Content for NMR-STAR saveframe, "assigned_chem_shift"
save_assigned_chem_shift
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift
_Assigned_chem_shift_list.Entry_ID 21010
_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
_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' . . . 21010 1
2 '2D 1H-13C HSQC' . . . 21010 1
3 '2D 1H-1H NOESY' . . . 21010 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 ACE C C 13 24.230 0.05 . 1 . . . . 1 ACE C . 21010 1
2 . 1 1 1 1 ACE H1 H 1 2.048 0.01 . 1 . . . . 1 ACE H . 21010 1
3 . 1 1 1 1 ACE H2 H 1 2.048 0.01 . 1 . . . . 1 ACE H . 21010 1
4 . 1 1 1 1 ACE H3 H 1 2.048 0.01 . 1 . . . . 1 ACE H . 21010 1
5 . 1 1 2 2 MET H H 1 8.646 0.01 . 1 . . . . 2 MET H . 21010 1
6 . 1 1 2 2 MET HA H 1 4.469 0.01 . 1 . . . . 2 MET HA . 21010 1
7 . 1 1 2 2 MET HB2 H 1 2.273 0.01 . 2 . . . . 2 MET HB2 . 21010 1
8 . 1 1 2 2 MET HB3 H 1 2.141 0.01 . 2 . . . . 2 MET HB3 . 21010 1
9 . 1 1 2 2 MET HG2 H 1 2.992 0.01 . 2 . . . . 2 MET HG2 . 21010 1
10 . 1 1 2 2 MET HG3 H 1 2.924 0.01 . 2 . . . . 2 MET HG3 . 21010 1
11 . 1 1 2 2 MET HE1 H 1 2.694 0.01 . 1 . . . . 2 MET ME . 21010 1
12 . 1 1 2 2 MET HE2 H 1 2.694 0.01 . 1 . . . . 2 MET ME . 21010 1
13 . 1 1 2 2 MET HE3 H 1 2.694 0.01 . 1 . . . . 2 MET ME . 21010 1
14 . 1 1 2 2 MET CA C 13 55.203 0.05 . 1 . . . . 2 MET CA . 21010 1
15 . 1 1 2 2 MET CB C 13 26.682 0.05 . 1 . . . . 2 MET CB . 21010 1
16 . 1 1 2 2 MET CG C 13 50.955 0.05 . 1 . . . . 2 MET CG . 21010 1
17 . 1 1 2 2 MET CE C 13 38.949 0.05 . 1 . . . . 2 MET CE . 21010 1
18 . 1 1 3 3 GLY H H 1 8.722 0.01 . 1 . . . . 3 GLY H . 21010 1
19 . 1 1 3 3 GLY HA2 H 1 3.989 0.01 . 2 . . . . 3 GLY QA . 21010 1
20 . 1 1 3 3 GLY HA3 H 1 3.989 0.01 . 2 . . . . 3 GLY QA . 21010 1
21 . 1 1 3 3 GLY CA C 13 44.971 0.05 . 1 . . . . 3 GLY CA . 21010 1
22 . 1 1 4 4 SER H H 1 8.368 0.01 . 1 . . . . 4 SER H . 21010 1
23 . 1 1 4 4 SER HA H 1 4.443 0.01 . 1 . . . . 4 SER HA . 21010 1
24 . 1 1 4 4 SER HB2 H 1 3.902 0.01 . 2 . . . . 4 SER HB2 . 21010 1
25 . 1 1 4 4 SER HB3 H 1 3.847 0.01 . 2 . . . . 4 SER HB3 . 21010 1
26 . 1 1 4 4 SER CA C 13 57.987 0.05 . 1 . . . . 4 SER CA . 21010 1
27 . 1 1 4 4 SER CB C 13 63.577 0.05 . 1 . . . . 4 SER CB . 21010 1
28 . 1 1 5 5 ALA H H 1 8.576 0.01 . 1 . . . . 5 ALA H . 21010 1
29 . 1 1 5 5 ALA HA H 1 4.340 0.01 . 1 . . . . 5 ALA HA . 21010 1
30 . 1 1 5 5 ALA HB1 H 1 1.397 0.01 . 1 . . . . 5 ALA MB . 21010 1
31 . 1 1 5 5 ALA HB2 H 1 1.397 0.01 . 1 . . . . 5 ALA MB . 21010 1
32 . 1 1 5 5 ALA HB3 H 1 1.397 0.01 . 1 . . . . 5 ALA MB . 21010 1
33 . 1 1 5 5 ALA CA C 13 52.528 0.05 . 1 . . . . 5 ALA CA . 21010 1
34 . 1 1 6 6 ASP H H 1 8.428 0.01 . 1 . . . . 6 ASP H . 21010 1
35 . 1 1 6 6 ASP HA H 1 4.661 0.01 . 1 . . . . 6 ASP HA . 21010 1
36 . 1 1 6 6 ASP HB2 H 1 2.874 0.01 . 2 . . . . 6 ASP HB2 . 21010 1
37 . 1 1 6 6 ASP HB3 H 1 2.788 0.01 . 2 . . . . 6 ASP HB3 . 21010 1
38 . 1 1 6 6 ASP CA C 13 53.101 0.05 . 1 . . . . 6 ASP CA . 21010 1
39 . 1 1 6 6 ASP CB C 13 38.566 0.05 . 1 . . . . 6 ASP CB . 21010 1
40 . 1 1 7 7 GLY H H 1 8.385 0.01 . 1 . . . . 7 GLY H . 21010 1
41 . 1 1 7 7 GLY HA2 H 1 3.930 0.01 . 2 . . . . 7 GLY QA . 21010 1
42 . 1 1 7 7 GLY HA3 H 1 3.930 0.01 . 2 . . . . 7 GLY QA . 21010 1
43 . 1 1 8 8 ALA H H 1 8.236 0.01 . 1 . . . . 8 ALA H . 21010 1
44 . 1 1 8 8 ALA HA H 1 4.249 0.01 . 1 . . . . 8 ALA HA . 21010 1
45 . 1 1 8 8 ALA HB1 H 1 1.385 0.01 . 1 . . . . 8 ALA MB . 21010 1
46 . 1 1 8 8 ALA HB2 H 1 1.385 0.01 . 1 . . . . 8 ALA MB . 21010 1
47 . 1 1 8 8 ALA HB3 H 1 1.385 0.01 . 1 . . . . 8 ALA MB . 21010 1
48 . 1 1 9 9 CYS H H 1 8.482 0.01 . 1 . . . . 9 CYS H . 21010 1
49 . 1 1 9 9 CYS HA H 1 4.630 0.01 . 1 . . . . 9 CYS HA . 21010 1
50 . 1 1 9 9 CYS HB2 H 1 3.105 0.01 . 2 . . . . 9 CYS HB2 . 21010 1
51 . 1 1 9 9 CYS HB3 H 1 2.972 0.01 . 2 . . . . 9 CYS HB3 . 21010 1
52 . 1 1 9 9 CYS CA C 13 55.274 0.05 . 1 . . . . 9 CYS CA . 21010 1
53 . 1 1 9 9 CYS CB C 13 40.935 0.05 . 1 . . . . 9 CYS CB . 21010 1
54 . 1 1 10 10 SER H H 1 8.388 0.01 . 1 . . . . 10 SER H . 21010 1
55 . 1 1 10 10 SER HA H 1 4.467 0.01 . 1 . . . . 10 SER HA . 21010 1
56 . 1 1 10 10 SER HB2 H 1 3.844 0.01 . 2 . . . . 10 SER HB2 . 21010 1
57 . 1 1 10 10 SER HB3 H 1 3.785 0.01 . 2 . . . . 10 SER HB3 . 21010 1
58 . 1 1 10 10 SER CA C 13 58.099 0.05 . 1 . . . . 10 SER CA . 21010 1
59 . 1 1 10 10 SER CB C 13 63.599 0.05 . 1 . . . . 10 SER CB . 21010 1
60 . 1 1 11 11 TRP H H 1 8.231 0.01 . 1 . . . . 11 TRP H . 21010 1
61 . 1 1 11 11 TRP HA H 1 4.682 0.01 . 1 . . . . 11 TRP HA . 21010 1
62 . 1 1 11 11 TRP HB2 H 1 3.273 0.01 . 2 . . . . 11 TRP QB . 21010 1
63 . 1 1 11 11 TRP HB3 H 1 3.273 0.01 . 2 . . . . 11 TRP QB . 21010 1
64 . 1 1 11 11 TRP HD1 H 1 7.249 0.01 . 1 . . . . 11 TRP HD1 . 21010 1
65 . 1 1 11 11 TRP HE1 H 1 10.188 0.01 . 1 . . . . 11 TRP HE1 . 21010 1
66 . 1 1 11 11 TRP HE3 H 1 7.544 0.01 . 1 . . . . 11 TRP HE3 . 21010 1
67 . 1 1 11 11 TRP HZ2 H 1 7.455 0.01 . 1 . . . . 11 TRP HZ2 . 21010 1
68 . 1 1 11 11 TRP HZ3 H 1 7.108 0.01 . 1 . . . . 11 TRP HZ3 . 21010 1
69 . 1 1 11 11 TRP HH2 H 1 7.202 0.01 . 1 . . . . 11 TRP HH2 . 21010 1
70 . 1 1 11 11 TRP CA C 13 57.279 0.05 . 1 . . . . 11 TRP CA . 21010 1
71 . 1 1 11 11 TRP CB C 13 29.078 0.05 . 1 . . . . 11 TRP CB . 21010 1
72 . 1 1 11 11 TRP CD1 C 13 126.874 0.05 . 1 . . . . 11 TRP CD1 . 21010 1
73 . 1 1 11 11 TRP CE3 C 13 120.474 0.05 . 1 . . . . 11 TRP CE3 . 21010 1
74 . 1 1 11 11 TRP CZ2 C 13 114.223 0.05 . 1 . . . . 11 TRP CZ2 . 21010 1
75 . 1 1 11 11 TRP CZ3 C 13 121.698 0.05 . 1 . . . . 11 TRP CZ3 . 21010 1
76 . 1 1 11 11 TRP CH2 C 13 124.342 0.05 . 1 . . . . 11 TRP CH2 . 21010 1
77 . 1 1 12 12 ARG H H 1 8.200 0.01 . 1 . . . . 12 ARG H . 21010 1
78 . 1 1 12 12 ARG HA H 1 4.160 0.01 . 1 . . . . 12 ARG HA . 21010 1
79 . 1 1 12 12 ARG HB2 H 1 1.736 0.01 . 2 . . . . 12 ARG HB2 . 21010 1
80 . 1 1 12 12 ARG HB3 H 1 1.542 0.01 . 2 . . . . 12 ARG HB3 . 21010 1
81 . 1 1 12 12 ARG HG2 H 1 1.289 0.01 . 2 . . . . 12 ARG QG . 21010 1
82 . 1 1 12 12 ARG HG3 H 1 1.289 0.01 . 2 . . . . 12 ARG QG . 21010 1
83 . 1 1 12 12 ARG HD2 H 1 3.050 0.01 . 2 . . . . 12 ARG QD . 21010 1
84 . 1 1 12 12 ARG HD3 H 1 3.050 0.01 . 2 . . . . 12 ARG QD . 21010 1
85 . 1 1 12 12 ARG HE H 1 7.133 0.01 . 1 . . . . 12 ARG HE . 21010 1
86 . 1 1 12 12 ARG CA C 13 56.051 0.05 . 1 . . . . 12 ARG CA . 21010 1
87 . 1 1 12 12 ARG CB C 13 30.109 0.05 . 1 . . . . 12 ARG CB . 21010 1
88 . 1 1 12 12 ARG CG C 13 26.535 0.05 . 1 . . . . 12 ARG CG . 21010 1
89 . 1 1 12 12 ARG CD C 13 42.873 0.05 . 1 . . . . 12 ARG CD . 21010 1
90 . 1 1 13 13 GLY H H 1 7.986 0.01 . 1 . . . . 13 GLY H . 21010 1
91 . 1 1 13 13 GLY HA2 H 1 3.929 0.01 . 2 . . . . 13 GLY HA2 . 21010 1
92 . 1 1 13 13 GLY HA3 H 1 3.813 0.01 . 2 . . . . 13 GLY HA3 . 21010 1
93 . 1 1 13 13 GLY CA C 13 45.134 0.05 . 1 . . . . 13 GLY CA . 21010 1
94 . 1 1 14 14 LEU H H 1 8.213 0.01 . 1 . . . . 14 LEU H . 21010 1
95 . 1 1 14 14 LEU HA H 1 4.319 0.01 . 1 . . . . 14 LEU HA . 21010 1
96 . 1 1 14 14 LEU HB2 H 1 1.685 0.01 . 2 . . . . 14 LEU HB2 . 21010 1
97 . 1 1 14 14 LEU HB3 H 1 1.588 0.01 . 2 . . . . 14 LEU HB3 . 21010 1
98 . 1 1 14 14 LEU HG H 1 1.619 0.01 . 1 . . . . 14 LEU HG . 21010 1
99 . 1 1 14 14 LEU HD11 H 1 0.923 0.01 . 2 . . . . 14 LEU MD1 . 21010 1
100 . 1 1 14 14 LEU HD12 H 1 0.923 0.01 . 2 . . . . 14 LEU MD1 . 21010 1
101 . 1 1 14 14 LEU HD13 H 1 0.923 0.01 . 2 . . . . 14 LEU MD1 . 21010 1
102 . 1 1 14 14 LEU HD21 H 1 0.871 0.01 . 2 . . . . 14 LEU MD2 . 21010 1
103 . 1 1 14 14 LEU HD22 H 1 0.871 0.01 . 2 . . . . 14 LEU MD2 . 21010 1
104 . 1 1 14 14 LEU HD23 H 1 0.871 0.01 . 2 . . . . 14 LEU MD2 . 21010 1
105 . 1 1 14 14 LEU CA C 13 55.229 0.05 . 1 . . . . 14 LEU CA . 21010 1
106 . 1 1 14 14 LEU CB C 13 42.035 0.05 . 1 . . . . 14 LEU CB . 21010 1
107 . 1 1 14 14 LEU CG C 13 26.607 0.05 . 1 . . . . 14 LEU CG . 21010 1
108 . 1 1 14 14 LEU CD1 C 13 24.759 0.05 . 2 . . . . 14 LEU CD1 . 21010 1
109 . 1 1 14 14 LEU CD2 C 13 22.987 0.05 . 2 . . . . 14 LEU CD2 . 21010 1
110 . 1 1 15 15 GLU H H 1 8.479 0.01 . 1 . . . . 15 GLU H . 21010 1
111 . 1 1 15 15 GLU HA H 1 4.238 0.01 . 1 . . . . 15 GLU HA . 21010 1
112 . 1 1 15 15 GLU HB2 H 1 2.063 0.01 . 2 . . . . 15 GLU HB2 . 21010 1
113 . 1 1 15 15 GLU HB3 H 1 1.961 0.01 . 2 . . . . 15 GLU HB3 . 21010 1
114 . 1 1 15 15 GLU HG2 H 1 2.392 0.01 . 2 . . . . 15 GLU QG . 21010 1
115 . 1 1 15 15 GLU HG3 H 1 2.392 0.01 . 2 . . . . 15 GLU QG . 21010 1
116 . 1 1 15 15 GLU CA C 13 55.978 0.05 . 1 . . . . 15 GLU CA . 21010 1
117 . 1 1 15 15 GLU CB C 13 28.154 0.05 . 1 . . . . 15 GLU CB . 21010 1
118 . 1 1 15 15 GLU CG C 13 32.930 0.05 . 1 . . . . 15 GLU CG . 21010 1
119 . 1 1 16 16 ASN H H 1 8.344 0.01 . 1 . . . . 16 ASN H . 21010 1
120 . 1 1 16 16 ASN HA H 1 4.546 0.01 . 1 . . . . 16 ASN HA . 21010 1
121 . 1 1 16 16 ASN HB2 H 1 2.801 0.01 . 2 . . . . 16 ASN HB2 . 21010 1
122 . 1 1 16 16 ASN HB3 H 1 2.704 0.01 . 2 . . . . 16 ASN HB3 . 21010 1
123 . 1 1 16 16 ASN HD21 H 1 7.634 0.01 . 2 . . . . 16 ASN HD21 . 21010 1
124 . 1 1 16 16 ASN HD22 H 1 6.984 0.01 . 2 . . . . 16 ASN HD22 . 21010 1
125 . 1 1 16 16 ASN CA C 13 53.061 0.05 . 1 . . . . 16 ASN CA . 21010 1
126 . 1 1 16 16 ASN CB C 13 38.083 0.05 . 1 . . . . 16 ASN CB . 21010 1
127 . 1 1 17 17 HIS H H 1 8.423 0.01 . 1 . . . . 17 HIS H . 21010 1
128 . 1 1 17 17 HIS HA H 1 4.533 0.01 . 1 . . . . 17 HIS HA . 21010 1
129 . 1 1 17 17 HIS HB2 H 1 3.251 0.01 . 2 . . . . 17 HIS HB2 . 21010 1
130 . 1 1 17 17 HIS HB3 H 1 3.131 0.01 . 2 . . . . 17 HIS HB3 . 21010 1
131 . 1 1 17 17 HIS HD2 H 1 7.210 0.01 . 1 . . . . 17 HIS HD2 . 21010 1
132 . 1 1 17 17 HIS HE1 H 1 8.529 0.01 . 1 . . . . 17 HIS HE1 . 21010 1
133 . 1 1 17 17 HIS CB C 13 28.107 0.05 . 1 . . . . 17 HIS CB . 21010 1
134 . 1 1 17 17 HIS CD2 C 13 119.536 0.05 . 1 . . . . 17 HIS CD2 . 21010 1
135 . 1 1 17 17 HIS CE1 C 13 135.765 0.05 . 1 . . . . 17 HIS CE1 . 21010 1
136 . 1 1 18 18 ALA H H 1 8.308 0.01 . 1 . . . . 18 ALA H . 21010 1
137 . 1 1 18 18 ALA HA H 1 4.251 0.01 . 1 . . . . 18 ALA HA . 21010 1
138 . 1 1 18 18 ALA HB1 H 1 1.375 0.01 . 1 . . . . 18 ALA MB . 21010 1
139 . 1 1 18 18 ALA HB2 H 1 1.375 0.01 . 1 . . . . 18 ALA MB . 21010 1
140 . 1 1 18 18 ALA HB3 H 1 1.375 0.01 . 1 . . . . 18 ALA MB . 21010 1
141 . 1 1 19 19 MET H H 1 8.507 0.01 . 1 . . . . 19 MET H . 21010 1
142 . 1 1 19 19 MET HA H 1 4.529 0.01 . 1 . . . . 19 MET HA . 21010 1
143 . 1 1 19 19 MET HB2 H 1 2.258 0.01 . 2 . . . . 19 MET HB2 . 21010 1
144 . 1 1 19 19 MET HB3 H 1 2.150 0.01 . 2 . . . . 19 MET HB3 . 21010 1
145 . 1 1 19 19 MET HG2 H 1 2.928 0.01 . 2 . . . . 19 MET HG2 . 21010 1
146 . 1 1 19 19 MET HG3 H 1 2.884 0.01 . 2 . . . . 19 MET HG3 . 21010 1
147 . 1 1 19 19 MET HE1 H 1 2.681 0.01 . 1 . . . . 19 MET ME . 21010 1
148 . 1 1 19 19 MET HE2 H 1 2.681 0.01 . 1 . . . . 19 MET ME . 21010 1
149 . 1 1 19 19 MET HE3 H 1 2.681 0.01 . 1 . . . . 19 MET ME . 21010 1
150 . 1 1 19 19 MET CB C 13 26.415 0.05 . 1 . . . . 19 MET CB . 21010 1
151 . 1 1 19 19 MET CG C 13 50.955 0.05 . 1 . . . . 19 MET CG . 21010 1
152 . 1 1 19 19 MET CE C 13 38.949 0.05 . 1 . . . . 19 MET CE . 21010 1
153 . 1 1 20 20 CYS H H 1 8.561 0.01 . 1 . . . . 20 CYS H . 21010 1
154 . 1 1 20 20 CYS HA H 1 4.679 0.01 . 1 . . . . 20 CYS HA . 21010 1
155 . 1 1 20 20 CYS HB2 H 1 3.165 0.01 . 2 . . . . 20 CYS HB2 . 21010 1
156 . 1 1 20 20 CYS HB3 H 1 2.891 0.01 . 2 . . . . 20 CYS HB3 . 21010 1
157 . 1 1 20 20 CYS CA C 13 55.298 0.05 . 1 . . . . 20 CYS CA . 21010 1
158 . 1 1 20 20 CYS CB C 13 40.880 0.05 . 1 . . . . 20 CYS CB . 21010 1
159 . 1 1 21 21 GLY H H 1 8.612 0.01 . 1 . . . . 21 GLY H . 21010 1
160 . 1 1 21 21 GLY HA2 H 1 3.956 0.01 . 2 . . . . 21 GLY QA . 21010 1
161 . 1 1 21 21 GLY HA3 H 1 3.956 0.01 . 2 . . . . 21 GLY QA . 21010 1
162 . 1 1 21 21 GLY CA C 13 44.962 0.05 . 1 . . . . 21 GLY CA . 21010 1
163 . 1 1 22 22 ALA H H 1 8.302 0.01 . 1 . . . . 22 ALA H . 21010 1
164 . 1 1 22 22 ALA HA H 1 4.296 0.01 . 1 . . . . 22 ALA HA . 21010 1
165 . 1 1 22 22 ALA HB1 H 1 1.386 0.01 . 1 . . . . 22 ALA MB . 21010 1
166 . 1 1 22 22 ALA HB2 H 1 1.386 0.01 . 1 . . . . 22 ALA MB . 21010 1
167 . 1 1 22 22 ALA HB3 H 1 1.386 0.01 . 1 . . . . 22 ALA MB . 21010 1
168 . 1 1 22 22 ALA CA C 13 52.091 0.05 . 1 . . . . 22 ALA CA . 21010 1
169 . 1 1 23 23 ALA H H 1 8.519 0.01 . 1 . . . . 23 ALA H . 21010 1
170 . 1 1 23 23 ALA HA H 1 4.266 0.01 . 1 . . . . 23 ALA HA . 21010 1
171 . 1 1 23 23 ALA HB1 H 1 1.393 0.01 . 1 . . . . 23 ALA MB . 21010 1
172 . 1 1 23 23 ALA HB2 H 1 1.393 0.01 . 1 . . . . 23 ALA MB . 21010 1
173 . 1 1 23 23 ALA HB3 H 1 1.393 0.01 . 1 . . . . 23 ALA MB . 21010 1
174 . 1 1 24 24 GLY H H 1 8.433 0.01 . 1 . . . . 24 GLY H . 21010 1
175 . 1 1 24 24 GLY HA2 H 1 3.915 0.01 . 2 . . . . 24 GLY HA2 . 21010 1
176 . 1 1 24 24 GLY HA3 H 1 3.862 0.01 . 2 . . . . 24 GLY HA3 . 21010 1
177 . 1 1 24 24 GLY CA C 13 44.616 0.05 . 1 . . . . 24 GLY CA . 21010 1
stop_
save_