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 26674
_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-1H TOCSY' . . . 26674 1
2 '2D 1H-1H NOESY' . . . 26674 1
3 '2D DQF-COSY' . . . 26674 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $CcpNmr . . 26674 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 3.779 0.017 . 2 . . . . 1 Gly HA2 . 26674 1
2 . 1 1 1 1 GLY HA3 H 1 3.888 0.007 . 2 . . . . 1 Gly HA3 . 26674 1
3 . 1 1 1 1 GLY CA C 13 42.742 0.009 . 1 . . . . 1 Gly CA . 26674 1
4 . 1 1 2 2 TRP H H 1 8.485 0.002 . 1 . . . . 2 Trp H . 26674 1
5 . 1 1 2 2 TRP HA H 1 4.831 0.011 . 1 . . . . 2 Trp HA . 26674 1
6 . 1 1 2 2 TRP HB2 H 1 2.682 0.000 . 2 . . . . 2 Trp HB2 . 26674 1
7 . 1 1 2 2 TRP HB3 H 1 3.293 0.013 . 2 . . . . 2 Trp HB3 . 26674 1
8 . 1 1 2 2 TRP HD1 H 1 7.310 0.011 . 1 . . . . 2 Trp HD1 . 26674 1
9 . 1 1 2 2 TRP HE1 H 1 10.171 0.002 . 1 . . . . 2 Trp HE1 . 26674 1
10 . 1 1 2 2 TRP HE3 H 1 7.571 0.001 . 1 . . . . 2 Trp HE3 . 26674 1
11 . 1 1 2 2 TRP HZ2 H 1 7.512 0.007 . 1 . . . . 2 Trp HZ2 . 26674 1
12 . 1 1 2 2 TRP HZ3 H 1 7.080 0.014 . 1 . . . . 2 Trp HZ3 . 26674 1
13 . 1 1 2 2 TRP HH2 H 1 7.233 0.009 . 1 . . . . 2 Trp HH2 . 26674 1
14 . 1 1 2 2 TRP CB C 13 29.326 0.000 . 1 . . . . 2 Trp CB . 26674 1
15 . 1 1 2 2 TRP CE3 C 13 120.633 0.000 . 1 . . . . 2 Trp CE3 . 26674 1
16 . 1 1 2 2 TRP CZ2 C 13 114.431 0.000 . 1 . . . . 2 Trp CZ2 . 26674 1
17 . 1 1 2 2 TRP CZ3 C 13 121.868 0.000 . 1 . . . . 2 Trp CZ3 . 26674 1
18 . 1 1 2 2 TRP N N 15 120.397 0.000 . 1 . . . . 2 Trp N . 26674 1
19 . 1 1 3 3 CYS H H 1 7.732 0.005 . 1 . . . . 3 Cys H . 26674 1
20 . 1 1 3 3 CYS HA H 1 4.633 0.000 . 1 . . . . 3 Cys HA . 26674 1
21 . 1 1 3 3 CYS HB2 H 1 2.441 0.000 . 2 . . . . 3 Cys HB2 . 26674 1
22 . 1 1 3 3 CYS HB3 H 1 2.791 0.000 . 2 . . . . 3 Cys HB3 . 26674 1
23 . 1 1 3 3 CYS CA C 13 53.194 0.000 . 1 . . . . 3 Cys CA . 26674 1
24 . 1 1 3 3 CYS CB C 13 42.423 0.013 . 1 . . . . 3 Cys CB . 26674 1
25 . 1 1 4 4 GLY H H 1 9.145 0.002 . 1 . . . . 4 Gly H . 26674 1
26 . 1 1 4 4 GLY HA2 H 1 3.587 0.000 . 2 . . . . 4 Gly HA2 . 26674 1
27 . 1 1 4 4 GLY HA3 H 1 4.078 0.000 . 2 . . . . 4 Gly HA3 . 26674 1
28 . 1 1 4 4 GLY CA C 13 44.458 0.000 . 1 . . . . 4 Gly CA . 26674 1
29 . 1 1 5 5 ASP H H 1 9.039 0.005 . 1 . . . . 5 Asp H . 26674 1
30 . 1 1 5 5 ASP HA H 1 4.610 0.003 . 1 . . . . 5 Asp HA . 26674 1
31 . 1 1 5 5 ASP HB2 H 1 2.572 0.031 . 2 . . . . 5 Asp HB2 . 26674 1
32 . 1 1 5 5 ASP HB3 H 1 2.846 0.028 . 2 . . . . 5 Asp HB3 . 26674 1
33 . 1 1 5 5 ASP CA C 13 52.553 0.000 . 1 . . . . 5 Asp CA . 26674 1
34 . 1 1 5 5 ASP N N 15 129.349 0.000 . 1 . . . . 5 Asp N . 26674 1
35 . 1 1 6 6 HYP HA H 1 4.121 0.005 . 1 . . . . 6 HYP HA . 26674 1
36 . 1 1 6 6 HYP HB2 H 1 2.023 0.006 . 2 . . . . 6 HYP HB2 . 26674 1
37 . 1 1 6 6 HYP HB3 H 1 2.134 0.009 . 2 . . . . 6 HYP HB3 . 26674 1
38 . 1 1 6 6 HYP HG2 H 1 4.742 0.001 . 1 . . . . 6 HYP HG2 . 26674 1
39 . 1 1 6 6 HYP HD3 H 1 3.740 0.010 . 1 . . . . 6 HYP HD3 . 26674 1
40 . 1 1 6 6 HYP CA C 13 62.581 0.000 . 1 . . . . 6 HYP CA . 26674 1
41 . 1 1 6 6 HYP CB C 13 38.696 0.033 . 1 . . . . 6 HYP CB . 26674 1
42 . 1 1 6 6 HYP CD C 13 57.716 0.037 . 1 . . . . 6 HYP CD . 26674 1
43 . 1 1 7 7 GLY H H 1 9.434 0.004 . 1 . . . . 7 Gly H . 26674 1
44 . 1 1 7 7 GLY HA2 H 1 3.593 0.005 . 2 . . . . 7 Gly HA2 . 26674 1
45 . 1 1 7 7 GLY HA3 H 1 4.527 0.000 . 2 . . . . 7 Gly HA3 . 26674 1
46 . 1 1 7 7 GLY CA C 13 44.332 0.018 . 1 . . . . 7 Gly CA . 26674 1
47 . 1 1 7 7 GLY N N 15 114.740 0.000 . 1 . . . . 7 Gly N . 26674 1
48 . 1 1 8 8 ALA H H 1 8.295 0.004 . 1 . . . . 8 Ala H . 26674 1
49 . 1 1 8 8 ALA HA H 1 4.375 0.000 . 1 . . . . 8 Ala HA . 26674 1
50 . 1 1 8 8 ALA HB1 H 1 1.486 0.006 . 1 . . . . 8 Ala HB1 . 26674 1
51 . 1 1 8 8 ALA HB2 H 1 1.486 0.006 . 1 . . . . 8 Ala HB2 . 26674 1
52 . 1 1 8 8 ALA HB3 H 1 1.486 0.006 . 1 . . . . 8 Ala HB3 . 26674 1
53 . 1 1 8 8 ALA CA C 13 51.761 0.000 . 1 . . . . 8 Ala CA . 26674 1
54 . 1 1 8 8 ALA CB C 13 19.499 0.000 . 1 . . . . 8 Ala CB . 26674 1
55 . 1 1 8 8 ALA N N 15 123.822 0.000 . 1 . . . . 8 Ala N . 26674 1
56 . 1 1 9 9 THR H H 1 8.464 0.001 . 1 . . . . 9 Thr H . 26674 1
57 . 1 1 9 9 THR HA H 1 4.686 0.000 . 1 . . . . 9 Thr HA . 26674 1
58 . 1 1 9 9 THR HB H 1 4.025 0.002 . 1 . . . . 9 Thr HB . 26674 1
59 . 1 1 9 9 THR HG21 H 1 1.310 0.006 . 1 . . . . 9 Thr HG21 . 26674 1
60 . 1 1 9 9 THR HG22 H 1 1.310 0.006 . 1 . . . . 9 Thr HG22 . 26674 1
61 . 1 1 9 9 THR HG23 H 1 1.310 0.006 . 1 . . . . 9 Thr HG23 . 26674 1
62 . 1 1 9 9 THR CA C 13 63.003 0.000 . 1 . . . . 9 Thr CA . 26674 1
63 . 1 1 9 9 THR CB C 13 69.033 0.000 . 1 . . . . 9 Thr CB . 26674 1
64 . 1 1 9 9 THR N N 15 126.097 0.000 . 1 . . . . 9 Thr N . 26674 1
65 . 1 1 10 10 CYS H H 1 8.246 0.005 . 1 . . . . 10 Cys H . 26674 1
66 . 1 1 10 10 CYS HA H 1 4.812 0.016 . 1 . . . . 10 Cys HA . 26674 1
67 . 1 1 10 10 CYS HB2 H 1 3.134 0.009 . 2 . . . . 10 Cys HB2 . 26674 1
68 . 1 1 10 10 CYS HB3 H 1 3.255 0.002 . 2 . . . . 10 Cys HB3 . 26674 1
69 . 1 1 10 10 CYS CA C 13 54.034 0.000 . 1 . . . . 10 Cys CA . 26674 1
70 . 1 1 10 10 CYS CB C 13 46.146 0.003 . 1 . . . . 10 Cys CB . 26674 1
71 . 1 1 10 10 CYS N N 15 121.365 0.000 . 1 . . . . 10 Cys N . 26674 1
72 . 1 1 11 11 GLY H H 1 8.378 0.003 . 1 . . . . 11 Gly H . 26674 1
73 . 1 1 11 11 GLY HA2 H 1 3.715 0.008 . 2 . . . . 11 Gly HA2 . 26674 1
74 . 1 1 11 11 GLY HA3 H 1 4.219 0.012 . 2 . . . . 11 Gly HA3 . 26674 1
75 . 1 1 11 11 GLY CA C 13 44.275 0.014 . 1 . . . . 11 Gly CA . 26674 1
76 . 1 1 11 11 GLY N N 15 108.432 0.000 . 1 . . . . 11 Gly N . 26674 1
77 . 1 1 12 12 LYS H H 1 8.163 0.003 . 1 . . . . 12 Lys H . 26674 1
78 . 1 1 12 12 LYS HA H 1 4.198 0.004 . 1 . . . . 12 Lys HA . 26674 1
79 . 1 1 12 12 LYS HB2 H 1 1.806 0.000 . 2 . . . . 12 Lys HB2 . 26674 1
80 . 1 1 12 12 LYS HB3 H 1 1.745 0.001 . 2 . . . . 12 Lys HB3 . 26674 1
81 . 1 1 12 12 LYS HG3 H 1 1.399 0.001 . 1 . . . . 12 Lys HG3 . 26674 1
82 . 1 1 12 12 LYS HD3 H 1 1.664 0.001 . 1 . . . . 12 Lys HD3 . 26674 1
83 . 1 1 12 12 LYS HE3 H 1 2.962 0.001 . 1 . . . . 12 Lys HE3 . 26674 1
84 . 1 1 12 12 LYS HZ1 H 1 7.540 0.008 . 1 . . . . 12 Lys HZ1 . 26674 1
85 . 1 1 12 12 LYS HZ2 H 1 7.540 0.008 . 1 . . . . 12 Lys HZ2 . 26674 1
86 . 1 1 12 12 LYS HZ3 H 1 7.540 0.008 . 1 . . . . 12 Lys HZ3 . 26674 1
87 . 1 1 12 12 LYS CA C 13 57.287 0.000 . 1 . . . . 12 Lys CA . 26674 1
88 . 1 1 12 12 LYS CB C 13 32.917 0.000 . 1 . . . . 12 Lys CB . 26674 1
89 . 1 1 12 12 LYS N N 15 120.672 0.000 . 1 . . . . 12 Lys N . 26674 1
90 . 1 1 13 13 LEU H H 1 8.507 0.002 . 1 . . . . 13 Leu H . 26674 1
91 . 1 1 13 13 LEU HA H 1 4.194 0.007 . 1 . . . . 13 Leu HA . 26674 1
92 . 1 1 13 13 LEU HB2 H 1 1.631 0.006 . 2 . . . . 13 Leu HB2 . 26674 1
93 . 1 1 13 13 LEU HB3 H 1 1.768 0.017 . 2 . . . . 13 Leu HB3 . 26674 1
94 . 1 1 13 13 LEU HG H 1 1.534 0.000 . 1 . . . . 13 Leu HG . 26674 1
95 . 1 1 13 13 LEU HD21 H 1 0.888 0.013 . 1 . . . . 13 Leu HD21 . 26674 1
96 . 1 1 13 13 LEU HD22 H 1 0.888 0.013 . 1 . . . . 13 Leu HD22 . 26674 1
97 . 1 1 13 13 LEU HD23 H 1 0.888 0.013 . 1 . . . . 13 Leu HD23 . 26674 1
98 . 1 1 13 13 LEU CA C 13 55.706 0.000 . 1 . . . . 13 Leu CA . 26674 1
99 . 1 1 13 13 LEU CB C 13 40.782 0.009 . 1 . . . . 13 Leu CB . 26674 1
100 . 1 1 13 13 LEU N N 15 118.533 0.000 . 1 . . . . 13 Leu N . 26674 1
101 . 1 1 14 14 ARG H H 1 7.918 0.004 . 1 . . . . 14 Arg H . 26674 1
102 . 1 1 14 14 ARG HA H 1 4.332 0.002 . 1 . . . . 14 Arg HA . 26674 1
103 . 1 1 14 14 ARG HB2 H 1 1.899 0.002 . 2 . . . . 14 Arg HB2 . 26674 1
104 . 1 1 14 14 ARG HB3 H 1 1.747 0.003 . 2 . . . . 14 Arg HB3 . 26674 1
105 . 1 1 14 14 ARG HG2 H 1 1.371 0.000 . 2 . . . . 14 Arg HG2 . 26674 1
106 . 1 1 14 14 ARG HG3 H 1 1.493 0.002 . 2 . . . . 14 Arg HG3 . 26674 1
107 . 1 1 14 14 ARG HD2 H 1 3.048 0.001 . 1 . . . . 14 Arg HD2 . 26674 1
108 . 1 1 14 14 ARG HE H 1 7.105 0.000 . 1 . . . . 14 Arg HE . 26674 1
109 . 1 1 14 14 ARG CA C 13 54.439 0.000 . 1 . . . . 14 Arg CA . 26674 1
110 . 1 1 14 14 ARG CB C 13 30.635 0.000 . 1 . . . . 14 Arg CB . 26674 1
111 . 1 1 14 14 ARG N N 15 118.619 0.000 . 1 . . . . 14 Arg N . 26674 1
112 . 1 1 15 15 LEU H H 1 8.072 0.004 . 1 . . . . 15 Leu H . 26674 1
113 . 1 1 15 15 LEU HA H 1 4.281 0.004 . 1 . . . . 15 Leu HA . 26674 1
114 . 1 1 15 15 LEU HB2 H 1 1.559 0.012 . 2 . . . . 15 Leu HB2 . 26674 1
115 . 1 1 15 15 LEU HB3 H 1 1.590 0.000 . 2 . . . . 15 Leu HB3 . 26674 1
116 . 1 1 15 15 LEU HG H 1 1.481 0.001 . 1 . . . . 15 Leu HG . 26674 1
117 . 1 1 15 15 LEU HD11 H 1 0.760 0.005 . 1 . . . . 15 Leu HD11 . 26674 1
118 . 1 1 15 15 LEU HD12 H 1 0.760 0.005 . 1 . . . . 15 Leu HD12 . 26674 1
119 . 1 1 15 15 LEU HD13 H 1 0.760 0.005 . 1 . . . . 15 Leu HD13 . 26674 1
120 . 1 1 15 15 LEU CA C 13 54.698 0.000 . 1 . . . . 15 Leu CA . 26674 1
121 . 1 1 15 15 LEU CB C 13 41.642 0.000 . 1 . . . . 15 Leu CB . 26674 1
122 . 1 1 15 15 LEU N N 15 120.967 0.000 . 1 . . . . 15 Leu N . 26674 1
123 . 1 1 16 16 TYR H H 1 8.265 0.004 . 1 . . . . 16 Tyr H . 26674 1
124 . 1 1 16 16 TYR HA H 1 4.619 0.011 . 1 . . . . 16 Tyr HA . 26674 1
125 . 1 1 16 16 TYR HB2 H 1 3.050 0.008 . 2 . . . . 16 Tyr HB2 . 26674 1
126 . 1 1 16 16 TYR HB3 H 1 3.047 0.001 . 2 . . . . 16 Tyr HB3 . 26674 1
127 . 1 1 16 16 TYR HD1 H 1 7.169 0.006 . 3 . . . . 16 Tyr HD1 . 26674 1
128 . 1 1 16 16 TYR HD2 H 1 7.169 0.006 . 3 . . . . 16 Tyr HD2 . 26674 1
129 . 1 1 16 16 TYR HE1 H 1 6.861 0.005 . 3 . . . . 16 Tyr HE1 . 26674 1
130 . 1 1 16 16 TYR HE2 H 1 6.861 0.005 . 3 . . . . 16 Tyr HE2 . 26674 1
131 . 1 1 16 16 TYR CA C 13 56.984 0.000 . 1 . . . . 16 Tyr CA . 26674 1
132 . 1 1 16 16 TYR CB C 13 39.033 0.000 . 1 . . . . 16 Tyr CB . 26674 1
133 . 1 1 16 16 TYR N N 15 123.142 0.000 . 1 . . . . 16 Tyr N . 26674 1
134 . 1 1 17 17 CYS H H 1 9.056 0.002 . 1 . . . . 17 Cys H . 26674 1
135 . 1 1 17 17 CYS HA H 1 4.657 0.015 . 1 . . . . 17 Cys HA . 26674 1
136 . 1 1 17 17 CYS HB2 H 1 2.351 0.010 . 2 . . . . 17 Cys HB2 . 26674 1
137 . 1 1 17 17 CYS HB3 H 1 3.296 0.008 . 2 . . . . 17 Cys HB3 . 26674 1
138 . 1 1 17 17 CYS CA C 13 54.470 0.000 . 1 . . . . 17 Cys CA . 26674 1
139 . 1 1 17 17 CYS CB C 13 36.672 0.008 . 1 . . . . 17 Cys CB . 26674 1
140 . 1 1 17 17 CYS N N 15 122.333 0.000 . 1 . . . . 17 Cys N . 26674 1
141 . 1 1 18 18 CYS H H 1 10.117 0.001 . 1 . . . . 18 Cys H . 26674 1
142 . 1 1 18 18 CYS HA H 1 4.320 0.009 . 1 . . . . 18 Cys HA . 26674 1
143 . 1 1 18 18 CYS HB2 H 1 2.719 0.007 . 2 . . . . 18 Cys HB2 . 26674 1
144 . 1 1 18 18 CYS HB3 H 1 3.162 0.015 . 2 . . . . 18 Cys HB3 . 26674 1
145 . 1 1 18 18 CYS CA C 13 56.187 0.000 . 1 . . . . 18 Cys CA . 26674 1
146 . 1 1 18 18 CYS CB C 13 38.387 0.000 . 1 . . . . 18 Cys CB . 26674 1
147 . 1 1 18 18 CYS N N 15 127.803 0.000 . 1 . . . . 18 Cys N . 26674 1
148 . 1 1 19 19 SER H H 1 9.244 0.002 . 1 . . . . 19 Ser H . 26674 1
149 . 1 1 19 19 SER HA H 1 4.272 0.014 . 1 . . . . 19 Ser HA . 26674 1
150 . 1 1 19 19 SER HB2 H 1 3.732 0.007 . 2 . . . . 19 Ser HB2 . 26674 1
151 . 1 1 19 19 SER HB3 H 1 4.256 0.000 . 2 . . . . 19 Ser HB3 . 26674 1
152 . 1 1 19 19 SER CA C 13 57.842 0.000 . 1 . . . . 19 Ser CA . 26674 1
153 . 1 1 19 19 SER CB C 13 64.654 0.005 . 1 . . . . 19 Ser CB . 26674 1
154 . 1 1 19 19 SER N N 15 113.457 0.000 . 1 . . . . 19 Ser N . 26674 1
155 . 1 1 20 20 GLY H H 1 7.720 0.002 . 1 . . . . 20 Gly H . 26674 1
156 . 1 1 20 20 GLY HA2 H 1 3.794 0.008 . 2 . . . . 20 Gly HA2 . 26674 1
157 . 1 1 20 20 GLY HA3 H 1 4.264 0.006 . 2 . . . . 20 Gly HA3 . 26674 1
158 . 1 1 20 20 GLY CA C 13 45.048 0.000 . 1 . . . . 20 Gly CA . 26674 1
159 . 1 1 20 20 GLY N N 15 108.007 0.000 . 1 . . . . 20 Gly N . 26674 1
160 . 1 1 21 21 PHE H H 1 8.622 0.002 . 1 . . . . 21 Phe H . 26674 1
161 . 1 1 21 21 PHE HA H 1 4.966 0.019 . 1 . . . . 21 Phe HA . 26674 1
162 . 1 1 21 21 PHE HB2 H 1 2.794 0.007 . 2 . . . . 21 Phe HB2 . 26674 1
163 . 1 1 21 21 PHE HB3 H 1 3.182 0.001 . 2 . . . . 21 Phe HB3 . 26674 1
164 . 1 1 21 21 PHE HD1 H 1 7.143 0.003 . 3 . . . . 21 Phe HD1 . 26674 1
165 . 1 1 21 21 PHE HD2 H 1 7.143 0.003 . 3 . . . . 21 Phe HD2 . 26674 1
166 . 1 1 21 21 PHE HE1 H 1 7.358 0.003 . 3 . . . . 21 Phe HE1 . 26674 1
167 . 1 1 21 21 PHE HE2 H 1 7.358 0.003 . 3 . . . . 21 Phe HE2 . 26674 1
168 . 1 1 21 21 PHE HZ H 1 7.409 0.002 . 1 . . . . 21 Phe HZ . 26674 1
169 . 1 1 21 21 PHE CA C 13 56.167 0.000 . 1 . . . . 21 Phe CA . 26674 1
170 . 1 1 21 21 PHE CB C 13 40.016 0.025 . 1 . . . . 21 Phe CB . 26674 1
171 . 1 1 21 21 PHE N N 15 122.142 0.000 . 1 . . . . 21 Phe N . 26674 1
172 . 1 1 22 22 CYS H H 1 8.447 0.003 . 1 . . . . 22 Cys H . 26674 1
173 . 1 1 22 22 CYS HA H 1 4.733 0.005 . 1 . . . . 22 Cys HA . 26674 1
174 . 1 1 22 22 CYS HB2 H 1 2.672 0.001 . 2 . . . . 22 Cys HB2 . 26674 1
175 . 1 1 22 22 CYS HB3 H 1 3.016 0.012 . 2 . . . . 22 Cys HB3 . 26674 1
176 . 1 1 22 22 CYS CA C 13 53.219 0.000 . 1 . . . . 22 Cys CA . 26674 1
177 . 1 1 22 22 CYS CB C 13 39.353 0.028 . 1 . . . . 22 Cys CB . 26674 1
178 . 1 1 22 22 CYS N N 15 116.713 0.000 . 1 . . . . 22 Cys N . 26674 1
179 . 1 1 23 23 ASP H H 1 8.290 0.002 . 1 . . . . 23 Asp H . 26674 1
180 . 1 1 23 23 ASP HA H 1 4.313 0.001 . 1 . . . . 23 Asp HA . 26674 1
181 . 1 1 23 23 ASP HB2 H 1 2.369 0.003 . 2 . . . . 23 Asp HB2 . 26674 1
182 . 1 1 23 23 ASP HB3 H 1 3.280 0.004 . 2 . . . . 23 Asp HB3 . 26674 1
183 . 1 1 23 23 ASP CA C 13 53.094 0.000 . 1 . . . . 23 Asp CA . 26674 1
184 . 1 1 23 23 ASP CB C 13 38.963 0.000 . 1 . . . . 23 Asp CB . 26674 1
185 . 1 1 23 23 ASP N N 15 129.376 0.000 . 1 . . . . 23 Asp N . 26674 1
186 . 1 1 24 24 SER H H 1 8.762 0.003 . 1 . . . . 24 Ser H . 26674 1
187 . 1 1 24 24 SER HA H 1 4.043 0.005 . 1 . . . . 24 Ser HA . 26674 1
188 . 1 1 24 24 SER HB3 H 1 3.849 0.003 . 1 . . . . 24 Ser HB3 . 26674 1
189 . 1 1 24 24 SER CA C 13 60.577 0.000 . 1 . . . . 24 Ser CA . 26674 1
190 . 1 1 24 24 SER CB C 13 62.597 0.000 . 1 . . . . 24 Ser CB . 26674 1
191 . 1 1 24 24 SER N N 15 121.077 0.000 . 1 . . . . 24 Ser N . 26674 1
192 . 1 1 25 25 TYR H H 1 8.263 0.008 . 1 . . . . 25 Tyr H . 26674 1
193 . 1 1 25 25 TYR HA H 1 4.449 0.003 . 1 . . . . 25 Tyr HA . 26674 1
194 . 1 1 25 25 TYR HB2 H 1 3.265 0.004 . 2 . . . . 25 Tyr HB2 . 26674 1
195 . 1 1 25 25 TYR HB3 H 1 3.224 0.005 . 2 . . . . 25 Tyr HB3 . 26674 1
196 . 1 1 25 25 TYR HD1 H 1 7.277 0.004 . 3 . . . . 25 Tyr HD1 . 26674 1
197 . 1 1 25 25 TYR HD2 H 1 7.277 0.004 . 3 . . . . 25 Tyr HD2 . 26674 1
198 . 1 1 25 25 TYR HE1 H 1 6.886 0.004 . 3 . . . . 25 Tyr HE1 . 26674 1
199 . 1 1 25 25 TYR HE2 H 1 6.886 0.004 . 3 . . . . 25 Tyr HE2 . 26674 1
200 . 1 1 25 25 TYR CA C 13 60.270 0.000 . 1 . . . . 25 Tyr CA . 26674 1
201 . 1 1 25 25 TYR CB C 13 37.771 0.000 . 1 . . . . 25 Tyr CB . 26674 1
202 . 1 1 25 25 TYR N N 15 120.608 0.000 . 1 . . . . 25 Tyr N . 26674 1
203 . 1 1 26 26 THR H H 1 7.680 0.002 . 1 . . . . 26 Thr H . 26674 1
204 . 1 1 26 26 THR HA H 1 4.205 0.011 . 1 . . . . 26 Thr HA . 26674 1
205 . 1 1 26 26 THR HB H 1 4.345 0.008 . 1 . . . . 26 Thr HB . 26674 1
206 . 1 1 26 26 THR HG21 H 1 1.246 0.006 . 1 . . . . 26 Thr HG21 . 26674 1
207 . 1 1 26 26 THR HG22 H 1 1.246 0.006 . 1 . . . . 26 Thr HG22 . 26674 1
208 . 1 1 26 26 THR HG23 H 1 1.246 0.006 . 1 . . . . 26 Thr HG23 . 26674 1
209 . 1 1 26 26 THR CA C 13 61.597 0.000 . 1 . . . . 26 Thr CA . 26674 1
210 . 1 1 26 26 THR CB C 13 69.313 0.000 . 1 . . . . 26 Thr CB . 26674 1
211 . 1 1 26 26 THR N N 15 106.849 0.000 . 1 . . . . 26 Thr N . 26674 1
212 . 1 1 27 27 LYS H H 1 8.387 0.004 . 1 . . . . 27 Lys H . 26674 1
213 . 1 1 27 27 LYS HA H 1 3.764 0.009 . 1 . . . . 27 Lys HA . 26674 1
214 . 1 1 27 27 LYS HB2 H 1 2.111 0.003 . 2 . . . . 27 Lys HB2 . 26674 1
215 . 1 1 27 27 LYS HB3 H 1 2.171 0.003 . 2 . . . . 27 Lys HB3 . 26674 1
216 . 1 1 27 27 LYS HG2 H 1 1.337 0.001 . 2 . . . . 27 Lys HG2 . 26674 1
217 . 1 1 27 27 LYS HG3 H 1 1.335 0.001 . 2 . . . . 27 Lys HG3 . 26674 1
218 . 1 1 27 27 LYS HD2 H 1 1.610 0.003 . 2 . . . . 27 Lys HD2 . 26674 1
219 . 1 1 27 27 LYS HD3 H 1 1.687 0.021 . 2 . . . . 27 Lys HD3 . 26674 1
220 . 1 1 27 27 LYS HE2 H 1 3.029 0.003 . 2 . . . . 27 Lys HE2 . 26674 1
221 . 1 1 27 27 LYS HE3 H 1 3.032 0.005 . 2 . . . . 27 Lys HE3 . 26674 1
222 . 1 1 27 27 LYS HZ1 H 1 7.477 0.014 . 1 . . . . 27 Lys HZ1 . 26674 1
223 . 1 1 27 27 LYS HZ2 H 1 7.477 0.014 . 1 . . . . 27 Lys HZ2 . 26674 1
224 . 1 1 27 27 LYS HZ3 H 1 7.477 0.014 . 1 . . . . 27 Lys HZ3 . 26674 1
225 . 1 1 27 27 LYS CA C 13 57.221 0.000 . 1 . . . . 27 Lys CA . 26674 1
226 . 1 1 27 27 LYS N N 15 119.520 0.000 . 1 . . . . 27 Lys N . 26674 1
227 . 1 1 28 28 THR H H 1 7.172 0.003 . 1 . . . . 28 Thr H . 26674 1
228 . 1 1 28 28 THR HA H 1 5.291 0.007 . 1 . . . . 28 Thr HA . 26674 1
229 . 1 1 28 28 THR HB H 1 3.738 0.018 . 1 . . . . 28 Thr HB . 26674 1
230 . 1 1 28 28 THR HG21 H 1 1.038 0.011 . 1 . . . . 28 Thr HG21 . 26674 1
231 . 1 1 28 28 THR HG22 H 1 1.038 0.011 . 1 . . . . 28 Thr HG22 . 26674 1
232 . 1 1 28 28 THR HG23 H 1 1.038 0.011 . 1 . . . . 28 Thr HG23 . 26674 1
233 . 1 1 28 28 THR CA C 13 58.884 0.000 . 1 . . . . 28 Thr CA . 26674 1
234 . 1 1 28 28 THR CB C 13 73.381 0.000 . 1 . . . . 28 Thr CB . 26674 1
235 . 1 1 28 28 THR CG2 C 13 22.134 0.000 . 1 . . . . 28 Thr CG2 . 26674 1
236 . 1 1 28 28 THR N N 15 106.931 0.000 . 1 . . . . 28 Thr N . 26674 1
237 . 1 1 29 29 CYS H H 1 8.984 0.008 . 1 . . . . 29 Cys H . 26674 1
238 . 1 1 29 29 CYS HA H 1 5.064 0.002 . 1 . . . . 29 Cys HA . 26674 1
239 . 1 1 29 29 CYS HB2 H 1 2.894 0.012 . 2 . . . . 29 Cys HB2 . 26674 1
240 . 1 1 29 29 CYS HB3 H 1 3.324 0.009 . 2 . . . . 29 Cys HB3 . 26674 1
241 . 1 1 29 29 CYS CA C 13 53.937 0.000 . 1 . . . . 29 Cys CA . 26674 1
242 . 1 1 29 29 CYS CB C 13 37.465 0.000 . 1 . . . . 29 Cys CB . 26674 1
243 . 1 1 29 29 CYS N N 15 121.489 0.000 . 1 . . . . 29 Cys N . 26674 1
244 . 1 1 30 30 LYS H H 1 8.673 0.002 . 1 . . . . 30 Lys H . 26674 1
245 . 1 1 30 30 LYS HA H 1 4.803 0.007 . 1 . . . . 30 Lys HA . 26674 1
246 . 1 1 30 30 LYS HB2 H 1 1.634 0.005 . 2 . . . . 30 Lys HB2 . 26674 1
247 . 1 1 30 30 LYS HB3 H 1 1.937 0.004 . 2 . . . . 30 Lys HB3 . 26674 1
248 . 1 1 30 30 LYS HG2 H 1 1.487 0.002 . 2 . . . . 30 Lys HG2 . 26674 1
249 . 1 1 30 30 LYS HG3 H 1 1.490 0.004 . 2 . . . . 30 Lys HG3 . 26674 1
250 . 1 1 30 30 LYS HD2 H 1 1.746 0.001 . 2 . . . . 30 Lys HD2 . 26674 1
251 . 1 1 30 30 LYS HD3 H 1 1.747 0.002 . 2 . . . . 30 Lys HD3 . 26674 1
252 . 1 1 30 30 LYS HE2 H 1 2.984 0.000 . 2 . . . . 30 Lys HE2 . 26674 1
253 . 1 1 30 30 LYS HE3 H 1 2.990 0.003 . 2 . . . . 30 Lys HE3 . 26674 1
254 . 1 1 30 30 LYS HZ1 H 1 7.597 0.004 . 1 . . . . 30 Lys HZ1 . 26674 1
255 . 1 1 30 30 LYS HZ2 H 1 7.597 0.004 . 1 . . . . 30 Lys HZ2 . 26674 1
256 . 1 1 30 30 LYS HZ3 H 1 7.597 0.004 . 1 . . . . 30 Lys HZ3 . 26674 1
257 . 1 1 30 30 LYS CB C 13 37.045 0.041 . 1 . . . . 30 Lys CB . 26674 1
258 . 1 1 30 30 LYS N N 15 124.282 0.000 . 1 . . . . 30 Lys N . 26674 1
259 . 1 1 31 31 ASP H H 1 8.767 0.002 . 1 . . . . 31 Asp H . 26674 1
260 . 1 1 31 31 ASP HA H 1 4.796 0.000 . 1 . . . . 31 Asp HA . 26674 1
261 . 1 1 31 31 ASP HB2 H 1 2.730 0.057 . 2 . . . . 31 Asp HB2 . 26674 1
262 . 1 1 31 31 ASP HB3 H 1 2.816 0.062 . 2 . . . . 31 Asp HB3 . 26674 1
263 . 1 1 31 31 ASP N N 15 123.790 0.000 . 1 . . . . 31 Asp N . 26674 1
264 . 1 1 32 32 LYS H H 1 8.533 0.001 . 1 . . . . 32 Lys H . 26674 1
265 . 1 1 32 32 LYS HA H 1 4.064 0.007 . 1 . . . . 32 Lys HA . 26674 1
266 . 1 1 32 32 LYS HB2 H 1 1.757 0.002 . 2 . . . . 32 Lys HB2 . 26674 1
267 . 1 1 32 32 LYS HB3 H 1 1.624 0.001 . 2 . . . . 32 Lys HB3 . 26674 1
268 . 1 1 32 32 LYS HG3 H 1 1.277 0.001 . 1 . . . . 32 Lys HG3 . 26674 1
269 . 1 1 32 32 LYS HD3 H 1 1.519 0.002 . 1 . . . . 32 Lys HD3 . 26674 1
270 . 1 1 32 32 LYS HE3 H 1 2.854 0.001 . 1 . . . . 32 Lys HE3 . 26674 1
271 . 1 1 32 32 LYS HZ1 H 1 7.464 0.003 . 1 . . . . 32 Lys HZ1 . 26674 1
272 . 1 1 32 32 LYS HZ2 H 1 7.464 0.003 . 1 . . . . 32 Lys HZ2 . 26674 1
273 . 1 1 32 32 LYS HZ3 H 1 7.464 0.003 . 1 . . . . 32 Lys HZ3 . 26674 1
274 . 1 1 32 32 LYS CA C 13 56.639 0.000 . 1 . . . . 32 Lys CA . 26674 1
275 . 1 1 32 32 LYS N N 15 122.102 0.000 . 1 . . . . 32 Lys N . 26674 1
276 . 1 1 33 33 SER H H 1 8.274 0.002 . 1 . . . . 33 Ser H . 26674 1
277 . 1 1 33 33 SER HA H 1 4.344 0.006 . 1 . . . . 33 Ser HA . 26674 1
278 . 1 1 33 33 SER HB2 H 1 3.789 0.003 . 2 . . . . 33 Ser HB2 . 26674 1
279 . 1 1 33 33 SER HB3 H 1 3.847 0.001 . 2 . . . . 33 Ser HB3 . 26674 1
280 . 1 1 33 33 SER CA C 13 58.107 0.000 . 1 . . . . 33 Ser CA . 26674 1
281 . 1 1 33 33 SER CB C 13 63.155 0.009 . 1 . . . . 33 Ser CB . 26674 1
282 . 1 1 33 33 SER N N 15 116.913 0.000 . 1 . . . . 33 Ser N . 26674 1
283 . 1 1 34 34 SER H H 1 8.216 0.001 . 1 . . . . 34 Ser H . 26674 1
284 . 1 1 34 34 SER HA H 1 4.473 0.008 . 1 . . . . 34 Ser HA . 26674 1
285 . 1 1 34 34 SER HB3 H 1 3.899 0.009 . 1 . . . . 34 Ser HB3 . 26674 1
286 . 1 1 34 34 SER CA C 13 57.883 0.000 . 1 . . . . 34 Ser CA . 26674 1
287 . 1 1 34 34 SER CB C 13 63.628 0.000 . 1 . . . . 34 Ser CB . 26674 1
288 . 1 1 34 34 SER N N 15 117.921 0.000 . 1 . . . . 34 Ser N . 26674 1
289 . 1 1 35 35 ALA H H 1 8.091 0.002 . 1 . . . . 35 Ala H . 26674 1
290 . 1 1 35 35 ALA HA H 1 4.242 0.000 . 1 . . . . 35 Ala HA . 26674 1
291 . 1 1 35 35 ALA HB1 H 1 1.361 0.010 . 1 . . . . 35 Ala HB1 . 26674 1
292 . 1 1 35 35 ALA HB2 H 1 1.361 0.010 . 1 . . . . 35 Ala HB2 . 26674 1
293 . 1 1 35 35 ALA HB3 H 1 1.361 0.010 . 1 . . . . 35 Ala HB3 . 26674 1
294 . 1 1 35 35 ALA CA C 13 51.727 0.000 . 1 . . . . 35 Ala CA . 26674 1
295 . 1 1 35 35 ALA CB C 13 18.815 0.000 . 1 . . . . 35 Ala CB . 26674 1
296 . 1 1 35 35 ALA N N 15 128.348 0.000 . 1 . . . . 35 Ala N . 26674 1
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