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 25804
_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' . . . 25804 1
2 '2D 1H-13C HSQC' . . . 25804 1
3 '2D 1H-1H TOCSY' . . . 25804 1
4 '2D 1H-1H NOESY' . . . 25804 1
5 '3D 13C HSQC-NOESY' . . . 25804 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 ARG HA H 1 3.969 0.000 . . . . . A 1 ARG HA . 25804 1
2 . 1 1 1 1 ARG HB2 H 1 1.894 0.000 . . . . . A 1 ARG HB2 . 25804 1
3 . 1 1 1 1 ARG HB3 H 1 1.894 0.000 . . . . . A 1 ARG HB3 . 25804 1
4 . 1 1 1 1 ARG HG2 H 1 1.654 0.000 . . . . . A 1 ARG HG2 . 25804 1
5 . 1 1 1 1 ARG HG3 H 1 1.654 0.000 . . . . . A 1 ARG HG3 . 25804 1
6 . 1 1 1 1 ARG HD2 H 1 3.156 0.000 . . . . . A 1 ARG HD2 . 25804 1
7 . 1 1 1 1 ARG HD3 H 1 3.156 0.000 . . . . . A 1 ARG HD3 . 25804 1
8 . 1 1 1 1 ARG HE H 1 7.197 0.000 . . . . . A 1 ARG HE . 25804 1
9 . 1 1 1 1 ARG CA C 13 55.492 0.000 . . . . . A 1 ARG CA . 25804 1
10 . 1 1 1 1 ARG CB C 13 30.867 0.000 . . . . . A 1 ARG CB . 25804 1
11 . 1 1 1 1 ARG CG C 13 26.457 0.000 . . . . . A 1 ARG CG . 25804 1
12 . 1 1 1 1 ARG CD C 13 43.316 0.000 . . . . . A 1 ARG CD . 25804 1
13 . 1 1 1 1 ARG NE N 15 113.868 0.000 . . . . . A 1 ARG NE . 25804 1
14 . 1 1 2 2 ASP H H 1 8.669 0.000 . . . . . A 2 ASP H . 25804 1
15 . 1 1 2 2 ASP HA H 1 4.778 0.000 . . . . . A 2 ASP HA . 25804 1
16 . 1 1 2 2 ASP HB2 H 1 2.806 0.000 . . . . . A 2 ASP HB2 . 25804 1
17 . 1 1 2 2 ASP HB3 H 1 2.869 0.000 . . . . . A 2 ASP HB3 . 25804 1
18 . 1 1 2 2 ASP CA C 13 52.775 0.000 . . . . . A 2 ASP CA . 25804 1
19 . 1 1 2 2 ASP CB C 13 37.967 0.000 . . . . . A 2 ASP CB . 25804 1
20 . 1 1 2 2 ASP N N 15 121.625 0.000 . . . . . A 2 ASP N . 25804 1
21 . 1 1 3 3 CYS H H 1 7.661 0.000 . . . . . A 3 CYS H . 25804 1
22 . 1 1 3 3 CYS HA H 1 4.790 0.000 . . . . . A 3 CYS HA . 25804 1
23 . 1 1 3 3 CYS HB2 H 1 2.750 0.000 . . . . . A 3 CYS HB2 . 25804 1
24 . 1 1 3 3 CYS HB3 H 1 3.099 0.000 . . . . . A 3 CYS HB3 . 25804 1
25 . 1 1 3 3 CYS CA C 13 53.912 0.000 . . . . . A 3 CYS CA . 25804 1
26 . 1 1 3 3 CYS CB C 13 43.345 0.000 . . . . . A 3 CYS CB . 25804 1
27 . 1 1 3 3 CYS N N 15 113.713 0.000 . . . . . A 3 CYS N . 25804 1
28 . 1 1 4 4 GLN H H 1 8.770 0.000 . . . . . A 4 GLN H . 25804 1
29 . 1 1 4 4 GLN HA H 1 4.440 0.000 . . . . . A 4 GLN HA . 25804 1
30 . 1 1 4 4 GLN HB2 H 1 1.807 0.000 . . . . . A 4 GLN HB2 . 25804 1
31 . 1 1 4 4 GLN HB3 H 1 2.005 0.000 . . . . . A 4 GLN HB3 . 25804 1
32 . 1 1 4 4 GLN HG2 H 1 1.890 0.001 . . . . . A 4 GLN HG2 . 25804 1
33 . 1 1 4 4 GLN HG3 H 1 2.536 0.000 . . . . . A 4 GLN HG3 . 25804 1
34 . 1 1 4 4 GLN HE21 H 1 6.306 0.000 . . . . . A 4 GLN HE21 . 25804 1
35 . 1 1 4 4 GLN HE22 H 1 8.275 0.000 . . . . . A 4 GLN HE22 . 25804 1
36 . 1 1 4 4 GLN CB C 13 32.094 0.000 . . . . . A 4 GLN CB . 25804 1
37 . 1 1 4 4 GLN CG C 13 33.538 0.000 . . . . . A 4 GLN CG . 25804 1
38 . 1 1 4 4 GLN N N 15 118.330 0.000 . . . . . A 4 GLN N . 25804 1
39 . 1 1 5 5 GLU H H 1 7.629 0.000 . . . . . A 5 GLU H . 25804 1
40 . 1 1 5 5 GLU HA H 1 4.043 0.000 . . . . . A 5 GLU HA . 25804 1
41 . 1 1 5 5 GLU HB2 H 1 1.548 0.000 . . . . . A 5 GLU HB2 . 25804 1
42 . 1 1 5 5 GLU HB3 H 1 2.189 0.000 . . . . . A 5 GLU HB3 . 25804 1
43 . 1 1 5 5 GLU HG2 H 1 2.360 0.000 . . . . . A 5 GLU HG2 . 25804 1
44 . 1 1 5 5 GLU HG3 H 1 2.490 0.000 . . . . . A 5 GLU HG3 . 25804 1
45 . 1 1 5 5 GLU CA C 13 53.922 0.000 . . . . . A 5 GLU CA . 25804 1
46 . 1 1 5 5 GLU CB C 13 29.327 0.000 . . . . . A 5 GLU CB . 25804 1
47 . 1 1 5 5 GLU CG C 13 32.961 0.000 . . . . . A 5 GLU CG . 25804 1
48 . 1 1 5 5 GLU N N 15 120.832 0.000 . . . . . A 5 GLU N . 25804 1
49 . 1 1 6 6 LYS H H 1 7.670 0.000 . . . . . A 6 LYS H . 25804 1
50 . 1 1 6 6 LYS HA H 1 3.151 0.000 . . . . . A 6 LYS HA . 25804 1
51 . 1 1 6 6 LYS HB2 H 1 1.276 0.000 . . . . . A 6 LYS HB2 . 25804 1
52 . 1 1 6 6 LYS HB3 H 1 1.276 0.000 . . . . . A 6 LYS HB3 . 25804 1
53 . 1 1 6 6 LYS HG2 H 1 0.041 0.000 . . . . . A 6 LYS HG2 . 25804 1
54 . 1 1 6 6 LYS HG3 H 1 0.550 0.000 . . . . . A 6 LYS HG3 . 25804 1
55 . 1 1 6 6 LYS HD2 H 1 1.216 0.000 . . . . . A 6 LYS HD2 . 25804 1
56 . 1 1 6 6 LYS HD3 H 1 1.216 0.000 . . . . . A 6 LYS HD3 . 25804 1
57 . 1 1 6 6 LYS HE2 H 1 2.258 0.000 . . . . . A 6 LYS HE2 . 25804 1
58 . 1 1 6 6 LYS HE3 H 1 2.477 0.000 . . . . . A 6 LYS HE3 . 25804 1
59 . 1 1 6 6 LYS HZ1 H 1 7.359 0.000 . . . . . A 6 LYS HZ1 . 25804 1
60 . 1 1 6 6 LYS HZ2 H 1 7.359 0.000 . . . . . A 6 LYS HZ2 . 25804 1
61 . 1 1 6 6 LYS HZ3 H 1 7.359 0.000 . . . . . A 6 LYS HZ3 . 25804 1
62 . 1 1 6 6 LYS CA C 13 59.015 0.000 . . . . . A 6 LYS CA . 25804 1
63 . 1 1 6 6 LYS CB C 13 32.388 0.000 . . . . . A 6 LYS CB . 25804 1
64 . 1 1 6 6 LYS CG C 13 25.021 0.000 . . . . . A 6 LYS CG . 25804 1
65 . 1 1 6 6 LYS CD C 13 29.675 0.000 . . . . . A 6 LYS CD . 25804 1
66 . 1 1 6 6 LYS CE C 13 41.561 0.000 . . . . . A 6 LYS CE . 25804 1
67 . 1 1 6 6 LYS N N 15 119.543 0.000 . . . . . A 6 LYS N . 25804 1
68 . 1 1 7 7 TRP H H 1 8.913 0.000 . . . . . A 7 TRP H . 25804 1
69 . 1 1 7 7 TRP HA H 1 4.048 0.000 . . . . . A 7 TRP HA . 25804 1
70 . 1 1 7 7 TRP HB2 H 1 3.410 0.000 . . . . . A 7 TRP HB2 . 25804 1
71 . 1 1 7 7 TRP HB3 H 1 3.670 0.001 . . . . . A 7 TRP HB3 . 25804 1
72 . 1 1 7 7 TRP HD1 H 1 6.993 0.000 . . . . . A 7 TRP HD1 . 25804 1
73 . 1 1 7 7 TRP HE1 H 1 9.952 0.000 . . . . . A 7 TRP HE1 . 25804 1
74 . 1 1 7 7 TRP HE3 H 1 7.425 0.000 . . . . . A 7 TRP HE3 . 25804 1
75 . 1 1 7 7 TRP HZ2 H 1 7.424 0.000 . . . . . A 7 TRP HZ2 . 25804 1
76 . 1 1 7 7 TRP HZ3 H 1 6.960 0.000 . . . . . A 7 TRP HZ3 . 25804 1
77 . 1 1 7 7 TRP HH2 H 1 7.131 0.000 . . . . . A 7 TRP HH2 . 25804 1
78 . 1 1 7 7 TRP CA C 13 58.717 0.000 . . . . . A 7 TRP CA . 25804 1
79 . 1 1 7 7 TRP CB C 13 27.295 0.000 . . . . . A 7 TRP CB . 25804 1
80 . 1 1 7 7 TRP CD1 C 13 126.765 0.000 . . . . . A 7 TRP CD1 . 25804 1
81 . 1 1 7 7 TRP CE3 C 13 121.058 0.000 . . . . . A 7 TRP CE3 . 25804 1
82 . 1 1 7 7 TRP CZ2 C 13 114.185 0.000 . . . . . A 7 TRP CZ2 . 25804 1
83 . 1 1 7 7 TRP CZ3 C 13 121.584 0.000 . . . . . A 7 TRP CZ3 . 25804 1
84 . 1 1 7 7 TRP CH2 C 13 124.212 0.000 . . . . . A 7 TRP CH2 . 25804 1
85 . 1 1 7 7 TRP N N 15 115.545 0.000 . . . . . A 7 TRP N . 25804 1
86 . 1 1 7 7 TRP NE1 N 15 127.049 0.000 . . . . . A 7 TRP NE1 . 25804 1
87 . 1 1 8 8 GLU H H 1 7.779 0.000 . . . . . A 8 GLU H . 25804 1
88 . 1 1 8 8 GLU HA H 1 4.413 0.000 . . . . . A 8 GLU HA . 25804 1
89 . 1 1 8 8 GLU HB2 H 1 2.068 0.000 . . . . . A 8 GLU HB2 . 25804 1
90 . 1 1 8 8 GLU HB3 H 1 2.068 0.000 . . . . . A 8 GLU HB3 . 25804 1
91 . 1 1 8 8 GLU HG2 H 1 2.234 0.000 . . . . . A 8 GLU HG2 . 25804 1
92 . 1 1 8 8 GLU HG3 H 1 2.259 0.000 . . . . . A 8 GLU HG3 . 25804 1
93 . 1 1 8 8 GLU CB C 13 29.536 0.000 . . . . . A 8 GLU CB . 25804 1
94 . 1 1 8 8 GLU CG C 13 34.064 0.000 . . . . . A 8 GLU CG . 25804 1
95 . 1 1 8 8 GLU N N 15 115.184 0.000 . . . . . A 8 GLU N . 25804 1
96 . 1 1 9 9 TYR H H 1 7.863 0.000 . . . . . A 9 TYR H . 25804 1
97 . 1 1 9 9 TYR HA H 1 4.924 0.000 . . . . . A 9 TYR HA . 25804 1
98 . 1 1 9 9 TYR HB2 H 1 2.711 0.000 . . . . . A 9 TYR HB2 . 25804 1
99 . 1 1 9 9 TYR HB3 H 1 3.032 0.000 . . . . . A 9 TYR HB3 . 25804 1
100 . 1 1 9 9 TYR HD1 H 1 7.282 0.000 . . . . . A 9 TYR HD1 . 25804 1
101 . 1 1 9 9 TYR HD2 H 1 7.282 0.000 . . . . . A 9 TYR HD2 . 25804 1
102 . 1 1 9 9 TYR HE1 H 1 6.727 0.000 . . . . . A 9 TYR HE1 . 25804 1
103 . 1 1 9 9 TYR HE2 H 1 6.727 0.000 . . . . . A 9 TYR HE2 . 25804 1
104 . 1 1 9 9 TYR CA C 13 59.058 0.000 . . . . . A 9 TYR CA . 25804 1
105 . 1 1 9 9 TYR CB C 13 39.219 0.000 . . . . . A 9 TYR CB . 25804 1
106 . 1 1 9 9 TYR CD2 C 13 133.364 0.000 . . . . . A 9 TYR CD2 . 25804 1
107 . 1 1 9 9 TYR CE2 C 13 117.947 0.000 . . . . . A 9 TYR CE2 . 25804 1
108 . 1 1 9 9 TYR N N 15 118.021 0.000 . . . . . A 9 TYR N . 25804 1
109 . 1 1 10 10 CYS H H 1 8.273 0.000 . . . . . A 10 CYS H . 25804 1
110 . 1 1 10 10 CYS HA H 1 4.933 0.000 . . . . . A 10 CYS HA . 25804 1
111 . 1 1 10 10 CYS HB2 H 1 2.457 0.000 . . . . . A 10 CYS HB2 . 25804 1
112 . 1 1 10 10 CYS HB3 H 1 2.914 0.000 . . . . . A 10 CYS HB3 . 25804 1
113 . 1 1 10 10 CYS CA C 13 54.821 0.000 . . . . . A 10 CYS CA . 25804 1
114 . 1 1 10 10 CYS CB C 13 40.569 0.000 . . . . . A 10 CYS CB . 25804 1
115 . 1 1 11 11 ILE H H 1 8.313 0.000 . . . . . A 11 ILE H . 25804 1
116 . 1 1 11 11 ILE HA H 1 4.410 0.000 . . . . . A 11 ILE HA . 25804 1
117 . 1 1 11 11 ILE HB H 1 1.598 0.000 . . . . . A 11 ILE HB . 25804 1
118 . 1 1 11 11 ILE HG12 H 1 0.937 0.000 . . . . . A 11 ILE HG12 . 25804 1
119 . 1 1 11 11 ILE HG13 H 1 1.289 0.000 . . . . . A 11 ILE HG13 . 25804 1
120 . 1 1 11 11 ILE HG21 H 1 0.747 0.000 . . . . . A 11 ILE HG21 . 25804 1
121 . 1 1 11 11 ILE HG22 H 1 0.747 0.000 . . . . . A 11 ILE HG22 . 25804 1
122 . 1 1 11 11 ILE HG23 H 1 0.747 0.000 . . . . . A 11 ILE HG23 . 25804 1
123 . 1 1 11 11 ILE HD11 H 1 0.734 0.000 . . . . . A 11 ILE HD11 . 25804 1
124 . 1 1 11 11 ILE HD12 H 1 0.734 0.000 . . . . . A 11 ILE HD12 . 25804 1
125 . 1 1 11 11 ILE HD13 H 1 0.734 0.000 . . . . . A 11 ILE HD13 . 25804 1
126 . 1 1 11 11 ILE CB C 13 42.112 0.000 . . . . . A 11 ILE CB . 25804 1
127 . 1 1 11 11 ILE CG1 C 13 26.722 0.000 . . . . . A 11 ILE CG1 . 25804 1
128 . 1 1 11 11 ILE CG2 C 13 17.847 0.000 . . . . . A 11 ILE CG2 . 25804 1
129 . 1 1 11 11 ILE CD1 C 13 13.501 0.000 . . . . . A 11 ILE CD1 . 25804 1
130 . 1 1 11 11 ILE N N 15 115.502 0.000 . . . . . A 11 ILE N . 25804 1
131 . 1 1 12 12 VAL H H 1 8.218 0.000 . . . . . A 12 VAL H . 25804 1
132 . 1 1 12 12 VAL HA H 1 4.521 0.000 . . . . . A 12 VAL HA . 25804 1
133 . 1 1 12 12 VAL HB H 1 2.035 0.000 . . . . . A 12 VAL HB . 25804 1
134 . 1 1 12 12 VAL HG11 H 1 0.869 0.000 . . . . . A 12 VAL HG11 . 25804 1
135 . 1 1 12 12 VAL HG12 H 1 0.869 0.000 . . . . . A 12 VAL HG12 . 25804 1
136 . 1 1 12 12 VAL HG13 H 1 0.869 0.000 . . . . . A 12 VAL HG13 . 25804 1
137 . 1 1 12 12 VAL HG21 H 1 0.816 0.000 . . . . . A 12 VAL HG21 . 25804 1
138 . 1 1 12 12 VAL HG22 H 1 0.816 0.000 . . . . . A 12 VAL HG22 . 25804 1
139 . 1 1 12 12 VAL HG23 H 1 0.816 0.000 . . . . . A 12 VAL HG23 . 25804 1
140 . 1 1 12 12 VAL CA C 13 57.736 0.000 . . . . . A 12 VAL CA . 25804 1
141 . 1 1 12 12 VAL CB C 13 34.704 0.000 . . . . . A 12 VAL CB . 25804 1
142 . 1 1 12 12 VAL CG1 C 13 21.426 0.000 . . . . . A 12 VAL CG1 . 25804 1
143 . 1 1 12 12 VAL CG2 C 13 20.635 0.000 . . . . . A 12 VAL CG2 . 25804 1
144 . 1 1 13 13 PRO HA H 1 4.119 0.000 . . . . . A 13 PRO HA . 25804 1
145 . 1 1 13 13 PRO HB2 H 1 2.164 0.003 . . . . . A 13 PRO HB2 . 25804 1
146 . 1 1 13 13 PRO HB3 H 1 1.796 0.000 . . . . . A 13 PRO HB3 . 25804 1
147 . 1 1 13 13 PRO HG2 H 1 1.781 0.000 . . . . . A 13 PRO HG2 . 25804 1
148 . 1 1 13 13 PRO HG3 H 1 1.388 0.000 . . . . . A 13 PRO HG3 . 25804 1
149 . 1 1 13 13 PRO HD2 H 1 3.590 0.000 . . . . . A 13 PRO HD2 . 25804 1
150 . 1 1 13 13 PRO HD3 H 1 3.654 0.000 . . . . . A 13 PRO HD3 . 25804 1
151 . 1 1 13 13 PRO CA C 13 64.402 0.000 . . . . . A 13 PRO CA . 25804 1
152 . 1 1 13 13 PRO CB C 13 31.742 0.000 . . . . . A 13 PRO CB . 25804 1
153 . 1 1 13 13 PRO CG C 13 27.509 0.000 . . . . . A 13 PRO CG . 25804 1
154 . 1 1 13 13 PRO CD C 13 50.568 0.000 . . . . . A 13 PRO CD . 25804 1
155 . 1 1 14 14 ILE H H 1 7.703 0.000 . . . . . A 14 ILE H . 25804 1
156 . 1 1 14 14 ILE HA H 1 4.117 0.000 . . . . . A 14 ILE HA . 25804 1
157 . 1 1 14 14 ILE HB H 1 1.378 0.000 . . . . . A 14 ILE HB . 25804 1
158 . 1 1 14 14 ILE HG12 H 1 1.083 0.000 . . . . . A 14 ILE HG12 . 25804 1
159 . 1 1 14 14 ILE HG13 H 1 1.388 0.000 . . . . . A 14 ILE HG13 . 25804 1
160 . 1 1 14 14 ILE HG21 H 1 0.813 0.000 . . . . . A 14 ILE HG21 . 25804 1
161 . 1 1 14 14 ILE HG22 H 1 0.813 0.000 . . . . . A 14 ILE HG22 . 25804 1
162 . 1 1 14 14 ILE HG23 H 1 0.813 0.000 . . . . . A 14 ILE HG23 . 25804 1
163 . 1 1 14 14 ILE HD11 H 1 0.820 0.000 . . . . . A 14 ILE HD11 . 25804 1
164 . 1 1 14 14 ILE HD12 H 1 0.820 0.000 . . . . . A 14 ILE HD12 . 25804 1
165 . 1 1 14 14 ILE HD13 H 1 0.820 0.000 . . . . . A 14 ILE HD13 . 25804 1
166 . 1 1 14 14 ILE CA C 13 55.871 0.000 . . . . . A 14 ILE CA . 25804 1
167 . 1 1 14 14 ILE CB C 13 42.329 0.000 . . . . . A 14 ILE CB . 25804 1
168 . 1 1 14 14 ILE CG1 C 13 27.762 0.000 . . . . . A 14 ILE CG1 . 25804 1
169 . 1 1 14 14 ILE CG2 C 13 17.629 0.000 . . . . . A 14 ILE CG2 . 25804 1
170 . 1 1 14 14 ILE CD1 C 13 12.771 0.000 . . . . . A 14 ILE CD1 . 25804 1
171 . 1 1 16 16 GLY H H 1 7.983 0.000 . . . . . A 16 GLY H . 25804 1
172 . 1 1 16 16 GLY HA2 H 1 4.068 0.000 . . . . . A 16 GLY HA2 . 25804 1
173 . 1 1 16 16 GLY HA3 H 1 3.376 0.000 . . . . . A 16 GLY HA3 . 25804 1
174 . 1 1 16 16 GLY CA C 13 45.406 0.000 . . . . . A 16 GLY CA . 25804 1
175 . 1 1 16 16 GLY N N 15 106.027 0.000 . . . . . A 16 GLY N . 25804 1
176 . 1 1 17 17 PHE H H 1 7.690 0.000 . . . . . A 17 PHE H . 25804 1
177 . 1 1 17 17 PHE HA H 1 4.509 0.000 . . . . . A 17 PHE HA . 25804 1
178 . 1 1 17 17 PHE HB2 H 1 2.788 0.003 . . . . . A 17 PHE HB2 . 25804 1
179 . 1 1 17 17 PHE HB3 H 1 2.978 0.000 . . . . . A 17 PHE HB3 . 25804 1
180 . 1 1 17 17 PHE HD1 H 1 7.146 0.000 . . . . . A 17 PHE HD1 . 25804 1
181 . 1 1 17 17 PHE HD2 H 1 7.146 0.000 . . . . . A 17 PHE HD2 . 25804 1
182 . 1 1 17 17 PHE HE1 H 1 6.724 0.000 . . . . . A 17 PHE HE1 . 25804 1
183 . 1 1 17 17 PHE HE2 H 1 6.724 0.000 . . . . . A 17 PHE HE2 . 25804 1
184 . 1 1 17 17 PHE CB C 13 39.503 0.000 . . . . . A 17 PHE CB . 25804 1
185 . 1 1 17 17 PHE CD1 C 13 131.853 0.000 . . . . . A 17 PHE CD1 . 25804 1
186 . 1 1 17 17 PHE CE1 C 13 133.353 0.000 . . . . . A 17 PHE CE1 . 25804 1
187 . 1 1 18 18 VAL H H 1 7.549 0.000 . . . . . A 18 VAL H . 25804 1
188 . 1 1 18 18 VAL HA H 1 4.893 0.000 . . . . . A 18 VAL HA . 25804 1
189 . 1 1 18 18 VAL HB H 1 1.681 0.006 . . . . . A 18 VAL HB . 25804 1
190 . 1 1 18 18 VAL HG11 H 1 0.761 0.000 . . . . . A 18 VAL HG11 . 25804 1
191 . 1 1 18 18 VAL HG12 H 1 0.761 0.000 . . . . . A 18 VAL HG12 . 25804 1
192 . 1 1 18 18 VAL HG13 H 1 0.761 0.000 . . . . . A 18 VAL HG13 . 25804 1
193 . 1 1 18 18 VAL HG21 H 1 0.592 0.000 . . . . . A 18 VAL HG21 . 25804 1
194 . 1 1 18 18 VAL HG22 H 1 0.592 0.000 . . . . . A 18 VAL HG22 . 25804 1
195 . 1 1 18 18 VAL HG23 H 1 0.592 0.000 . . . . . A 18 VAL HG23 . 25804 1
196 . 1 1 18 18 VAL CA C 13 58.728 0.000 . . . . . A 18 VAL CA . 25804 1
197 . 1 1 18 18 VAL CB C 13 35.994 0.000 . . . . . A 18 VAL CB . 25804 1
198 . 1 1 18 18 VAL CG1 C 13 21.621 0.000 . . . . . A 18 VAL CG1 . 25804 1
199 . 1 1 18 18 VAL CG2 C 13 21.562 0.000 . . . . . A 18 VAL CG2 . 25804 1
200 . 1 1 19 19 TYR H H 1 7.528 0.000 . . . . . A 19 TYR H . 25804 1
201 . 1 1 19 19 TYR HA H 1 4.419 0.000 . . . . . A 19 TYR HA . 25804 1
202 . 1 1 19 19 TYR HB2 H 1 2.770 0.000 . . . . . A 19 TYR HB2 . 25804 1
203 . 1 1 19 19 TYR HB3 H 1 3.003 0.000 . . . . . A 19 TYR HB3 . 25804 1
204 . 1 1 19 19 TYR HD1 H 1 6.975 0.000 . . . . . A 19 TYR HD1 . 25804 1
205 . 1 1 19 19 TYR HD2 H 1 6.975 0.000 . . . . . A 19 TYR HD2 . 25804 1
206 . 1 1 19 19 TYR HE1 H 1 6.665 0.000 . . . . . A 19 TYR HE1 . 25804 1
207 . 1 1 19 19 TYR HE2 H 1 6.665 0.000 . . . . . A 19 TYR HE2 . 25804 1
208 . 1 1 19 19 TYR CB C 13 39.210 0.000 . . . . . A 19 TYR CB . 25804 1
209 . 1 1 19 19 TYR CD1 C 13 133.043 0.000 . . . . . A 19 TYR CD1 . 25804 1
210 . 1 1 19 19 TYR CE2 C 13 117.939 0.000 . . . . . A 19 TYR CE2 . 25804 1
211 . 1 1 20 20 CYS H H 1 8.399 0.000 . . . . . A 20 CYS H . 25804 1
212 . 1 1 20 20 CYS HA H 1 4.912 0.000 . . . . . A 20 CYS HA . 25804 1
213 . 1 1 20 20 CYS HB2 H 1 2.477 0.000 . . . . . A 20 CYS HB2 . 25804 1
214 . 1 1 20 20 CYS HB3 H 1 2.940 0.006 . . . . . A 20 CYS HB3 . 25804 1
215 . 1 1 20 20 CYS CA C 13 55.045 0.000 . . . . . A 20 CYS CA . 25804 1
216 . 1 1 20 20 CYS CB C 13 40.529 0.000 . . . . . A 20 CYS CB . 25804 1
217 . 1 1 21 21 CYS H H 1 9.291 0.000 . . . . . A 21 CYS H . 25804 1
218 . 1 1 21 21 CYS HA H 1 4.628 0.000 . . . . . A 21 CYS HA . 25804 1
219 . 1 1 21 21 CYS HB2 H 1 2.220 0.000 . . . . . A 21 CYS HB2 . 25804 1
220 . 1 1 21 21 CYS HB3 H 1 3.192 0.000 . . . . . A 21 CYS HB3 . 25804 1
221 . 1 1 21 21 CYS CA C 13 53.306 0.000 . . . . . A 21 CYS CA . 25804 1
222 . 1 1 21 21 CYS CB C 13 37.726 0.000 . . . . . A 21 CYS CB . 25804 1
223 . 1 1 21 21 CYS N N 15 121.142 0.000 . . . . . A 21 CYS N . 25804 1
224 . 1 1 22 22 PRO HA H 1 4.216 0.000 . . . . . A 22 PRO HA . 25804 1
225 . 1 1 22 22 PRO HB2 H 1 2.228 0.000 . . . . . A 22 PRO HB2 . 25804 1
226 . 1 1 22 22 PRO HB3 H 1 1.724 0.000 . . . . . A 22 PRO HB3 . 25804 1
227 . 1 1 22 22 PRO HG2 H 1 1.959 0.000 . . . . . A 22 PRO HG2 . 25804 1
228 . 1 1 22 22 PRO HG3 H 1 2.051 0.000 . . . . . A 22 PRO HG3 . 25804 1
229 . 1 1 22 22 PRO HD2 H 1 3.503 0.000 . . . . . A 22 PRO HD2 . 25804 1
230 . 1 1 22 22 PRO HD3 H 1 3.842 0.000 . . . . . A 22 PRO HD3 . 25804 1
231 . 1 1 22 22 PRO CA C 13 64.242 0.000 . . . . . A 22 PRO CA . 25804 1
232 . 1 1 22 22 PRO CB C 13 31.749 0.000 . . . . . A 22 PRO CB . 25804 1
233 . 1 1 22 22 PRO CG C 13 27.773 0.000 . . . . . A 22 PRO CG . 25804 1
234 . 1 1 22 22 PRO CD C 13 50.470 0.000 . . . . . A 22 PRO CD . 25804 1
235 . 1 1 23 23 GLY H H 1 8.603 0.000 . . . . . A 23 GLY H . 25804 1
236 . 1 1 23 23 GLY HA2 H 1 4.205 0.000 . . . . . A 23 GLY HA2 . 25804 1
237 . 1 1 23 23 GLY HA3 H 1 3.425 0.000 . . . . . A 23 GLY HA3 . 25804 1
238 . 1 1 23 23 GLY CA C 13 44.618 0.000 . . . . . A 23 GLY CA . 25804 1
239 . 1 1 23 23 GLY N N 15 111.521 0.000 . . . . . A 23 GLY N . 25804 1
240 . 1 1 24 24 LEU H H 1 7.774 0.000 . . . . . A 24 LEU H . 25804 1
241 . 1 1 24 24 LEU HA H 1 4.706 0.000 . . . . . A 24 LEU HA . 25804 1
242 . 1 1 24 24 LEU HB2 H 1 1.013 0.000 . . . . . A 24 LEU HB2 . 25804 1
243 . 1 1 24 24 LEU HB3 H 1 2.021 0.000 . . . . . A 24 LEU HB3 . 25804 1
244 . 1 1 24 24 LEU HG H 1 1.244 0.000 . . . . . A 24 LEU HG . 25804 1
245 . 1 1 24 24 LEU HD11 H 1 0.659 0.000 . . . . . A 24 LEU HD11 . 25804 1
246 . 1 1 24 24 LEU HD12 H 1 0.659 0.000 . . . . . A 24 LEU HD12 . 25804 1
247 . 1 1 24 24 LEU HD13 H 1 0.659 0.000 . . . . . A 24 LEU HD13 . 25804 1
248 . 1 1 24 24 LEU HD21 H 1 0.487 0.000 . . . . . A 24 LEU HD21 . 25804 1
249 . 1 1 24 24 LEU HD22 H 1 0.487 0.000 . . . . . A 24 LEU HD22 . 25804 1
250 . 1 1 24 24 LEU HD23 H 1 0.487 0.000 . . . . . A 24 LEU HD23 . 25804 1
251 . 1 1 24 24 LEU CA C 13 52.692 0.000 . . . . . A 24 LEU CA . 25804 1
252 . 1 1 24 24 LEU CB C 13 44.385 0.000 . . . . . A 24 LEU CB . 25804 1
253 . 1 1 24 24 LEU CG C 13 26.543 0.000 . . . . . A 24 LEU CG . 25804 1
254 . 1 1 24 24 LEU CD1 C 13 26.778 0.000 . . . . . A 24 LEU CD1 . 25804 1
255 . 1 1 24 24 LEU CD2 C 13 22.960 0.000 . . . . . A 24 LEU CD2 . 25804 1
256 . 1 1 24 24 LEU N N 15 119.440 0.000 . . . . . A 24 LEU N . 25804 1
257 . 1 1 25 25 ILE H H 1 8.265 0.000 . . . . . A 25 ILE H . 25804 1
258 . 1 1 25 25 ILE HA H 1 4.438 0.000 . . . . . A 25 ILE HA . 25804 1
259 . 1 1 25 25 ILE HB H 1 1.625 0.000 . . . . . A 25 ILE HB . 25804 1
260 . 1 1 25 25 ILE HG12 H 1 0.931 0.000 . . . . . A 25 ILE HG12 . 25804 1
261 . 1 1 25 25 ILE HG13 H 1 1.263 0.000 . . . . . A 25 ILE HG13 . 25804 1
262 . 1 1 25 25 ILE HG21 H 1 0.745 0.000 . . . . . A 25 ILE HG21 . 25804 1
263 . 1 1 25 25 ILE HG22 H 1 0.745 0.000 . . . . . A 25 ILE HG22 . 25804 1
264 . 1 1 25 25 ILE HG23 H 1 0.745 0.000 . . . . . A 25 ILE HG23 . 25804 1
265 . 1 1 25 25 ILE HD11 H 1 0.745 0.000 . . . . . A 25 ILE HD11 . 25804 1
266 . 1 1 25 25 ILE HD12 H 1 0.745 0.000 . . . . . A 25 ILE HD12 . 25804 1
267 . 1 1 25 25 ILE HD13 H 1 0.745 0.000 . . . . . A 25 ILE HD13 . 25804 1
268 . 1 1 25 25 ILE CB C 13 42.336 0.000 . . . . . A 25 ILE CB . 25804 1
269 . 1 1 25 25 ILE CG1 C 13 26.785 0.000 . . . . . A 25 ILE CG1 . 25804 1
270 . 1 1 25 25 ILE CG2 C 13 17.558 0.000 . . . . . A 25 ILE CG2 . 25804 1
271 . 1 1 25 25 ILE CD1 C 13 13.343 0.000 . . . . . A 25 ILE CD1 . 25804 1
272 . 1 1 25 25 ILE N N 15 114.487 0.000 . . . . . A 25 ILE N . 25804 1
273 . 1 1 26 26 CYS H H 1 8.668 0.000 . . . . . A 26 CYS H . 25804 1
274 . 1 1 26 26 CYS HA H 1 4.624 0.000 . . . . . A 26 CYS HA . 25804 1
275 . 1 1 26 26 CYS HB2 H 1 2.936 0.000 . . . . . A 26 CYS HB2 . 25804 1
276 . 1 1 26 26 CYS HB3 H 1 2.987 0.000 . . . . . A 26 CYS HB3 . 25804 1
277 . 1 1 26 26 CYS CA C 13 55.914 0.000 . . . . . A 26 CYS CA . 25804 1
278 . 1 1 26 26 CYS CB C 13 39.778 0.000 . . . . . A 26 CYS CB . 25804 1
279 . 1 1 26 26 CYS N N 15 123.741 0.000 . . . . . A 26 CYS N . 25804 1
280 . 1 1 27 27 GLY H H 1 8.330 0.000 . . . . . A 27 GLY H . 25804 1
281 . 1 1 27 27 GLY HA2 H 1 4.396 0.000 . . . . . A 27 GLY HA2 . 25804 1
282 . 1 1 27 27 GLY HA3 H 1 3.623 0.000 . . . . . A 27 GLY HA3 . 25804 1
283 . 1 1 27 27 GLY CA C 13 43.012 0.000 . . . . . A 27 GLY CA . 25804 1
284 . 1 1 27 27 GLY N N 15 118.253 0.000 . . . . . A 27 GLY N . 25804 1
285 . 1 1 28 28 PRO HA H 1 4.490 0.000 . . . . . A 28 PRO HA . 25804 1
286 . 1 1 28 28 PRO HB2 H 1 2.282 0.000 . . . . . A 28 PRO HB2 . 25804 1
287 . 1 1 28 28 PRO HB3 H 1 1.772 0.000 . . . . . A 28 PRO HB3 . 25804 1
288 . 1 1 28 28 PRO HG2 H 1 1.974 0.004 . . . . . A 28 PRO HG2 . 25804 1
289 . 1 1 28 28 PRO HG3 H 1 2.053 0.006 . . . . . A 28 PRO HG3 . 25804 1
290 . 1 1 28 28 PRO HD2 H 1 3.611 0.000 . . . . . A 28 PRO HD2 . 25804 1
291 . 1 1 28 28 PRO HD3 H 1 3.611 0.000 . . . . . A 28 PRO HD3 . 25804 1
292 . 1 1 28 28 PRO CA C 13 62.587 0.000 . . . . . A 28 PRO CA . 25804 1
293 . 1 1 28 28 PRO CB C 13 27.868 0.000 . . . . . A 28 PRO CB . 25804 1
294 . 1 1 28 28 PRO CG C 13 27.520 0.000 . . . . . A 28 PRO CG . 25804 1
295 . 1 1 28 28 PRO CD C 13 50.176 0.000 . . . . . A 28 PRO CD . 25804 1
296 . 1 1 29 29 PHE H H 1 8.257 0.000 . . . . . A 29 PHE H . 25804 1
297 . 1 1 29 29 PHE HA H 1 3.643 0.000 . . . . . A 29 PHE HA . 25804 1
298 . 1 1 29 29 PHE HB2 H 1 3.508 0.000 . . . . . A 29 PHE HB2 . 25804 1
299 . 1 1 29 29 PHE HB3 H 1 3.634 0.000 . . . . . A 29 PHE HB3 . 25804 1
300 . 1 1 29 29 PHE HD1 H 1 7.254 0.000 . . . . . A 29 PHE HD1 . 25804 1
301 . 1 1 29 29 PHE HD2 H 1 7.254 0.000 . . . . . A 29 PHE HD2 . 25804 1
302 . 1 1 29 29 PHE HE1 H 1 7.318 0.000 . . . . . A 29 PHE HE1 . 25804 1
303 . 1 1 29 29 PHE HE2 H 1 7.318 0.000 . . . . . A 29 PHE HE2 . 25804 1
304 . 1 1 29 29 PHE CA C 13 50.361 0.000 . . . . . A 29 PHE CA . 25804 1
305 . 1 1 29 29 PHE CB C 13 37.549 0.000 . . . . . A 29 PHE CB . 25804 1
306 . 1 1 29 29 PHE N N 15 110.773 0.000 . . . . . A 29 PHE N . 25804 1
307 . 1 1 30 30 VAL H H 1 6.842 0.000 . . . . . A 30 VAL H . 25804 1
308 . 1 1 30 30 VAL HA H 1 4.998 0.000 . . . . . A 30 VAL HA . 25804 1
309 . 1 1 30 30 VAL HB H 1 1.602 0.000 . . . . . A 30 VAL HB . 25804 1
310 . 1 1 30 30 VAL HG11 H 1 0.597 0.000 . . . . . A 30 VAL HG11 . 25804 1
311 . 1 1 30 30 VAL HG12 H 1 0.597 0.000 . . . . . A 30 VAL HG12 . 25804 1
312 . 1 1 30 30 VAL HG13 H 1 0.597 0.000 . . . . . A 30 VAL HG13 . 25804 1
313 . 1 1 30 30 VAL HG21 H 1 0.710 0.000 . . . . . A 30 VAL HG21 . 25804 1
314 . 1 1 30 30 VAL HG22 H 1 0.710 0.000 . . . . . A 30 VAL HG22 . 25804 1
315 . 1 1 30 30 VAL HG23 H 1 0.710 0.000 . . . . . A 30 VAL HG23 . 25804 1
316 . 1 1 30 30 VAL CA C 13 58.219 0.000 . . . . . A 30 VAL CA . 25804 1
317 . 1 1 30 30 VAL CB C 13 36.646 0.000 . . . . . A 30 VAL CB . 25804 1
318 . 1 1 30 30 VAL CG1 C 13 21.553 0.000 . . . . . A 30 VAL CG1 . 25804 1
319 . 1 1 30 30 VAL CG2 C 13 21.559 0.000 . . . . . A 30 VAL CG2 . 25804 1
320 . 1 1 30 30 VAL N N 15 108.125 0.000 . . . . . A 30 VAL N . 25804 1
321 . 1 1 31 31 CYS H H 1 8.515 0.000 . . . . . A 31 CYS H . 25804 1
322 . 1 1 31 31 CYS HA H 1 4.931 0.000 . . . . . A 31 CYS HA . 25804 1
323 . 1 1 31 31 CYS HB2 H 1 2.464 0.000 . . . . . A 31 CYS HB2 . 25804 1
324 . 1 1 31 31 CYS HB3 H 1 3.013 0.000 . . . . . A 31 CYS HB3 . 25804 1
325 . 1 1 31 31 CYS CA C 13 55.292 0.000 . . . . . A 31 CYS CA . 25804 1
326 . 1 1 31 31 CYS CB C 13 40.733 0.000 . . . . . A 31 CYS CB . 25804 1
327 . 1 1 31 31 CYS N N 15 121.703 0.000 . . . . . A 31 CYS N . 25804 1
328 . 1 1 32 32 VAL H H 1 9.485 0.000 . . . . . A 32 VAL H . 25804 1
329 . 1 1 32 32 VAL HA H 1 4.226 0.000 . . . . . A 32 VAL HA . 25804 1
330 . 1 1 32 32 VAL HB H 1 2.063 0.000 . . . . . A 32 VAL HB . 25804 1
331 . 1 1 32 32 VAL HG11 H 1 0.810 0.000 . . . . . A 32 VAL HG11 . 25804 1
332 . 1 1 32 32 VAL HG12 H 1 0.810 0.000 . . . . . A 32 VAL HG12 . 25804 1
333 . 1 1 32 32 VAL HG13 H 1 0.810 0.000 . . . . . A 32 VAL HG13 . 25804 1
334 . 1 1 32 32 VAL HG21 H 1 0.740 0.000 . . . . . A 32 VAL HG21 . 25804 1
335 . 1 1 32 32 VAL HG22 H 1 0.740 0.000 . . . . . A 32 VAL HG22 . 25804 1
336 . 1 1 32 32 VAL HG23 H 1 0.740 0.000 . . . . . A 32 VAL HG23 . 25804 1
337 . 1 1 32 32 VAL CA C 13 59.273 0.000 . . . . . A 32 VAL CA . 25804 1
338 . 1 1 32 32 VAL CB C 13 34.730 0.000 . . . . . A 32 VAL CB . 25804 1
339 . 1 1 32 32 VAL CG1 C 13 23.298 0.000 . . . . . A 32 VAL CG1 . 25804 1
340 . 1 1 32 32 VAL CG2 C 13 21.940 0.000 . . . . . A 32 VAL CG2 . 25804 1
341 . 1 1 32 32 VAL N N 15 117.995 0.000 . . . . . A 32 VAL N . 25804 1
stop_
save_