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 17495
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 17495 1
2 '2D 1H-13C HSQC' . . . 17495 1
3 '2D 1H-13C HSQC aliphatic' . . . 17495 1
5 '3D CBCA(CO)NH' . . . 17495 1
6 '3D HCCH-TOCSY' . . . 17495 1
7 '3D HNCO' . . . 17495 1
8 '3D HNCACB' . . . 17495 1
11 '3D 1H-15N TOCSY' . . . 17495 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 3.619 0.03 . 2 . . . A 1 GLY HA2 . 17495 1
2 . 1 1 1 1 GLY HA3 H 1 3.538 0.03 . 2 . . . A 1 GLY HA3 . 17495 1
3 . 1 1 1 1 GLY CA C 13 43.163 0.3 . 1 . . . A 1 GLY CA . 17495 1
4 . 1 1 2 2 TRP H H 1 8.542 0.03 . 1 . . . A 2 TRP H . 17495 1
5 . 1 1 2 2 TRP HA H 1 4.392 0.03 . 1 . . . A 2 TRP HA . 17495 1
6 . 1 1 2 2 TRP HB2 H 1 3.320 0.03 . 2 . . . A 2 TRP HB2 . 17495 1
7 . 1 1 2 2 TRP HB3 H 1 3.258 0.03 . 2 . . . A 2 TRP HB3 . 17495 1
8 . 1 1 2 2 TRP CA C 13 60.005 0.3 . 1 . . . A 2 TRP CA . 17495 1
9 . 1 1 2 2 TRP CB C 13 29.583 0.3 . 1 . . . A 2 TRP CB . 17495 1
10 . 1 1 2 2 TRP N N 15 120.682 0.3 . 1 . . . A 2 TRP N . 17495 1
11 . 1 1 3 3 VAL H H 1 7.697 0.03 . 1 . . . A 3 VAL H . 17495 1
12 . 1 1 3 3 VAL HA H 1 3.337 0.03 . 1 . . . A 3 VAL HA . 17495 1
13 . 1 1 3 3 VAL HB H 1 1.748 0.03 . 1 . . . A 3 VAL HB . 17495 1
14 . 1 1 3 3 VAL HG11 H 1 0.713 0.03 . 1 . . . A 3 VAL HG11 . 17495 1
15 . 1 1 3 3 VAL HG12 H 1 0.713 0.03 . 1 . . . A 3 VAL HG12 . 17495 1
16 . 1 1 3 3 VAL HG13 H 1 0.713 0.03 . 1 . . . A 3 VAL HG13 . 17495 1
17 . 1 1 3 3 VAL HG21 H 1 0.449 0.03 . 1 . . . A 3 VAL HG21 . 17495 1
18 . 1 1 3 3 VAL HG22 H 1 0.449 0.03 . 1 . . . A 3 VAL HG22 . 17495 1
19 . 1 1 3 3 VAL HG23 H 1 0.449 0.03 . 1 . . . A 3 VAL HG23 . 17495 1
20 . 1 1 3 3 VAL CA C 13 65.541 0.3 . 1 . . . A 3 VAL CA . 17495 1
21 . 1 1 3 3 VAL CB C 13 31.402 0.3 . 1 . . . A 3 VAL CB . 17495 1
22 . 1 1 3 3 VAL CG1 C 13 20.591 0.3 . 1 . . . A 3 VAL CG1 . 17495 1
23 . 1 1 3 3 VAL CG2 C 13 20.993 0.3 . 1 . . . A 3 VAL CG2 . 17495 1
24 . 1 1 3 3 VAL N N 15 119.566 0.3 . 1 . . . A 3 VAL N . 17495 1
25 . 1 1 4 4 ALA H H 1 7.331 0.03 . 1 . . . A 4 ALA H . 17495 1
26 . 1 1 4 4 ALA HA H 1 4.032 0.03 . 1 . . . A 4 ALA HA . 17495 1
27 . 1 1 4 4 ALA HB1 H 1 1.306 0.03 . 1 . . . A 4 ALA HB1 . 17495 1
28 . 1 1 4 4 ALA HB2 H 1 1.306 0.03 . 1 . . . A 4 ALA HB2 . 17495 1
29 . 1 1 4 4 ALA HB3 H 1 1.306 0.03 . 1 . . . A 4 ALA HB3 . 17495 1
30 . 1 1 4 4 ALA CA C 13 54.107 0.3 . 1 . . . A 4 ALA CA . 17495 1
31 . 1 1 4 4 ALA CB C 13 17.965 0.3 . 1 . . . A 4 ALA CB . 17495 1
32 . 1 1 4 4 ALA N N 15 120.567 0.3 . 1 . . . A 4 ALA N . 17495 1
33 . 1 1 5 5 CYS H H 1 7.716 0.03 . 1 . . . A 5 CYS H . 17495 1
34 . 1 1 5 5 CYS HA H 1 4.244 0.03 . 1 . . . A 5 CYS HA . 17495 1
35 . 1 1 5 5 CYS HB2 H 1 3.328 0.03 . 2 . . . A 5 CYS HB2 . 17495 1
36 . 1 1 5 5 CYS HB3 H 1 2.945 0.03 . 2 . . . A 5 CYS HB3 . 17495 1
37 . 1 1 5 5 CYS CA C 13 60.605 0.3 . 1 . . . A 5 CYS CA . 17495 1
38 . 1 1 5 5 CYS CB C 13 30.513 0.3 . 1 . . . A 5 CYS CB . 17495 1
39 . 1 1 5 5 CYS N N 15 114.687 0.3 . 1 . . . A 5 CYS N . 17495 1
40 . 1 1 6 6 VAL H H 1 8.175 0.03 . 1 . . . A 6 VAL H . 17495 1
41 . 1 1 6 6 VAL HA H 1 3.542 0.03 . 1 . . . A 6 VAL HA . 17495 1
42 . 1 1 6 6 VAL HB H 1 2.033 0.03 . 1 . . . A 6 VAL HB . 17495 1
43 . 1 1 6 6 VAL HG11 H 1 0.970 0.03 . 1 . . . A 6 VAL HG11 . 17495 1
44 . 1 1 6 6 VAL HG12 H 1 0.970 0.03 . 1 . . . A 6 VAL HG12 . 17495 1
45 . 1 1 6 6 VAL HG13 H 1 0.970 0.03 . 1 . . . A 6 VAL HG13 . 17495 1
46 . 1 1 6 6 VAL HG21 H 1 0.886 0.03 . 1 . . . A 6 VAL HG21 . 17495 1
47 . 1 1 6 6 VAL HG22 H 1 0.886 0.03 . 1 . . . A 6 VAL HG22 . 17495 1
48 . 1 1 6 6 VAL HG23 H 1 0.886 0.03 . 1 . . . A 6 VAL HG23 . 17495 1
49 . 1 1 6 6 VAL CA C 13 66.962 0.3 . 1 . . . A 6 VAL CA . 17495 1
50 . 1 1 6 6 VAL CB C 13 31.382 0.3 . 1 . . . A 6 VAL CB . 17495 1
51 . 1 1 6 6 VAL CG1 C 13 22.194 0.3 . 1 . . . A 6 VAL CG1 . 17495 1
52 . 1 1 6 6 VAL CG2 C 13 20.683 0.3 . 1 . . . A 6 VAL CG2 . 17495 1
53 . 1 1 6 6 VAL N N 15 118.323 0.3 . 1 . . . A 6 VAL N . 17495 1
54 . 1 1 7 7 GLY H H 1 7.947 0.03 . 1 . . . A 7 GLY H . 17495 1
55 . 1 1 7 7 GLY HA2 H 1 3.755 0.03 . 1 . . . A 7 GLY HA2 . 17495 1
56 . 1 1 7 7 GLY HA3 H 1 3.755 0.03 . 1 . . . A 7 GLY HA3 . 17495 1
57 . 1 1 7 7 GLY CA C 13 46.828 0.3 . 1 . . . A 7 GLY CA . 17495 1
58 . 1 1 7 7 GLY N N 15 105.401 0.3 . 1 . . . A 7 GLY N . 17495 1
59 . 1 1 8 8 ALA H H 1 8.141 0.03 . 1 . . . A 8 ALA H . 17495 1
60 . 1 1 8 8 ALA HA H 1 4.065 0.03 . 1 . . . A 8 ALA HA . 17495 1
61 . 1 1 8 8 ALA HB1 H 1 1.468 0.03 . 1 . . . A 8 ALA HB1 . 17495 1
62 . 1 1 8 8 ALA HB2 H 1 1.468 0.03 . 1 . . . A 8 ALA HB2 . 17495 1
63 . 1 1 8 8 ALA HB3 H 1 1.468 0.03 . 1 . . . A 8 ALA HB3 . 17495 1
64 . 1 1 8 8 ALA CA C 13 55.488 0.3 . 1 . . . A 8 ALA CA . 17495 1
65 . 1 1 8 8 ALA CB C 13 17.810 0.3 . 1 . . . A 8 ALA CB . 17495 1
66 . 1 1 8 8 ALA N N 15 125.672 0.3 . 1 . . . A 8 ALA N . 17495 1
67 . 1 1 9 9 CYS H H 1 8.948 0.03 . 1 . . . A 9 CYS H . 17495 1
68 . 1 1 9 9 CYS HA H 1 3.858 0.03 . 1 . . . A 9 CYS HA . 17495 1
69 . 1 1 9 9 CYS HB2 H 1 3.157 0.03 . 2 . . . A 9 CYS HB2 . 17495 1
70 . 1 1 9 9 CYS HB3 H 1 2.911 0.03 . 2 . . . A 9 CYS HB3 . 17495 1
71 . 1 1 9 9 CYS CA C 13 60.627 0.3 . 1 . . . A 9 CYS CA . 17495 1
72 . 1 1 9 9 CYS CB C 13 30.261 0.3 . 1 . . . A 9 CYS CB . 17495 1
73 . 1 1 9 9 CYS N N 15 114.698 0.3 . 1 . . . A 9 CYS N . 17495 1
74 . 1 1 10 10 GLY H H 1 8.535 0.03 . 1 . . . A 10 GLY H . 17495 1
75 . 1 1 10 10 GLY HA2 H 1 3.847 0.03 . 2 . . . A 10 GLY HA2 . 17495 1
76 . 1 1 10 10 GLY HA3 H 1 3.573 0.03 . 2 . . . A 10 GLY HA3 . 17495 1
77 . 1 1 10 10 GLY CA C 13 47.854 0.3 . 1 . . . A 10 GLY CA . 17495 1
78 . 1 1 10 10 GLY N N 15 104.531 0.3 . 1 . . . A 10 GLY N . 17495 1
79 . 1 1 11 11 THR H H 1 7.879 0.03 . 1 . . . A 11 THR H . 17495 1
80 . 1 1 11 11 THR HA H 1 3.769 0.03 . 1 . . . A 11 THR HA . 17495 1
81 . 1 1 11 11 THR HB H 1 4.101 0.03 . 1 . . . A 11 THR HB . 17495 1
82 . 1 1 11 11 THR HG21 H 1 1.173 0.03 . 1 . . . A 11 THR HG21 . 17495 1
83 . 1 1 11 11 THR HG22 H 1 1.173 0.03 . 1 . . . A 11 THR HG22 . 17495 1
84 . 1 1 11 11 THR HG23 H 1 1.173 0.03 . 1 . . . A 11 THR HG23 . 17495 1
85 . 1 1 11 11 THR CA C 13 67.485 0.3 . 1 . . . A 11 THR CA . 17495 1
86 . 1 1 11 11 THR CB C 13 68.686 0.3 . 1 . . . A 11 THR CB . 17495 1
87 . 1 1 11 11 THR CG2 C 13 20.962 0.3 . 1 . . . A 11 THR CG2 . 17495 1
88 . 1 1 11 11 THR N N 15 114.892 0.3 . 1 . . . A 11 THR N . 17495 1
89 . 1 1 12 12 VAL H H 1 7.510 0.03 . 1 . . . A 12 VAL H . 17495 1
90 . 1 1 12 12 VAL HA H 1 3.601 0.03 . 1 . . . A 12 VAL HA . 17495 1
91 . 1 1 12 12 VAL HB H 1 1.954 0.03 . 1 . . . A 12 VAL HB . 17495 1
92 . 1 1 12 12 VAL HG11 H 1 1.047 0.03 . 1 . . . A 12 VAL HG11 . 17495 1
93 . 1 1 12 12 VAL HG12 H 1 1.047 0.03 . 1 . . . A 12 VAL HG12 . 17495 1
94 . 1 1 12 12 VAL HG13 H 1 1.047 0.03 . 1 . . . A 12 VAL HG13 . 17495 1
95 . 1 1 12 12 VAL HG21 H 1 0.913 0.03 . 1 . . . A 12 VAL HG21 . 17495 1
96 . 1 1 12 12 VAL HG22 H 1 0.913 0.03 . 1 . . . A 12 VAL HG22 . 17495 1
97 . 1 1 12 12 VAL HG23 H 1 0.913 0.03 . 1 . . . A 12 VAL HG23 . 17495 1
98 . 1 1 12 12 VAL CA C 13 66.548 0.3 . 1 . . . A 12 VAL CA . 17495 1
99 . 1 1 12 12 VAL CB C 13 31.256 0.3 . 1 . . . A 12 VAL CB . 17495 1
100 . 1 1 12 12 VAL CG1 C 13 22.572 0.3 . 1 . . . A 12 VAL CG1 . 17495 1
101 . 1 1 12 12 VAL CG2 C 13 21.574 0.3 . 1 . . . A 12 VAL CG2 . 17495 1
102 . 1 1 12 12 VAL N N 15 119.926 0.3 . 1 . . . A 12 VAL N . 17495 1
103 . 1 1 13 13 CYS H H 1 9.013 0.03 . 1 . . . A 13 CYS H . 17495 1
104 . 1 1 13 13 CYS HA H 1 3.657 0.03 . 1 . . . A 13 CYS HA . 17495 1
105 . 1 1 13 13 CYS HB2 H 1 4.375 0.03 . 2 . . . A 13 CYS HB2 . 17495 1
106 . 1 1 13 13 CYS HB3 H 1 2.939 0.03 . 2 . . . A 13 CYS HB3 . 17495 1
107 . 1 1 13 13 CYS CA C 13 63.570 0.3 . 1 . . . A 13 CYS CA . 17495 1
108 . 1 1 13 13 CYS CB C 13 29.537 0.3 . 1 . . . A 13 CYS CB . 17495 1
109 . 1 1 13 13 CYS N N 15 120.346 0.3 . 1 . . . A 13 CYS N . 17495 1
110 . 1 1 14 14 LEU H H 1 8.158 0.03 . 1 . . . A 14 LEU H . 17495 1
111 . 1 1 14 14 LEU HA H 1 4.016 0.03 . 1 . . . A 14 LEU HA . 17495 1
112 . 1 1 14 14 LEU HB2 H 1 1.864 0.03 . 2 . . . A 14 LEU HB2 . 17495 1
113 . 1 1 14 14 LEU HB3 H 1 1.594 0.03 . 2 . . . A 14 LEU HB3 . 17495 1
114 . 1 1 14 14 LEU HG H 1 1.724 0.03 . 1 . . . A 14 LEU HG . 17495 1
115 . 1 1 14 14 LEU HD11 H 1 0.844 0.03 . 1 . . . A 14 LEU HD11 . 17495 1
116 . 1 1 14 14 LEU HD12 H 1 0.844 0.03 . 1 . . . A 14 LEU HD12 . 17495 1
117 . 1 1 14 14 LEU HD13 H 1 0.844 0.03 . 1 . . . A 14 LEU HD13 . 17495 1
118 . 1 1 14 14 LEU HD21 H 1 0.854 0.03 . 1 . . . A 14 LEU HD21 . 17495 1
119 . 1 1 14 14 LEU HD22 H 1 0.854 0.03 . 1 . . . A 14 LEU HD22 . 17495 1
120 . 1 1 14 14 LEU HD23 H 1 0.854 0.03 . 1 . . . A 14 LEU HD23 . 17495 1
121 . 1 1 14 14 LEU CA C 13 58.456 0.3 . 1 . . . A 14 LEU CA . 17495 1
122 . 1 1 14 14 LEU CB C 13 41.746 0.3 . 1 . . . A 14 LEU CB . 17495 1
123 . 1 1 14 14 LEU CG C 13 27.124 0.3 . 1 . . . A 14 LEU CG . 17495 1
124 . 1 1 14 14 LEU CD1 C 13 23.545 0.3 . 1 . . . A 14 LEU CD1 . 17495 1
125 . 1 1 14 14 LEU CD2 C 13 24.054 0.3 . 1 . . . A 14 LEU CD2 . 17495 1
126 . 1 1 14 14 LEU N N 15 118.839 0.3 . 1 . . . A 14 LEU N . 17495 1
127 . 1 1 15 15 ALA H H 1 8.165 0.03 . 1 . . . A 15 ALA H . 17495 1
128 . 1 1 15 15 ALA HA H 1 4.084 0.03 . 1 . . . A 15 ALA HA . 17495 1
129 . 1 1 15 15 ALA HB1 H 1 1.501 0.03 . 1 . . . A 15 ALA HB1 . 17495 1
130 . 1 1 15 15 ALA HB2 H 1 1.501 0.03 . 1 . . . A 15 ALA HB2 . 17495 1
131 . 1 1 15 15 ALA HB3 H 1 1.501 0.03 . 1 . . . A 15 ALA HB3 . 17495 1
132 . 1 1 15 15 ALA CA C 13 54.860 0.3 . 1 . . . A 15 ALA CA . 17495 1
133 . 1 1 15 15 ALA CB C 13 17.941 0.3 . 1 . . . A 15 ALA CB . 17495 1
134 . 1 1 15 15 ALA N N 15 120.708 0.3 . 1 . . . A 15 ALA N . 17495 1
135 . 1 1 16 16 SER H H 1 7.538 0.03 . 1 . . . A 16 SER H . 17495 1
136 . 1 1 16 16 SER HA H 1 4.560 0.03 . 1 . . . A 16 SER HA . 17495 1
137 . 1 1 16 16 SER HB2 H 1 4.318 0.03 . 2 . . . A 16 SER HB2 . 17495 1
138 . 1 1 16 16 SER HB3 H 1 3.771 0.03 . 2 . . . A 16 SER HB3 . 17495 1
139 . 1 1 16 16 SER CA C 13 57.108 0.3 . 1 . . . A 16 SER CA . 17495 1
140 . 1 1 16 16 SER CB C 13 64.148 0.3 . 1 . . . A 16 SER CB . 17495 1
141 . 1 1 16 16 SER N N 15 105.935 0.3 . 1 . . . A 16 SER N . 17495 1
142 . 1 1 17 17 GLY H H 1 8.101 0.03 . 1 . . . A 17 GLY H . 17495 1
143 . 1 1 17 17 GLY HA2 H 1 3.996 0.03 . 2 . . . A 17 GLY HA2 . 17495 1
144 . 1 1 17 17 GLY HA3 H 1 3.839 0.03 . 2 . . . A 17 GLY HA3 . 17495 1
145 . 1 1 17 17 GLY CA C 13 46.586 0.3 . 1 . . . A 17 GLY CA . 17495 1
146 . 1 1 17 17 GLY N N 15 109.603 0.3 . 1 . . . A 17 GLY N . 17495 1
147 . 1 1 18 18 GLY H H 1 8.483 0.03 . 1 . . . A 18 GLY H . 17495 1
148 . 1 1 18 18 GLY HA2 H 1 4.408 0.03 . 2 . . . A 18 GLY HA2 . 17495 1
149 . 1 1 18 18 GLY HA3 H 1 3.382 0.03 . 2 . . . A 18 GLY HA3 . 17495 1
150 . 1 1 18 18 GLY CA C 13 44.284 0.3 . 1 . . . A 18 GLY CA . 17495 1
151 . 1 1 18 18 GLY N N 15 103.443 0.3 . 1 . . . A 18 GLY N . 17495 1
152 . 1 1 19 19 VAL H H 1 7.596 0.03 . 1 . . . A 19 VAL H . 17495 1
153 . 1 1 19 19 VAL HA H 1 3.811 0.03 . 1 . . . A 19 VAL HA . 17495 1
154 . 1 1 19 19 VAL HB H 1 2.164 0.03 . 1 . . . A 19 VAL HB . 17495 1
155 . 1 1 19 19 VAL HG11 H 1 1.128 0.03 . 1 . . . A 19 VAL HG11 . 17495 1
156 . 1 1 19 19 VAL HG12 H 1 1.128 0.03 . 1 . . . A 19 VAL HG12 . 17495 1
157 . 1 1 19 19 VAL HG13 H 1 1.128 0.03 . 1 . . . A 19 VAL HG13 . 17495 1
158 . 1 1 19 19 VAL HG21 H 1 0.992 0.03 . 1 . . . A 19 VAL HG21 . 17495 1
159 . 1 1 19 19 VAL HG22 H 1 0.992 0.03 . 1 . . . A 19 VAL HG22 . 17495 1
160 . 1 1 19 19 VAL HG23 H 1 0.992 0.03 . 1 . . . A 19 VAL HG23 . 17495 1
161 . 1 1 19 19 VAL CA C 13 65.723 0.3 . 1 . . . A 19 VAL CA . 17495 1
162 . 1 1 19 19 VAL CB C 13 31.970 0.3 . 1 . . . A 19 VAL CB . 17495 1
163 . 1 1 19 19 VAL CG1 C 13 21.838 0.3 . 1 . . . A 19 VAL CG1 . 17495 1
164 . 1 1 19 19 VAL CG2 C 13 20.638 0.3 . 1 . . . A 19 VAL CG2 . 17495 1
165 . 1 1 19 19 VAL N N 15 120.364 0.3 . 1 . . . A 19 VAL N . 17495 1
166 . 1 1 20 20 GLY H H 1 8.498 0.03 . 1 . . . A 20 GLY H . 17495 1
167 . 1 1 20 20 GLY HA2 H 1 4.278 0.03 . 2 . . . A 20 GLY HA2 . 17495 1
168 . 1 1 20 20 GLY HA3 H 1 3.490 0.03 . 2 . . . A 20 GLY HA3 . 17495 1
169 . 1 1 20 20 GLY CA C 13 46.126 0.3 . 1 . . . A 20 GLY CA . 17495 1
170 . 1 1 20 20 GLY N N 15 102.201 0.3 . 1 . . . A 20 GLY N . 17495 1
171 . 1 1 21 21 THR H H 1 7.896 0.03 . 1 . . . A 21 THR H . 17495 1
172 . 1 1 21 21 THR HB H 1 4.432 0.03 . 1 . . . A 21 THR HB . 17495 1
173 . 1 1 21 21 THR HG21 H 1 1.176 0.03 . 1 . . . A 21 THR HG21 . 17495 1
174 . 1 1 21 21 THR HG22 H 1 1.176 0.03 . 1 . . . A 21 THR HG22 . 17495 1
175 . 1 1 21 21 THR HG23 H 1 1.176 0.03 . 1 . . . A 21 THR HG23 . 17495 1
176 . 1 1 21 21 THR CA C 13 76.049 0.3 . 1 . . . A 21 THR CA . 17495 1
177 . 1 1 21 21 THR CB C 13 77.141 0.3 . 1 . . . A 21 THR CB . 17495 1
178 . 1 1 21 21 THR CG2 C 13 20.449 0.3 . 1 . . . A 21 THR CG2 . 17495 1
179 . 1 1 21 21 THR N N 15 125.215 0.3 . 1 . . . A 21 THR N . 17495 1
180 . 1 1 22 22 GLU H H 1 8.635 0.03 . 1 . . . A 22 GLU H . 17495 1
181 . 1 1 22 22 GLU HA H 1 3.782 0.03 . 1 . . . A 22 GLU HA . 17495 1
182 . 1 1 22 22 GLU HB2 H 1 1.852 0.03 . 1 . . . A 22 GLU HB2 . 17495 1
183 . 1 1 22 22 GLU HB3 H 1 1.852 0.03 . 1 . . . A 22 GLU HB3 . 17495 1
184 . 1 1 22 22 GLU HG2 H 1 2.239 0.03 . 1 . . . A 22 GLU HG2 . 17495 1
185 . 1 1 22 22 GLU HG3 H 1 2.239 0.03 . 1 . . . A 22 GLU HG3 . 17495 1
186 . 1 1 22 22 GLU CA C 13 60.043 0.3 . 1 . . . A 22 GLU CA . 17495 1
187 . 1 1 22 22 GLU CB C 13 27.876 0.3 . 1 . . . A 22 GLU CB . 17495 1
188 . 1 1 22 22 GLU CG C 13 32.456 0.3 . 1 . . . A 22 GLU CG . 17495 1
189 . 1 1 22 22 GLU N N 15 116.101 0.3 . 1 . . . A 22 GLU N . 17495 1
190 . 1 1 23 23 PHE H H 1 7.499 0.03 . 1 . . . A 23 PHE H . 17495 1
191 . 1 1 23 23 PHE HA H 1 4.267 0.03 . 1 . . . A 23 PHE HA . 17495 1
192 . 1 1 23 23 PHE HB2 H 1 3.068 0.03 . 1 . . . A 23 PHE HB2 . 17495 1
193 . 1 1 23 23 PHE HB3 H 1 3.068 0.03 . 1 . . . A 23 PHE HB3 . 17495 1
194 . 1 1 23 23 PHE CA C 13 59.990 0.3 . 1 . . . A 23 PHE CA . 17495 1
195 . 1 1 23 23 PHE CB C 13 39.091 0.3 . 1 . . . A 23 PHE CB . 17495 1
196 . 1 1 23 23 PHE N N 15 115.946 0.3 . 1 . . . A 23 PHE N . 17495 1
197 . 1 1 24 24 ALA H H 1 8.616 0.03 . 1 . . . A 24 ALA H . 17495 1
198 . 1 1 24 24 ALA HA H 1 4.009 0.03 . 1 . . . A 24 ALA HA . 17495 1
199 . 1 1 24 24 ALA HB1 H 1 1.665 0.03 . 1 . . . A 24 ALA HB1 . 17495 1
200 . 1 1 24 24 ALA HB2 H 1 1.665 0.03 . 1 . . . A 24 ALA HB2 . 17495 1
201 . 1 1 24 24 ALA HB3 H 1 1.665 0.03 . 1 . . . A 24 ALA HB3 . 17495 1
202 . 1 1 24 24 ALA CA C 13 55.810 0.3 . 1 . . . A 24 ALA CA . 17495 1
203 . 1 1 24 24 ALA CB C 13 19.178 0.3 . 1 . . . A 24 ALA CB . 17495 1
204 . 1 1 24 24 ALA N N 15 119.298 0.3 . 1 . . . A 24 ALA N . 17495 1
205 . 1 1 25 25 ALA H H 1 8.320 0.03 . 1 . . . A 25 ALA H . 17495 1
206 . 1 1 25 25 ALA HB1 H 1 1.834 0.03 . 1 . . . A 25 ALA HB1 . 17495 1
207 . 1 1 25 25 ALA HB2 H 1 1.834 0.03 . 1 . . . A 25 ALA HB2 . 17495 1
208 . 1 1 25 25 ALA HB3 H 1 1.834 0.03 . 1 . . . A 25 ALA HB3 . 17495 1
209 . 1 1 25 25 ALA CA C 13 70.189 0.3 . 1 . . . A 25 ALA CA . 17495 1
210 . 1 1 25 25 ALA CB C 13 28.069 0.3 . 1 . . . A 25 ALA CB . 17495 1
211 . 1 1 25 25 ALA N N 15 121.594 0.3 . 1 . . . A 25 ALA N . 17495 1
212 . 1 1 26 26 ALA H H 1 7.664 0.03 . 1 . . . A 26 ALA H . 17495 1
213 . 1 1 26 26 ALA HA H 1 4.265 0.03 . 1 . . . A 26 ALA HA . 17495 1
214 . 1 1 26 26 ALA HB1 H 1 1.634 0.03 . 1 . . . A 26 ALA HB1 . 17495 1
215 . 1 1 26 26 ALA HB2 H 1 1.634 0.03 . 1 . . . A 26 ALA HB2 . 17495 1
216 . 1 1 26 26 ALA HB3 H 1 1.634 0.03 . 1 . . . A 26 ALA HB3 . 17495 1
217 . 1 1 26 26 ALA CA C 13 36.367 0.3 . 1 . . . A 26 ALA CA . 17495 1
218 . 1 1 26 26 ALA CB C 13 17.216 0.3 . 1 . . . A 26 ALA CB . 17495 1
219 . 1 1 26 26 ALA N N 15 119.470 0.3 . 1 . . . A 26 ALA N . 17495 1
220 . 1 1 27 27 SER H H 1 8.324 0.03 . 1 . . . A 27 SER H . 17495 1
221 . 1 1 27 27 SER HA H 1 3.934 0.03 . 1 . . . A 27 SER HA . 17495 1
222 . 1 1 27 27 SER HB2 H 1 4.138 0.03 . 2 . . . A 27 SER HB2 . 17495 1
223 . 1 1 27 27 SER HB3 H 1 3.904 0.03 . 2 . . . A 27 SER HB3 . 17495 1
224 . 1 1 27 27 SER CA C 13 62.684 0.3 . 1 . . . A 27 SER CA . 17495 1
225 . 1 1 27 27 SER CB C 13 62.993 0.3 . 1 . . . A 27 SER CB . 17495 1
226 . 1 1 27 27 SER N N 15 114.102 0.3 . 1 . . . A 27 SER N . 17495 1
227 . 1 1 28 28 DTY CA C 13 76.082 0.3 . 1 . . . A 28 DTY CA . 17495 1
228 . 1 1 28 28 DTY CB C 13 45.007 0.3 . 1 . . . A 28 DTY CB . 17495 1
229 . 1 1 28 28 DTY H H 1 8.204 0.03 . 1 . . . A 28 DTY H . 17495 1
230 . 1 1 28 28 DTY HB2 H 1 3.164 0.03 . 1 . . . A 28 DTY HB2 . 17495 1
231 . 1 1 28 28 DTY HB3 H 1 2.624 0.03 . 1 . . . A 28 DTY HB3 . 17495 1
232 . 1 1 28 28 DTY N N 15 129.274 0.3 . 1 . . . A 28 DTY N . 17495 1
233 . 1 1 29 29 PHE H H 1 7.783 0.03 . 1 . . . A 29 PHE H . 17495 1
234 . 1 1 29 29 PHE HA H 1 4.170 0.03 . 1 . . . A 29 PHE HA . 17495 1
235 . 1 1 29 29 PHE HB2 H 1 3.389 0.03 . 2 . . . A 29 PHE HB2 . 17495 1
236 . 1 1 29 29 PHE HB3 H 1 2.905 0.03 . 2 . . . A 29 PHE HB3 . 17495 1
237 . 1 1 29 29 PHE CA C 13 60.471 0.3 . 1 . . . A 29 PHE CA . 17495 1
238 . 1 1 29 29 PHE CB C 13 39.718 0.3 . 1 . . . A 29 PHE CB . 17495 1
239 . 1 1 29 29 PHE N N 15 110.808 0.3 . 1 . . . A 29 PHE N . 17495 1
240 . 1 1 30 30 LEU H H 1 7.750 0.03 . 1 . . . A 30 LEU H . 17495 1
241 . 1 1 30 30 LEU HA H 1 4.298 0.03 . 1 . . . A 30 LEU HA . 17495 1
242 . 1 1 30 30 LEU HB2 H 1 1.801 0.03 . 2 . . . A 30 LEU HB2 . 17495 1
243 . 1 1 30 30 LEU HB3 H 1 1.560 0.03 . 2 . . . A 30 LEU HB3 . 17495 1
244 . 1 1 30 30 LEU HG H 1 1.706 0.03 . 1 . . . A 30 LEU HG . 17495 1
245 . 1 1 30 30 LEU HD11 H 1 0.885 0.03 . 1 . . . A 30 LEU HD11 . 17495 1
246 . 1 1 30 30 LEU HD12 H 1 0.885 0.03 . 1 . . . A 30 LEU HD12 . 17495 1
247 . 1 1 30 30 LEU HD13 H 1 0.885 0.03 . 1 . . . A 30 LEU HD13 . 17495 1
248 . 1 1 30 30 LEU HD21 H 1 0.848 0.03 . 1 . . . A 30 LEU HD21 . 17495 1
249 . 1 1 30 30 LEU HD22 H 1 0.848 0.03 . 1 . . . A 30 LEU HD22 . 17495 1
250 . 1 1 30 30 LEU HD23 H 1 0.848 0.03 . 1 . . . A 30 LEU HD23 . 17495 1
251 . 1 1 30 30 LEU CA C 13 54.080 0.3 . 1 . . . A 30 LEU CA . 17495 1
252 . 1 1 30 30 LEU CB C 13 42.127 0.3 . 1 . . . A 30 LEU CB . 17495 1
253 . 1 1 30 30 LEU CD1 C 13 24.759 0.3 . 1 . . . A 30 LEU CD1 . 17495 1
254 . 1 1 30 30 LEU CD2 C 13 22.545 0.3 . 1 . . . A 30 LEU CD2 . 17495 1
255 . 1 1 30 30 LEU N N 15 118.789 0.3 . 1 . . . A 30 LEU N . 17495 1
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