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 19396
_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 0.01
_Assigned_chem_shift_list.Chem_shift_13C_err 0.05
_Assigned_chem_shift_list.Chem_shift_15N_err 0.05
_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-1H NOESY' . . . 19396 1
2 '2D 1H-1H TOCSY' . . . 19396 1
3 '2D 1H-15N HSQC' . . . 19396 1
4 '2D 1H-13C HSQC' . . . 19396 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 GLY HA2 H 1 3.859 0.001 . 2 . . . A 1 GLY HA2 . 19396 1
2 . 1 1 1 1 GLY HA3 H 1 3.859 0.001 . 2 . . . A 1 GLY HA3 . 19396 1
3 . 1 1 1 1 GLY C C 13 169.826 0.031 . 1 . . . A 1 GLY C . 19396 1
4 . 1 1 1 1 GLY CA C 13 43.162 0.050 . 1 . . . A 1 GLY CA . 19396 1
5 . 1 1 2 2 LEU H H 1 8.622 0.006 . 1 . . . A 2 LEU H . 19396 1
6 . 1 1 2 2 LEU HA H 1 4.646 0.010 . 1 . . . A 2 LEU HA . 19396 1
7 . 1 1 2 2 LEU HB2 H 1 1.592 0.010 . 1 . . . A 2 LEU HB2 . 19396 1
8 . 1 1 2 2 LEU HB3 H 1 1.414 0.010 . 1 . . . A 2 LEU HB3 . 19396 1
9 . 1 1 2 2 LEU HG H 1 1.720 0.010 . 1 . . . A 2 LEU HG . 19396 1
10 . 1 1 2 2 LEU HD11 H 1 0.936 0.010 . 2 . . . A 2 LEU HD11 . 19396 1
11 . 1 1 2 2 LEU HD12 H 1 0.936 0.010 . 2 . . . A 2 LEU HD12 . 19396 1
12 . 1 1 2 2 LEU HD13 H 1 0.936 0.010 . 2 . . . A 2 LEU HD13 . 19396 1
13 . 1 1 2 2 LEU HD21 H 1 0.925 0.010 . 2 . . . A 2 LEU HD21 . 19396 1
14 . 1 1 2 2 LEU HD22 H 1 0.925 0.010 . 2 . . . A 2 LEU HD22 . 19396 1
15 . 1 1 2 2 LEU HD23 H 1 0.925 0.010 . 2 . . . A 2 LEU HD23 . 19396 1
16 . 1 1 2 2 LEU CA C 13 53.404 0.050 . 1 . . . A 2 LEU CA . 19396 1
17 . 1 1 2 2 LEU CB C 13 42.567 0.050 . 1 . . . A 2 LEU CB . 19396 1
18 . 1 1 2 2 LEU CG C 13 27.075 0.050 . 1 . . . A 2 LEU CG . 19396 1
19 . 1 1 2 2 LEU CD1 C 13 23.433 0.050 . 1 . . . A 2 LEU CD1 . 19396 1
20 . 1 1 2 2 LEU CD2 C 13 25.369 0.050 . 1 . . . A 2 LEU CD2 . 19396 1
21 . 1 1 2 2 LEU N N 15 122.568 0.050 . 1 . . . A 2 LEU N . 19396 1
22 . 1 1 3 3 PRO HA H 1 4.500 0.003 . 1 . . . A 3 PRO HA . 19396 1
23 . 1 1 3 3 PRO HB2 H 1 1.910 0.002 . 1 . . . A 3 PRO HB2 . 19396 1
24 . 1 1 3 3 PRO HB3 H 1 2.466 0.003 . 1 . . . A 3 PRO HB3 . 19396 1
25 . 1 1 3 3 PRO HG2 H 1 2.117 0.002 . 2 . . . A 3 PRO HG2 . 19396 1
26 . 1 1 3 3 PRO HG3 H 1 2.117 0.002 . 2 . . . A 3 PRO HG3 . 19396 1
27 . 1 1 3 3 PRO HD2 H 1 3.555 0.010 . 1 . . . A 3 PRO HD2 . 19396 1
28 . 1 1 3 3 PRO HD3 H 1 4.012 0.010 . 1 . . . A 3 PRO HD3 . 19396 1
29 . 1 1 3 3 PRO C C 13 177.335 0.050 . 1 . . . A 3 PRO C . 19396 1
30 . 1 1 3 3 PRO CA C 13 62.864 0.050 . 1 . . . A 3 PRO CA . 19396 1
31 . 1 1 3 3 PRO CB C 13 32.406 0.053 . 1 . . . A 3 PRO CB . 19396 1
32 . 1 1 3 3 PRO CG C 13 27.845 0.049 . 1 . . . A 3 PRO CG . 19396 1
33 . 1 1 3 3 PRO CD C 13 50.798 0.005 . 1 . . . A 3 PRO CD . 19396 1
34 . 1 1 4 4 ARG H H 1 8.721 0.002 . 1 . . . A 4 ARG H . 19396 1
35 . 1 1 4 4 ARG HA H 1 3.994 0.001 . 1 . . . A 4 ARG HA . 19396 1
36 . 1 1 4 4 ARG HB2 H 1 1.933 0.004 . 1 . . . A 4 ARG HB2 . 19396 1
37 . 1 1 4 4 ARG HB3 H 1 1.826 0.003 . 1 . . . A 4 ARG HB3 . 19396 1
38 . 1 1 4 4 ARG HG2 H 1 1.692 0.010 . 2 . . . A 4 ARG HG2 . 19396 1
39 . 1 1 4 4 ARG HG3 H 1 1.692 0.010 . 2 . . . A 4 ARG HG3 . 19396 1
40 . 1 1 4 4 ARG HD2 H 1 3.207 0.001 . 2 . . . A 4 ARG HD2 . 19396 1
41 . 1 1 4 4 ARG HD3 H 1 3.207 0.001 . 2 . . . A 4 ARG HD3 . 19396 1
42 . 1 1 4 4 ARG HE H 1 7.268 0.004 . 1 . . . A 4 ARG HE . 19396 1
43 . 1 1 4 4 ARG CA C 13 59.115 0.050 . 1 . . . A 4 ARG CA . 19396 1
44 . 1 1 4 4 ARG CB C 13 30.298 0.004 . 1 . . . A 4 ARG CB . 19396 1
45 . 1 1 4 4 ARG CD C 13 43.379 0.050 . 1 . . . A 4 ARG CD . 19396 1
46 . 1 1 4 4 ARG N N 15 124.305 0.050 . 1 . . . A 4 ARG N . 19396 1
47 . 1 1 4 4 ARG NE N 15 78.160 0.050 . 1 . . . A 4 ARG NE . 19396 1
48 . 1 1 5 5 LYS H H 1 8.686 0.003 . 1 . . . A 5 LYS H . 19396 1
49 . 1 1 5 5 LYS HA H 1 4.048 0.003 . 1 . . . A 5 LYS HA . 19396 1
50 . 1 1 5 5 LYS HB2 H 1 1.865 0.010 . 1 . . . A 5 LYS HB2 . 19396 1
51 . 1 1 5 5 LYS HB3 H 1 1.762 0.003 . 1 . . . A 5 LYS HB3 . 19396 1
52 . 1 1 5 5 LYS HG2 H 1 1.481 0.010 . 2 . . . A 5 LYS HG2 . 19396 1
53 . 1 1 5 5 LYS HG3 H 1 1.481 0.010 . 2 . . . A 5 LYS HG3 . 19396 1
54 . 1 1 5 5 LYS HD2 H 1 1.692 0.010 . 2 . . . A 5 LYS HD2 . 19396 1
55 . 1 1 5 5 LYS HD3 H 1 1.692 0.010 . 2 . . . A 5 LYS HD3 . 19396 1
56 . 1 1 5 5 LYS HE2 H 1 2.984 0.010 . 2 . . . A 5 LYS HE2 . 19396 1
57 . 1 1 5 5 LYS HE3 H 1 2.984 0.010 . 2 . . . A 5 LYS HE3 . 19396 1
58 . 1 1 5 5 LYS C C 13 178.657 0.050 . 1 . . . A 5 LYS C . 19396 1
59 . 1 1 5 5 LYS CA C 13 59.163 0.050 . 1 . . . A 5 LYS CA . 19396 1
60 . 1 1 5 5 LYS CB C 13 32.635 0.020 . 1 . . . A 5 LYS CB . 19396 1
61 . 1 1 5 5 LYS N N 15 117.116 0.050 . 1 . . . A 5 LYS N . 19396 1
62 . 1 1 6 6 ILE H H 1 7.364 0.005 . 1 . . . A 6 ILE H . 19396 1
63 . 1 1 6 6 ILE HA H 1 4.007 0.001 . 1 . . . A 6 ILE HA . 19396 1
64 . 1 1 6 6 ILE HB H 1 1.940 0.010 . 1 . . . A 6 ILE HB . 19396 1
65 . 1 1 6 6 ILE HG12 H 1 1.577 0.010 . 1 . . . A 6 ILE HG12 . 19396 1
66 . 1 1 6 6 ILE HG13 H 1 1.291 0.010 . 1 . . . A 6 ILE HG13 . 19396 1
67 . 1 1 6 6 ILE HG21 H 1 0.991 0.010 . 1 . . . A 6 ILE HG21 . 19396 1
68 . 1 1 6 6 ILE HG22 H 1 0.991 0.010 . 1 . . . A 6 ILE HG22 . 19396 1
69 . 1 1 6 6 ILE HG23 H 1 0.991 0.010 . 1 . . . A 6 ILE HG23 . 19396 1
70 . 1 1 6 6 ILE HD11 H 1 0.861 0.001 . 1 . . . A 6 ILE HD11 . 19396 1
71 . 1 1 6 6 ILE HD12 H 1 0.861 0.001 . 1 . . . A 6 ILE HD12 . 19396 1
72 . 1 1 6 6 ILE HD13 H 1 0.861 0.001 . 1 . . . A 6 ILE HD13 . 19396 1
73 . 1 1 6 6 ILE C C 13 180.162 0.050 . 1 . . . A 6 ILE C . 19396 1
74 . 1 1 6 6 ILE CA C 13 62.758 0.026 . 1 . . . A 6 ILE CA . 19396 1
75 . 1 1 6 6 ILE CB C 13 37.885 0.018 . 1 . . . A 6 ILE CB . 19396 1
76 . 1 1 6 6 ILE CG1 C 13 28.113 0.002 . 1 . . . A 6 ILE CG1 . 19396 1
77 . 1 1 6 6 ILE CG2 C 13 17.706 0.050 . 1 . . . A 6 ILE CG2 . 19396 1
78 . 1 1 6 6 ILE CD1 C 13 11.635 0.050 . 1 . . . A 6 ILE CD1 . 19396 1
79 . 1 1 6 6 ILE N N 15 119.465 0.050 . 1 . . . A 6 ILE N . 19396 1
80 . 1 1 7 7 LEU H H 1 8.080 0.003 . 1 . . . A 7 LEU H . 19396 1
81 . 1 1 7 7 LEU HA H 1 4.038 0.002 . 1 . . . A 7 LEU HA . 19396 1
82 . 1 1 7 7 LEU HB2 H 1 1.688 0.010 . 2 . . . A 7 LEU HB2 . 19396 1
83 . 1 1 7 7 LEU HB3 H 1 1.688 0.010 . 2 . . . A 7 LEU HB3 . 19396 1
84 . 1 1 7 7 LEU HG H 1 1.585 0.010 . 1 . . . A 7 LEU HG . 19396 1
85 . 1 1 7 7 LEU HD11 H 1 0.914 0.010 . 2 . . . A 7 LEU HD11 . 19396 1
86 . 1 1 7 7 LEU HD12 H 1 0.914 0.010 . 2 . . . A 7 LEU HD12 . 19396 1
87 . 1 1 7 7 LEU HD13 H 1 0.914 0.010 . 2 . . . A 7 LEU HD13 . 19396 1
88 . 1 1 7 7 LEU HD21 H 1 0.882 0.010 . 2 . . . A 7 LEU HD21 . 19396 1
89 . 1 1 7 7 LEU HD22 H 1 0.882 0.010 . 2 . . . A 7 LEU HD22 . 19396 1
90 . 1 1 7 7 LEU HD23 H 1 0.882 0.010 . 2 . . . A 7 LEU HD23 . 19396 1
91 . 1 1 7 7 LEU C C 13 179.647 0.050 . 1 . . . A 7 LEU C . 19396 1
92 . 1 1 7 7 LEU CA C 13 58.045 0.050 . 1 . . . A 7 LEU CA . 19396 1
93 . 1 1 7 7 LEU CB C 13 42.252 0.050 . 1 . . . A 7 LEU CB . 19396 1
94 . 1 1 7 7 LEU CG C 13 26.855 0.050 . 1 . . . A 7 LEU CG . 19396 1
95 . 1 1 7 7 LEU CD1 C 13 24.948 0.050 . 1 . . . A 7 LEU CD1 . 19396 1
96 . 1 1 7 7 LEU CD2 C 13 23.283 0.050 . 1 . . . A 7 LEU CD2 . 19396 1
97 . 1 1 7 7 LEU N N 15 121.958 0.050 . 1 . . . A 7 LEU N . 19396 1
98 . 1 1 8 8 CYS H H 1 8.730 0.002 . 1 . . . A 8 CYS H . 19396 1
99 . 1 1 8 8 CYS HA H 1 4.548 0.010 . 1 . . . A 8 CYS HA . 19396 1
100 . 1 1 8 8 CYS HB2 H 1 3.051 0.010 . 1 . . . A 8 CYS HB2 . 19396 1
101 . 1 1 8 8 CYS HB3 H 1 2.865 0.001 . 1 . . . A 8 CYS HB3 . 19396 1
102 . 1 1 8 8 CYS CB C 13 36.142 0.050 . 1 . . . A 8 CYS CB . 19396 1
103 . 1 1 8 8 CYS N N 15 115.638 0.050 . 1 . . . A 8 CYS N . 19396 1
104 . 1 1 9 9 ALA H H 1 7.736 0.002 . 1 . . . A 9 ALA H . 19396 1
105 . 1 1 9 9 ALA HA H 1 4.184 0.009 . 1 . . . A 9 ALA HA . 19396 1
106 . 1 1 9 9 ALA HB1 H 1 1.567 0.010 . 1 . . . A 9 ALA HB1 . 19396 1
107 . 1 1 9 9 ALA HB2 H 1 1.567 0.010 . 1 . . . A 9 ALA HB2 . 19396 1
108 . 1 1 9 9 ALA HB3 H 1 1.567 0.010 . 1 . . . A 9 ALA HB3 . 19396 1
109 . 1 1 9 9 ALA C C 13 180.836 0.016 . 1 . . . A 9 ALA C . 19396 1
110 . 1 1 9 9 ALA CA C 13 55.477 0.014 . 1 . . . A 9 ALA CA . 19396 1
111 . 1 1 9 9 ALA CB C 13 18.171 0.003 . 1 . . . A 9 ALA CB . 19396 1
112 . 1 1 9 9 ALA N N 15 124.009 0.050 . 1 . . . A 9 ALA N . 19396 1
113 . 1 1 10 10 ILE H H 1 8.101 0.003 . 1 . . . A 10 ILE H . 19396 1
114 . 1 1 10 10 ILE HA H 1 3.739 0.010 . 1 . . . A 10 ILE HA . 19396 1
115 . 1 1 10 10 ILE HB H 1 1.919 0.001 . 1 . . . A 10 ILE HB . 19396 1
116 . 1 1 10 10 ILE HG12 H 1 1.753 0.010 . 1 . . . A 10 ILE HG12 . 19396 1
117 . 1 1 10 10 ILE HG13 H 1 1.138 0.010 . 1 . . . A 10 ILE HG13 . 19396 1
118 . 1 1 10 10 ILE HG21 H 1 0.899 0.001 . 1 . . . A 10 ILE HG21 . 19396 1
119 . 1 1 10 10 ILE HG22 H 1 0.899 0.001 . 1 . . . A 10 ILE HG22 . 19396 1
120 . 1 1 10 10 ILE HG23 H 1 0.899 0.001 . 1 . . . A 10 ILE HG23 . 19396 1
121 . 1 1 10 10 ILE HD11 H 1 0.845 0.001 . 1 . . . A 10 ILE HD11 . 19396 1
122 . 1 1 10 10 ILE HD12 H 1 0.845 0.001 . 1 . . . A 10 ILE HD12 . 19396 1
123 . 1 1 10 10 ILE HD13 H 1 0.845 0.001 . 1 . . . A 10 ILE HD13 . 19396 1
124 . 1 1 10 10 ILE C C 13 177.596 0.050 . 1 . . . A 10 ILE C . 19396 1
125 . 1 1 10 10 ILE CA C 13 64.534 0.004 . 1 . . . A 10 ILE CA . 19396 1
126 . 1 1 10 10 ILE CB C 13 38.223 0.032 . 1 . . . A 10 ILE CB . 19396 1
127 . 1 1 10 10 ILE CG1 C 13 28.768 0.034 . 1 . . . A 10 ILE CG1 . 19396 1
128 . 1 1 10 10 ILE CG2 C 13 17.332 0.050 . 1 . . . A 10 ILE CG2 . 19396 1
129 . 1 1 10 10 ILE CD1 C 13 13.537 0.050 . 1 . . . A 10 ILE CD1 . 19396 1
130 . 1 1 10 10 ILE N N 15 119.305 0.050 . 1 . . . A 10 ILE N . 19396 1
131 . 1 1 11 11 ALA H H 1 7.999 0.004 . 1 . . . A 11 ALA H . 19396 1
132 . 1 1 11 11 ALA HA H 1 3.942 0.001 . 1 . . . A 11 ALA HA . 19396 1
133 . 1 1 11 11 ALA HB1 H 1 1.382 0.010 . 1 . . . A 11 ALA HB1 . 19396 1
134 . 1 1 11 11 ALA HB2 H 1 1.382 0.010 . 1 . . . A 11 ALA HB2 . 19396 1
135 . 1 1 11 11 ALA HB3 H 1 1.382 0.010 . 1 . . . A 11 ALA HB3 . 19396 1
136 . 1 1 11 11 ALA C C 13 179.663 0.011 . 1 . . . A 11 ALA C . 19396 1
137 . 1 1 11 11 ALA CA C 13 55.290 0.019 . 1 . . . A 11 ALA CA . 19396 1
138 . 1 1 11 11 ALA CB C 13 18.434 0.018 . 1 . . . A 11 ALA CB . 19396 1
139 . 1 1 11 11 ALA N N 15 121.508 0.050 . 1 . . . A 11 ALA N . 19396 1
140 . 1 1 12 12 LYS H H 1 8.058 0.002 . 1 . . . A 12 LYS H . 19396 1
141 . 1 1 12 12 LYS HA H 1 4.059 0.001 . 1 . . . A 12 LYS HA . 19396 1
142 . 1 1 12 12 LYS HB2 H 1 1.976 0.005 . 1 . . . A 12 LYS HB2 . 19396 1
143 . 1 1 12 12 LYS HB3 H 1 1.862 0.010 . 1 . . . A 12 LYS HB3 . 19396 1
144 . 1 1 12 12 LYS HG2 H 1 1.499 0.010 . 2 . . . A 12 LYS HG2 . 19396 1
145 . 1 1 12 12 LYS HG3 H 1 1.499 0.010 . 2 . . . A 12 LYS HG3 . 19396 1
146 . 1 1 12 12 LYS HD2 H 1 1.634 0.010 . 2 . . . A 12 LYS HD2 . 19396 1
147 . 1 1 12 12 LYS HD3 H 1 1.634 0.010 . 2 . . . A 12 LYS HD3 . 19396 1
148 . 1 1 12 12 LYS HE2 H 1 2.986 0.010 . 2 . . . A 12 LYS HE2 . 19396 1
149 . 1 1 12 12 LYS HE3 H 1 2.986 0.010 . 2 . . . A 12 LYS HE3 . 19396 1
150 . 1 1 12 12 LYS CA C 13 59.187 0.050 . 1 . . . A 12 LYS CA . 19396 1
151 . 1 1 12 12 LYS CB C 13 32.600 0.050 . 1 . . . A 12 LYS CB . 19396 1
152 . 1 1 12 12 LYS N N 15 115.687 0.050 . 1 . . . A 12 LYS N . 19396 1
153 . 1 1 13 13 LYS H H 1 7.826 0.006 . 1 . . . A 13 LYS H . 19396 1
154 . 1 1 13 13 LYS HA H 1 4.143 0.003 . 1 . . . A 13 LYS HA . 19396 1
155 . 1 1 13 13 LYS HB2 H 1 1.981 0.010 . 2 . . . A 13 LYS HB2 . 19396 1
156 . 1 1 13 13 LYS HB3 H 1 1.981 0.010 . 2 . . . A 13 LYS HB3 . 19396 1
157 . 1 1 13 13 LYS HG2 H 1 1.569 0.010 . 1 . . . A 13 LYS HG2 . 19396 1
158 . 1 1 13 13 LYS HG3 H 1 1.514 0.010 . 1 . . . A 13 LYS HG3 . 19396 1
159 . 1 1 13 13 LYS HD2 H 1 1.702 0.010 . 2 . . . A 13 LYS HD2 . 19396 1
160 . 1 1 13 13 LYS HD3 H 1 1.702 0.010 . 2 . . . A 13 LYS HD3 . 19396 1
161 . 1 1 13 13 LYS HE2 H 1 2.989 0.010 . 2 . . . A 13 LYS HE2 . 19396 1
162 . 1 1 13 13 LYS HE3 H 1 2.989 0.010 . 2 . . . A 13 LYS HE3 . 19396 1
163 . 1 1 13 13 LYS C C 13 178.141 0.050 . 1 . . . A 13 LYS C . 19396 1
164 . 1 1 13 13 LYS CA C 13 58.685 0.088 . 1 . . . A 13 LYS CA . 19396 1
165 . 1 1 13 13 LYS CB C 13 32.600 0.050 . 1 . . . A 13 LYS CB . 19396 1
166 . 1 1 13 13 LYS N N 15 120.587 0.050 . 1 . . . A 13 LYS N . 19396 1
167 . 1 1 14 14 LYS H H 1 8.025 0.002 . 1 . . . A 14 LYS H . 19396 1
168 . 1 1 14 14 LYS HA H 1 4.288 0.003 . 1 . . . A 14 LYS HA . 19396 1
169 . 1 1 14 14 LYS HB2 H 1 1.955 0.010 . 1 . . . A 14 LYS HB2 . 19396 1
170 . 1 1 14 14 LYS HB3 H 1 1.762 0.010 . 1 . . . A 14 LYS HB3 . 19396 1
171 . 1 1 14 14 LYS HG2 H 1 1.464 0.010 . 2 . . . A 14 LYS HG2 . 19396 1
172 . 1 1 14 14 LYS HG3 H 1 1.464 0.010 . 2 . . . A 14 LYS HG3 . 19396 1
173 . 1 1 14 14 LYS HD2 H 1 1.617 0.010 . 1 . . . A 14 LYS HD2 . 19396 1
174 . 1 1 14 14 LYS HD3 H 1 1.591 0.010 . 1 . . . A 14 LYS HD3 . 19396 1
175 . 1 1 14 14 LYS HE2 H 1 2.940 0.010 . 2 . . . A 14 LYS HE2 . 19396 1
176 . 1 1 14 14 LYS HE3 H 1 2.940 0.010 . 2 . . . A 14 LYS HE3 . 19396 1
177 . 1 1 14 14 LYS CA C 13 56.651 0.018 . 1 . . . A 14 LYS CA . 19396 1
178 . 1 1 14 14 LYS CB C 13 32.979 0.005 . 1 . . . A 14 LYS CB . 19396 1
179 . 1 1 14 14 LYS N N 15 116.430 0.050 . 1 . . . A 14 LYS N . 19396 1
180 . 1 1 15 15 GLY H H 1 7.885 0.002 . 1 . . . A 15 GLY H . 19396 1
181 . 1 1 15 15 GLY HA2 H 1 3.954 0.004 . 1 . . . A 15 GLY HA2 . 19396 1
182 . 1 1 15 15 GLY HA3 H 1 4.080 0.002 . 1 . . . A 15 GLY HA3 . 19396 1
183 . 1 1 15 15 GLY C C 13 174.966 0.014 . 1 . . . A 15 GLY C . 19396 1
184 . 1 1 15 15 GLY CA C 13 46.409 0.010 . 1 . . . A 15 GLY CA . 19396 1
185 . 1 1 15 15 GLY N N 15 108.661 0.050 . 1 . . . A 15 GLY N . 19396 1
186 . 1 1 16 16 LYS H H 1 8.299 0.004 . 1 . . . A 16 LYS H . 19396 1
187 . 1 1 16 16 LYS HA H 1 4.407 0.004 . 1 . . . A 16 LYS HA . 19396 1
188 . 1 1 16 16 LYS HB2 H 1 2.032 0.010 . 1 . . . A 16 LYS HB2 . 19396 1
189 . 1 1 16 16 LYS HB3 H 1 1.599 0.010 . 1 . . . A 16 LYS HB3 . 19396 1
190 . 1 1 16 16 LYS HG2 H 1 1.382 0.003 . 1 . . . A 16 LYS HG2 . 19396 1
191 . 1 1 16 16 LYS HG3 H 1 1.268 0.002 . 1 . . . A 16 LYS HG3 . 19396 1
192 . 1 1 16 16 LYS HD2 H 1 1.618 0.010 . 2 . . . A 16 LYS HD2 . 19396 1
193 . 1 1 16 16 LYS HD3 H 1 1.618 0.010 . 2 . . . A 16 LYS HD3 . 19396 1
194 . 1 1 16 16 LYS HE2 H 1 2.978 0.010 . 2 . . . A 16 LYS HE2 . 19396 1
195 . 1 1 16 16 LYS HE3 H 1 2.978 0.010 . 2 . . . A 16 LYS HE3 . 19396 1
196 . 1 1 16 16 LYS C C 13 175.840 0.050 . 1 . . . A 16 LYS C . 19396 1
197 . 1 1 16 16 LYS CA C 13 54.744 0.050 . 1 . . . A 16 LYS CA . 19396 1
198 . 1 1 16 16 LYS CB C 13 32.897 0.002 . 1 . . . A 16 LYS CB . 19396 1
199 . 1 1 16 16 LYS CG C 13 24.631 0.001 . 1 . . . A 16 LYS CG . 19396 1
200 . 1 1 16 16 LYS N N 15 117.160 0.050 . 1 . . . A 16 LYS N . 19396 1
201 . 1 1 17 17 CYS H H 1 8.691 0.003 . 1 . . . A 17 CYS H . 19396 1
202 . 1 1 17 17 CYS HA H 1 4.331 0.002 . 1 . . . A 17 CYS HA . 19396 1
203 . 1 1 17 17 CYS HB2 H 1 3.443 0.002 . 1 . . . A 17 CYS HB2 . 19396 1
204 . 1 1 17 17 CYS HB3 H 1 2.642 0.002 . 1 . . . A 17 CYS HB3 . 19396 1
205 . 1 1 17 17 CYS C C 13 172.022 0.003 . 1 . . . A 17 CYS C . 19396 1
206 . 1 1 17 17 CYS CA C 13 56.795 0.050 . 1 . . . A 17 CYS CA . 19396 1
207 . 1 1 17 17 CYS CB C 13 39.930 0.018 . 1 . . . A 17 CYS CB . 19396 1
208 . 1 1 17 17 CYS N N 15 123.378 0.050 . 1 . . . A 17 CYS N . 19396 1
209 . 1 1 18 18 LYS H H 1 7.708 0.003 . 1 . . . A 18 LYS H . 19396 1
210 . 1 1 18 18 LYS HA H 1 4.538 0.001 . 1 . . . A 18 LYS HA . 19396 1
211 . 1 1 18 18 LYS HB2 H 1 1.902 0.010 . 1 . . . A 18 LYS HB2 . 19396 1
212 . 1 1 18 18 LYS HB3 H 1 1.687 0.010 . 1 . . . A 18 LYS HB3 . 19396 1
213 . 1 1 18 18 LYS HG2 H 1 1.244 0.010 . 2 . . . A 18 LYS HG2 . 19396 1
214 . 1 1 18 18 LYS HG3 H 1 1.244 0.010 . 2 . . . A 18 LYS HG3 . 19396 1
215 . 1 1 18 18 LYS HD2 H 1 1.668 0.010 . 2 . . . A 18 LYS HD2 . 19396 1
216 . 1 1 18 18 LYS HD3 H 1 1.668 0.010 . 2 . . . A 18 LYS HD3 . 19396 1
217 . 1 1 18 18 LYS HE2 H 1 2.963 0.010 . 2 . . . A 18 LYS HE2 . 19396 1
218 . 1 1 18 18 LYS HE3 H 1 2.963 0.010 . 2 . . . A 18 LYS HE3 . 19396 1
219 . 1 1 18 18 LYS CB C 13 35.840 0.004 . 1 . . . A 18 LYS CB . 19396 1
220 . 1 1 18 18 LYS CG C 13 24.164 0.050 . 1 . . . A 18 LYS CG . 19396 1
221 . 1 1 18 18 LYS N N 15 121.370 0.050 . 1 . . . A 18 LYS N . 19396 1
222 . 1 1 19 19 GLY H H 1 9.036 0.001 . 1 . . . A 19 GLY H . 19396 1
223 . 1 1 19 19 GLY HA2 H 1 4.263 0.010 . 1 . . . A 19 GLY HA2 . 19396 1
224 . 1 1 19 19 GLY HA3 H 1 3.802 0.002 . 1 . . . A 19 GLY HA3 . 19396 1
225 . 1 1 19 19 GLY C C 13 174.356 0.050 . 1 . . . A 19 GLY C . 19396 1
226 . 1 1 19 19 GLY CA C 13 45.353 0.020 . 1 . . . A 19 GLY CA . 19396 1
227 . 1 1 19 19 GLY N N 15 111.141 0.050 . 1 . . . A 19 GLY N . 19396 1
228 . 1 1 20 20 PRO HA H 1 4.371 0.010 . 1 . . . A 20 PRO HA . 19396 1
229 . 1 1 20 20 PRO HB2 H 1 1.990 0.001 . 1 . . . A 20 PRO HB2 . 19396 1
230 . 1 1 20 20 PRO HB3 H 1 2.471 0.001 . 1 . . . A 20 PRO HB3 . 19396 1
231 . 1 1 20 20 PRO HG2 H 1 2.120 0.010 . 1 . . . A 20 PRO HG2 . 19396 1
232 . 1 1 20 20 PRO HG3 H 1 2.097 0.010 . 1 . . . A 20 PRO HG3 . 19396 1
233 . 1 1 20 20 PRO HD2 H 1 3.999 0.010 . 1 . . . A 20 PRO HD2 . 19396 1
234 . 1 1 20 20 PRO HD3 H 1 3.794 0.001 . 1 . . . A 20 PRO HD3 . 19396 1
235 . 1 1 20 20 PRO C C 13 178.505 0.017 . 1 . . . A 20 PRO C . 19396 1
236 . 1 1 20 20 PRO CA C 13 64.938 0.050 . 1 . . . A 20 PRO CA . 19396 1
237 . 1 1 20 20 PRO CB C 13 32.256 0.050 . 1 . . . A 20 PRO CB . 19396 1
238 . 1 1 20 20 PRO CG C 13 27.398 0.036 . 1 . . . A 20 PRO CG . 19396 1
239 . 1 1 20 20 PRO CD C 13 50.939 0.008 . 1 . . . A 20 PRO CD . 19396 1
240 . 1 1 21 21 LEU H H 1 7.625 0.002 . 1 . . . A 21 LEU H . 19396 1
241 . 1 1 21 21 LEU HA H 1 4.154 0.003 . 1 . . . A 21 LEU HA . 19396 1
242 . 1 1 21 21 LEU HB2 H 1 1.590 0.010 . 1 . . . A 21 LEU HB2 . 19396 1
243 . 1 1 21 21 LEU HB3 H 1 1.846 0.010 . 1 . . . A 21 LEU HB3 . 19396 1
244 . 1 1 21 21 LEU HG H 1 1.779 0.010 . 1 . . . A 21 LEU HG . 19396 1
245 . 1 1 21 21 LEU HD11 H 1 0.969 0.010 . 2 . . . A 21 LEU HD11 . 19396 1
246 . 1 1 21 21 LEU HD12 H 1 0.969 0.010 . 2 . . . A 21 LEU HD12 . 19396 1
247 . 1 1 21 21 LEU HD13 H 1 0.969 0.010 . 2 . . . A 21 LEU HD13 . 19396 1
248 . 1 1 21 21 LEU HD21 H 1 0.870 0.010 . 2 . . . A 21 LEU HD21 . 19396 1
249 . 1 1 21 21 LEU HD22 H 1 0.870 0.010 . 2 . . . A 21 LEU HD22 . 19396 1
250 . 1 1 21 21 LEU HD23 H 1 0.870 0.010 . 2 . . . A 21 LEU HD23 . 19396 1
251 . 1 1 21 21 LEU CA C 13 56.895 0.055 . 1 . . . A 21 LEU CA . 19396 1
252 . 1 1 21 21 LEU CB C 13 41.972 0.013 . 1 . . . A 21 LEU CB . 19396 1
253 . 1 1 21 21 LEU CG C 13 27.772 0.050 . 1 . . . A 21 LEU CG . 19396 1
254 . 1 1 21 21 LEU CD1 C 13 25.296 0.050 . 1 . . . A 21 LEU CD1 . 19396 1
255 . 1 1 21 21 LEU CD2 C 13 23.951 0.050 . 1 . . . A 21 LEU CD2 . 19396 1
256 . 1 1 21 21 LEU N N 15 116.727 0.050 . 1 . . . A 21 LEU N . 19396 1
257 . 1 1 22 22 LYS H H 1 7.583 0.003 . 1 . . . A 22 LYS H . 19396 1
258 . 1 1 22 22 LYS HA H 1 4.063 0.002 . 1 . . . A 22 LYS HA . 19396 1
259 . 1 1 22 22 LYS HB2 H 1 1.626 0.010 . 1 . . . A 22 LYS HB2 . 19396 1
260 . 1 1 22 22 LYS HB3 H 1 1.893 0.010 . 1 . . . A 22 LYS HB3 . 19396 1
261 . 1 1 22 22 LYS HG2 H 1 1.307 0.001 . 2 . . . A 22 LYS HG2 . 19396 1
262 . 1 1 22 22 LYS HG3 H 1 1.307 0.001 . 2 . . . A 22 LYS HG3 . 19396 1
263 . 1 1 22 22 LYS HD2 H 1 1.476 0.010 . 2 . . . A 22 LYS HD2 . 19396 1
264 . 1 1 22 22 LYS HD3 H 1 1.476 0.010 . 2 . . . A 22 LYS HD3 . 19396 1
265 . 1 1 22 22 LYS HE2 H 1 3.038 0.010 . 2 . . . A 22 LYS HE2 . 19396 1
266 . 1 1 22 22 LYS HE3 H 1 3.038 0.010 . 2 . . . A 22 LYS HE3 . 19396 1
267 . 1 1 22 22 LYS CA C 13 59.719 0.050 . 1 . . . A 22 LYS CA . 19396 1
268 . 1 1 22 22 LYS CB C 13 32.167 0.010 . 1 . . . A 22 LYS CB . 19396 1
269 . 1 1 22 22 LYS CG C 13 25.049 0.050 . 1 . . . A 22 LYS CG . 19396 1
270 . 1 1 22 22 LYS N N 15 118.668 0.050 . 1 . . . A 22 LYS N . 19396 1
271 . 1 1 23 23 LEU H H 1 7.330 0.003 . 1 . . . A 23 LEU H . 19396 1
272 . 1 1 23 23 LEU HA H 1 4.270 0.001 . 1 . . . A 23 LEU HA . 19396 1
273 . 1 1 23 23 LEU HB2 H 1 1.829 0.010 . 1 . . . A 23 LEU HB2 . 19396 1
274 . 1 1 23 23 LEU HB3 H 1 1.677 0.010 . 1 . . . A 23 LEU HB3 . 19396 1
275 . 1 1 23 23 LEU HG H 1 1.670 0.010 . 1 . . . A 23 LEU HG . 19396 1
276 . 1 1 23 23 LEU HD11 H 1 0.949 0.010 . 2 . . . A 23 LEU HD11 . 19396 1
277 . 1 1 23 23 LEU HD12 H 1 0.949 0.010 . 2 . . . A 23 LEU HD12 . 19396 1
278 . 1 1 23 23 LEU HD13 H 1 0.949 0.010 . 2 . . . A 23 LEU HD13 . 19396 1
279 . 1 1 23 23 LEU HD21 H 1 0.880 0.010 . 2 . . . A 23 LEU HD21 . 19396 1
280 . 1 1 23 23 LEU HD22 H 1 0.880 0.010 . 2 . . . A 23 LEU HD22 . 19396 1
281 . 1 1 23 23 LEU HD23 H 1 0.880 0.010 . 2 . . . A 23 LEU HD23 . 19396 1
282 . 1 1 23 23 LEU CA C 13 56.820 0.016 . 1 . . . A 23 LEU CA . 19396 1
283 . 1 1 23 23 LEU CB C 13 41.944 0.007 . 1 . . . A 23 LEU CB . 19396 1
284 . 1 1 23 23 LEU CG C 13 27.421 0.050 . 1 . . . A 23 LEU CG . 19396 1
285 . 1 1 23 23 LEU CD1 C 13 24.828 0.050 . 1 . . . A 23 LEU CD1 . 19396 1
286 . 1 1 23 23 LEU CD2 C 13 24.503 0.050 . 1 . . . A 23 LEU CD2 . 19396 1
287 . 1 1 23 23 LEU N N 15 116.195 0.050 . 1 . . . A 23 LEU N . 19396 1
288 . 1 1 24 24 VAL H H 1 7.326 0.002 . 1 . . . A 24 VAL H . 19396 1
289 . 1 1 24 24 VAL HA H 1 3.982 0.010 . 1 . . . A 24 VAL HA . 19396 1
290 . 1 1 24 24 VAL HB H 1 2.086 0.010 . 1 . . . A 24 VAL HB . 19396 1
291 . 1 1 24 24 VAL HG11 H 1 0.926 0.003 . 2 . . . A 24 VAL HG11 . 19396 1
292 . 1 1 24 24 VAL HG12 H 1 0.926 0.003 . 2 . . . A 24 VAL HG12 . 19396 1
293 . 1 1 24 24 VAL HG13 H 1 0.926 0.003 . 2 . . . A 24 VAL HG13 . 19396 1
294 . 1 1 24 24 VAL HG21 H 1 1.039 0.010 . 2 . . . A 24 VAL HG21 . 19396 1
295 . 1 1 24 24 VAL HG22 H 1 1.039 0.010 . 2 . . . A 24 VAL HG22 . 19396 1
296 . 1 1 24 24 VAL HG23 H 1 1.039 0.010 . 2 . . . A 24 VAL HG23 . 19396 1
297 . 1 1 24 24 VAL CA C 13 64.319 0.043 . 1 . . . A 24 VAL CA . 19396 1
298 . 1 1 24 24 VAL CB C 13 33.258 0.025 . 1 . . . A 24 VAL CB . 19396 1
299 . 1 1 24 24 VAL CG1 C 13 21.340 0.050 . 1 . . . A 24 VAL CG1 . 19396 1
300 . 1 1 24 24 VAL CG2 C 13 20.995 0.050 . 1 . . . A 24 VAL CG2 . 19396 1
301 . 1 1 24 24 VAL N N 15 115.225 0.050 . 1 . . . A 24 VAL N . 19396 1
302 . 1 1 25 25 CYS H H 1 8.258 0.003 . 1 . . . A 25 CYS H . 19396 1
303 . 1 1 25 25 CYS HA H 1 4.061 0.010 . 1 . . . A 25 CYS HA . 19396 1
304 . 1 1 25 25 CYS HB2 H 1 2.817 0.001 . 1 . . . A 25 CYS HB2 . 19396 1
305 . 1 1 25 25 CYS HB3 H 1 3.000 0.010 . 1 . . . A 25 CYS HB3 . 19396 1
306 . 1 1 25 25 CYS C C 13 174.297 0.002 . 1 . . . A 25 CYS C . 19396 1
307 . 1 1 25 25 CYS CB C 13 38.233 0.005 . 1 . . . A 25 CYS CB . 19396 1
308 . 1 1 25 25 CYS N N 15 115.376 0.050 . 1 . . . A 25 CYS N . 19396 1
309 . 1 1 26 26 LYS H H 1 7.978 0.002 . 1 . . . A 26 LYS H . 19396 1
310 . 1 1 26 26 LYS HA H 1 4.173 0.004 . 1 . . . A 26 LYS HA . 19396 1
311 . 1 1 26 26 LYS HB2 H 1 1.920 0.010 . 1 . . . A 26 LYS HB2 . 19396 1
312 . 1 1 26 26 LYS HB3 H 1 1.884 0.010 . 1 . . . A 26 LYS HB3 . 19396 1
313 . 1 1 26 26 LYS HG2 H 1 1.377 0.010 . 2 . . . A 26 LYS HG2 . 19396 1
314 . 1 1 26 26 LYS HG3 H 1 1.377 0.010 . 2 . . . A 26 LYS HG3 . 19396 1
315 . 1 1 26 26 LYS HD2 H 1 1.685 0.010 . 2 . . . A 26 LYS HD2 . 19396 1
316 . 1 1 26 26 LYS HD3 H 1 1.685 0.010 . 2 . . . A 26 LYS HD3 . 19396 1
317 . 1 1 26 26 LYS HE2 H 1 3.011 0.010 . 2 . . . A 26 LYS HE2 . 19396 1
318 . 1 1 26 26 LYS HE3 H 1 3.011 0.010 . 2 . . . A 26 LYS HE3 . 19396 1
319 . 1 1 26 26 LYS C C 13 175.125 0.032 . 1 . . . A 26 LYS C . 19396 1
320 . 1 1 26 26 LYS CA C 13 56.792 0.050 . 1 . . . A 26 LYS CA . 19396 1
321 . 1 1 26 26 LYS N N 15 119.613 0.050 . 1 . . . A 26 LYS N . 19396 1
322 . 1 1 27 27 CYS H H 1 7.697 0.002 . 1 . . . A 27 CYS H . 19396 1
323 . 1 1 27 27 CYS HA H 1 4.483 0.010 . 1 . . . A 27 CYS HA . 19396 1
324 . 1 1 27 27 CYS HB2 H 1 3.172 0.010 . 1 . . . A 27 CYS HB2 . 19396 1
325 . 1 1 27 27 CYS HB3 H 1 3.237 0.001 . 1 . . . A 27 CYS HB3 . 19396 1
326 . 1 1 27 27 CYS CB C 13 44.755 0.002 . 1 . . . A 27 CYS CB . 19396 1
327 . 1 1 27 27 CYS N N 15 121.591 0.050 . 1 . . . A 27 CYS N . 19396 1
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