38 38 HIS C C 13 178.081 0.000 . 1 . . . . 695 HIS C . 15161 1
390 . 1 1 38 38 HIS CA C 13 59.057 0.210 . 1 . . . . 695 HIS CA . 15161 1
391 . 1 1 38 38 HIS CB C 13 29.947 0.145 . 1 . . . . 695 HIS CB . 15161 1
392 . 1 1 38 38 HIS CD2 C 13 126.987 0.155 . 1 . . . . 695 HIS CD2 . 15161 1
393 . 1 1 38 38 HIS CE1 C 13 143.099 10.300 . 1 . . . . 695 HIS CE1 . 15161 1
394 . 1 1 38 38 HIS N N 15 119.225 0.074 . 1 . . . . 695 HIS N . 15161 1
395 . 1 1 38 38 HIS NE2 N 15 215.137 0.004 . 1 . . . . 695 HIS NE2 . 15161 1
396 . 1 1 39 39 HIS H H 1 8.713 0.015 . 1 . . . . 696 HIS H . 15161 1
397 . 1 1 39 39 HIS HA H 1 3.654 0.014 . 1 . . . . 696 HIS HA . 15161 1
398 . 1 1 39 39 HIS HB2 H 1 1.550 0.024 . 2 . . . . 696 HIS HB2 . 15161 1
399 . 1 1 39 39 HIS HB3 H 1 2.428 0.009 . 2 . . . . 696 HIS HB3 . 15161 1
400 . 1 1 39 39 HIS HD2 H 1 6.860 0.004 . 1 . . . . 696 HIS HD2 . 15161 1
401 . 1 1 39 39 HIS HE1 H 1 8.136 0.010 . 1 . . . . 696 HIS HE1 . 15161 1
402 . 1 1 39 39 HIS C C 13 175.242 0.000 . 1 . . . . 696 HIS C . 15161 1
403 . 1 1 39 39 HIS CA C 13 58.450 0.189 . 1 . . . . 696 HIS CA . 15161 1
404 . 1 1 39 39 HIS CB C 13 26.113 0.157 . 1 . . . . 696 HIS CB . 15161 1
405 . 1 1 39 39 HIS CD2 C 13 120.974 0.130 . 1 . . . . 696 HIS CD2 . 15161 1
406 . 1 1 39 39 HIS CE1 C 13 136.736 0.010 . 1 . . . . 696 HIS CE1 . 15161 1
407 . 1 1 39 39 HIS N N 15 114.471 0.073 . 1 . . . . 696 HIS N . 15161 1
408 . 1 1 39 39 HIS ND1 N 15 177.997 0.000 . 1 . . . . 696 HIS ND1 . 15161 1
409 . 1 1 39 39 HIS NE2 N 15 177.282 0.036 . 1 . . . . 696 HIS NE2 . 15161 1
410 . 1 1 40 40 HIS H H 1 6.789 0.021 . 1 . . . . 697 HIS H . 15161 1
411 . 1 1 40 40 HIS HA H 1 4.143 0.013 . 1 . . . . 697 HIS HA . 15161 1
412 . 1 1 40 40 HIS HB2 H 1 2.957 0.014 . 2 . . . . 697 HIS HB2 . 15161 1
413 . 1 1 40 40 HIS HB3 H 1 3.151 0.012 . 2 . . . . 697 HIS HB3 . 15161 1
414 . 1 1 40 40 HIS HD2 H 1 7.222 0.010 . 1 . . . . 697 HIS HD2 . 15161 1
415 . 1 1 40 40 HIS HE1 H 1 8.187 0.031 . 1 . . . . 697 HIS HE1 . 15161 1
416 . 1 1 40 40 HIS C C 13 175.754 0.000 . 1 . . . . 697 HIS C . 15161 1
417 . 1 1 40 40 HIS CA C 13 58.204 0.183 . 1 . . . . 697 HIS CA . 15161 1
418 . 1 1 40 40 HIS CB C 13 30.219 0.166 . 1 . . . . 697 HIS CB . 15161 1
419 . 1 1 40 40 HIS CD2 C 13 120.418 0.157 . 1 . . . . 697 HIS CD2 . 15161 1
420 . 1 1 40 40 HIS CE1 C 13 138.378 0.006 . 1 . . . . 697 HIS CE1 . 15161 1
421 . 1 1 40 40 HIS N N 15 114.645 0.020 . 1 . . . . 697 HIS N . 15161 1
422 . 1 1 40 40 HIS NE2 N 15 174.935 0.017 . 1 . . . . 697 HIS NE2 . 15161 1
423 . 1 1 41 41 ILE H H 1 7.218 0.011 . 1 . . . . 698 ILE H . 15161 1
424 . 1 1 41 41 ILE HA H 1 4.482 0.009 . 1 . . . . 698 ILE HA . 15161 1
425 . 1 1 41 41 ILE HB H 1 2.123 0.005 . 1 . . . . 698 ILE HB . 15161 1
426 . 1 1 41 41 ILE HG12 H 1 1.268 0.017 . 2 . . . . 698 ILE HG12 . 15161 1
427 . 1 1 41 41 ILE HG13 H 1 1.361 0.011 . 2 . . . . 698 ILE HG13 . 15161 1
428 . 1 1 41 41 ILE HG21 H 1 0.947 0.015 . 1 . . . . 698 ILE HG2 . 15161 1
429 . 1 1 41 41 ILE HG22 H 1 0.947 0.015 . 1 . . . . 698 ILE HG2 . 15161 1
430 . 1 1 41 41 ILE HG23 H 1 0.947 0.015 . 1 . . . . 698 ILE HG2 . 15161 1
431 . 1 1 41 41 ILE HD11 H 1 1.109 0.006 . 1 . . . . 698 ILE HD1 . 15161 1
432 . 1 1 41 41 ILE HD12 H 1 1.109 0.006 . 1 . . . . 698 ILE HD1 . 15161 1
433 . 1 1 41 41 ILE HD13 H 1 1.109 0.006 . 1 . . . . 698 ILE HD1 . 15161 1
434 . 1 1 41 41 ILE C C 13 175.335 0.000 . 1 . . . . 698 ILE C . 15161 1
435 . 1 1 41 41 ILE CA C 13 60.539 0.224 . 1 . . . . 698 ILE CA . 15161 1
436 . 1 1 41 41 ILE CB C 13 40.093 0.135 . 1 . . . . 698 ILE CB . 15161 1
437 . 1 1 41 41 ILE CG1 C 13 27.207 0.154 . 1 . . . . 698 ILE CG1 . 15161 1
438 . 1 1 41 41 ILE CG2 C 13 18.447 0.154 . 1 . . . . 698 ILE CG2 . 15161 1
439 . 1 1 41 41 ILE CD1 C 13 14.517 0.125 . 1 . . . . 698 ILE CD1 . 15161 1
440 . 1 1 41 41 ILE N N 15 111.185 0.076 . 1 . . . . 698 ILE N . 15161 1
441 . 1 1 42 42 CYS H H 1 7.171 0.009 . 1 . . . . 699 CYS H . 15161 1
442 . 1 1 42 42 CYS HA H 1 3.765 0.013 . 1 . . . . 699 CYS HA . 15161 1
443 . 1 1 42 42 CYS HB2 H 1 1.900 0.006 . 2 . . . . 699 CYS HB2 . 15161 1
444 . 1 1 42 42 CYS HB3 H 1 2.476 0.009 . 2 . . . . 699 CYS HB3 . 15161 1
445 . 1 1 42 42 CYS C C 13 176.115 0.000 . 1 . . . . 699 CYS C . 15161 1
446 . 1 1 42 42 CYS CA C 13 61.934 0.175 . 1 . . . . 699 CYS CA . 15161 1
447 . 1 1 42 42 CYS CB C 13 29.542 0.150 . 1 . . . . 699 CYS CB . 15161 1
448 . 1 1 42 42 CYS N N 15 126.040 0.057 . 1 . . . . 699 CYS N . 15161 1
449 . 1 1 43 43 GLY H H 1 8.329 0.011 . 1 . . . . 700 GLY H . 15161 1
450 . 1 1 43 43 GLY HA2 H 1 4.032 0.053 . 2 . . . . 700 GLY HA2 . 15161 1
451 . 1 1 43 43 GLY HA3 H 1 4.185 0.010 . 2 . . . . 700 GLY HA3 . 15161 1
452 . 1 1 43 43 GLY C C 13 174.766 0.000 . 1 . . . . 700 GLY C . 15161 1
453 . 1 1 43 43 GLY CA C 13 45.957 0.208 . 1 . . . . 700 GLY CA . 15161 1
454 . 1 1 43 43 GLY N N 15 113.993 0.119 . 1 . . . . 700 GLY N . 15161 1
455 . 1 1 44 44 GLN H H 1 8.121 0.010 . 1 . . . . 701 GLN H . 15161 1
456 . 1 1 44 44 GLN HA H 1 4.411 0.039 . 1 . . . . 701 GLN HA . 15161 1
457 . 1 1 44 44 GLN HB2 H 1 2.053 0.005 . 2 . . . . 701 GLN HB2 . 15161 1
458 . 1 1 44 44 GLN HB3 H 1 2.199 0.020 . 2 . . . . 701 GLN HB3 . 15161 1
459 . 1 1 44 44 GLN HG2 H 1 2.428 0.012 . 2 . . . . 701 GLN HG2 . 15161 1
460 . 1 1 44 44 GLN C C 13 176.561 0.000 . 1 . . . . 701 GLN C . 15161 1
461 . 1 1 44 44 GLN CA C 13 56.251 0.252 . 1 . . . . 701 GLN CA . 15161 1
462 . 1 1 44 44 GLN CB C 13 29.797 0.150 . 1 . . . . 701 GLN CB . 15161 1
463 . 1 1 44 44 GLN CG C 13 34.153 0.094 . 1 . . . . 701 GLN CG . 15161 1
464 . 1 1 44 44 GLN N N 15 119.450 0.071 . 1 . . . . 701 GLN N . 15161 1
465 . 1 1 45 45 THR H H 1 8.178 0.010 . 1 . . . . 702 THR H . 15161 1
466 . 1 1 45 45 THR HA H 1 4.406 0.021 . 1 . . . . 702 THR HA . 15161 1
467 . 1 1 45 45 THR HB H 1 4.331 0.009 . 1 . . . . 702 THR HB . 15161 1
468 . 1 1 45 45 THR HG21 H 1 1.312 0.016 . 1 . . . . 702 THR HG2 . 15161 1
469 . 1 1 45 45 THR HG22 H 1 1.312 0.016 . 1 . . . . 702 THR HG2 . 15161 1
470 . 1 1 45 45 THR HG23 H 1 1.312 0.016 . 1 . . . . 702 THR HG2 . 15161 1
471 . 1 1 45 45 THR C C 13 174.734 0.000 . 1 . . . . 702 THR C . 15161 1
472 . 1 1 45 45 THR CA C 13 62.642 0.264 . 1 . . . . 702 THR CA . 15161 1
473 . 1 1 45 45 THR CB C 13 69.631 0.162 . 1 . . . . 702 THR CB . 15161 1
474 . 1 1 45 45 THR CG2 C 13 21.731 0.171 . 1 . . . . 702 THR CG2 . 15161 1
475 . 1 1 45 45 THR N N 15 115.110 0.0641 . 1 . . . . 702 THR N . 15161 1
476 . 1 1 46 46 LEU H H 1 8.173 0.010 . 1 . . . . 703 LEU H . 15161 1
477 . 1 1 46 46 LEU HA H 1 4.435 0.013 . 1 . . . . 703 LEU HA . 15161 1
478 . 1 1 46 46 LEU HB2 H 1 1.694 0.005 . 2 . . . . 703 LEU HB2 . 15161 1
479 . 1 1 46 46 LEU HG H 1 1.676 0.015 . 1 . . . . 703 LEU HG . 15161 1
480 . 1 1 46 46 LEU HD11 H 1 0.973 0.007 . 2 . . . . 703 LEU HD1 . 15161 1
481 . 1 1 46 46 LEU HD12 H 1 0.973 0.007 . 2 . . . . 703 LEU HD1 . 15161 1
482 . 1 1 46 46 LEU HD13 H 1 0.973 0.007 . 2 . . . . 703 LEU HD1 . 15161 1
483 . 1 1 46 46 LEU HD21 H 1 1.014 0.005 . 2 . . . . 703 LEU HD2 . 15161 1
484 . 1 1 46 46 LEU HD22 H 1 1.014 0.005 . 2 . . . . 703 LEU HD2 . 15161 1
485 . 1 1 46 46 LEU HD23 H 1 1.014 0.005 . 2 . . . . 703 LEU HD2 . 15161 1
486 . 1 1 46 46 LEU C C 13 177.291 0.000 . 1 . . . . 703 LEU C . 15161 1
487 . 1 1 46 46 LEU CA C 13 55.624 0.212 . 1 . . . . 703 LEU CA . 15161 1
488 . 1 1 46 46 LEU CB C 13 42.659 0.182 . 1 . . . . 703 LEU CB . 15161 1
489 . 1 1 46 46 LEU CG C 13 27.368 0.208 . 1 . . . . 703 LEU CG . 15161 1
490 . 1 1 46 46 LEU CD1 C 13 25.152 0.170 . 2 . . . . 703 LEU CD1 . 15161 1
491 . 1 1 46 46 LEU CD2 C 13 24.825 0.184 . 2 . . . . 703 LEU CD2 . 15161 1
492 . 1 1 46 46 LEU N N 15 124.572 0.067 . 1 . . . . 703 LEU N . 15161 1
493 . 1 1 47 47 GLN H H 1 8.266 0.006 . 1 . . . . 704 GLN H . 15161 1
494 . 1 1 47 47 GLN HA H 1 4.388 0.008 . 1 . . . . 704 GLN HA . 15161 1
495 . 1 1 47 47 GLN HB2 H 1 1.798 0.000 . 2 . . . . 704 GLN HB2 . 15161 1
496 . 1 1 47 47 GLN HB3 H 1 1.905 0.000 . 2 . . . . 704 GLN HB3 . 15161 1
497 . 1 1 47 47 GLN HG2 H 1 2.445 0.000 . 2 . . . . 704 GLN HG2 . 15161 1
498 . 1 1 47 47 GLN C C 13 175.708 0.000 . 1 . . . . 704 GLN C . 15161 1
499 . 1 1 47 47 GLN CA C 13 56.162 0.238 . 1 . . . . 704 GLN CA . 15161 1
500 . 1 1 47 47 GLN CB C 13 29.842 0.211 . 1 . . . . 704 GLN CB . 15161 1
501 . 1 1 47 47 GLN CG C 13 34.206 0.167 . 1 . . . . 704 GLN CG . 15161 1
502 . 1 1 47 47 GLN N N 15 121.097 0.038 . 1 . . . . 704 GLN N . 15161 1
503 . 1 1 48 48 ALA H H 1 8.223 0.015 . 1 . . . . 705 ALA H . 15161 1
504 . 1 1 48 48 ALA HA H 1 4.376 0.010 . 1 . . . . 705 ALA HA . 15161 1
505 . 1 1 48 48 ALA HB1 H 1 1.458 0.008 . 1 . . . . 705 ALA HB . 15161 1
506 . 1 1 48 48 ALA HB2 H 1 1.458 0.008 . 1 . . . . 705 ALA HB . 15161 1
507 . 1 1 48 48 ALA HB3 H 1 1.458 0.008 . 1 . . . . 705 ALA HB . 15161 1
508 . 1 1 48 48 ALA C C 13 177.584 0.000 . 1 . . . . 705 ALA C . 15161 1
509 . 1 1 48 48 ALA CA C 13 52.748 0.179 . 1 . . . . 705 ALA CA . 15161 1
510 . 1 1 48 48 ALA CB C 13 19.513 0.182 . 1 . . . . 705 ALA CB . 15161 1
511 . 1 1 48 48 ALA N N 15 125.078 0.074 . 1 . . . . 705 ALA N . 15161 1
512 . 1 1 49 49 GLN H H 1 8.278 0.011 . 1 . . . . 706 GLN H . 15161 1
513 . 1 1 49 49 GLN HA H 1 4.467 0.022 . 1 . . . . 706 GLN HA . 15161 1
514 . 1 1 49 49 GLN HB2 H 1 2.081 0.000 . 2 . . . . 706 GLN HB2 . 15161 1
515 . 1 1 49 49 GLN HB3 H 1 2.182 0.000 . 2 . . . . 706 GLN HB3 . 15161 1
516 . 1 1 49 49 GLN HG2 H 1 2.398 0.000 . 2 . . . . 706 GLN HG2 . 15161 1
517 . 1 1 49 49 GLN C C 13 175.198 0.000 . 1 . . . . 706 GLN C . 15161 1
518 . 1 1 49 49 GLN CA C 13 56.238 0.221 . 1 . . . . 706 GLN CA . 15161 1
519 . 1 1 49 49 GLN CB C 13 30.008 0.203 . 1 . . . . 706 GLN CB . 15161 1
520 . 1 1 49 49 GLN CG C 13 34.195 0.157 . 1 . . . . 706 GLN CG . 15161 1
521 . 1 1 49 49 GLN N N 15 120.034 0.072 . 1 . . . . 706 GLN N . 15161 1
522 . 1 1 50 50 GLN H H 1 7.982 0.010 . 1 . . . . 707 GLN H . 15161 1
523 . 1 1 50 50 GLN HA H 1 4.243 0.003 . 1 . . . . 707 GLN HA . 15161 1
524 . 1 1 50 50 GLN HB2 H 1 2.005 0.008 . 2 . . . . 707 GLN HB2 . 15161 1
525 . 1 1 50 50 GLN HB3 H 1 2.186 0.003 . 2 . . . . 707 GLN HB3 . 15161 1
526 . 1 1 50 50 GLN HG2 H 1 2.362 0.003 . 2 . . . . 707 GLN HG2 . 15161 1
527 . 1 1 50 50 GLN CA C 13 57.554 0.074 . 1 . . . . 707 GLN CA . 15161 1
528 . 1 1 50 50 GLN CB C 13 30.519 0.106 . 1 . . . . 707 GLN CB . 15161 1
529 . 1 1 50 50 GLN CG C 13 34.497 0.054 . 1 . . . . 707 GLN CG . 15161 1
530 . 1 1 50 50 GLN N N 15 126.838 0.055 . 1 . . . . 707 GLN N . 15161 1
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