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 26691
_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
2 '2D 1H-15N HSQC' . . . 26691 1
3 '2D 1H-13C HSQC aliphatic' . . . 26691 1
4 '3D CBCA(CO)NH' . . . 26691 1
5 '3D HNCO' . . . 26691 1
6 '3D HNHA' . . . 26691 1
7 '3D HNCACB' . . . 26691 1
8 '3D HCCH-TOCSY' . . . 26691 1
12 '2D 1H-13C HSQC aromatic' . . . 26691 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 3.972 0.000 . 2 . . . . -2 GLY HA . 26691 1
2 . 1 1 1 1 GLY HA3 H 1 3.972 0.000 . 2 . . . . -2 GLY HA . 26691 1
3 . 1 1 1 1 GLY CA C 13 43.514 0.000 . 1 . . . . -2 GLY CA . 26691 1
4 . 1 1 2 2 PRO HA H 1 4.455 0.002 . 1 . . . . -1 PRO HA . 26691 1
5 . 1 1 2 2 PRO HB2 H 1 2.258 0.003 . 1 . . . . -1 PRO HB2 . 26691 1
6 . 1 1 2 2 PRO HB3 H 1 1.84 0.005 . 1 . . . . -1 PRO HB3 . 26691 1
7 . 1 1 2 2 PRO HG2 H 1 1.994 0.003 . 1 . . . . -1 PRO HG2 . 26691 1
8 . 1 1 2 2 PRO HG3 H 1 1.921 0.003 . 1 . . . . -1 PRO HG3 . 26691 1
9 . 1 1 2 2 PRO HD2 H 1 3.558 0.002 . 2 . . . . -1 PRO HD . 26691 1
10 . 1 1 2 2 PRO HD3 H 1 3.558 0.002 . 2 . . . . -1 PRO HD . 26691 1
11 . 1 1 2 2 PRO CA C 13 63.062 0.024 . 1 . . . . -1 PRO CA . 26691 1
12 . 1 1 2 2 PRO CB C 13 32.19 0.104 . 1 . . . . -1 PRO CB . 26691 1
13 . 1 1 2 2 PRO CG C 13 26.959 0.087 . 1 . . . . -1 PRO CG . 26691 1
14 . 1 1 2 2 PRO CD C 13 49.744 0.043 . 1 . . . . -1 PRO CD . 26691 1
15 . 1 1 3 3 HIS HA H 1 4.421 0.003 . 1 . . . . 0 HIS HA . 26691 1
16 . 1 1 3 3 HIS HB2 H 1 2.696 0.003 . 1 . . . . 0 HIS HB2 . 26691 1
17 . 1 1 3 3 HIS HB3 H 1 2.56 0.005 . 1 . . . . 0 HIS HB3 . 26691 1
18 . 1 1 3 3 HIS CA C 13 56.01 0.000 . 1 . . . . 0 HIS CA . 26691 1
19 . 1 1 3 3 HIS CB C 13 42.175 0.019 . 1 . . . . 0 HIS CB . 26691 1
20 . 1 1 4 4 MET HA H 1 4.362 0.002 . 1 . . . . 1 MET HA . 26691 1
21 . 1 1 4 4 MET HB2 H 1 2.024 0.007 . 1 . . . . 1 MET HB2 . 26691 1
22 . 1 1 4 4 MET HB3 H 1 1.951 0.007 . 1 . . . . 1 MET HB3 . 26691 1
23 . 1 1 4 4 MET HG2 H 1 2.541 0.007 . 1 . . . . 1 MET HG2 . 26691 1
24 . 1 1 4 4 MET HG3 H 1 2.48 0.006 . 1 . . . . 1 MET HG3 . 26691 1
25 . 1 1 4 4 MET HE1 H 1 2.083 0.002 . 1 . . . . 1 MET HE . 26691 1
26 . 1 1 4 4 MET HE2 H 1 2.083 0.002 . 1 . . . . 1 MET HE . 26691 1
27 . 1 1 4 4 MET HE3 H 1 2.083 0.002 . 1 . . . . 1 MET HE . 26691 1
28 . 1 1 4 4 MET CA C 13 55.761 0.037 . 1 . . . . 1 MET CA . 26691 1
29 . 1 1 4 4 MET CB C 13 33.104 0.011 . 1 . . . . 1 MET CB . 26691 1
30 . 1 1 4 4 MET CG C 13 31.976 0.057 . 1 . . . . 1 MET CG . 26691 1
31 . 1 1 4 4 MET CE C 13 16.964 0.010 . 1 . . . . 1 MET CE . 26691 1
32 . 1 1 5 5 ALA H H 1 8.359 0.001 . 1 . . . . 2 ALA H . 26691 1
33 . 1 1 5 5 ALA HA H 1 4.329 0.004 . 1 . . . . 2 ALA HA . 26691 1
34 . 1 1 5 5 ALA HB1 H 1 1.365 0.003 . 1 . . . . 2 ALA HB . 26691 1
35 . 1 1 5 5 ALA HB2 H 1 1.365 0.003 . 1 . . . . 2 ALA HB . 26691 1
36 . 1 1 5 5 ALA HB3 H 1 1.365 0.003 . 1 . . . . 2 ALA HB . 26691 1
37 . 1 1 5 5 ALA CA C 13 52.775 0.052 . 1 . . . . 2 ALA CA . 26691 1
38 . 1 1 5 5 ALA CB C 13 19.432 0.023 . 1 . . . . 2 ALA CB . 26691 1
39 . 1 1 5 5 ALA N N 15 124.722 0.000 . 1 . . . . 2 ALA N . 26691 1
40 . 1 1 6 6 VAL H H 1 8.061 0.006 . 1 . . . . 3 VAL H . 26691 1
41 . 1 1 6 6 VAL HA H 1 4.225 0.006 . 1 . . . . 3 VAL HA . 26691 1
42 . 1 1 6 6 VAL HB H 1 2.264 0.004 . 1 . . . . 3 VAL HB . 26691 1
43 . 1 1 6 6 VAL HG11 H 1 0.925 0.002 . 2 . . . . 3 VAL HG1 . 26691 1
44 . 1 1 6 6 VAL HG12 H 1 0.925 0.002 . 2 . . . . 3 VAL HG1 . 26691 1
45 . 1 1 6 6 VAL HG13 H 1 0.925 0.002 . 2 . . . . 3 VAL HG1 . 26691 1
46 . 1 1 6 6 VAL HG21 H 1 0.853 0.005 . 2 . . . . 3 VAL HG2 . 26691 1
47 . 1 1 6 6 VAL HG22 H 1 0.853 0.005 . 2 . . . . 3 VAL HG2 . 26691 1
48 . 1 1 6 6 VAL HG23 H 1 0.853 0.005 . 2 . . . . 3 VAL HG2 . 26691 1
49 . 1 1 6 6 VAL C C 13 177.531 0.000 . 1 . . . . 3 VAL C . 26691 1
50 . 1 1 6 6 VAL CA C 13 62.086 0.084 . 1 . . . . 3 VAL CA . 26691 1
51 . 1 1 6 6 VAL CB C 13 32.177 0.068 . 1 . . . . 3 VAL CB . 26691 1
52 . 1 1 6 6 VAL CG1 C 13 20.351 0.092 . 1 . . . . 3 VAL CG1 . 26691 1
53 . 1 1 6 6 VAL CG2 C 13 21.552 0.058 . 1 . . . . 3 VAL CG2 . 26691 1
54 . 1 1 6 6 VAL N N 15 117.243 0.027 . 1 . . . . 3 VAL N . 26691 1
55 . 1 1 7 7 LEU H H 1 7.82 0.009 . 1 . . . . 4 LEU H . 26691 1
56 . 1 1 7 7 LEU HA H 1 4.42 0.004 . 1 . . . . 4 LEU HA . 26691 1
57 . 1 1 7 7 LEU HB2 H 1 1.68 0.002 . 1 . . . . 4 LEU HB2 . 26691 1
58 . 1 1 7 7 LEU HB3 H 1 1.051 0.008 . 1 . . . . 4 LEU HB3 . 26691 1
59 . 1 1 7 7 LEU HG H 1 1.592 0.006 . 1 . . . . 4 LEU HG . 26691 1
60 . 1 1 7 7 LEU HD11 H 1 0.815 0.005 . 2 . . . . 4 LEU HD1 . 26691 1
61 . 1 1 7 7 LEU HD12 H 1 0.815 0.005 . 2 . . . . 4 LEU HD1 . 26691 1
62 . 1 1 7 7 LEU HD13 H 1 0.815 0.005 . 2 . . . . 4 LEU HD1 . 26691 1
63 . 1 1 7 7 LEU HD21 H 1 0.544 0.004 . 2 . . . . 4 LEU HD2 . 26691 1
64 . 1 1 7 7 LEU HD22 H 1 0.544 0.004 . 2 . . . . 4 LEU HD2 . 26691 1
65 . 1 1 7 7 LEU HD23 H 1 0.544 0.004 . 2 . . . . 4 LEU HD2 . 26691 1
66 . 1 1 7 7 LEU C C 13 175.402 0.000 . 1 . . . . 4 LEU C . 26691 1
67 . 1 1 7 7 LEU CA C 13 54.331 0.057 . 1 . . . . 4 LEU CA . 26691 1
68 . 1 1 7 7 LEU CB C 13 43.477 0.043 . 1 . . . . 4 LEU CB . 26691 1
69 . 1 1 7 7 LEU CG C 13 26.807 0.076 . 1 . . . . 4 LEU CG . 26691 1
70 . 1 1 7 7 LEU CD1 C 13 25.17 0.081 . 1 . . . . 4 LEU CD1 . 26691 1
71 . 1 1 7 7 LEU CD2 C 13 22.316 0.064 . 1 . . . . 4 LEU CD2 . 26691 1
72 . 1 1 7 7 LEU N N 15 123.475 0.034 . 1 . . . . 4 LEU N . 26691 1
73 . 1 1 8 8 CYS H H 1 8.681 0.006 . 1 . . . . 5 CYS H . 26691 1
74 . 1 1 8 8 CYS HA H 1 3.986 0.010 . 1 . . . . 5 CYS HA . 26691 1
75 . 1 1 8 8 CYS HB2 H 1 3.474 0.004 . 1 . . . . 5 CYS HB2 . 26691 1
76 . 1 1 8 8 CYS HB3 H 1 2.941 0.004 . 1 . . . . 5 CYS HB3 . 26691 1
77 . 1 1 8 8 CYS C C 13 176.369 0.000 . 1 . . . . 5 CYS C . 26691 1
78 . 1 1 8 8 CYS CA C 13 60.16 0.126 . 1 . . . . 5 CYS CA . 26691 1
79 . 1 1 8 8 CYS CB C 13 32.053 0.030 . 1 . . . . 5 CYS CB . 26691 1
80 . 1 1 8 8 CYS N N 15 121.211 0.021 . 1 . . . . 5 CYS N . 26691 1
81 . 1 1 9 9 GLY H H 1 9.517 0.007 . 1 . . . . 6 GLY H . 26691 1
82 . 1 1 9 9 GLY HA2 H 1 4.21 0.004 . 1 . . . . 6 GLY HA2 . 26691 1
83 . 1 1 9 9 GLY HA3 H 1 3.842 0.003 . 1 . . . . 6 GLY HA3 . 26691 1
84 . 1 1 9 9 GLY C C 13 177.243 0.000 . 1 . . . . 6 GLY C . 26691 1
85 . 1 1 9 9 GLY CA C 13 46.488 0.009 . 1 . . . . 6 GLY CA . 26691 1
86 . 1 1 9 9 GLY N N 15 117.703 0.023 . 1 . . . . 6 GLY N . 26691 1
87 . 1 1 10 10 VAL H H 1 9.173 0.004 . 1 . . . . 7 VAL H . 26691 1
88 . 1 1 10 10 VAL HA H 1 4.173 0.004 . 1 . . . . 7 VAL HA . 26691 1
89 . 1 1 10 10 VAL HB H 1 2.273 0.005 . 1 . . . . 7 VAL HB . 26691 1
90 . 1 1 10 10 VAL HG11 H 1 1.029 0.005 . 2 . . . . 7 VAL HG1 . 26691 1
91 . 1 1 10 10 VAL HG12 H 1 1.029 0.005 . 2 . . . . 7 VAL HG1 . 26691 1
92 . 1 1 10 10 VAL HG13 H 1 1.029 0.005 . 2 . . . . 7 VAL HG1 . 26691 1
93 . 1 1 10 10 VAL HG21 H 1 0.955 0.002 . 2 . . . . 7 VAL HG2 . 26691 1
94 . 1 1 10 10 VAL HG22 H 1 0.955 0.002 . 2 . . . . 7 VAL HG2 . 26691 1
95 . 1 1 10 10 VAL HG23 H 1 0.955 0.002 . 2 . . . . 7 VAL HG2 . 26691 1
96 . 1 1 10 10 VAL C C 13 173.473 0.000 . 1 . . . . 7 VAL C . 26691 1
97 . 1 1 10 10 VAL CA C 13 64.787 0.075 . 1 . . . . 7 VAL CA . 26691 1
98 . 1 1 10 10 VAL CB C 13 32.701 0.062 . 1 . . . . 7 VAL CB . 26691 1
99 . 1 1 10 10 VAL CG1 C 13 21.612 0.056 . 1 . . . . 7 VAL CG1 . 26691 1
100 . 1 1 10 10 VAL CG2 C 13 21.539 0.045 . 1 . . . . 7 VAL CG2 . 26691 1
101 . 1 1 10 10 VAL N N 15 122.967 0.014 . 1 . . . . 7 VAL N . 26691 1
102 . 1 1 11 11 CYS H H 1 8.515 0.003 . 1 . . . . 8 CYS H . 26691 1
103 . 1 1 11 11 CYS HA H 1 4.811 0.003 . 1 . . . . 8 CYS HA . 26691 1
104 . 1 1 11 11 CYS HB2 H 1 3.129 0.005 . 1 . . . . 8 CYS HB2 . 26691 1
105 . 1 1 11 11 CYS HB3 H 1 2.977 0.006 . 1 . . . . 8 CYS HB3 . 26691 1
106 . 1 1 11 11 CYS C C 13 176.335 0.000 . 1 . . . . 8 CYS C . 26691 1
107 . 1 1 11 11 CYS CA C 13 59.518 0.076 . 1 . . . . 8 CYS CA . 26691 1
108 . 1 1 11 11 CYS CB C 13 32.011 0.032 . 1 . . . . 8 CYS CB . 26691 1
109 . 1 1 11 11 CYS N N 15 118.853 0.019 . 1 . . . . 8 CYS N . 26691 1
110 . 1 1 12 12 GLY H H 1 7.39 0.004 . 1 . . . . 9 GLY H . 26691 1
111 . 1 1 12 12 GLY HA2 H 1 4.096 0.003 . 2 . . . . 9 GLY HA . 26691 1
112 . 1 1 12 12 GLY HA3 H 1 4.096 0.003 . 2 . . . . 9 GLY HA . 26691 1
113 . 1 1 12 12 GLY C C 13 177.026 0.000 . 1 . . . . 9 GLY C . 26691 1
114 . 1 1 12 12 GLY CA C 13 46.906 0.060 . 1 . . . . 9 GLY CA . 26691 1
115 . 1 1 12 12 GLY N N 15 110.571 0.013 . 1 . . . . 9 GLY N . 26691 1
116 . 1 1 13 13 ILE H H 1 8.094 0.003 . 1 . . . . 10 ILE H . 26691 1
117 . 1 1 13 13 ILE HA H 1 4.533 0.006 . 1 . . . . 10 ILE HA . 26691 1
118 . 1 1 13 13 ILE HB H 1 2.097 0.006 . 1 . . . . 10 ILE HB . 26691 1
119 . 1 1 13 13 ILE HG12 H 1 1.522 0.005 . 1 . . . . 10 ILE HG12 . 26691 1
120 . 1 1 13 13 ILE HG13 H 1 1.167 0.005 . 1 . . . . 10 ILE HG13 . 26691 1
121 . 1 1 13 13 ILE HG21 H 1 0.962 0.006 . 1 . . . . 10 ILE HG2 . 26691 1
122 . 1 1 13 13 ILE HG22 H 1 0.962 0.006 . 1 . . . . 10 ILE HG2 . 26691 1
123 . 1 1 13 13 ILE HG23 H 1 0.962 0.006 . 1 . . . . 10 ILE HG2 . 26691 1
124 . 1 1 13 13 ILE HD11 H 1 0.897 0.004 . 1 . . . . 10 ILE HD1 . 26691 1
125 . 1 1 13 13 ILE HD12 H 1 0.897 0.004 . 1 . . . . 10 ILE HD1 . 26691 1
126 . 1 1 13 13 ILE HD13 H 1 0.897 0.004 . 1 . . . . 10 ILE HD1 . 26691 1
127 . 1 1 13 13 ILE C C 13 173.968 0.000 . 1 . . . . 10 ILE C . 26691 1
128 . 1 1 13 13 ILE CA C 13 62.354 0.062 . 1 . . . . 10 ILE CA . 26691 1
129 . 1 1 13 13 ILE CB C 13 40.93 0.038 . 1 . . . . 10 ILE CB . 26691 1
130 . 1 1 13 13 ILE CG1 C 13 27.205 0.047 . 1 . . . . 10 ILE CG1 . 26691 1
131 . 1 1 13 13 ILE CG2 C 13 17.696 0.098 . 1 . . . . 10 ILE CG2 . 26691 1
132 . 1 1 13 13 ILE CD1 C 13 13.389 0.036 . 1 . . . . 10 ILE CD1 . 26691 1
133 . 1 1 13 13 ILE N N 15 115.63 0.036 . 1 . . . . 10 ILE N . 26691 1
134 . 1 1 14 14 LYS HA H 1 4.635 0.000 . 1 . . . . 11 LYS HA . 26691 1
135 . 1 1 14 14 LYS HB2 H 1 1.855 0.003 . 2 . . . . 11 LYS HB . 26691 1
136 . 1 1 14 14 LYS HB3 H 1 1.855 0.003 . 2 . . . . 11 LYS HB . 26691 1
137 . 1 1 14 14 LYS HG2 H 1 1.569 0.008 . 1 . . . . 11 LYS HG2 . 26691 1
138 . 1 1 14 14 LYS HG3 H 1 1.495 0.005 . 1 . . . . 11 LYS HG3 . 26691 1
139 . 1 1 14 14 LYS HD2 H 1 1.922 0.005 . 2 . . . . 11 LYS HD . 26691 1
140 . 1 1 14 14 LYS HD3 H 1 1.922 0.005 . 2 . . . . 11 LYS HD . 26691 1
141 . 1 1 14 14 LYS HE2 H 1 3.083 0.004 . 2 . . . . 11 LYS HE . 26691 1
142 . 1 1 14 14 LYS HE3 H 1 3.083 0.004 . 2 . . . . 11 LYS HE . 26691 1
143 . 1 1 14 14 LYS CA C 13 54.727 0.088 . 1 . . . . 11 LYS CA . 26691 1
144 . 1 1 14 14 LYS CB C 13 28.997 0.044 . 1 . . . . 11 LYS CB . 26691 1
145 . 1 1 14 14 LYS CG C 13 25.574 0.037 . 1 . . . . 11 LYS CG . 26691 1
146 . 1 1 14 14 LYS CD C 13 35.734 0.034 . 1 . . . . 11 LYS CD . 26691 1
147 . 1 1 14 14 LYS CE C 13 42.445 0.046 . 1 . . . . 11 LYS CE . 26691 1
148 . 1 1 15 15 GLU H H 1 8.729 0.013 . 1 . . . . 12 GLU H . 26691 1
149 . 1 1 15 15 GLU HA H 1 4.316 0.004 . 1 . . . . 12 GLU HA . 26691 1
150 . 1 1 15 15 GLU HB2 H 1 1.901 0.007 . 2 . . . . 12 GLU HB . 26691 1
151 . 1 1 15 15 GLU HB3 H 1 1.901 0.007 . 2 . . . . 12 GLU HB . 26691 1
152 . 1 1 15 15 GLU HG2 H 1 2.258 0.005 . 2 . . . . 12 GLU HG . 26691 1
153 . 1 1 15 15 GLU HG3 H 1 2.258 0.005 . 2 . . . . 12 GLU HG . 26691 1
154 . 1 1 15 15 GLU C C 13 175.309 0.000 . 1 . . . . 12 GLU C . 26691 1
155 . 1 1 15 15 GLU CA C 13 57.059 0.062 . 1 . . . . 12 GLU CA . 26691 1
156 . 1 1 15 15 GLU CB C 13 30.517 0.013 . 1 . . . . 12 GLU CB . 26691 1
157 . 1 1 15 15 GLU CG C 13 36.723 0.029 . 1 . . . . 12 GLU CG . 26691 1
158 . 1 1 15 15 GLU N N 15 122.371 0.020 . 1 . . . . 12 GLU N . 26691 1
159 . 1 1 16 16 PHE H H 1 8.407 0.005 . 1 . . . . 13 PHE H . 26691 1
160 . 1 1 16 16 PHE HA H 1 3.964 0.008 . 1 . . . . 13 PHE HA . 26691 1
161 . 1 1 16 16 PHE HB2 H 1 3.021 0.005 . 1 . . . . 13 PHE HB2 . 26691 1
162 . 1 1 16 16 PHE HB3 H 1 2.573 0.013 . 1 . . . . 13 PHE HB3 . 26691 1
163 . 1 1 16 16 PHE HD1 H 1 7.182 0.003 . 3 . . . . 13 PHE QD . 26691 1
164 . 1 1 16 16 PHE HD2 H 1 7.182 0.003 . 3 . . . . 13 PHE QD . 26691 1
165 . 1 1 16 16 PHE HE1 H 1 7.18 0.007 . 3 . . . . 13 PHE QE . 26691 1
166 . 1 1 16 16 PHE HE2 H 1 7.18 0.007 . 3 . . . . 13 PHE QE . 26691 1
167 . 1 1 16 16 PHE C C 13 176.102 0.000 . 1 . . . . 13 PHE C . 26691 1
168 . 1 1 16 16 PHE CA C 13 57.624 0.076 . 1 . . . . 13 PHE CA . 26691 1
169 . 1 1 16 16 PHE CB C 13 39.665 0.041 . 1 . . . . 13 PHE CB . 26691 1
170 . 1 1 16 16 PHE CD1 C 13 132.823 0.000 . 1 . . . . 13 PHE CD1 . 26691 1
171 . 1 1 16 16 PHE CE1 C 13 130.901 0.000 . 1 . . . . 13 PHE CE1 . 26691 1
172 . 1 1 16 16 PHE N N 15 120.479 0.024 . 1 . . . . 13 PHE N . 26691 1
173 . 1 1 17 17 LYS H H 1 8.636 0.007 . 1 . . . . 14 LYS H . 26691 1
174 . 1 1 17 17 LYS HA H 1 3.918 0.006 . 1 . . . . 14 LYS HA . 26691 1
175 . 1 1 17 17 LYS HB2 H 1 1.113 0.006 . 2 . . . . 14 LYS HB . 26691 1
176 . 1 1 17 17 LYS HB3 H 1 1.113 0.006 . 2 . . . . 14 LYS HB . 26691 1
177 . 1 1 17 17 LYS HG2 H 1 1.009 0.004 . 1 . . . . 14 LYS HG2 . 26691 1
178 . 1 1 17 17 LYS HG3 H 1 0.863 0.004 . 1 . . . . 14 LYS HG3 . 26691 1
179 . 1 1 17 17 LYS HD2 H 1 1.473 0.002 . 2 . . . . 14 LYS HD . 26691 1
180 . 1 1 17 17 LYS HD3 H 1 1.473 0.002 . 2 . . . . 14 LYS HD . 26691 1
181 . 1 1 17 17 LYS HE2 H 1 2.87 0.006 . 2 . . . . 14 LYS HE . 26691 1
182 . 1 1 17 17 LYS HE3 H 1 2.87 0.006 . 2 . . . . 14 LYS HE . 26691 1
183 . 1 1 17 17 LYS C C 13 172.532 0.000 . 1 . . . . 14 LYS C . 26691 1
184 . 1 1 17 17 LYS CA C 13 56.717 0.057 . 1 . . . . 14 LYS CA . 26691 1
185 . 1 1 17 17 LYS CB C 13 36.794 0.045 . 1 . . . . 14 LYS CB . 26691 1
186 . 1 1 17 17 LYS CG C 13 24.452 0.048 . 1 . . . . 14 LYS CG . 26691 1
187 . 1 1 17 17 LYS CD C 13 28.9 0.027 . 1 . . . . 14 LYS CD . 26691 1
188 . 1 1 17 17 LYS CE C 13 42.206 0.017 . 1 . . . . 14 LYS CE . 26691 1
189 . 1 1 17 17 LYS N N 15 119.32 0.025 . 1 . . . . 14 LYS N . 26691 1
190 . 1 1 18 18 TYR H H 1 8.483 0.003 . 1 . . . . 15 TYR H . 26691 1
191 . 1 1 18 18 TYR HA H 1 4.962 0.005 . 1 . . . . 15 TYR HA . 26691 1
192 . 1 1 18 18 TYR HB2 H 1 3.05 0.005 . 1 . . . . 15 TYR HB2 . 26691 1
193 . 1 1 18 18 TYR HB3 H 1 2.873 0.005 . 1 . . . . 15 TYR HB3 . 26691 1
194 . 1 1 18 18 TYR HD1 H 1 6.97 0.006 . 3 . . . . 15 TYR QD . 26691 1
195 . 1 1 18 18 TYR HD2 H 1 6.97 0.006 . 3 . . . . 15 TYR QD . 26691 1
196 . 1 1 18 18 TYR HE1 H 1 6.684 0.005 . 3 . . . . 15 TYR QE . 26691 1
197 . 1 1 18 18 TYR HE2 H 1 6.684 0.005 . 3 . . . . 15 TYR QE . 26691 1
198 . 1 1 18 18 TYR C C 13 174.48 0.000 . 1 . . . . 15 TYR C . 26691 1
199 . 1 1 18 18 TYR CA C 13 56.477 0.043 . 1 . . . . 15 TYR CA . 26691 1
200 . 1 1 18 18 TYR CB C 13 41.109 0.036 . 1 . . . . 15 TYR CB . 26691 1
201 . 1 1 18 18 TYR CD1 C 13 133.512 0.031 . 1 . . . . 15 TYR CD1 . 26691 1
202 . 1 1 18 18 TYR CE1 C 13 117.655 0.053 . 1 . . . . 15 TYR CE1 . 26691 1
203 . 1 1 18 18 TYR N N 15 119.016 0.020 . 1 . . . . 15 TYR N . 26691 1
204 . 1 1 19 19 LYS H H 1 8.561 0.003 . 1 . . . . 16 LYS H . 26691 1
205 . 1 1 19 19 LYS HA H 1 4.86 0.003 . 1 . . . . 16 LYS HA . 26691 1
206 . 1 1 19 19 LYS HB2 H 1 1.562 0.010 . 2 . . . . 16 LYS HB . 26691 1
207 . 1 1 19 19 LYS HB3 H 1 1.562 0.010 . 2 . . . . 16 LYS HB . 26691 1
208 . 1 1 19 19 LYS HG2 H 1 1.263 0.006 . 1 . . . . 16 LYS HG2 . 26691 1
209 . 1 1 19 19 LYS HG3 H 1 1.131 0.006 . 1 . . . . 16 LYS HG3 . 26691 1
210 . 1 1 19 19 LYS HD2 H 1 1.591 0.003 . 2 . . . . 16 LYS HD . 26691 1
211 . 1 1 19 19 LYS HD3 H 1 1.591 0.003 . 2 . . . . 16 LYS HD . 26691 1
212 . 1 1 19 19 LYS HE2 H 1 2.847 0.015 . 2 . . . . 16 LYS HE . 26691 1
213 . 1 1 19 19 LYS HE3 H 1 2.847 0.015 . 2 . . . . 16 LYS HE . 26691 1
214 . 1 1 19 19 LYS C C 13 174.626 0.000 . 1 . . . . 16 LYS C . 26691 1
215 . 1 1 19 19 LYS CA C 13 54.979 0.043 . 1 . . . . 16 LYS CA . 26691 1
216 . 1 1 19 19 LYS CB C 13 35.614 0.031 . 1 . . . . 16 LYS CB . 26691 1
217 . 1 1 19 19 LYS CG C 13 24.969 0.054 . 1 . . . . 16 LYS CG . 26691 1
218 . 1 1 19 19 LYS CD C 13 29.624 0.053 . 1 . . . . 16 LYS CD . 26691 1
219 . 1 1 19 19 LYS CE C 13 42.12 0.077 . 1 . . . . 16 LYS CE . 26691 1
220 . 1 1 19 19 LYS N N 15 120.639 0.013 . 1 . . . . 16 LYS N . 26691 1
221 . 1 1 20 20 CYS H H 1 8.61 0.003 . 1 . . . . 17 CYS H . 26691 1
222 . 1 1 20 20 CYS HA H 1 4.614 0.011 . 1 . . . . 17 CYS HA . 26691 1
223 . 1 1 20 20 CYS HB2 H 1 3.116 0.013 . 2 . . . . 17 CYS HB . 26691 1
224 . 1 1 20 20 CYS HB3 H 1 3.116 0.013 . 2 . . . . 17 CYS HB . 26691 1
225 . 1 1 20 20 CYS C C 13 175.6 0.000 . 1 . . . . 17 CYS C . 26691 1
226 . 1 1 20 20 CYS CA C 13 56.578 0.261 . 1 . . . . 17 CYS CA . 26691 1
227 . 1 1 20 20 CYS CB C 13 30.532 0.021 . 1 . . . . 17 CYS CB . 26691 1
228 . 1 1 20 20 CYS N N 15 129.851 0.020 . 1 . . . . 17 CYS N . 26691 1
229 . 1 1 21 21 PRO HA H 1 4.365 0.004 . 1 . . . . 18 PRO HA . 26691 1
230 . 1 1 21 21 PRO HB2 H 1 2.376 0.003 . 1 . . . . 18 PRO HB2 . 26691 1
231 . 1 1 21 21 PRO HB3 H 1 1.907 0.006 . 1 . . . . 18 PRO HB3 . 26691 1
232 . 1 1 21 21 PRO HG2 H 1 2.123 0.004 . 1 . . . . 18 PRO HG2 . 26691 1
233 . 1 1 21 21 PRO HG3 H 1 2.013 0.003 . 1 . . . . 18 PRO HG3 . 26691 1
234 . 1 1 21 21 PRO HD2 H 1 4.092 0.003 . 2 . . . . 18 PRO HD . 26691 1
235 . 1 1 21 21 PRO HD3 H 1 4.092 0.003 . 2 . . . . 18 PRO HD . 26691 1
236 . 1 1 21 21 PRO CA C 13 64.307 0.070 . 1 . . . . 18 PRO CA . 26691 1
237 . 1 1 21 21 PRO CB C 13 32.521 0.050 . 1 . . . . 18 PRO CB . 26691 1
238 . 1 1 21 21 PRO CG C 13 27.458 0.040 . 1 . . . . 18 PRO CG . 26691 1
239 . 1 1 21 21 PRO CD C 13 51.358 0.038 . 1 . . . . 18 PRO CD . 26691 1
240 . 1 1 22 22 ARG H H 1 8.517 0.004 . 1 . . . . 19 ARG H . 26691 1
241 . 1 1 22 22 ARG HA H 1 4.286 0.005 . 1 . . . . 19 ARG HA . 26691 1
242 . 1 1 22 22 ARG HB2 H 1 1.677 0.004 . 1 . . . . 19 ARG HB2 . 26691 1
243 . 1 1 22 22 ARG HB3 H 1 1.579 0.004 . 1 . . . . 19 ARG HB3 . 26691 1
244 . 1 1 22 22 ARG HG2 H 1 1.56 0.005 . 2 . . . . 19 ARG HG . 26691 1
245 . 1 1 22 22 ARG HG3 H 1 1.56 0.005 . 2 . . . . 19 ARG HG . 26691 1
246 . 1 1 22 22 ARG HD2 H 1 3.469 0.005 . 1 . . . . 19 ARG HD2 . 26691 1
247 . 1 1 22 22 ARG HD3 H 1 3.326 0.004 . 1 . . . . 19 ARG HD3 . 26691 1
248 . 1 1 22 22 ARG C C 13 176.802 0.000 . 1 . . . . 19 ARG C . 26691 1
249 . 1 1 22 22 ARG CA C 13 57.648 0.058 . 1 . . . . 19 ARG CA . 26691 1
250 . 1 1 22 22 ARG CB C 13 31.745 0.061 . 1 . . . . 19 ARG CB . 26691 1
251 . 1 1 22 22 ARG CG C 13 27.944 0.058 . 1 . . . . 19 ARG CG . 26691 1
252 . 1 1 22 22 ARG CD C 13 43.075 0.021 . 1 . . . . 19 ARG CD . 26691 1
253 . 1 1 22 22 ARG N N 15 118.939 0.017 . 1 . . . . 19 ARG N . 26691 1
254 . 1 1 23 23 CYS H H 1 7.821 0.005 . 1 . . . . 20 CYS H . 26691 1
255 . 1 1 23 23 CYS HA H 1 4.973 0.003 . 1 . . . . 20 CYS HA . 26691 1
256 . 1 1 23 23 CYS HB2 H 1 3.296 0.005 . 1 . . . . 20 CYS HB2 . 26691 1
257 . 1 1 23 23 CYS HB3 H 1 2.802 0.004 . 1 . . . . 20 CYS HB3 . 26691 1
258 . 1 1 23 23 CYS C C 13 176.205 0.000 . 1 . . . . 20 CYS C . 26691 1
259 . 1 1 23 23 CYS CA C 13 58.642 0.053 . 1 . . . . 20 CYS CA . 26691 1
260 . 1 1 23 23 CYS CB C 13 32.047 0.014 . 1 . . . . 20 CYS CB . 26691 1
261 . 1 1 23 23 CYS N N 15 117.499 0.023 . 1 . . . . 20 CYS N . 26691 1
262 . 1 1 24 24 LEU H H 1 7.899 0.004 . 1 . . . . 21 LEU H . 26691 1
263 . 1 1 24 24 LEU HA H 1 4.107 0.003 . 1 . . . . 21 LEU HA . 26691 1
264 . 1 1 24 24 LEU HB2 H 1 2.116 0.003 . 1 . . . . 21 LEU HB2 . 26691 1
265 . 1 1 24 24 LEU HB3 H 1 1.58 0.005 . 1 . . . . 21 LEU HB3 . 26691 1
266 . 1 1 24 24 LEU HG H 1 1.411 0.004 . 1 . . . . 21 LEU HG . 26691 1
267 . 1 1 24 24 LEU HD11 H 1 0.852 0.005 . 2 . . . . 21 LEU HD1 . 26691 1
268 . 1 1 24 24 LEU HD12 H 1 0.852 0.005 . 2 . . . . 21 LEU HD1 . 26691 1
269 . 1 1 24 24 LEU HD13 H 1 0.852 0.005 . 2 . . . . 21 LEU HD1 . 26691 1
270 . 1 1 24 24 LEU HD21 H 1 0.797 0.005 . 2 . . . . 21 LEU HD2 . 26691 1
271 . 1 1 24 24 LEU HD22 H 1 0.797 0.005 . 2 . . . . 21 LEU HD2 . 26691 1
272 . 1 1 24 24 LEU HD23 H 1 0.797 0.005 . 2 . . . . 21 LEU HD2 . 26691 1
273 . 1 1 24 24 LEU C C 13 175.579 0.000 . 1 . . . . 21 LEU C . 26691 1
274 . 1 1 24 24 LEU CA C 13 57.136 0.031 . 1 . . . . 21 LEU CA . 26691 1
275 . 1 1 24 24 LEU CB C 13 38.886 0.019 . 1 . . . . 21 LEU CB . 26691 1
276 . 1 1 24 24 LEU CG C 13 27.57 0.089 . 1 . . . . 21 LEU CG . 26691 1
277 . 1 1 24 24 LEU CD1 C 13 25.067 0.089 . 1 . . . . 21 LEU CD1 . 26691 1
278 . 1 1 24 24 LEU CD2 C 13 22.768 0.070 . 1 . . . . 21 LEU CD2 . 26691 1
279 . 1 1 24 24 LEU N N 15 117.65 0.017 . 1 . . . . 21 LEU N . 26691 1
280 . 1 1 25 25 VAL H H 1 8.285 0.002 . 1 . . . . 22 VAL H . 26691 1
281 . 1 1 25 25 VAL HA H 1 3.73 0.003 . 1 . . . . 22 VAL HA . 26691 1
282 . 1 1 25 25 VAL HB H 1 1.45 0.006 . 1 . . . . 22 VAL HB . 26691 1
283 . 1 1 25 25 VAL HG11 H 1 0.999 0.008 . 2 . . . . 22 VAL HG1 . 26691 1
284 . 1 1 25 25 VAL HG12 H 1 0.999 0.008 . 2 . . . . 22 VAL HG1 . 26691 1
285 . 1 1 25 25 VAL HG13 H 1 0.999 0.008 . 2 . . . . 22 VAL HG1 . 26691 1
286 . 1 1 25 25 VAL HG21 H 1 0.341 0.005 . 2 . . . . 22 VAL HG2 . 26691 1
287 . 1 1 25 25 VAL HG22 H 1 0.341 0.005 . 2 . . . . 22 VAL HG2 . 26691 1
288 . 1 1 25 25 VAL HG23 H 1 0.341 0.005 . 2 . . . . 22 VAL HG2 . 26691 1
289 . 1 1 25 25 VAL C C 13 176.347 0.000 . 1 . . . . 22 VAL C . 26691 1
290 . 1 1 25 25 VAL CA C 13 65.062 0.037 . 1 . . . . 22 VAL CA . 26691 1
291 . 1 1 25 25 VAL CB C 13 31.549 0.066 . 1 . . . . 22 VAL CB . 26691 1
292 . 1 1 25 25 VAL CG1 C 13 24.648 0.071 . 1 . . . . 22 VAL CG1 . 26691 1
293 . 1 1 25 25 VAL CG2 C 13 20.227 0.049 . 1 . . . . 22 VAL CG2 . 26691 1
294 . 1 1 25 25 VAL N N 15 123.023 0.026 . 1 . . . . 22 VAL N . 26691 1
295 . 1 1 26 26 GLN H H 1 8.579 0.004 . 1 . . . . 23 GLN H . 26691 1
296 . 1 1 26 26 GLN HA H 1 5.193 0.004 . 1 . . . . 23 GLN HA . 26691 1
297 . 1 1 26 26 GLN HB2 H 1 1.679 0.006 . 1 . . . . 23 GLN HB2 . 26691 1
298 . 1 1 26 26 GLN HB3 H 1 1.539 0.005 . 1 . . . . 23 GLN HB3 . 26691 1
299 . 1 1 26 26 GLN HG2 H 1 2.2 0.003 . 1 . . . . 23 GLN HG2 . 26691 1
300 . 1 1 26 26 GLN HG3 H 1 1.696 0.007 . 1 . . . . 23 GLN HG3 . 26691 1
301 . 1 1 26 26 GLN HE21 H 1 6.382 0.008 . 1 . . . . 23 GLN HE21 . 26691 1
302 . 1 1 26 26 GLN C C 13 175.193 0.000 . 1 . . . . 23 GLN C . 26691 1
303 . 1 1 26 26 GLN CA C 13 54.051 0.032 . 1 . . . . 23 GLN CA . 26691 1
304 . 1 1 26 26 GLN CB C 13 29.549 0.071 . 1 . . . . 23 GLN CB . 26691 1
305 . 1 1 26 26 GLN CG C 13 34.209 0.043 . 1 . . . . 23 GLN CG . 26691 1
306 . 1 1 26 26 GLN N N 15 128.514 0.028 . 1 . . . . 23 GLN N . 26691 1
307 . 1 1 26 26 GLN NE2 N 15 109.282 0.046 . 1 . . . . 23 GLN NE2 . 26691 1
308 . 1 1 27 27 THR H H 1 9.234 0.002 . 1 . . . . 24 THR H . 26691 1
309 . 1 1 27 27 THR HA H 1 6.627 0.004 . 1 . . . . 24 THR HA . 26691 1
310 . 1 1 27 27 THR HB H 1 4.333 0.004 . 1 . . . . 24 THR HB . 26691 1
311 . 1 1 27 27 THR HG21 H 1 1.015 0.006 . 1 . . . . 24 THR HG2 . 26691 1
312 . 1 1 27 27 THR HG22 H 1 1.015 0.006 . 1 . . . . 24 THR HG2 . 26691 1
313 . 1 1 27 27 THR HG23 H 1 1.015 0.006 . 1 . . . . 24 THR HG2 . 26691 1
314 . 1 1 27 27 THR C C 13 175.958 0.000 . 1 . . . . 24 THR C . 26691 1
315 . 1 1 27 27 THR CA C 13 59.429 0.044 . 1 . . . . 24 THR CA . 26691 1
316 . 1 1 27 27 THR CB C 13 73.998 0.048 . 1 . . . . 24 THR CB . 26691 1
317 . 1 1 27 27 THR CG2 C 13 22.667 0.059 . 1 . . . . 24 THR CG2 . 26691 1
318 . 1 1 27 27 THR N N 15 112.072 0.010 . 1 . . . . 24 THR N . 26691 1
319 . 1 1 28 28 CYS H H 1 9.478 0.002 . 1 . . . . 25 CYS H . 26691 1
320 . 1 1 28 28 CYS HA H 1 4.771 0.006 . 1 . . . . 25 CYS HA . 26691 1
321 . 1 1 28 28 CYS HB2 H 1 3.203 0.005 . 1 . . . . 25 CYS HB2 . 26691 1
322 . 1 1 28 28 CYS HB3 H 1 2.677 0.005 . 1 . . . . 25 CYS HB3 . 26691 1
323 . 1 1 28 28 CYS C C 13 177.213 0.000 . 1 . . . . 25 CYS C . 26691 1
324 . 1 1 28 28 CYS CA C 13 60.01 0.261 . 1 . . . . 25 CYS CA . 26691 1
325 . 1 1 28 28 CYS CB C 13 35.179 0.026 . 1 . . . . 25 CYS CB . 26691 1
326 . 1 1 28 28 CYS N N 15 121.322 0.015 . 1 . . . . 25 CYS N . 26691 1
327 . 1 1 29 29 SER H H 1 7.421 0.003 . 1 . . . . 26 SER H . 26691 1
328 . 1 1 29 29 SER HA H 1 5.045 0.004 . 1 . . . . 26 SER HA . 26691 1
329 . 1 1 29 29 SER HB2 H 1 4.41 0.002 . 1 . . . . 26 SER HB2 . 26691 1
330 . 1 1 29 29 SER HB3 H 1 4.313 0.003 . 1 . . . . 26 SER HB3 . 26691 1
331 . 1 1 29 29 SER C C 13 174.806 0.000 . 1 . . . . 26 SER C . 26691 1
332 . 1 1 29 29 SER CA C 13 57.56 0.061 . 1 . . . . 26 SER CA . 26691 1
333 . 1 1 29 29 SER CB C 13 64.875 0.046 . 1 . . . . 26 SER CB . 26691 1
334 . 1 1 29 29 SER N N 15 111.216 0.018 . 1 . . . . 26 SER N . 26691 1
335 . 1 1 30 30 LEU HA H 1 4.019 0.004 . 1 . . . . 27 LEU HA . 26691 1
336 . 1 1 30 30 LEU HB2 H 1 1.766 0.005 . 1 . . . . 27 LEU HB2 . 26691 1
337 . 1 1 30 30 LEU HB3 H 1 1.587 0.005 . 1 . . . . 27 LEU HB3 . 26691 1
338 . 1 1 30 30 LEU HG H 1 1.643 0.005 . 1 . . . . 27 LEU HG . 26691 1
339 . 1 1 30 30 LEU HD11 H 1 0.914 0.002 . 2 . . . . 27 LEU HD1 . 26691 1
340 . 1 1 30 30 LEU HD12 H 1 0.914 0.002 . 2 . . . . 27 LEU HD1 . 26691 1
341 . 1 1 30 30 LEU HD13 H 1 0.914 0.002 . 2 . . . . 27 LEU HD1 . 26691 1
342 . 1 1 30 30 LEU HD21 H 1 0.703 0.003 . 2 . . . . 27 LEU HD2 . 26691 1
343 . 1 1 30 30 LEU HD22 H 1 0.703 0.003 . 2 . . . . 27 LEU HD2 . 26691 1
344 . 1 1 30 30 LEU HD23 H 1 0.703 0.003 . 2 . . . . 27 LEU HD2 . 26691 1
345 . 1 1 30 30 LEU CA C 13 57.797 0.021 . 1 . . . . 27 LEU CA . 26691 1
346 . 1 1 30 30 LEU CB C 13 40.998 0.018 . 1 . . . . 27 LEU CB . 26691 1
347 . 1 1 30 30 LEU CG C 13 27.26 0.032 . 1 . . . . 27 LEU CG . 26691 1
348 . 1 1 30 30 LEU CD1 C 13 24.339 0.063 . 1 . . . . 27 LEU CD1 . 26691 1
349 . 1 1 30 30 LEU CD2 C 13 23.319 0.078 . 1 . . . . 27 LEU CD2 . 26691 1
350 . 1 1 31 31 GLU H H 1 8.875 0.003 . 1 . . . . 28 GLU H . 26691 1
351 . 1 1 31 31 GLU HA H 1 4.039 0.003 . 1 . . . . 28 GLU HA . 26691 1
352 . 1 1 31 31 GLU HB2 H 1 2.227 0.004 . 1 . . . . 28 GLU HB2 . 26691 1
353 . 1 1 31 31 GLU HB3 H 1 2.005 0.005 . 1 . . . . 28 GLU HB3 . 26691 1
354 . 1 1 31 31 GLU HG2 H 1 2.461 0.009 . 1 . . . . 28 GLU HG2 . 26691 1
355 . 1 1 31 31 GLU HG3 H 1 2.282 0.004 . 1 . . . . 28 GLU HG3 . 26691 1
356 . 1 1 31 31 GLU C C 13 179.56 0.000 . 1 . . . . 28 GLU C . 26691 1
357 . 1 1 31 31 GLU CA C 13 60.929 0.022 . 1 . . . . 28 GLU CA . 26691 1
358 . 1 1 31 31 GLU CB C 13 28.926 0.028 . 1 . . . . 28 GLU CB . 26691 1
359 . 1 1 31 31 GLU CG C 13 36.901 0.017 . 1 . . . . 28 GLU CG . 26691 1
360 . 1 1 31 31 GLU N N 15 119.798 0.018 . 1 . . . . 28 GLU N . 26691 1
361 . 1 1 32 32 CYS H H 1 8.116 0.003 . 1 . . . . 29 CYS H . 26691 1
362 . 1 1 32 32 CYS HA H 1 4.249 0.005 . 1 . . . . 29 CYS HA . 26691 1
363 . 1 1 32 32 CYS HB2 H 1 3.018 0.005 . 1 . . . . 29 CYS HB2 . 26691 1
364 . 1 1 32 32 CYS HB3 H 1 2.856 0.004 . 1 . . . . 29 CYS HB3 . 26691 1
365 . 1 1 32 32 CYS C C 13 179.893 0.000 . 1 . . . . 29 CYS C . 26691 1
366 . 1 1 32 32 CYS CA C 13 66.081 0.056 . 1 . . . . 29 CYS CA . 26691 1
367 . 1 1 32 32 CYS CB C 13 30.949 0.028 . 1 . . . . 29 CYS CB . 26691 1
368 . 1 1 32 32 CYS N N 15 120.451 0.012 . 1 . . . . 29 CYS N . 26691 1
369 . 1 1 33 33 SER H H 1 8.666 0.004 . 1 . . . . 30 SER H . 26691 1
370 . 1 1 33 33 SER HA H 1 4.247 0.003 . 1 . . . . 30 SER HA . 26691 1
371 . 1 1 33 33 SER HB2 H 1 4.135 0.004 . 1 . . . . 30 SER HB2 . 26691 1
372 . 1 1 33 33 SER HB3 H 1 4.014 0.004 . 1 . . . . 30 SER HB3 . 26691 1
373 . 1 1 33 33 SER C C 13 178.198 0.000 . 1 . . . . 30 SER C . 26691 1
374 . 1 1 33 33 SER CA C 13 63.184 0.079 . 1 . . . . 30 SER CA . 26691 1
375 . 1 1 33 33 SER CB C 13 62.658 0.105 . 1 . . . . 30 SER CB . 26691 1
376 . 1 1 33 33 SER N N 15 117.222 0.024 . 1 . . . . 30 SER N . 26691 1
377 . 1 1 34 34 LYS H H 1 8.541 0.005 . 1 . . . . 31 LYS H . 26691 1
378 . 1 1 34 34 LYS HA H 1 3.991 0.004 . 1 . . . . 31 LYS HA . 26691 1
379 . 1 1 34 34 LYS HB2 H 1 1.981 0.004 . 2 . . . . 31 LYS HB . 26691 1
380 . 1 1 34 34 LYS HB3 H 1 1.981 0.004 . 2 . . . . 31 LYS HB . 26691 1
381 . 1 1 34 34 LYS HG2 H 1 1.608 0.003 . 1 . . . . 31 LYS HG2 . 26691 1
382 . 1 1 34 34 LYS HG3 H 1 1.439 0.004 . 1 . . . . 31 LYS HG3 . 26691 1
383 . 1 1 34 34 LYS HD2 H 1 1.685 0.002 . 2 . . . . 31 LYS HD . 26691 1
384 . 1 1 34 34 LYS HD3 H 1 1.685 0.002 . 2 . . . . 31 LYS HD . 26691 1
385 . 1 1 34 34 LYS HE2 H 1 2.937 0.006 . 2 . . . . 31 LYS HE . 26691 1
386 . 1 1 34 34 LYS HE3 H 1 2.937 0.006 . 2 . . . . 31 LYS HE . 26691 1
387 . 1 1 34 34 LYS C C 13 177.28 0.000 . 1 . . . . 31 LYS C . 26691 1
388 . 1 1 34 34 LYS CA C 13 60.302 0.094 . 1 . . . . 31 LYS CA . 26691 1
389 . 1 1 34 34 LYS CB C 13 32.209 0.053 . 1 . . . . 31 LYS CB . 26691 1
390 . 1 1 34 34 LYS CG C 13 25.557 0.066 . 1 . . . . 31 LYS CG . 26691 1
391 . 1 1 34 34 LYS CD C 13 29.606 0.009 . 1 . . . . 31 LYS CD . 26691 1
392 . 1 1 34 34 LYS CE C 13 42.209 0.003 . 1 . . . . 31 LYS CE . 26691 1
393 . 1 1 34 34 LYS N N 15 122.734 0.023 . 1 . . . . 31 LYS N . 26691 1
394 . 1 1 35 35 LYS H H 1 7.932 0.005 . 1 . . . . 32 LYS H . 26691 1
395 . 1 1 35 35 LYS HA H 1 4.134 0.004 . 1 . . . . 32 LYS HA . 26691 1
396 . 1 1 35 35 LYS HB2 H 1 2.02 0.004 . 1 . . . . 32 LYS HB2 . 26691 1
397 . 1 1 35 35 LYS HB3 H 1 1.929 0.007 . 1 . . . . 32 LYS HB3 . 26691 1
398 . 1 1 35 35 LYS HG2 H 1 1.614 0.005 . 1 . . . . 32 LYS HG2 . 26691 1
399 . 1 1 35 35 LYS HG3 H 1 1.442 0.005 . 1 . . . . 32 LYS HG3 . 26691 1
400 . 1 1 35 35 LYS HD2 H 1 1.671 0.014 . 2 . . . . 32 LYS HD . 26691 1
401 . 1 1 35 35 LYS HD3 H 1 1.671 0.014 . 2 . . . . 32 LYS HD . 26691 1
402 . 1 1 35 35 LYS HE2 H 1 2.949 0.003 . 2 . . . . 32 LYS HE . 26691 1
403 . 1 1 35 35 LYS HE3 H 1 2.949 0.003 . 2 . . . . 32 LYS HE . 26691 1
404 . 1 1 35 35 LYS C C 13 179.333 0.000 . 1 . . . . 32 LYS C . 26691 1
405 . 1 1 35 35 LYS CA C 13 59.299 0.047 . 1 . . . . 32 LYS CA . 26691 1
406 . 1 1 35 35 LYS CB C 13 32.593 0.027 . 1 . . . . 32 LYS CB . 26691 1
407 . 1 1 35 35 LYS CG C 13 25.748 0.049 . 1 . . . . 32 LYS CG . 26691 1
408 . 1 1 35 35 LYS CD C 13 29.383 0.010 . 1 . . . . 32 LYS CD . 26691 1
409 . 1 1 35 35 LYS CE C 13 42.29 0.000 . 1 . . . . 32 LYS CE . 26691 1
410 . 1 1 35 35 LYS N N 15 119.963 0.019 . 1 . . . . 32 LYS N . 26691 1
411 . 1 1 36 36 HIS H H 1 8.426 0.003 . 1 . . . . 33 HIS H . 26691 1
412 . 1 1 36 36 HIS HA H 1 4.302 0.006 . 1 . . . . 33 HIS HA . 26691 1
413 . 1 1 36 36 HIS HB2 H 1 3.369 0.013 . 1 . . . . 33 HIS HB2 . 26691 1
414 . 1 1 36 36 HIS HB3 H 1 3.147 0.015 . 1 . . . . 33 HIS HB3 . 26691 1
415 . 1 1 36 36 HIS HD2 H 1 7.059 0.046 . 1 . . . . 33 HIS HD2 . 26691 1
416 . 1 1 36 36 HIS HE1 H 1 8.033 0.002 . 1 . . . . 33 HIS HE1 . 26691 1
417 . 1 1 36 36 HIS C C 13 178.772 0.000 . 1 . . . . 33 HIS C . 26691 1
418 . 1 1 36 36 HIS CA C 13 58.398 0.055 . 1 . . . . 33 HIS CA . 26691 1
419 . 1 1 36 36 HIS CB C 13 27.396 0.015 . 1 . . . . 33 HIS CB . 26691 1
420 . 1 1 36 36 HIS CD2 C 13 120.098 0.030 . 1 . . . . 33 HIS CD2 . 26691 1
421 . 1 1 36 36 HIS CE1 C 13 141.034 0.035 . 1 . . . . 33 HIS CE1 . 26691 1
422 . 1 1 36 36 HIS N N 15 118.699 0.026 . 1 . . . . 33 HIS N . 26691 1
423 . 1 1 36 36 HIS ND1 N 15 216.421 0.015 . 1 . . . . 33 HIS ND1 . 26691 1
424 . 1 1 36 36 HIS NE2 N 15 174.615 0.029 . 1 . . . . 33 HIS NE2 . 26691 1
425 . 1 1 37 37 LYS H H 1 7.42 0.005 . 1 . . . . 34 LYS H . 26691 1
426 . 1 1 37 37 LYS HA H 1 3.638 0.003 . 1 . . . . 34 LYS HA . 26691 1
427 . 1 1 37 37 LYS HB2 H 1 1.9 0.004 . 2 . . . . 34 LYS HB . 26691 1
428 . 1 1 37 37 LYS HB3 H 1 1.9 0.004 . 2 . . . . 34 LYS HB . 26691 1
429 . 1 1 37 37 LYS HG2 H 1 1.659 0.004 . 1 . . . . 34 LYS HG2 . 26691 1
430 . 1 1 37 37 LYS HG3 H 1 1.205 0.009 . 1 . . . . 34 LYS HG3 . 26691 1
431 . 1 1 37 37 LYS HD2 H 1 1.673 0.005 . 2 . . . . 34 LYS HD . 26691 1
432 . 1 1 37 37 LYS HD3 H 1 1.673 0.005 . 2 . . . . 34 LYS HD . 26691 1
433 . 1 1 37 37 LYS HE2 H 1 2.945 0.002 . 2 . . . . 34 LYS HE . 26691 1
434 . 1 1 37 37 LYS HE3 H 1 2.945 0.002 . 2 . . . . 34 LYS HE . 26691 1
435 . 1 1 37 37 LYS CA C 13 60.169 0.053 . 1 . . . . 34 LYS CA . 26691 1
436 . 1 1 37 37 LYS CB C 13 32.235 0.058 . 1 . . . . 34 LYS CB . 26691 1
437 . 1 1 37 37 LYS CG C 13 25.415 0.057 . 1 . . . . 34 LYS CG . 26691 1
438 . 1 1 37 37 LYS CD C 13 29.801 0.049 . 1 . . . . 34 LYS CD . 26691 1
439 . 1 1 37 37 LYS CE C 13 42.215 0.008 . 1 . . . . 34 LYS CE . 26691 1
440 . 1 1 37 37 LYS N N 15 118.268 0.025 . 1 . . . . 34 LYS N . 26691 1
441 . 1 1 38 38 THR HA H 1 4.106 0.003 . 1 . . . . 35 THR HA . 26691 1
442 . 1 1 38 38 THR HB H 1 4.173 0.006 . 1 . . . . 35 THR HB . 26691 1
443 . 1 1 38 38 THR HG21 H 1 1.257 0.004 . 1 . . . . 35 THR HG2 . 26691 1
444 . 1 1 38 38 THR HG22 H 1 1.257 0.004 . 1 . . . . 35 THR HG2 . 26691 1
445 . 1 1 38 38 THR HG23 H 1 1.257 0.004 . 1 . . . . 35 THR HG2 . 26691 1
446 . 1 1 38 38 THR CA C 13 64.364 0.046 . 1 . . . . 35 THR CA . 26691 1
447 . 1 1 38 38 THR CB C 13 69.192 0.026 . 1 . . . . 35 THR CB . 26691 1
448 . 1 1 38 38 THR CG2 C 13 22.056 0.037 . 1 . . . . 35 THR CG2 . 26691 1
449 . 1 1 39 39 ARG HA H 1 4.05 0.003 . 1 . . . . 36 ARG HA . 26691 1
450 . 1 1 39 39 ARG HB2 H 1 1.86 0.013 . 2 . . . . 36 ARG HB . 26691 1
451 . 1 1 39 39 ARG HB3 H 1 1.86 0.013 . 2 . . . . 36 ARG HB . 26691 1
452 . 1 1 39 39 ARG HG2 H 1 1.83 0.006 . 1 . . . . 36 ARG HG2 . 26691 1
453 . 1 1 39 39 ARG HG3 H 1 1.647 0.006 . 1 . . . . 36 ARG HG3 . 26691 1
454 . 1 1 39 39 ARG HD2 H 1 3.318 0.005 . 1 . . . . 36 ARG HD2 . 26691 1
455 . 1 1 39 39 ARG HD3 H 1 3.01 0.004 . 1 . . . . 36 ARG HD3 . 26691 1
456 . 1 1 39 39 ARG CA C 13 59.034 0.040 . 1 . . . . 36 ARG CA . 26691 1
457 . 1 1 39 39 ARG CB C 13 31.467 0.055 . 1 . . . . 36 ARG CB . 26691 1
458 . 1 1 39 39 ARG CG C 13 26.104 0.037 . 1 . . . . 36 ARG CG . 26691 1
459 . 1 1 39 39 ARG CD C 13 43.861 0.070 . 1 . . . . 36 ARG CD . 26691 1
460 . 1 1 40 40 ASP H H 1 8.011 0.003 . 1 . . . . 37 ASP H . 26691 1
461 . 1 1 40 40 ASP HA H 1 4.786 0.003 . 1 . . . . 37 ASP HA . 26691 1
462 . 1 1 40 40 ASP HB2 H 1 2.922 0.006 . 1 . . . . 37 ASP HB2 . 26691 1
463 . 1 1 40 40 ASP HB3 H 1 2.56 0.006 . 1 . . . . 37 ASP HB3 . 26691 1
464 . 1 1 40 40 ASP C C 13 177.616 0.000 . 1 . . . . 37 ASP C . 26691 1
465 . 1 1 40 40 ASP CA C 13 54.135 0.041 . 1 . . . . 37 ASP CA . 26691 1
466 . 1 1 40 40 ASP CB C 13 40.36 0.094 . 1 . . . . 37 ASP CB . 26691 1
467 . 1 1 40 40 ASP N N 15 113.984 0.020 . 1 . . . . 37 ASP N . 26691 1
468 . 1 1 41 41 ASN H H 1 7.474 0.006 . 1 . . . . 38 ASN H . 26691 1
469 . 1 1 41 41 ASN HA H 1 4.342 0.003 . 1 . . . . 38 ASN HA . 26691 1
470 . 1 1 41 41 ASN HB2 H 1 3.072 0.005 . 1 . . . . 38 ASN HB2 . 26691 1
471 . 1 1 41 41 ASN HB3 H 1 2.668 0.006 . 1 . . . . 38 ASN HB3 . 26691 1
472 . 1 1 41 41 ASN HD21 H 1 7.479 0.004 . 1 . . . . 38 ASN HD21 . 26691 1
473 . 1 1 41 41 ASN HD22 H 1 6.736 0.002 . 1 . . . . 38 ASN HD22 . 26691 1
474 . 1 1 41 41 ASN C C 13 175.772 0.000 . 1 . . . . 38 ASN C . 26691 1
475 . 1 1 41 41 ASN CA C 13 54.024 0.033 . 1 . . . . 38 ASN CA . 26691 1
476 . 1 1 41 41 ASN CB C 13 37.225 0.044 . 1 . . . . 38 ASN CB . 26691 1
477 . 1 1 41 41 ASN N N 15 117.891 0.014 . 1 . . . . 38 ASN N . 26691 1
478 . 1 1 41 41 ASN ND2 N 15 111.992 0.015 . 1 . . . . 38 ASN ND2 . 26691 1
479 . 1 1 42 42 CYS H H 1 7.696 0.003 . 1 . . . . 39 CYS H . 26691 1
480 . 1 1 42 42 CYS HA H 1 4.511 0.008 . 1 . . . . 39 CYS HA . 26691 1
481 . 1 1 42 42 CYS HB2 H 1 2.456 0.005 . 1 . . . . 39 CYS HB2 . 26691 1
482 . 1 1 42 42 CYS HB3 H 1 2.239 0.003 . 1 . . . . 39 CYS HB3 . 26691 1
483 . 1 1 42 42 CYS C C 13 173.534 0.000 . 1 . . . . 39 CYS C . 26691 1
484 . 1 1 42 42 CYS CA C 13 58.346 0.074 . 1 . . . . 39 CYS CA . 26691 1
485 . 1 1 42 42 CYS CB C 13 30.842 0.029 . 1 . . . . 39 CYS CB . 26691 1
486 . 1 1 42 42 CYS N N 15 120.336 0.017 . 1 . . . . 39 CYS N . 26691 1
487 . 1 1 43 43 SER H H 1 8.471 0.013 . 1 . . . . 40 SER H . 26691 1
488 . 1 1 43 43 SER HA H 1 4.306 0.006 . 1 . . . . 40 SER HA . 26691 1
489 . 1 1 43 43 SER HB2 H 1 3.97 0.005 . 1 . . . . 40 SER HB2 . 26691 1
490 . 1 1 43 43 SER HB3 H 1 3.904 0.009 . 1 . . . . 40 SER HB3 . 26691 1
491 . 1 1 43 43 SER C C 13 175.553 0.000 . 1 . . . . 40 SER C . 26691 1
492 . 1 1 43 43 SER CA C 13 59.143 0.051 . 1 . . . . 40 SER CA . 26691 1
493 . 1 1 43 43 SER CB C 13 64.057 0.020 . 1 . . . . 40 SER CB . 26691 1
494 . 1 1 43 43 SER N N 15 121.737 0.033 . 1 . . . . 40 SER N . 26691 1
495 . 1 1 44 44 GLY HA2 H 1 4.098 0.004 . 1 . . . . 41 GLY HA2 . 26691 1
496 . 1 1 44 44 GLY HA3 H 1 3.954 0.004 . 1 . . . . 41 GLY HA3 . 26691 1
497 . 1 1 44 44 GLY CA C 13 45.91 0.009 . 1 . . . . 41 GLY CA . 26691 1
498 . 1 1 45 45 GLN H H 1 8.011 0.002 . 1 . . . . 42 GLN H . 26691 1
499 . 1 1 45 45 GLN HA H 1 4.554 0.004 . 1 . . . . 42 GLN HA . 26691 1
500 . 1 1 45 45 GLN HB2 H 1 2.058 0.006 . 1 . . . . 42 GLN HB2 . 26691 1
501 . 1 1 45 45 GLN HB3 H 1 1.9 0.004 . 1 . . . . 42 GLN HB3 . 26691 1
502 . 1 1 45 45 GLN HG2 H 1 2.311 0.004 . 2 . . . . 42 GLN HG . 26691 1
503 . 1 1 45 45 GLN HG3 H 1 2.311 0.004 . 2 . . . . 42 GLN HG . 26691 1
504 . 1 1 45 45 GLN HE21 H 1 7.432 0.004 . 1 . . . . 42 GLN HE21 . 26691 1
505 . 1 1 45 45 GLN HE22 H 1 6.8 0.003 . 1 . . . . 42 GLN HE22 . 26691 1
506 . 1 1 45 45 GLN C C 13 173.004 0.000 . 1 . . . . 42 GLN C . 26691 1
507 . 1 1 45 45 GLN CA C 13 55.08 0.033 . 1 . . . . 42 GLN CA . 26691 1
508 . 1 1 45 45 GLN CB C 13 30.613 0.049 . 1 . . . . 42 GLN CB . 26691 1
509 . 1 1 45 45 GLN CG C 13 33.572 0.051 . 1 . . . . 42 GLN CG . 26691 1
510 . 1 1 45 45 GLN N N 15 118.668 0.011 . 1 . . . . 42 GLN N . 26691 1
511 . 1 1 45 45 GLN NE2 N 15 111.934 0.002 . 1 . . . . 42 GLN NE2 . 26691 1
512 . 1 1 46 46 THR HB H 1 4.214 0.004 . 1 . . . . 43 THR HB . 26691 1
513 . 1 1 46 46 THR HG21 H 1 1.136 0.003 . 1 . . . . 43 THR HG2 . 26691 1
514 . 1 1 46 46 THR HG22 H 1 1.136 0.003 . 1 . . . . 43 THR HG2 . 26691 1
515 . 1 1 46 46 THR HG23 H 1 1.136 0.003 . 1 . . . . 43 THR HG2 . 26691 1
516 . 1 1 46 46 THR CB C 13 69.631 0.060 . 1 . . . . 43 THR CB . 26691 1
517 . 1 1 46 46 THR CG2 C 13 21.749 0.024 . 1 . . . . 43 THR CG2 . 26691 1
518 . 1 1 47 47 HIS CA C 13 55.501 0.039 . 1 . . . . 44 HIS CA . 26691 1
519 . 1 1 47 47 HIS CB C 13 30.54 0.000 . 1 . . . . 44 HIS CB . 26691 1
520 . 1 1 48 48 ASP H H 1 8.156 0.017 . 1 . . . . 45 ASP H . 26691 1
521 . 1 1 48 48 ASP C C 13 173.797 0.000 . 1 . . . . 45 ASP C . 26691 1
522 . 1 1 48 48 ASP CA C 13 56.043 0.000 . 1 . . . . 45 ASP CA . 26691 1
523 . 1 1 48 48 ASP N N 15 127.049 0.038 . 1 . . . . 45 ASP N . 26691 1
stop_
save_