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 30625
_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' . . . 30625 1
2 '2D 1H-1H TOCSY' . . . 30625 1
3 '2D 1H-1H COSY' . . . 30625 1
4 '2D 1H-1H NOESY' . . . 30625 1
5 '2D 1H-1H NOESY' . . . 30625 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 H H 1 7.834 0.000 . . . . . . A 1 GLY H1 . 30625 1
2 . 1 . 1 1 1 GLY HA2 H 1 4.033 0.000 . . . . . . A 1 GLY HA2 . 30625 1
3 . 1 . 1 1 1 GLY HA3 H 1 3.817 0.000 . . . . . . A 1 GLY HA3 . 30625 1
4 . 1 . 1 2 2 GLY H H 1 8.545 0.000 . . . . . . A 2 GLY H . 30625 1
5 . 1 . 1 2 2 GLY HA2 H 1 3.719 0.000 . . . . . . A 2 GLY HA2 . 30625 1
6 . 1 . 1 2 2 GLY HA3 H 1 4.407 0.000 . . . . . . A 2 GLY HA3 . 30625 1
7 . 1 . 1 3 3 ASP H H 1 8.635 0.000 . . . . . . A 3 ASP H . 30625 1
8 . 1 . 1 3 3 ASP HA H 1 5.043 0.000 . . . . . . A 3 ASP HA . 30625 1
9 . 1 . 1 3 3 ASP HB2 H 1 2.742 0.000 . . . . . . A 3 ASP HB2 . 30625 1
10 . 1 . 1 3 3 ASP HB3 H 1 2.639 0.000 . . . . . . A 3 ASP HB3 . 30625 1
11 . 1 . 1 4 4 GLY H H 1 8.033 0.000 . . . . . . A 4 GLY H . 30625 1
12 . 1 . 1 4 4 GLY HA2 H 1 3.959 0.000 . . . . . . A 4 GLY HA2 . 30625 1
13 . 1 . 1 4 4 GLY HA3 H 1 3.623 0.000 . . . . . . A 4 GLY HA3 . 30625 1
14 . 1 . 1 5 5 SER H H 1 7.208 0.000 . . . . . . A 5 SER H . 30625 1
15 . 1 . 1 5 5 SER HA H 1 4.287 0.000 . . . . . . A 5 SER HA . 30625 1
16 . 1 . 1 5 5 SER HB2 H 1 3.676 0.000 . . . . . . A 5 SER HB2 . 30625 1
17 . 1 . 1 5 5 SER HB3 H 1 3.615 0.000 . . . . . . A 5 SER HB3 . 30625 1
18 . 1 . 1 6 6 ILE H H 1 8.609 0.000 . . . . . . A 6 ILE H . 30625 1
19 . 1 . 1 6 6 ILE HA H 1 4.131 0.000 . . . . . . A 6 ILE HA . 30625 1
20 . 1 . 1 6 6 ILE HB H 1 0.824 0.000 . . . . . . A 6 ILE HB . 30625 1
21 . 1 . 1 6 6 ILE HG12 H 1 1.243 0.000 . . . . . . A 6 ILE HG12 . 30625 1
22 . 1 . 1 6 6 ILE HG13 H 1 0.694 0.000 . . . . . . A 6 ILE HG13 . 30625 1
23 . 1 . 1 6 6 ILE HG21 H 1 0.768 0.000 . . . . . . A 6 ILE HG21 . 30625 1
24 . 1 . 1 6 6 ILE HG22 H 1 0.768 0.000 . . . . . . A 6 ILE HG22 . 30625 1
25 . 1 . 1 6 6 ILE HG23 H 1 0.768 0.000 . . . . . . A 6 ILE HG23 . 30625 1
26 . 1 . 1 6 6 ILE HD11 H 1 0.506 0.000 . . . . . . A 6 ILE HD11 . 30625 1
27 . 1 . 1 6 6 ILE HD12 H 1 0.506 0.000 . . . . . . A 6 ILE HD12 . 30625 1
28 . 1 . 1 6 6 ILE HD13 H 1 0.506 0.000 . . . . . . A 6 ILE HD13 . 30625 1
29 . 1 . 1 7 7 ALA H H 1 8.692 0.000 . . . . . . A 7 ALA H . 30625 1
30 . 1 . 1 7 7 ALA HA H 1 3.730 0.000 . . . . . . A 7 ALA HA . 30625 1
31 . 1 . 1 7 7 ALA HB1 H 1 1.074 0.000 . . . . . . A 7 ALA HB1 . 30625 1
32 . 1 . 1 7 7 ALA HB2 H 1 1.074 0.000 . . . . . . A 7 ALA HB2 . 30625 1
33 . 1 . 1 7 7 ALA HB3 H 1 1.074 0.000 . . . . . . A 7 ALA HB3 . 30625 1
34 . 1 . 1 8 8 GLU H H 1 7.974 0.000 . . . . . . A 8 GLU H . 30625 1
35 . 1 . 1 8 8 GLU HA H 1 3.904 0.000 . . . . . . A 8 GLU HA . 30625 1
36 . 1 . 1 8 8 GLU HB2 H 1 1.598 0.000 . . . . . . A 8 GLU HB2 . 30625 1
37 . 1 . 1 8 8 GLU HB3 H 1 1.447 0.000 . . . . . . A 8 GLU HB3 . 30625 1
38 . 1 . 1 8 8 GLU HG2 H 1 1.935 0.000 . . . . . . A 8 GLU HG2 . 30625 1
39 . 1 . 1 8 8 GLU HG3 H 1 1.815 0.000 . . . . . . A 8 GLU HG3 . 30625 1
40 . 1 . 1 9 9 TYR H H 1 7.773 0.000 . . . . . . A 9 TYR H . 30625 1
41 . 1 . 1 9 9 TYR HA H 1 4.336 0.000 . . . . . . A 9 TYR HA . 30625 1
42 . 1 . 1 9 9 TYR HB2 H 1 2.775 0.000 . . . . . . A 9 TYR HB2 . 30625 1
43 . 1 . 1 9 9 TYR HB3 H 1 2.683 0.000 . . . . . . A 9 TYR HB3 . 30625 1
44 . 1 . 1 9 9 TYR HD1 H 1 6.783 0.000 . . . . . . A 9 TYR HD1 . 30625 1
45 . 1 . 1 9 9 TYR HD2 H 1 6.783 0.000 . . . . . . A 9 TYR HD2 . 30625 1
46 . 1 . 1 9 9 TYR HE1 H 1 6.590 0.000 . . . . . . A 9 TYR HE1 . 30625 1
47 . 1 . 1 9 9 TYR HE2 H 1 6.590 0.000 . . . . . . A 9 TYR HE2 . 30625 1
48 . 1 . 1 10 10 PHE H H 1 7.743 0.000 . . . . . . A 10 PHE H . 30625 1
49 . 1 . 1 10 10 PHE HA H 1 4.366 0.000 . . . . . . A 10 PHE HA . 30625 1
50 . 1 . 1 10 10 PHE HB2 H 1 2.936 0.000 . . . . . . A 10 PHE HB2 . 30625 1
51 . 1 . 1 10 10 PHE HB3 H 1 2.786 0.000 . . . . . . A 10 PHE HB3 . 30625 1
52 . 1 . 1 10 10 PHE HD1 H 1 7.024 0.000 . . . . . . A 10 PHE HD1 . 30625 1
53 . 1 . 1 10 10 PHE HD2 H 1 7.024 0.000 . . . . . . A 10 PHE HD2 . 30625 1
54 . 1 . 1 10 10 PHE HE1 H 1 7.138 0.000 . . . . . . A 10 PHE HE1 . 30625 1
55 . 1 . 1 10 10 PHE HE2 H 1 7.138 0.000 . . . . . . A 10 PHE HE2 . 30625 1
56 . 1 . 1 10 10 PHE HZ H 1 7.065 0.000 . . . . . . A 10 PHE HZ . 30625 1
57 . 1 . 1 11 11 ASN H H 1 8.125 0.000 . . . . . . A 11 ASN H . 30625 1
58 . 1 . 1 11 11 ASN HA H 1 4.459 0.000 . . . . . . A 11 ASN HA . 30625 1
59 . 1 . 1 11 11 ASN HB2 H 1 2.604 0.000 . . . . . . A 11 ASN HB2 . 30625 1
60 . 1 . 1 11 11 ASN HB3 H 1 2.460 0.000 . . . . . . A 11 ASN HB3 . 30625 1
61 . 1 . 1 11 11 ASN HD21 H 1 7.310 0.000 . . . . . . A 11 ASN HD21 . 30625 1
62 . 1 . 1 11 11 ASN HD22 H 1 6.661 0.000 . . . . . . A 11 ASN HD22 . 30625 1
63 . 1 . 1 12 12 ARG H H 1 7.818 0.000 . . . . . . A 12 ARG H . 30625 1
64 . 1 . 1 12 12 ARG HA H 1 4.328 0.000 . . . . . . A 12 ARG HA . 30625 1
65 . 1 . 1 12 12 ARG HB2 H 1 1.604 0.000 . . . . . . A 12 ARG HB2 . 30625 1
66 . 1 . 1 12 12 ARG HB3 H 1 1.486 0.000 . . . . . . A 12 ARG HB3 . 30625 1
67 . 1 . 1 12 12 ARG HG2 H 1 1.376 0.000 . . . . . . A 12 ARG HG2 . 30625 1
68 . 1 . 1 12 12 ARG HG3 H 1 1.376 0.000 . . . . . . A 12 ARG HG3 . 30625 1
69 . 1 . 1 12 12 ARG HD2 H 1 2.921 0.000 . . . . . . A 12 ARG HD2 . 30625 1
70 . 1 . 1 12 12 ARG HD3 H 1 2.921 0.000 . . . . . . A 12 ARG HD3 . 30625 1
71 . 1 . 1 12 12 ARG HE H 1 6.954 0.000 . . . . . . A 12 ARG HE . 30625 1
72 . 1 . 1 13 13 PRO HA H 1 4.168 0.000 . . . . . . A 13 PRO HA . 30625 1
73 . 1 . 1 13 13 PRO HB2 H 1 2.041 0.000 . . . . . . A 13 PRO HB2 . 30625 1
74 . 1 . 1 13 13 PRO HB3 H 1 1.645 0.000 . . . . . . A 13 PRO HB3 . 30625 1
75 . 1 . 1 13 13 PRO HG2 H 1 1.833 0.000 . . . . . . A 13 PRO HG2 . 30625 1
76 . 1 . 1 13 13 PRO HG3 H 1 1.776 0.000 . . . . . . A 13 PRO HG3 . 30625 1
77 . 1 . 1 13 13 PRO HD2 H 1 3.538 0.000 . . . . . . A 13 PRO HD2 . 30625 1
78 . 1 . 1 13 13 PRO HD3 H 1 3.359 0.000 . . . . . . A 13 PRO HD3 . 30625 1
79 . 1 . 1 14 14 MET H H 1 8.083 0.000 . . . . . . A 14 MET H . 30625 1
80 . 1 . 1 14 14 MET HA H 1 4.169 0.000 . . . . . . A 14 MET HA . 30625 1
81 . 1 . 1 14 14 MET HB2 H 1 1.711 0.000 . . . . . . A 14 MET HB2 . 30625 1
82 . 1 . 1 14 14 MET HB3 H 1 1.711 0.000 . . . . . . A 14 MET HB3 . 30625 1
83 . 1 . 1 14 14 MET HG2 H 1 2.318 0.000 . . . . . . A 14 MET HG2 . 30625 1
84 . 1 . 1 14 14 MET HG3 H 1 2.233 0.000 . . . . . . A 14 MET HG3 . 30625 1
85 . 1 . 1 15 15 HIS H H 1 8.288 0.000 . . . . . . A 15 HIS H . 30625 1
86 . 1 . 1 15 15 HIS HA H 1 4.484 0.000 . . . . . . A 15 HIS HA . 30625 1
87 . 1 . 1 15 15 HIS HB2 H 1 3.093 0.000 . . . . . . A 15 HIS HB2 . 30625 1
88 . 1 . 1 15 15 HIS HB3 H 1 2.979 0.000 . . . . . . A 15 HIS HB3 . 30625 1
89 . 1 . 1 15 15 HIS HD2 H 1 7.045 0.000 . . . . . . A 15 HIS HD2 . 30625 1
90 . 1 . 1 16 16 ILE H H 1 7.762 0.000 . . . . . . A 16 ILE H . 30625 1
91 . 1 . 1 16 16 ILE HA H 1 3.974 0.000 . . . . . . A 16 ILE HA . 30625 1
92 . 1 . 1 16 16 ILE HB H 1 1.614 0.000 . . . . . . A 16 ILE HB . 30625 1
93 . 1 . 1 16 16 ILE HG12 H 1 1.124 0.000 . . . . . . A 16 ILE HG12 . 30625 1
94 . 1 . 1 16 16 ILE HG13 H 1 0.900 0.000 . . . . . . A 16 ILE HG13 . 30625 1
95 . 1 . 1 16 16 ILE HG21 H 1 0.626 0.000 . . . . . . A 16 ILE HG21 . 30625 1
96 . 1 . 1 16 16 ILE HG22 H 1 0.626 0.000 . . . . . . A 16 ILE HG22 . 30625 1
97 . 1 . 1 16 16 ILE HG23 H 1 0.626 0.000 . . . . . . A 16 ILE HG23 . 30625 1
98 . 1 . 1 16 16 ILE HD11 H 1 0.647 0.000 . . . . . . A 16 ILE HD11 . 30625 1
99 . 1 . 1 16 16 ILE HD12 H 1 0.647 0.000 . . . . . . A 16 ILE HD12 . 30625 1
100 . 1 . 1 16 16 ILE HD13 H 1 0.647 0.000 . . . . . . A 16 ILE HD13 . 30625 1
101 . 1 . 1 17 17 HIS H H 1 8.460 0.000 . . . . . . A 17 HIS H . 30625 1
102 . 1 . 1 17 17 HIS HA H 1 4.427 0.000 . . . . . . A 17 HIS HA . 30625 1
103 . 1 . 1 17 17 HIS HB2 H 1 2.862 0.000 . . . . . . A 17 HIS HB2 . 30625 1
104 . 1 . 1 17 17 HIS HB3 H 1 2.862 0.000 . . . . . . A 17 HIS HB3 . 30625 1
105 . 1 . 1 17 17 HIS HD2 H 1 7.066 0.000 . . . . . . A 17 HIS HD2 . 30625 1
106 . 1 . 1 18 18 ASP H H 1 8.320 0.000 . . . . . . A 18 ASP H . 30625 1
107 . 1 . 1 18 18 ASP HA H 1 4.466 0.000 . . . . . . A 18 ASP HA . 30625 1
108 . 1 . 1 18 18 ASP HB2 H 1 2.764 0.000 . . . . . . A 18 ASP HB2 . 30625 1
109 . 1 . 1 18 18 ASP HB3 H 1 2.642 0.000 . . . . . . A 18 ASP HB3 . 30625 1
110 . 1 . 1 19 19 TRP H H 1 7.809 0.000 . . . . . . A 19 TRP H . 30625 1
111 . 1 . 1 19 19 TRP HA H 1 4.390 0.000 . . . . . . A 19 TRP HA . 30625 1
112 . 1 . 1 19 19 TRP HB2 H 1 3.146 0.000 . . . . . . A 19 TRP HB2 . 30625 1
113 . 1 . 1 19 19 TRP HB3 H 1 3.146 0.000 . . . . . . A 19 TRP HB3 . 30625 1
114 . 1 . 1 19 19 TRP HD1 H 1 7.123 0.000 . . . . . . A 19 TRP HD1 . 30625 1
115 . 1 . 1 19 19 TRP HE1 H 1 10.002 0.000 . . . . . . A 19 TRP HE1 . 30625 1
116 . 1 . 1 19 19 TRP HE3 H 1 7.371 0.000 . . . . . . A 19 TRP HE3 . 30625 1
117 . 1 . 1 19 19 TRP HZ2 H 1 7.219 0.000 . . . . . . A 19 TRP HZ2 . 30625 1
118 . 1 . 1 19 19 TRP HZ3 H 1 6.955 0.000 . . . . . . A 19 TRP HZ3 . 30625 1
119 . 1 . 1 19 19 TRP HH2 H 1 7.010 0.000 . . . . . . A 19 TRP HH2 . 30625 1
120 . 1 . 1 20 20 GLN H H 1 7.811 0.000 . . . . . . A 20 GLN H . 30625 1
121 . 1 . 1 20 20 GLN HA H 1 3.983 0.000 . . . . . . A 20 GLN HA . 30625 1
122 . 1 . 1 20 20 GLN HB2 H 1 1.611 0.000 . . . . . . A 20 GLN HB2 . 30625 1
123 . 1 . 1 20 20 GLN HB3 H 1 1.731 0.000 . . . . . . A 20 GLN HB3 . 30625 1
124 . 1 . 1 20 20 GLN HG2 H 1 1.908 0.000 . . . . . . A 20 GLN HG2 . 30625 1
125 . 1 . 1 20 20 GLN HG3 H 1 1.694 0.000 . . . . . . A 20 GLN HG3 . 30625 1
126 . 1 . 1 21 21 ILE H H 1 7.689 0.000 . . . . . . A 21 ILE H . 30625 1
127 . 1 . 1 21 21 ILE HA H 1 3.897 0.000 . . . . . . A 21 ILE HA . 30625 1
128 . 1 . 1 21 21 ILE HB H 1 1.657 0.000 . . . . . . A 21 ILE HB . 30625 1
129 . 1 . 1 21 21 ILE HG12 H 1 1.260 0.000 . . . . . . A 21 ILE HG12 . 30625 1
130 . 1 . 1 21 21 ILE HG13 H 1 0.963 0.000 . . . . . . A 21 ILE HG13 . 30625 1
131 . 1 . 1 21 21 ILE HG21 H 1 0.700 0.000 . . . . . . A 21 ILE HG21 . 30625 1
132 . 1 . 1 21 21 ILE HG22 H 1 0.700 0.000 . . . . . . A 21 ILE HG22 . 30625 1
133 . 1 . 1 21 21 ILE HG23 H 1 0.700 0.000 . . . . . . A 21 ILE HG23 . 30625 1
134 . 1 . 1 21 21 ILE HD11 H 1 0.685 0.000 . . . . . . A 21 ILE HD11 . 30625 1
135 . 1 . 1 21 21 ILE HD12 H 1 0.685 0.000 . . . . . . A 21 ILE HD12 . 30625 1
136 . 1 . 1 21 21 ILE HD13 H 1 0.685 0.000 . . . . . . A 21 ILE HD13 . 30625 1
137 . 1 . 1 22 22 MET H H 1 8.090 0.000 . . . . . . A 22 MET H . 30625 1
138 . 1 . 1 22 22 MET HA H 1 4.338 0.000 . . . . . . A 22 MET HA . 30625 1
139 . 1 . 1 22 22 MET HB2 H 1 1.903 0.000 . . . . . . A 22 MET HB2 . 30625 1
140 . 1 . 1 22 22 MET HB3 H 1 1.812 0.000 . . . . . . A 22 MET HB3 . 30625 1
141 . 1 . 1 22 22 MET HG2 H 1 2.394 0.000 . . . . . . A 22 MET HG2 . 30625 1
142 . 1 . 1 22 22 MET HG3 H 1 2.326 0.000 . . . . . . A 22 MET HG3 . 30625 1
143 . 1 . 1 23 23 ASP H H 1 8.213 0.000 . . . . . . A 23 ASP H . 30625 1
144 . 1 . 1 23 23 ASP HA H 1 4.629 0.000 . . . . . . A 23 ASP HA . 30625 1
145 . 1 . 1 23 23 ASP HB2 H 1 2.709 0.000 . . . . . . A 23 ASP HB2 . 30625 1
146 . 1 . 1 23 23 ASP HB3 H 1 2.614 0.000 . . . . . . A 23 ASP HB3 . 30625 1
147 . 1 . 1 24 24 SER H H 1 7.913 0.000 . . . . . . A 24 SER H . 30625 1
148 . 1 . 1 24 24 SER HA H 1 4.344 0.000 . . . . . . A 24 SER HA . 30625 1
149 . 1 . 1 24 24 SER HB2 H 1 3.730 0.000 . . . . . . A 24 SER HB2 . 30625 1
150 . 1 . 1 24 24 SER HB3 H 1 3.641 0.000 . . . . . . A 24 SER HB3 . 30625 1
151 . 1 . 1 25 25 GLY H H 1 7.896 0.000 . . . . . . A 25 GLY H . 30625 1
152 . 1 . 1 25 25 GLY HA2 H 1 3.837 0.000 . . . . . . A 25 GLY HA2 . 30625 1
153 . 1 . 1 25 25 GLY HA3 H 1 3.726 0.000 . . . . . . A 25 GLY HA3 . 30625 1
154 . 1 . 1 26 26 TYR H H 1 8.406 0.000 . . . . . . A 26 TYR H . 30625 1
155 . 1 . 1 26 26 TYR HA H 1 5.241 0.000 . . . . . . A 26 TYR HA . 30625 1
156 . 1 . 1 26 26 TYR HB2 H 1 2.332 0.000 . . . . . . A 26 TYR HB2 . 30625 1
157 . 1 . 1 26 26 TYR HB3 H 1 2.332 0.000 . . . . . . A 26 TYR HB3 . 30625 1
158 . 1 . 1 26 26 TYR HD1 H 1 6.652 0.000 . . . . . . A 26 TYR HD1 . 30625 1
159 . 1 . 1 26 26 TYR HD2 H 1 6.652 0.000 . . . . . . A 26 TYR HD2 . 30625 1
160 . 1 . 1 26 26 TYR HE1 H 1 7.234 0.000 . . . . . . A 26 TYR HE1 . 30625 1
161 . 1 . 1 26 26 TYR HE2 H 1 7.234 0.000 . . . . . . A 26 TYR HE2 . 30625 1
162 . 1 . 1 27 27 TYR H H 1 9.512 0.000 . . . . . . A 27 TYR H . 30625 1
163 . 1 . 1 27 27 TYR HA H 1 4.835 0.000 . . . . . . A 27 TYR HA . 30625 1
164 . 1 . 1 27 27 TYR HB2 H 1 2.971 0.000 . . . . . . A 27 TYR HB2 . 30625 1
165 . 1 . 1 27 27 TYR HB3 H 1 2.971 0.000 . . . . . . A 27 TYR HB3 . 30625 1
166 . 1 . 1 27 27 TYR HD1 H 1 6.832 0.000 . . . . . . A 27 TYR HD1 . 30625 1
167 . 1 . 1 27 27 TYR HD2 H 1 6.832 0.000 . . . . . . A 27 TYR HD2 . 30625 1
168 . 1 . 1 27 27 TYR HE1 H 1 6.638 0.000 . . . . . . A 27 TYR HE1 . 30625 1
169 . 1 . 1 27 27 TYR HE2 H 1 6.638 0.000 . . . . . . A 27 TYR HE2 . 30625 1
170 . 1 . 1 28 28 GLY H H 1 8.527 0.000 . . . . . . A 28 GLY H . 30625 1
171 . 1 . 1 28 28 GLY HA2 H 1 3.837 0.000 . . . . . . A 28 GLY HA2 . 30625 1
172 . 1 . 1 28 28 GLY HA3 H 1 3.728 0.000 . . . . . . A 28 GLY HA3 . 30625 1
stop_
save_