Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 31102
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 $chem_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' . . . 31102 1
2 '2D 1H-1H NOESY' . . . 31102 1
3 '2D 1H-13C HSQC' . . . 31102 1
4 '2D 1H-15N HSQC' . . . 31102 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID
_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 3.845 0.001 . . . . . . A 1 GLY HA2 . 31102 1
2 . 1 . 1 1 1 GLY HA3 H 1 3.846 0.000 . . . . . . A 1 GLY HA3 . 31102 1
3 . 1 . 1 1 1 GLY CA C 13 45.564 0.000 . . . . . . A 1 GLY CA . 31102 1
4 . 1 . 1 2 2 LEU H H 1 8.565 0.001 . . . . . . A 2 LEU H . 31102 1
5 . 1 . 1 2 2 LEU HA H 1 4.631 0.003 . . . . . . A 2 LEU HA . 31102 1
6 . 1 . 1 2 2 LEU HB2 H 1 1.460 0.003 . . . . . . A 2 LEU HB2 . 31102 1
7 . 1 . 1 2 2 LEU HB3 H 1 1.586 0.004 . . . . . . A 2 LEU HB3 . 31102 1
8 . 1 . 1 2 2 LEU HG H 1 1.696 0.003 . . . . . . A 2 LEU HG . 31102 1
9 . 1 . 1 2 2 LEU HD11 H 1 0.931 0.003 . . . . . . A 2 LEU HD11 . 31102 1
10 . 1 . 1 2 2 LEU HD12 H 1 0.931 0.003 . . . . . . A 2 LEU HD12 . 31102 1
11 . 1 . 1 2 2 LEU HD13 H 1 0.931 0.003 . . . . . . A 2 LEU HD13 . 31102 1
12 . 1 . 1 2 2 LEU HD21 H 1 0.931 0.003 . . . . . . A 2 LEU HD21 . 31102 1
13 . 1 . 1 2 2 LEU HD22 H 1 0.931 0.003 . . . . . . A 2 LEU HD22 . 31102 1
14 . 1 . 1 2 2 LEU HD23 H 1 0.931 0.003 . . . . . . A 2 LEU HD23 . 31102 1
15 . 1 . 1 2 2 LEU CA C 13 55.876 0.000 . . . . . . A 2 LEU CA . 31102 1
16 . 1 . 1 2 2 LEU CB C 13 44.294 0.020 . . . . . . A 2 LEU CB . 31102 1
17 . 1 . 1 2 2 LEU CG C 13 29.728 0.000 . . . . . . A 2 LEU CG . 31102 1
18 . 1 . 1 2 2 LEU N N 15 122.764 0.000 . . . . . . A 2 LEU N . 31102 1
19 . 1 . 1 3 3 PRO HA H 1 4.455 0.002 . . . . . . A 3 PRO HA . 31102 1
20 . 1 . 1 3 3 PRO HB2 H 1 2.317 0.003 . . . . . . A 3 PRO HB2 . 31102 1
21 . 1 . 1 3 3 PRO HB3 H 1 2.098 0.000 . . . . . . A 3 PRO HB3 . 31102 1
22 . 1 . 1 3 3 PRO HG2 H 1 2.052 0.001 . . . . . . A 3 PRO HG2 . 31102 1
23 . 1 . 1 3 3 PRO HG3 H 1 1.848 0.001 . . . . . . A 3 PRO HG3 . 31102 1
24 . 1 . 1 3 3 PRO HD2 H 1 3.887 0.001 . . . . . . A 3 PRO HD2 . 31102 1
25 . 1 . 1 3 3 PRO HD3 H 1 3.617 0.001 . . . . . . A 3 PRO HD3 . 31102 1
26 . 1 . 1 3 3 PRO CA C 13 65.728 0.000 . . . . . . A 3 PRO CA . 31102 1
27 . 1 . 1 3 3 PRO CB C 13 34.680 0.000 . . . . . . A 3 PRO CB . 31102 1
28 . 1 . 1 3 3 PRO CD C 13 53.247 0.004 . . . . . . A 3 PRO CD . 31102 1
29 . 1 . 1 4 4 VAL H H 1 8.280 0.003 . . . . . . A 4 VAL H . 31102 1
30 . 1 . 1 4 4 VAL HA H 1 4.087 0.003 . . . . . . A 4 VAL HA . 31102 1
31 . 1 . 1 4 4 VAL HB H 1 2.089 0.002 . . . . . . A 4 VAL HB . 31102 1
32 . 1 . 1 4 4 VAL HG11 H 1 0.970 0.002 . . . . . . A 4 VAL HG11 . 31102 1
33 . 1 . 1 4 4 VAL HG12 H 1 0.970 0.002 . . . . . . A 4 VAL HG12 . 31102 1
34 . 1 . 1 4 4 VAL HG13 H 1 0.970 0.002 . . . . . . A 4 VAL HG13 . 31102 1
35 . 1 . 1 4 4 VAL HG21 H 1 0.970 0.002 . . . . . . A 4 VAL HG21 . 31102 1
36 . 1 . 1 4 4 VAL HG22 H 1 0.970 0.002 . . . . . . A 4 VAL HG22 . 31102 1
37 . 1 . 1 4 4 VAL HG23 H 1 0.970 0.002 . . . . . . A 4 VAL HG23 . 31102 1
38 . 1 . 1 4 4 VAL CA C 13 64.980 0.000 . . . . . . A 4 VAL CA . 31102 1
39 . 1 . 1 4 4 VAL CB C 13 35.237 0.001 . . . . . . A 4 VAL CB . 31102 1
40 . 1 . 1 4 4 VAL CG1 C 13 23.053 0.000 . . . . . . A 4 VAL CG1 . 31102 1
41 . 1 . 1 4 4 VAL N N 15 120.682 0.000 . . . . . . A 4 VAL N . 31102 1
42 . 1 . 1 5 5 CYS H H 1 8.490 0.001 . . . . . . A 5 CYS H . 31102 1
43 . 1 . 1 5 5 CYS HA H 1 4.953 0.005 . . . . . . A 5 CYS HA . 31102 1
44 . 1 . 1 5 5 CYS HB2 H 1 2.845 0.002 . . . . . . A 5 CYS HB2 . 31102 1
45 . 1 . 1 5 5 CYS HB3 H 1 2.845 0.002 . . . . . . A 5 CYS HB3 . 31102 1
46 . 1 . 1 5 5 CYS CA C 13 56.897 0.000 . . . . . . A 5 CYS CA . 31102 1
47 . 1 . 1 5 5 CYS CB C 13 42.035 0.040 . . . . . . A 5 CYS CB . 31102 1
48 . 1 . 1 5 5 CYS N N 15 121.649 0.000 . . . . . . A 5 CYS N . 31102 1
49 . 1 . 1 6 6 GLY H H 1 8.117 0.002 . . . . . . A 6 GLY H . 31102 1
50 . 1 . 1 6 6 GLY HA2 H 1 3.739 0.003 . . . . . . A 6 GLY HA2 . 31102 1
51 . 1 . 1 6 6 GLY HA3 H 1 4.199 0.003 . . . . . . A 6 GLY HA3 . 31102 1
52 . 1 . 1 6 6 GLY CA C 13 48.304 0.010 . . . . . . A 6 GLY CA . 31102 1
53 . 1 . 1 6 6 GLY N N 15 108.395 0.000 . . . . . . A 6 GLY N . 31102 1
54 . 1 . 1 7 7 GLU H H 1 8.198 0.003 . . . . . . A 7 GLU H . 31102 1
55 . 1 . 1 7 7 GLU HA H 1 4.454 0.002 . . . . . . A 7 GLU HA . 31102 1
56 . 1 . 1 7 7 GLU HB2 H 1 2.196 0.003 . . . . . . A 7 GLU HB2 . 31102 1
57 . 1 . 1 7 7 GLU HB3 H 1 2.069 0.003 . . . . . . A 7 GLU HB3 . 31102 1
58 . 1 . 1 7 7 GLU HG2 H 1 2.640 0.003 . . . . . . A 7 GLU HG2 . 31102 1
59 . 1 . 1 7 7 GLU HG3 H 1 2.544 0.005 . . . . . . A 7 GLU HG3 . 31102 1
60 . 1 . 1 7 7 GLU CA C 13 58.908 0.000 . . . . . . A 7 GLU CA . 31102 1
61 . 1 . 1 7 7 GLU CB C 13 31.255 0.023 . . . . . . A 7 GLU CB . 31102 1
62 . 1 . 1 7 7 GLU CG C 13 36.237 0.007 . . . . . . A 7 GLU CG . 31102 1
63 . 1 . 1 7 7 GLU N N 15 118.702 0.000 . . . . . . A 7 GLU N . 31102 1
64 . 1 . 1 8 8 THR H H 1 8.416 0.002 . . . . . . A 8 THR H . 31102 1
65 . 1 . 1 8 8 THR HA H 1 4.502 0.004 . . . . . . A 8 THR HA . 31102 1
66 . 1 . 1 8 8 THR HB H 1 4.260 0.002 . . . . . . A 8 THR HB . 31102 1
67 . 1 . 1 8 8 THR HG21 H 1 1.354 0.002 . . . . . . A 8 THR HG1 . 31102 1
68 . 1 . 1 8 8 THR HG22 H 1 1.354 0.002 . . . . . . A 8 THR HG1 . 31102 1
69 . 1 . 1 8 8 THR HG23 H 1 1.354 0.002 . . . . . . A 8 THR HG1 . 31102 1
70 . 1 . 1 8 8 THR CA C 13 65.025 0.000 . . . . . . A 8 THR CA . 31102 1
71 . 1 . 1 8 8 THR CB C 13 72.413 0.000 . . . . . . A 8 THR CB . 31102 1
72 . 1 . 1 8 8 THR CG2 C 13 24.696 0.000 . . . . . . A 8 THR CG2 . 31102 1
73 . 1 . 1 8 8 THR N N 15 114.020 0.000 . . . . . . A 8 THR N . 31102 1
74 . 1 . 1 9 9 CYS H H 1 8.051 0.003 . . . . . . A 9 CYS H . 31102 1
75 . 1 . 1 9 9 CYS HA H 1 4.730 0.008 . . . . . . A 9 CYS HA . 31102 1
76 . 1 . 1 9 9 CYS HB2 H 1 3.059 0.002 . . . . . . A 9 CYS HB2 . 31102 1
77 . 1 . 1 9 9 CYS HB3 H 1 3.059 0.002 . . . . . . A 9 CYS HB3 . 31102 1
78 . 1 . 1 9 9 CYS CA C 13 58.067 0.000 . . . . . . A 9 CYS CA . 31102 1
79 . 1 . 1 9 9 CYS CB C 13 47.481 0.000 . . . . . . A 9 CYS CB . 31102 1
80 . 1 . 1 9 9 CYS N N 15 119.349 0.000 . . . . . . A 9 CYS N . 31102 1
81 . 1 . 1 10 10 VAL H H 1 8.593 0.002 . . . . . . A 10 VAL H . 31102 1
82 . 1 . 1 10 10 VAL HA H 1 4.106 0.003 . . . . . . A 10 VAL HA . 31102 1
83 . 1 . 1 10 10 VAL HB H 1 1.994 0.002 . . . . . . A 10 VAL HB . 31102 1
84 . 1 . 1 10 10 VAL HG11 H 1 0.936 0.009 . . . . . . A 10 VAL HG11 . 31102 1
85 . 1 . 1 10 10 VAL HG12 H 1 0.936 0.009 . . . . . . A 10 VAL HG12 . 31102 1
86 . 1 . 1 10 10 VAL HG13 H 1 0.936 0.009 . . . . . . A 10 VAL HG13 . 31102 1
87 . 1 . 1 10 10 VAL HG21 H 1 0.936 0.009 . . . . . . A 10 VAL HG21 . 31102 1
88 . 1 . 1 10 10 VAL HG22 H 1 0.936 0.009 . . . . . . A 10 VAL HG22 . 31102 1
89 . 1 . 1 10 10 VAL HG23 H 1 0.936 0.009 . . . . . . A 10 VAL HG23 . 31102 1
90 . 1 . 1 10 10 VAL CA C 13 65.782 0.000 . . . . . . A 10 VAL CA . 31102 1
91 . 1 . 1 10 10 VAL CB C 13 35.213 0.027 . . . . . . A 10 VAL CB . 31102 1
92 . 1 . 1 10 10 VAL CG1 C 13 23.437 0.000 . . . . . . A 10 VAL CG1 . 31102 1
93 . 1 . 1 10 10 VAL N N 15 123.528 0.000 . . . . . . A 10 VAL N . 31102 1
94 . 1 . 1 11 11 GLY H H 1 8.973 0.002 . . . . . . A 11 GLY H . 31102 1
95 . 1 . 1 11 11 GLY HA2 H 1 3.882 0.003 . . . . . . A 11 GLY HA2 . 31102 1
96 . 1 . 1 11 11 GLY HA3 H 1 3.972 0.002 . . . . . . A 11 GLY HA3 . 31102 1
97 . 1 . 1 11 11 GLY CA C 13 48.947 0.000 . . . . . . A 11 GLY CA . 31102 1
98 . 1 . 1 11 11 GLY N N 15 115.316 0.000 . . . . . . A 11 GLY N . 31102 1
99 . 1 . 1 12 12 GLY H H 1 8.241 0.002 . . . . . . A 12 GLY H . 31102 1
100 . 1 . 1 12 12 GLY HA2 H 1 3.881 0.001 . . . . . . A 12 GLY HA2 . 31102 1
101 . 1 . 1 12 12 GLY HA3 H 1 4.182 0.001 . . . . . . A 12 GLY HA3 . 31102 1
102 . 1 . 1 12 12 GLY CA C 13 48.047 0.010 . . . . . . A 12 GLY CA . 31102 1
103 . 1 . 1 12 12 GLY N N 15 105.594 0.000 . . . . . . A 12 GLY N . 31102 1
104 . 1 . 1 13 13 THR H H 1 7.729 0.002 . . . . . . A 13 THR H . 31102 1
105 . 1 . 1 13 13 THR HA H 1 4.729 0.009 . . . . . . A 13 THR HA . 31102 1
106 . 1 . 1 13 13 THR HB H 1 4.139 0.005 . . . . . . A 13 THR HB . 31102 1
107 . 1 . 1 13 13 THR HG21 H 1 1.153 0.001 . . . . . . A 13 THR HG1 . 31102 1
108 . 1 . 1 13 13 THR HG22 H 1 1.153 0.001 . . . . . . A 13 THR HG1 . 31102 1
109 . 1 . 1 13 13 THR HG23 H 1 1.153 0.001 . . . . . . A 13 THR HG1 . 31102 1
110 . 1 . 1 13 13 THR CA C 13 63.262 0.000 . . . . . . A 13 THR CA . 31102 1
111 . 1 . 1 13 13 THR CB C 13 74.123 0.000 . . . . . . A 13 THR CB . 31102 1
112 . 1 . 1 13 13 THR CG2 C 13 23.716 0.000 . . . . . . A 13 THR CG2 . 31102 1
113 . 1 . 1 13 13 THR N N 15 113.084 0.000 . . . . . . A 13 THR N . 31102 1
114 . 1 . 1 14 14 CYS H H 1 8.718 0.001 . . . . . . A 14 CYS H . 31102 1
115 . 1 . 1 14 14 CYS HA H 1 4.820 0.009 . . . . . . A 14 CYS HA . 31102 1
116 . 1 . 1 14 14 CYS HB2 H 1 3.203 0.002 . . . . . . A 14 CYS HB2 . 31102 1
117 . 1 . 1 14 14 CYS HB3 H 1 2.853 0.002 . . . . . . A 14 CYS HB3 . 31102 1
118 . 1 . 1 14 14 CYS CA C 13 58.472 0.000 . . . . . . A 14 CYS CA . 31102 1
119 . 1 . 1 14 14 CYS CB C 13 47.689 0.029 . . . . . . A 14 CYS CB . 31102 1
120 . 1 . 1 14 14 CYS N N 15 121.162 0.000 . . . . . . A 14 CYS N . 31102 1
121 . 1 . 1 15 15 ASN H H 1 8.748 0.002 . . . . . . A 15 ASN H . 31102 1
122 . 1 . 1 15 15 ASN HA H 1 4.657 0.004 . . . . . . A 15 ASN HA . 31102 1
123 . 1 . 1 15 15 ASN HB2 H 1 2.831 0.003 . . . . . . A 15 ASN HB2 . 31102 1
124 . 1 . 1 15 15 ASN HB3 H 1 2.837 0.006 . . . . . . A 15 ASN HB3 . 31102 1
125 . 1 . 1 15 15 ASN HD21 H 1 7.603 0.005 . . . . . . A 15 ASN HD21 . 31102 1
126 . 1 . 1 15 15 ASN HD22 H 1 6.865 0.007 . . . . . . A 15 ASN HD22 . 31102 1
127 . 1 . 1 15 15 ASN CA C 13 56.650 0.000 . . . . . . A 15 ASN CA . 31102 1
128 . 1 . 1 15 15 ASN CB C 13 41.463 0.023 . . . . . . A 15 ASN CB . 31102 1
129 . 1 . 1 15 15 ASN N N 15 121.210 0.000 . . . . . . A 15 ASN N . 31102 1
130 . 1 . 1 15 15 ASN ND2 N 15 112.357 0.015 . . . . . . A 15 ASN ND2 . 31102 1
131 . 1 . 1 16 16 THR H H 1 7.695 0.005 . . . . . . A 16 THR H . 31102 1
132 . 1 . 1 16 16 THR HA H 1 4.604 0.005 . . . . . . A 16 THR HA . 31102 1
133 . 1 . 1 16 16 THR HB H 1 3.989 0.002 . . . . . . A 16 THR HB . 31102 1
134 . 1 . 1 16 16 THR HG21 H 1 1.266 0.003 . . . . . . A 16 THR HG1 . 31102 1
135 . 1 . 1 16 16 THR HG22 H 1 1.266 0.003 . . . . . . A 16 THR HG1 . 31102 1
136 . 1 . 1 16 16 THR HG23 H 1 1.266 0.003 . . . . . . A 16 THR HG1 . 31102 1
137 . 1 . 1 16 16 THR CA C 13 62.973 0.000 . . . . . . A 16 THR CA . 31102 1
138 . 1 . 1 16 16 THR CB C 13 73.179 0.000 . . . . . . A 16 THR CB . 31102 1
139 . 1 . 1 16 16 THR CG2 C 13 24.050 0.000 . . . . . . A 16 THR CG2 . 31102 1
140 . 1 . 1 16 16 THR N N 15 117.896 0.000 . . . . . . A 16 THR N . 31102 1
141 . 1 . 1 17 17 PRO HA H 1 4.327 0.002 . . . . . . A 17 PRO HA . 31102 1
142 . 1 . 1 17 17 PRO HB2 H 1 2.336 0.006 . . . . . . A 17 PRO HB2 . 31102 1
143 . 1 . 1 17 17 PRO HB3 H 1 2.123 0.005 . . . . . . A 17 PRO HB3 . 31102 1
144 . 1 . 1 17 17 PRO HG2 H 1 1.994 0.002 . . . . . . A 17 PRO HG2 . 31102 1
145 . 1 . 1 17 17 PRO HG3 H 1 1.898 0.001 . . . . . . A 17 PRO HG3 . 31102 1
146 . 1 . 1 17 17 PRO HD2 H 1 4.089 0.002 . . . . . . A 17 PRO HD2 . 31102 1
147 . 1 . 1 17 17 PRO HD3 H 1 3.721 0.002 . . . . . . A 17 PRO HD3 . 31102 1
148 . 1 . 1 17 17 PRO CA C 13 66.416 0.000 . . . . . . A 17 PRO CA . 31102 1
149 . 1 . 1 17 17 PRO CB C 13 34.637 0.000 . . . . . . A 17 PRO CB . 31102 1
150 . 1 . 1 17 17 PRO CD C 13 54.289 0.010 . . . . . . A 17 PRO CD . 31102 1
151 . 1 . 1 18 18 GLY H H 1 8.734 0.003 . . . . . . A 18 GLY H . 31102 1
152 . 1 . 1 18 18 GLY HA2 H 1 3.714 0.004 . . . . . . A 18 GLY HA2 . 31102 1
153 . 1 . 1 18 18 GLY HA3 H 1 4.237 0.003 . . . . . . A 18 GLY HA3 . 31102 1
154 . 1 . 1 18 18 GLY CA C 13 47.661 0.020 . . . . . . A 18 GLY CA . 31102 1
155 . 1 . 1 18 18 GLY N N 15 110.647 0.000 . . . . . . A 18 GLY N . 31102 1
156 . 1 . 1 19 19 CYS H H 1 7.667 0.003 . . . . . . A 19 CYS H . 31102 1
157 . 1 . 1 19 19 CYS HA H 1 5.333 0.003 . . . . . . A 19 CYS HA . 31102 1
158 . 1 . 1 19 19 CYS HB2 H 1 2.999 0.005 . . . . . . A 19 CYS HB2 . 31102 1
159 . 1 . 1 19 19 CYS HB3 H 1 2.772 0.002 . . . . . . A 19 CYS HB3 . 31102 1
160 . 1 . 1 19 19 CYS CA C 13 56.168 0.000 . . . . . . A 19 CYS CA . 31102 1
161 . 1 . 1 19 19 CYS CB C 13 46.359 0.010 . . . . . . A 19 CYS CB . 31102 1
162 . 1 . 1 19 19 CYS N N 15 117.256 0.000 . . . . . . A 19 CYS N . 31102 1
163 . 1 . 1 20 20 THR H H 1 9.515 0.002 . . . . . . A 20 THR H . 31102 1
164 . 1 . 1 20 20 THR HA H 1 4.590 0.002 . . . . . . A 20 THR HA . 31102 1
165 . 1 . 1 20 20 THR HB H 1 3.977 0.003 . . . . . . A 20 THR HB . 31102 1
166 . 1 . 1 20 20 THR HG21 H 1 1.119 0.002 . . . . . . A 20 THR HG1 . 31102 1
167 . 1 . 1 20 20 THR HG22 H 1 1.119 0.002 . . . . . . A 20 THR HG1 . 31102 1
168 . 1 . 1 20 20 THR HG23 H 1 1.119 0.002 . . . . . . A 20 THR HG1 . 31102 1
169 . 1 . 1 20 20 THR CA C 13 63.369 0.000 . . . . . . A 20 THR CA . 31102 1
170 . 1 . 1 20 20 THR CB C 13 74.040 0.000 . . . . . . A 20 THR CB . 31102 1
171 . 1 . 1 20 20 THR CG2 C 13 23.474 0.000 . . . . . . A 20 THR CG2 . 31102 1
172 . 1 . 1 20 20 THR N N 15 117.926 0.000 . . . . . . A 20 THR N . 31102 1
173 . 1 . 1 21 21 CYS H H 1 8.906 0.002 . . . . . . A 21 CYS H . 31102 1
174 . 1 . 1 21 21 CYS HA H 1 4.546 0.002 . . . . . . A 21 CYS HA . 31102 1
175 . 1 . 1 21 21 CYS HB2 H 1 3.046 0.003 . . . . . . A 21 CYS HB2 . 31102 1
176 . 1 . 1 21 21 CYS HB3 H 1 2.791 0.003 . . . . . . A 21 CYS HB3 . 31102 1
177 . 1 . 1 21 21 CYS CA C 13 59.931 0.000 . . . . . . A 21 CYS CA . 31102 1
178 . 1 . 1 21 21 CYS CB C 13 44.685 0.017 . . . . . . A 21 CYS CB . 31102 1
179 . 1 . 1 21 21 CYS N N 15 125.845 0.000 . . . . . . A 21 CYS N . 31102 1
180 . 1 . 1 22 22 SER H H 1 9.095 0.002 . . . . . . A 22 SER H . 31102 1
181 . 1 . 1 22 22 SER HA H 1 5.071 0.003 . . . . . . A 22 SER HA . 31102 1
182 . 1 . 1 22 22 SER HB2 H 1 3.838 0.004 . . . . . . A 22 SER HB2 . 31102 1
183 . 1 . 1 22 22 SER HB3 H 1 3.758 0.001 . . . . . . A 22 SER HB3 . 31102 1
184 . 1 . 1 22 22 SER CA C 13 57.521 0.000 . . . . . . A 22 SER CA . 31102 1
185 . 1 . 1 22 22 SER CB C 13 66.422 0.000 . . . . . . A 22 SER CB . 31102 1
186 . 1 . 1 22 22 SER N N 15 127.178 0.000 . . . . . . A 22 SER N . 31102 1
187 . 1 . 1 23 23 DPR CA C 13 67.398 0.000 . . . . . . A 23 DPR CA . 31102 1
188 . 1 . 1 23 23 DPR CB C 13 34.187 0.000 . . . . . . A 23 DPR CB . 31102 1
189 . 1 . 1 23 23 DPR CD C 13 53.464 0.011 . . . . . . A 23 DPR CD . 31102 1
190 . 1 . 1 23 23 DPR HA H 1 4.340 0.004 . . . . . . A 23 DPR HA . 31102 1
191 . 1 . 1 23 23 DPR HB2 H 1 2.387 0.002 . . . . . . A 23 DPR HB2 . 31102 1
192 . 1 . 1 23 23 DPR HB3 H 1 2.127 0.000 . . . . . . A 23 DPR HB3 . 31102 1
193 . 1 . 1 23 23 DPR HD2 H 1 3.913 0.002 . . . . . . A 23 DPR HD2 . 31102 1
194 . 1 . 1 23 23 DPR HD3 H 1 3.804 0.003 . . . . . . A 23 DPR HD3 . 31102 1
195 . 1 . 1 23 23 DPR HG2 H 1 2.057 0.003 . . . . . . A 23 DPR HG2 . 31102 1
196 . 1 . 1 23 23 DPR HG3 H 1 1.970 0.003 . . . . . . A 23 DPR HG3 . 31102 1
197 . 1 . 1 24 24 GLY H H 1 7.663 0.004 . . . . . . A 24 GLY H . 31102 1
198 . 1 . 1 24 24 GLY HA2 H 1 3.609 0.002 . . . . . . A 24 GLY HA2 . 31102 1
199 . 1 . 1 24 24 GLY HA3 H 1 4.225 0.009 . . . . . . A 24 GLY HA3 . 31102 1
200 . 1 . 1 24 24 GLY CA C 13 48.427 0.014 . . . . . . A 24 GLY CA . 31102 1
201 . 1 . 1 24 24 GLY N N 15 101.751 0.000 . . . . . . A 24 GLY N . 31102 1
202 . 1 . 1 25 25 VAL H H 1 7.813 0.003 . . . . . . A 25 VAL H . 31102 1
203 . 1 . 1 25 25 VAL HA H 1 4.532 0.004 . . . . . . A 25 VAL HA . 31102 1
204 . 1 . 1 25 25 VAL HB H 1 1.939 0.003 . . . . . . A 25 VAL HB . 31102 1
205 . 1 . 1 25 25 VAL HG11 H 1 0.871 0.004 . . . . . . A 25 VAL HG11 . 31102 1
206 . 1 . 1 25 25 VAL HG12 H 1 0.871 0.004 . . . . . . A 25 VAL HG12 . 31102 1
207 . 1 . 1 25 25 VAL HG13 H 1 0.871 0.004 . . . . . . A 25 VAL HG13 . 31102 1
208 . 1 . 1 25 25 VAL HG21 H 1 0.871 0.004 . . . . . . A 25 VAL HG21 . 31102 1
209 . 1 . 1 25 25 VAL HG22 H 1 0.871 0.004 . . . . . . A 25 VAL HG22 . 31102 1
210 . 1 . 1 25 25 VAL HG23 H 1 0.871 0.004 . . . . . . A 25 VAL HG23 . 31102 1
211 . 1 . 1 25 25 VAL CA C 13 63.420 0.000 . . . . . . A 25 VAL CA . 31102 1
212 . 1 . 1 25 25 VAL CB C 13 38.309 0.003 . . . . . . A 25 VAL CB . 31102 1
213 . 1 . 1 25 25 VAL CG1 C 13 23.572 0.000 . . . . . . A 25 VAL CG1 . 31102 1
214 . 1 . 1 25 25 VAL N N 15 121.024 0.000 . . . . . . A 25 VAL N . 31102 1
215 . 1 . 1 26 26 CYS H H 1 8.889 0.002 . . . . . . A 26 CYS H . 31102 1
216 . 1 . 1 26 26 CYS HA H 1 5.002 0.005 . . . . . . A 26 CYS HA . 31102 1
217 . 1 . 1 26 26 CYS HB2 H 1 2.730 0.006 . . . . . . A 26 CYS HB2 . 31102 1
218 . 1 . 1 26 26 CYS HB3 H 1 3.372 0.003 . . . . . . A 26 CYS HB3 . 31102 1
219 . 1 . 1 26 26 CYS CA C 13 59.267 0.000 . . . . . . A 26 CYS CA . 31102 1
220 . 1 . 1 26 26 CYS CB C 13 46.565 0.004 . . . . . . A 26 CYS CB . 31102 1
221 . 1 . 1 26 26 CYS N N 15 124.845 0.000 . . . . . . A 26 CYS N . 31102 1
222 . 1 . 1 27 27 THR H H 1 9.771 0.003 . . . . . . A 27 THR H . 31102 1
223 . 1 . 1 27 27 THR HA H 1 4.739 0.011 . . . . . . A 27 THR HA . 31102 1
224 . 1 . 1 27 27 THR HB H 1 4.134 0.003 . . . . . . A 27 THR HB . 31102 1
225 . 1 . 1 27 27 THR HG21 H 1 1.223 0.002 . . . . . . A 27 THR HG1 . 31102 1
226 . 1 . 1 27 27 THR HG22 H 1 1.223 0.002 . . . . . . A 27 THR HG1 . 31102 1
227 . 1 . 1 27 27 THR HG23 H 1 1.223 0.002 . . . . . . A 27 THR HG1 . 31102 1
228 . 1 . 1 27 27 THR CA C 13 63.238 0.000 . . . . . . A 27 THR CA . 31102 1
229 . 1 . 1 27 27 THR CB C 13 74.122 0.000 . . . . . . A 27 THR CB . 31102 1
230 . 1 . 1 27 27 THR CG2 C 13 23.544 0.000 . . . . . . A 27 THR CG2 . 31102 1
231 . 1 . 1 27 27 THR N N 15 122.099 0.000 . . . . . . A 27 THR N . 31102 1
232 . 1 . 1 28 28 ARG H H 1 8.629 0.002 . . . . . . A 28 ARG H . 31102 1
233 . 1 . 1 28 28 ARG HA H 1 4.682 0.004 . . . . . . A 28 ARG HA . 31102 1
234 . 1 . 1 28 28 ARG HB2 H 1 1.895 0.003 . . . . . . A 28 ARG HB2 . 31102 1
235 . 1 . 1 28 28 ARG HB3 H 1 1.777 0.003 . . . . . . A 28 ARG HB3 . 31102 1
236 . 1 . 1 28 28 ARG HG2 H 1 1.728 0.003 . . . . . . A 28 ARG HG2 . 31102 1
237 . 1 . 1 28 28 ARG HD2 H 1 3.253 0.001 . . . . . . A 28 ARG HD2 . 31102 1
238 . 1 . 1 28 28 ARG HE H 1 7.274 0.002 . . . . . . A 28 ARG HE . 31102 1
239 . 1 . 1 28 28 ARG CA C 13 59.539 0.000 . . . . . . A 28 ARG CA . 31102 1
240 . 1 . 1 28 28 ARG CB C 13 33.345 0.011 . . . . . . A 28 ARG CB . 31102 1
241 . 1 . 1 28 28 ARG CG C 13 30.026 0.000 . . . . . . A 28 ARG CG . 31102 1
242 . 1 . 1 28 28 ARG CD C 13 46.168 0.000 . . . . . . A 28 ARG CD . 31102 1
243 . 1 . 1 28 28 ARG N N 15 124.834 0.000 . . . . . . A 28 ARG N . 31102 1
244 . 1 . 1 28 28 ARG NE N 15 124.520 0.000 . . . . . . A 28 ARG NE . 31102 1
245 . 1 . 1 29 29 ASN H H 1 8.319 0.002 . . . . . . A 29 ASN H . 31102 1
246 . 1 . 1 29 29 ASN HA H 1 4.549 0.006 . . . . . . A 29 ASN HA . 31102 1
247 . 1 . 1 29 29 ASN HB2 H 1 2.720 0.004 . . . . . . A 29 ASN HB2 . 31102 1
248 . 1 . 1 29 29 ASN HB3 H 1 2.722 0.002 . . . . . . A 29 ASN HB3 . 31102 1
249 . 1 . 1 29 29 ASN HD21 H 1 7.480 0.004 . . . . . . A 29 ASN HD21 . 31102 1
250 . 1 . 1 29 29 ASN HD22 H 1 6.802 0.007 . . . . . . A 29 ASN HD22 . 31102 1
251 . 1 . 1 29 29 ASN CA C 13 56.332 0.000 . . . . . . A 29 ASN CA . 31102 1
252 . 1 . 1 29 29 ASN CB C 13 42.198 0.000 . . . . . . A 29 ASN CB . 31102 1
253 . 1 . 1 29 29 ASN N N 15 126.332 0.000 . . . . . . A 29 ASN N . 31102 1
254 . 1 . 1 29 29 ASN ND2 N 15 111.063 0.002 . . . . . . A 29 ASN ND2 . 31102 1
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