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 30412
_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 $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' . . . 30412 1
2 '2D 1H-1H NOESY' . . . 30412 1
3 '2D 1H-15N HSQC' . . . 30412 1
4 '2D 1H-13C HSQC' . . . 30412 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.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 H H 1 8.691 0.009 . 1 . . . . A 1 GLY H1 . 30412 1
2 . 1 1 1 1 GLY HA2 H 1 3.793 0.016 . 1 . . . . A 1 GLY HA2 . 30412 1
3 . 1 1 1 1 GLY HA3 H 1 3.928 0.017 . 1 . . . . A 1 GLY HA3 . 30412 1
4 . 1 1 1 1 GLY CA C 13 48.895 0.000 . 1 . . . . A 1 GLY CA . 30412 1
5 . 1 1 1 1 GLY N N 15 108.674 0.000 . 1 . . . . A 1 GLY N . 30412 1
6 . 1 1 2 2 CYS H H 1 8.834 0.006 . 1 . . . . A 2 CYS H . 30412 1
7 . 1 1 2 2 CYS HA H 1 4.591 0.003 . 1 . . . . A 2 CYS HA . 30412 1
8 . 1 1 2 2 CYS HB2 H 1 3.219 0.014 . 1 . . . . A 2 CYS HB3 . 30412 1
9 . 1 1 2 2 CYS HB3 H 1 2.728 0.018 . 1 . . . . A 2 CYS HB3 . 30412 1
10 . 1 1 2 2 CYS CA C 13 60.456 0.000 . 1 . . . . A 2 CYS CA . 30412 1
11 . 1 1 2 2 CYS CB C 13 44.324 0.021 . 1 . . . . A 2 CYS CB . 30412 1
12 . 1 1 2 2 CYS N N 15 122.061 0.000 . 1 . . . . A 2 CYS N . 30412 1
13 . 1 1 3 3 CYS H H 1 8.248 0.012 . 1 . . . . A 3 CYS H . 30412 1
14 . 1 1 3 3 CYS HA H 1 4.334 0.011 . 1 . . . . A 3 CYS HA . 30412 1
15 . 1 1 3 3 CYS HB2 H 1 2.815 0.000 . 1 . . . . A 3 CYS HB3 . 30412 1
16 . 1 1 3 3 CYS HB3 H 1 3.269 0.000 . 1 . . . . A 3 CYS HB3 . 30412 1
17 . 1 1 3 3 CYS CA C 13 58.824 0.000 . 1 . . . . A 3 CYS CA . 30412 1
18 . 1 1 3 3 CYS CB C 13 43.750 0.041 . 1 . . . . A 3 CYS CB . 30412 1
19 . 1 1 3 3 CYS N N 15 113.233 0.000 . 1 . . . . A 3 CYS N . 30412 1
20 . 1 1 4 4 SER H H 1 7.853 0.010 . 1 . . . . A 4 SER H . 30412 1
21 . 1 1 4 4 SER HA H 1 4.432 0.017 . 1 . . . . A 4 SER HA . 30412 1
22 . 1 1 4 4 SER HB2 H 1 3.968 0.014 . 2 . . . . A 4 SER HB3 . 30412 1
23 . 1 1 4 4 SER HB3 H 1 3.968 0.014 . 2 . . . . A 4 SER HB3 . 30412 1
24 . 1 1 4 4 SER CA C 13 63.026 0.000 . 1 . . . . A 4 SER CA . 30412 1
25 . 1 1 4 4 SER CB C 13 66.356 0.000 . 1 . . . . A 4 SER CB . 30412 1
26 . 1 1 4 4 SER N N 15 114.775 0.000 . 1 . . . . A 4 SER N . 30412 1
27 . 1 1 5 5 ASP H H 1 7.920 0.012 . 1 . . . . A 5 ASP H . 30412 1
28 . 1 1 5 5 ASP HA H 1 5.203 0.002 . 1 . . . . A 5 ASP HA . 30412 1
29 . 1 1 5 5 ASP HB2 H 1 3.181 0.002 . 1 . . . . A 5 ASP HB3 . 30412 1
30 . 1 1 5 5 ASP HB3 H 1 2.701 0.002 . 1 . . . . A 5 ASP HB3 . 30412 1
31 . 1 1 5 5 ASP CA C 13 52.438 0.000 . 1 . . . . A 5 ASP CA . 30412 1
32 . 1 1 5 5 ASP CB C 13 43.812 0.000 . 1 . . . . A 5 ASP CB . 30412 1
33 . 1 1 5 5 ASP N N 15 124.075 0.000 . 1 . . . . A 5 ASP N . 30412 1
34 . 1 1 6 6 PRO HA H 1 4.263 0.008 . 1 . . . . A 6 PRO HA . 30412 1
35 . 1 1 6 6 PRO HB2 H 1 2.371 0.017 . 1 . . . . A 6 PRO HB3 . 30412 1
36 . 1 1 6 6 PRO HB3 H 1 1.988 0.013 . 1 . . . . A 6 PRO HB3 . 30412 1
37 . 1 1 6 6 PRO HG2 H 1 2.058 0.014 . 1 . . . . A 6 PRO HG3 . 30412 1
38 . 1 1 6 6 PRO HG3 H 1 2.110 0.001 . 1 . . . . A 6 PRO HG3 . 30412 1
39 . 1 1 6 6 PRO HD2 H 1 3.922 0.014 . 1 . . . . A 6 PRO HD3 . 30412 1
40 . 1 1 6 6 PRO HD3 H 1 4.076 0.005 . 1 . . . . A 6 PRO HD3 . 30412 1
41 . 1 1 6 6 PRO CA C 13 68.479 0.000 . 1 . . . . A 6 PRO CA . 30412 1
42 . 1 1 6 6 PRO CB C 13 34.988 0.000 . 1 . . . . A 6 PRO CB . 30412 1
43 . 1 1 6 6 PRO CG C 13 30.152 0.015 . 1 . . . . A 6 PRO CG . 30412 1
44 . 1 1 7 7 ARG H H 1 7.984 0.002 . 1 . . . . A 7 ARG H . 30412 1
45 . 1 1 7 7 ARG HA H 1 4.147 0.013 . 1 . . . . A 7 ARG HA . 30412 1
46 . 1 1 7 7 ARG HB2 H 1 1.893 0.005 . 2 . . . . A 7 ARG HB3 . 30412 1
47 . 1 1 7 7 ARG HB3 H 1 1.893 0.005 . 2 . . . . A 7 ARG HB3 . 30412 1
48 . 1 1 7 7 ARG HG2 H 1 1.734 0.010 . 1 . . . . A 7 ARG HG3 . 30412 1
49 . 1 1 7 7 ARG HG3 H 1 1.645 0.011 . 1 . . . . A 7 ARG HG3 . 30412 1
50 . 1 1 7 7 ARG HD2 H 1 3.203 0.003 . 2 . . . . A 7 ARG HD3 . 30412 1
51 . 1 1 7 7 ARG HD3 H 1 3.203 0.003 . 2 . . . . A 7 ARG HD3 . 30412 1
52 . 1 1 7 7 ARG HE H 1 7.397 0.002 . 1 . . . . A 7 ARG HE . 30412 1
53 . 1 1 7 7 ARG CA C 13 61.231 0.000 . 1 . . . . A 7 ARG CA . 30412 1
54 . 1 1 7 7 ARG CB C 13 32.315 0.000 . 1 . . . . A 7 ARG CB . 30412 1
55 . 1 1 7 7 ARG CG C 13 29.918 0.009 . 1 . . . . A 7 ARG CG . 30412 1
56 . 1 1 7 7 ARG N N 15 115.845 0.000 . 1 . . . . A 7 ARG N . 30412 1
57 . 1 1 8 8 CYS H H 1 8.094 0.002 . 1 . . . . A 8 CYS H . 30412 1
58 . 1 1 8 8 CYS HA H 1 4.409 0.004 . 1 . . . . A 8 CYS HA . 30412 1
59 . 1 1 8 8 CYS HB2 H 1 3.259 0.003 . 1 . . . . A 8 CYS HB3 . 30412 1
60 . 1 1 8 8 CYS HB3 H 1 4.235 0.007 . 1 . . . . A 8 CYS HB3 . 30412 1
61 . 1 1 8 8 CYS CA C 13 61.999 0.000 . 1 . . . . A 8 CYS CA . 30412 1
62 . 1 1 8 8 CYS CB C 13 43.762 0.000 . 1 . . . . A 8 CYS CB . 30412 1
63 . 1 1 8 8 CYS N N 15 121.386 0.000 . 1 . . . . A 8 CYS N . 30412 1
64 . 1 1 9 9 ASN H H 1 9.021 0.002 . 1 . . . . A 9 ASN H . 30412 1
65 . 1 1 9 9 ASN HA H 1 4.349 0.023 . 1 . . . . A 9 ASN HA . 30412 1
66 . 1 1 9 9 ASN HB2 H 1 2.858 0.008 . 2 . . . . A 9 ASN HB3 . 30412 1
67 . 1 1 9 9 ASN HB3 H 1 2.858 0.008 . 2 . . . . A 9 ASN HB3 . 30412 1
68 . 1 1 9 9 ASN HD21 H 1 7.997 0.000 . 1 . . . . A 9 ASN HD21 . 30412 1
69 . 1 1 9 9 ASN HD22 H 1 6.956 0.010 . 1 . . . . A 9 ASN HD22 . 30412 1
70 . 1 1 9 9 ASN CA C 13 59.119 0.000 . 1 . . . . A 9 ASN CA . 30412 1
71 . 1 1 9 9 ASN CB C 13 41.634 0.000 . 1 . . . . A 9 ASN CB . 30412 1
72 . 1 1 9 9 ASN N N 15 121.717 0.000 . 1 . . . . A 9 ASN N . 30412 1
73 . 1 1 9 9 ASN ND2 N 15 114.114 0.000 . 1 . . . . A 9 ASN ND2 . 30412 1
74 . 1 1 10 10 TYR H H 1 7.902 0.001 . 1 . . . . A 10 TYR H . 30412 1
75 . 1 1 10 10 TYR HA H 1 4.155 0.001 . 1 . . . . A 10 TYR HA . 30412 1
76 . 1 1 10 10 TYR HB2 H 1 3.190 0.007 . 1 . . . . A 10 TYR HB3 . 30412 1
77 . 1 1 10 10 TYR HB3 H 1 3.010 0.015 . 1 . . . . A 10 TYR HB3 . 30412 1
78 . 1 1 10 10 TYR HD1 H 1 7.100 0.001 . 3 . . . . A 10 TYR HD1 . 30412 1
79 . 1 1 10 10 TYR HD2 H 1 7.100 0.001 . 3 . . . . A 10 TYR HD2 . 30412 1
80 . 1 1 10 10 TYR HE1 H 1 6.796 0.001 . 3 . . . . A 10 TYR HE1 . 30412 1
81 . 1 1 10 10 TYR HE2 H 1 6.796 0.001 . 3 . . . . A 10 TYR HE2 . 30412 1
82 . 1 1 10 10 TYR CA C 13 62.635 0.000 . 1 . . . . A 10 TYR CA . 30412 1
83 . 1 1 10 10 TYR CB C 13 40.929 0.000 . 1 . . . . A 10 TYR CB . 30412 1
84 . 1 1 10 10 TYR N N 15 117.485 0.000 . 1 . . . . A 10 TYR N . 30412 1
85 . 1 1 11 11 ALA H H 1 7.398 0.010 . 1 . . . . A 11 ALA H . 30412 1
86 . 1 1 11 11 ALA HA H 1 4.103 0.017 . 1 . . . . A 11 ALA HA . 30412 1
87 . 1 1 11 11 ALA HB1 H 1 1.312 0.018 . 1 . . . . A 11 ALA HB1 . 30412 1
88 . 1 1 11 11 ALA HB2 H 1 1.312 0.018 . 1 . . . . A 11 ALA HB2 . 30412 1
89 . 1 1 11 11 ALA HB3 H 1 1.312 0.018 . 1 . . . . A 11 ALA HB3 . 30412 1
90 . 1 1 11 11 ALA CA C 13 55.023 0.000 . 1 . . . . A 11 ALA CA . 30412 1
91 . 1 1 11 11 ALA CB C 13 21.795 0.000 . 1 . . . . A 11 ALA CB . 30412 1
92 . 1 1 11 11 ALA N N 15 117.934 0.000 . 1 . . . . A 11 ALA N . 30412 1
93 . 1 1 12 12 HIS H H 1 7.840 0.009 . 1 . . . . A 12 HIS H . 30412 1
94 . 1 1 12 12 HIS HA H 1 5.060 0.013 . 1 . . . . A 12 HIS HA . 30412 1
95 . 1 1 12 12 HIS HB2 H 1 3.051 0.019 . 1 . . . . A 12 HIS HB3 . 30412 1
96 . 1 1 12 12 HIS HB3 H 1 3.248 0.003 . 1 . . . . A 12 HIS HB3 . 30412 1
97 . 1 1 12 12 HIS HD2 H 1 7.463 0.004 . 1 . . . . A 12 HIS HD2 . 30412 1
98 . 1 1 12 12 HIS CA C 13 56.575 0.000 . 1 . . . . A 12 HIS CA . 30412 1
99 . 1 1 12 12 HIS CB C 13 31.278 0.000 . 1 . . . . A 12 HIS CB . 30412 1
100 . 1 1 12 12 HIS N N 15 115.860 0.000 . 1 . . . . A 12 HIS N . 30412 1
101 . 1 1 13 13 PRO HA H 1 4.475 0.012 . 1 . . . . A 13 PRO HA . 30412 1
102 . 1 1 13 13 PRO HB2 H 1 2.274 0.019 . 1 . . . . A 13 PRO HB3 . 30412 1
103 . 1 1 13 13 PRO HB3 H 1 1.957 0.015 . 1 . . . . A 13 PRO HB3 . 30412 1
104 . 1 1 13 13 PRO HG2 H 1 1.949 0.017 . 2 . . . . A 13 PRO HG3 . 30412 1
105 . 1 1 13 13 PRO HG3 H 1 1.949 0.017 . 2 . . . . A 13 PRO HG3 . 30412 1
106 . 1 1 13 13 PRO HD2 H 1 3.384 0.003 . 1 . . . . A 13 PRO HD3 . 30412 1
107 . 1 1 13 13 PRO HD3 H 1 3.473 0.019 . 1 . . . . A 13 PRO HD3 . 30412 1
108 . 1 1 13 13 PRO CA C 13 67.477 0.000 . 1 . . . . A 13 PRO CA . 30412 1
109 . 1 1 13 13 PRO CB C 13 34.036 0.000 . 1 . . . . A 13 PRO CB . 30412 1
110 . 1 1 13 13 PRO CG C 13 30.001 0.000 . 1 . . . . A 13 PRO CG . 30412 1
111 . 1 1 14 14 ALA H H 1 8.413 0.009 . 1 . . . . A 14 ALA H . 30412 1
112 . 1 1 14 14 ALA HA H 1 4.242 0.021 . 1 . . . . A 14 ALA HA . 30412 1
113 . 1 1 14 14 ALA HB1 H 1 1.440 0.018 . 1 . . . . A 14 ALA HB1 . 30412 1
114 . 1 1 14 14 ALA HB2 H 1 1.440 0.018 . 1 . . . . A 14 ALA HB2 . 30412 1
115 . 1 1 14 14 ALA HB3 H 1 1.440 0.018 . 1 . . . . A 14 ALA HB3 . 30412 1
116 . 1 1 14 14 ALA CB C 13 21.229 0.000 . 1 . . . . A 14 ALA CB . 30412 1
117 . 1 1 14 14 ALA N N 15 120.577 0.000 . 1 . . . . A 14 ALA N . 30412 1
118 . 1 1 15 15 ILE H H 1 7.469 0.012 . 1 . . . . A 15 ILE H . 30412 1
119 . 1 1 15 15 ILE HA H 1 4.241 0.013 . 1 . . . . A 15 ILE HA . 30412 1
120 . 1 1 15 15 ILE HB H 1 1.989 0.017 . 1 . . . . A 15 ILE HB . 30412 1
121 . 1 1 15 15 ILE HG12 H 1 1.201 0.018 . 1 . . . . A 15 ILE HG13 . 30412 1
122 . 1 1 15 15 ILE HG13 H 1 1.624 0.016 . 1 . . . . A 15 ILE HG13 . 30412 1
123 . 1 1 15 15 ILE HG21 H 1 0.874 0.008 . 1 . . . . A 15 ILE HG21 . 30412 1
124 . 1 1 15 15 ILE HG22 H 1 0.874 0.008 . 1 . . . . A 15 ILE HG22 . 30412 1
125 . 1 1 15 15 ILE HG23 H 1 0.874 0.008 . 1 . . . . A 15 ILE HG23 . 30412 1
126 . 1 1 15 15 ILE HD11 H 1 0.800 0.018 . 1 . . . . A 15 ILE HD11 . 30412 1
127 . 1 1 15 15 ILE HD12 H 1 0.800 0.018 . 1 . . . . A 15 ILE HD12 . 30412 1
128 . 1 1 15 15 ILE HD13 H 1 0.800 0.018 . 1 . . . . A 15 ILE HD13 . 30412 1
129 . 1 1 15 15 ILE CA C 13 56.821 0.000 . 1 . . . . A 15 ILE CA . 30412 1
130 . 1 1 15 15 ILE CB C 13 41.451 0.000 . 1 . . . . A 15 ILE CB . 30412 1
131 . 1 1 15 15 ILE CG1 C 13 30.255 0.032 . 1 . . . . A 15 ILE CG1 . 30412 1
132 . 1 1 15 15 ILE CG2 C 13 15.495 0.000 . 1 . . . . A 15 ILE CG2 . 30412 1
133 . 1 1 15 15 ILE CD1 C 13 15.558 0.000 . 1 . . . . A 15 ILE CD1 . 30412 1
134 . 1 1 15 15 ILE N N 15 114.104 0.000 . 1 . . . . A 15 ILE N . 30412 1
135 . 1 1 16 16 CYS H H 1 8.021 0.011 . 1 . . . . A 16 CYS H . 30412 1
136 . 1 1 16 16 CYS HA H 1 4.988 0.005 . 1 . . . . A 16 CYS HA . 30412 1
137 . 1 1 16 16 CYS HB2 H 1 3.299 0.015 . 1 . . . . A 16 CYS HB3 . 30412 1
138 . 1 1 16 16 CYS HB3 H 1 2.738 0.015 . 1 . . . . A 16 CYS HB3 . 30412 1
139 . 1 1 16 16 CYS CA C 13 56.894 0.000 . 1 . . . . A 16 CYS CA . 30412 1
140 . 1 1 16 16 CYS CB C 13 40.918 0.017 . 1 . . . . A 16 CYS CB . 30412 1
141 . 1 1 16 16 CYS N N 15 118.406 0.000 . 1 . . . . A 16 CYS N . 30412 1
142 . 1 1 17 17 GLY H H 1 8.357 0.009 . 1 . . . . A 17 GLY H . 30412 1
143 . 1 1 17 17 GLY HA2 H 1 3.864 0.018 . 1 . . . . A 17 GLY HA2 . 30412 1
144 . 1 1 17 17 GLY HA3 H 1 4.067 0.020 . 1 . . . . A 17 GLY HA3 . 30412 1
145 . 1 1 17 17 GLY CA C 13 48.688 0.000 . 1 . . . . A 17 GLY CA . 30412 1
146 . 1 1 17 17 GLY N N 15 110.624 0.000 . 1 . . . . A 17 GLY N . 30412 1
147 . 1 1 18 18 GLY H H 1 8.446 0.012 . 1 . . . . A 18 GLY H . 30412 1
148 . 1 1 18 18 GLY HA2 H 1 4.007 0.005 . 1 . . . . A 18 GLY HA2 . 30412 1
149 . 1 1 18 18 GLY HA3 H 1 3.846 0.001 . 1 . . . . A 18 GLY HA3 . 30412 1
150 . 1 1 18 18 GLY N N 15 110.034 0.000 . 1 . . . . A 18 GLY N . 30412 1
151 . 1 1 19 19 ALA H H 1 8.213 0.015 . 1 . . . . A 19 ALA H . 30412 1
152 . 1 1 19 19 ALA HA H 1 4.368 0.013 . 1 . . . . A 19 ALA HA . 30412 1
153 . 1 1 19 19 ALA HB1 H 1 1.396 0.022 . 1 . . . . A 19 ALA HB1 . 30412 1
154 . 1 1 19 19 ALA HB2 H 1 1.396 0.022 . 1 . . . . A 19 ALA HB2 . 30412 1
155 . 1 1 19 19 ALA HB3 H 1 1.396 0.022 . 1 . . . . A 19 ALA HB3 . 30412 1
156 . 1 1 19 19 ALA CA C 13 54.764 0.000 . 1 . . . . A 19 ALA CA . 30412 1
157 . 1 1 19 19 ALA CB C 13 21.931 0.000 . 1 . . . . A 19 ALA CB . 30412 1
158 . 1 1 19 19 ALA N N 15 124.137 0.000 . 1 . . . . A 19 ALA N . 30412 1
159 . 1 1 20 20 ALA H H 1 8.185 0.012 . 1 . . . . A 20 ALA H . 30412 1
160 . 1 1 20 20 ALA HA H 1 4.289 0.015 . 1 . . . . A 20 ALA HA . 30412 1
161 . 1 1 20 20 ALA HB1 H 1 1.388 0.015 . 1 . . . . A 20 ALA HB1 . 30412 1
162 . 1 1 20 20 ALA HB2 H 1 1.388 0.015 . 1 . . . . A 20 ALA HB2 . 30412 1
163 . 1 1 20 20 ALA HB3 H 1 1.388 0.015 . 1 . . . . A 20 ALA HB3 . 30412 1
164 . 1 1 20 20 ALA CA C 13 55.101 0.000 . 1 . . . . A 20 ALA CA . 30412 1
165 . 1 1 20 20 ALA CB C 13 21.917 0.000 . 1 . . . . A 20 ALA CB . 30412 1
166 . 1 1 20 20 ALA N N 15 122.795 0.000 . 1 . . . . A 20 ALA N . 30412 1
167 . 1 1 21 21 GLY H H 1 8.140 0.015 . 1 . . . . A 21 GLY H . 30412 1
168 . 1 1 21 21 GLY HA2 H 1 4.012 0.022 . 1 . . . . A 21 GLY HA2 . 30412 1
169 . 1 1 21 21 GLY HA3 H 1 3.855 0.000 . 1 . . . . A 21 GLY HA3 . 30412 1
170 . 1 1 21 21 GLY CA C 13 47.552 0.000 . 1 . . . . A 21 GLY CA . 30412 1
171 . 1 1 21 21 GLY N N 15 107.752 0.000 . 1 . . . . A 21 GLY N . 30412 1
172 . 1 1 22 22 GLY H H 1 8.312 0.001 . 1 . . . . A 22 GLY H . 30412 1
173 . 1 1 22 22 GLY HA2 H 1 4.116 0.016 . 1 . . . . A 22 GLY HA2 . 30412 1
174 . 1 1 22 22 GLY HA3 H 1 3.928 0.014 . 1 . . . . A 22 GLY HA3 . 30412 1
stop_
save_