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 52514
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'Small hydrophobic protein 1-34 in DHPC'
_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-15N HSQC' . . . 52514 1
2 '3D 1H-15N NOESY' . . . 52514 1
3 '3D HNCO' . . . 52514 1
4 '3D HNCACO' . . . 52514 1
5 '3D HNCACB' . . . 52514 1
6 '3D HN(CO)CACB' . . . 52514 1
7 '2D 1H-15N TROSY' . . . 52514 1
8 '2D 1H-15N TROSY' . . . 52514 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 52514 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 3 3 PRO C C 13 176.308 0.003 . 1 . . . . . 3 PRO C . 52514 1
2 . 1 . 1 3 3 PRO CA C 13 63.305 0.008 . 1 . . . . . 3 PRO CA . 52514 1
3 . 1 . 1 3 3 PRO CB C 13 32.069 0.007 . 1 . . . . . 3 PRO CB . 52514 1
4 . 1 . 1 4 4 ALA H H 1 8.285 0.001 . 1 . . . . . 4 ALA H . 52514 1
5 . 1 . 1 4 4 ALA C C 13 177.399 0.005 . 1 . . . . . 4 ALA C . 52514 1
6 . 1 . 1 4 4 ALA CA C 13 52.498 0.009 . 1 . . . . . 4 ALA CA . 52514 1
7 . 1 . 1 4 4 ALA CB C 13 19.232 0.007 . 1 . . . . . 4 ALA CB . 52514 1
8 . 1 . 1 4 4 ALA N N 15 123.834 0.018 . 1 . . . . . 4 ALA N . 52514 1
9 . 1 . 1 5 5 ILE H H 1 7.918 0.002 . 1 . . . . . 5 ILE H . 52514 1
10 . 1 . 1 5 5 ILE HA H 1 4.171 0.000 . 1 . . . . . 5 ILE HA . 52514 1
11 . 1 . 1 5 5 ILE HB H 1 1.844 0.000 . 1 . . . . . 5 ILE HB . 52514 1
12 . 1 . 1 5 5 ILE HG12 H 1 0.848 0.000 . 1 . . . . . 5 ILE HG12 . 52514 1
13 . 1 . 1 5 5 ILE C C 13 175.455 0.007 . 1 . . . . . 5 ILE C . 52514 1
14 . 1 . 1 5 5 ILE CA C 13 60.655 0.012 . 1 . . . . . 5 ILE CA . 52514 1
15 . 1 . 1 5 5 ILE CB C 13 38.914 0.011 . 1 . . . . . 5 ILE CB . 52514 1
16 . 1 . 1 5 5 ILE N N 15 118.822 0.039 . 1 . . . . . 5 ILE N . 52514 1
17 . 1 . 1 6 6 GLN H H 1 8.259 0.002 . 1 . . . . . 6 GLN H . 52514 1
18 . 1 . 1 6 6 GLN C C 13 173.972 0.000 . 1 . . . . . 6 GLN C . 52514 1
19 . 1 . 1 6 6 GLN CA C 13 54.323 0.000 . 1 . . . . . 6 GLN CA . 52514 1
20 . 1 . 1 6 6 GLN CB C 13 28.846 0.000 . 1 . . . . . 6 GLN CB . 52514 1
21 . 1 . 1 6 6 GLN N N 15 124.314 0.013 . 1 . . . . . 6 GLN N . 52514 1
22 . 1 . 1 9 9 LEU C C 13 178.302 0.007 . 1 . . . . . 9 LEU C . 52514 1
23 . 1 . 1 9 9 LEU CA C 13 57.763 0.004 . 1 . . . . . 9 LEU CA . 52514 1
24 . 1 . 1 9 9 LEU CB C 13 41.889 0.055 . 1 . . . . . 9 LEU CB . 52514 1
25 . 1 . 1 10 10 TYR H H 1 7.985 0.003 . 1 . . . . . 10 TYR H . 52514 1
26 . 1 . 1 10 10 TYR C C 13 177.509 0.020 . 1 . . . . . 10 TYR C . 52514 1
27 . 1 . 1 10 10 TYR CA C 13 60.830 0.031 . 1 . . . . . 10 TYR CA . 52514 1
28 . 1 . 1 10 10 TYR CB C 13 37.764 0.090 . 1 . . . . . 10 TYR CB . 52514 1
29 . 1 . 1 10 10 TYR N N 15 116.850 0.018 . 1 . . . . . 10 TYR N . 52514 1
30 . 1 . 1 11 11 LEU C C 13 178.043 0.005 . 1 . . . . . 11 LEU C . 52514 1
31 . 1 . 1 11 11 LEU CA C 13 57.897 0.057 . 1 . . . . . 11 LEU CA . 52514 1
32 . 1 . 1 11 11 LEU CB C 13 41.907 0.093 . 1 . . . . . 11 LEU CB . 52514 1
33 . 1 . 1 11 11 LEU N N 15 118.724 0.025 . 1 . . . . . 11 LEU N . 52514 1
34 . 1 . 1 12 12 THR H H 1 7.797 0.002 . 1 . . . . . 12 THR H . 52514 1
35 . 1 . 1 12 12 THR C C 13 175.801 0.007 . 1 . . . . . 12 THR C . 52514 1
36 . 1 . 1 12 12 THR CA C 13 67.923 0.000 . 1 . . . . . 12 THR CA . 52514 1
37 . 1 . 1 12 12 THR N N 15 115.565 0.017 . 1 . . . . . 12 THR N . 52514 1
38 . 1 . 1 13 13 PHE H H 1 8.150 0.001 . 1 . . . . . 13 PHE H . 52514 1
39 . 1 . 1 13 13 PHE C C 13 176.805 0.010 . 1 . . . . . 13 PHE C . 52514 1
40 . 1 . 1 13 13 PHE CA C 13 61.164 0.037 . 1 . . . . . 13 PHE CA . 52514 1
41 . 1 . 1 13 13 PHE CB C 13 38.924 0.022 . 1 . . . . . 13 PHE CB . 52514 1
42 . 1 . 1 13 13 PHE N N 15 119.439 0.029 . 1 . . . . . 13 PHE N . 52514 1
43 . 1 . 1 14 14 LEU H H 1 8.108 0.002 . 1 . . . . . 14 LEU H . 52514 1
44 . 1 . 1 14 14 LEU C C 13 178.189 0.011 . 1 . . . . . 14 LEU C . 52514 1
45 . 1 . 1 14 14 LEU CA C 13 58.327 0.033 . 1 . . . . . 14 LEU CA . 52514 1
46 . 1 . 1 14 14 LEU CB C 13 41.666 0.085 . 1 . . . . . 14 LEU CB . 52514 1
47 . 1 . 1 14 14 LEU N N 15 118.035 0.020 . 1 . . . . . 14 LEU N . 52514 1
48 . 1 . 1 15 15 LEU H H 1 8.230 0.002 . 1 . . . . . 15 LEU H . 52514 1
49 . 1 . 1 15 15 LEU C C 13 178.265 0.053 . 1 . . . . . 15 LEU C . 52514 1
50 . 1 . 1 15 15 LEU CA C 13 58.316 0.083 . 1 . . . . . 15 LEU CA . 52514 1
51 . 1 . 1 15 15 LEU CB C 13 41.597 0.065 . 1 . . . . . 15 LEU CB . 52514 1
52 . 1 . 1 15 15 LEU N N 15 117.763 0.019 . 1 . . . . . 15 LEU N . 52514 1
53 . 1 . 1 16 16 LEU H H 1 8.072 0.001 . 1 . . . . . 16 LEU H . 52514 1
54 . 1 . 1 16 16 LEU C C 13 178.334 0.009 . 1 . . . . . 16 LEU C . 52514 1
55 . 1 . 1 16 16 LEU CA C 13 58.421 0.092 . 1 . . . . . 16 LEU CA . 52514 1
56 . 1 . 1 16 16 LEU CB C 13 41.593 0.000 . 1 . . . . . 16 LEU CB . 52514 1
57 . 1 . 1 16 16 LEU N N 15 118.322 0.019 . 1 . . . . . 16 LEU N . 52514 1
58 . 1 . 1 17 17 ILE H H 1 8.033 0.002 . 1 . . . . . 17 ILE H . 52514 1
59 . 1 . 1 17 17 ILE C C 13 177.597 0.003 . 1 . . . . . 17 ILE C . 52514 1
60 . 1 . 1 17 17 ILE CA C 13 64.969 0.039 . 1 . . . . . 17 ILE CA . 52514 1
61 . 1 . 1 17 17 ILE CB C 13 37.128 0.087 . 1 . . . . . 17 ILE CB . 52514 1
62 . 1 . 1 17 17 ILE N N 15 117.859 0.024 . 1 . . . . . 17 ILE N . 52514 1
63 . 1 . 1 18 18 LEU H H 1 8.251 0.002 . 1 . . . . . 18 LEU H . 52514 1
64 . 1 . 1 18 18 LEU C C 13 178.419 0.006 . 1 . . . . . 18 LEU C . 52514 1
65 . 1 . 1 18 18 LEU CA C 13 58.538 0.000 . 1 . . . . . 18 LEU CA . 52514 1
66 . 1 . 1 18 18 LEU CB C 13 41.631 0.018 . 1 . . . . . 18 LEU CB . 52514 1
67 . 1 . 1 18 18 LEU N N 15 119.439 0.038 . 1 . . . . . 18 LEU N . 52514 1
68 . 1 . 1 19 19 LEU H H 1 8.490 0.002 . 1 . . . . . 19 LEU H . 52514 1
69 . 1 . 1 19 19 LEU C C 13 178.093 0.005 . 1 . . . . . 19 LEU C . 52514 1
70 . 1 . 1 19 19 LEU CA C 13 58.377 0.000 . 1 . . . . . 19 LEU CA . 52514 1
71 . 1 . 1 19 19 LEU N N 15 118.366 0.013 . 1 . . . . . 19 LEU N . 52514 1
72 . 1 . 1 20 20 TYR H H 1 8.464 0.002 . 1 . . . . . 20 TYR H . 52514 1
73 . 1 . 1 20 20 TYR C C 13 178.838 0.000 . 1 . . . . . 20 TYR C . 52514 1
74 . 1 . 1 20 20 TYR CA C 13 61.923 0.000 . 1 . . . . . 20 TYR CA . 52514 1
75 . 1 . 1 20 20 TYR N N 15 118.793 0.078 . 1 . . . . . 20 TYR N . 52514 1
76 . 1 . 1 21 21 LEU H H 1 8.618 0.003 . 1 . . . . . 21 LEU H . 52514 1
77 . 1 . 1 21 21 LEU C C 13 177.893 0.019 . 1 . . . . . 21 LEU C . 52514 1
78 . 1 . 1 21 21 LEU CA C 13 58.510 0.000 . 1 . . . . . 21 LEU CA . 52514 1
79 . 1 . 1 21 21 LEU CB C 13 41.678 0.000 . 1 . . . . . 21 LEU CB . 52514 1
80 . 1 . 1 21 21 LEU N N 15 121.167 0.019 . 1 . . . . . 21 LEU N . 52514 1
81 . 1 . 1 22 22 ILE H H 1 8.441 0.015 . 1 . . . . . 22 ILE H . 52514 1
82 . 1 . 1 22 22 ILE C C 13 177.309 0.007 . 1 . . . . . 22 ILE C . 52514 1
83 . 1 . 1 22 22 ILE CA C 13 65.690 0.031 . 1 . . . . . 22 ILE CA . 52514 1
84 . 1 . 1 22 22 ILE CB C 13 12.099 0.000 . 1 . . . . . 22 ILE CB . 52514 1
85 . 1 . 1 22 22 ILE N N 15 118.484 0.269 . 1 . . . . . 22 ILE N . 52514 1
86 . 1 . 1 23 23 ILE H H 1 8.411 0.001 . 1 . . . . . 23 ILE H . 52514 1
87 . 1 . 1 23 23 ILE C C 13 177.144 0.004 . 1 . . . . . 23 ILE C . 52514 1
88 . 1 . 1 23 23 ILE CA C 13 65.657 0.008 . 1 . . . . . 23 ILE CA . 52514 1
89 . 1 . 1 23 23 ILE CB C 13 37.581 0.066 . 1 . . . . . 23 ILE CB . 52514 1
90 . 1 . 1 23 23 ILE N N 15 118.631 0.015 . 1 . . . . . 23 ILE N . 52514 1
91 . 1 . 1 24 24 THR H H 1 8.045 0.004 . 1 . . . . . 24 THR H . 52514 1
92 . 1 . 1 24 24 THR C C 13 175.905 0.000 . 1 . . . . . 24 THR C . 52514 1
93 . 1 . 1 24 24 THR CA C 13 68.218 0.000 . 1 . . . . . 24 THR CA . 52514 1
94 . 1 . 1 24 24 THR N N 15 115.745 0.047 . 1 . . . . . 24 THR N . 52514 1
95 . 1 . 1 25 25 LEU H H 1 8.208 0.001 . 1 . . . . . 25 LEU H . 52514 1
96 . 1 . 1 25 25 LEU C C 13 177.856 0.005 . 1 . . . . . 25 LEU C . 52514 1
97 . 1 . 1 25 25 LEU CA C 13 58.493 0.003 . 1 . . . . . 25 LEU CA . 52514 1
98 . 1 . 1 25 25 LEU CB C 13 41.954 0.038 . 1 . . . . . 25 LEU CB . 52514 1
99 . 1 . 1 25 25 LEU N N 15 120.567 0.013 . 1 . . . . . 25 LEU N . 52514 1
100 . 1 . 1 26 26 TYR H H 1 8.406 0.002 . 1 . . . . . 26 TYR H . 52514 1
101 . 1 . 1 26 26 TYR C C 13 176.946 0.002 . 1 . . . . . 26 TYR C . 52514 1
102 . 1 . 1 26 26 TYR CA C 13 62.269 0.006 . 1 . . . . . 26 TYR CA . 52514 1
103 . 1 . 1 26 26 TYR CB C 13 38.722 0.024 . 1 . . . . . 26 TYR CB . 52514 1
104 . 1 . 1 26 26 TYR N N 15 118.745 0.044 . 1 . . . . . 26 TYR N . 52514 1
105 . 1 . 1 27 27 VAL H H 1 8.509 0.002 . 1 . . . . . 27 VAL H . 52514 1
106 . 1 . 1 27 27 VAL C C 13 176.955 0.006 . 1 . . . . . 27 VAL C . 52514 1
107 . 1 . 1 27 27 VAL CA C 13 67.119 0.025 . 1 . . . . . 27 VAL CA . 52514 1
108 . 1 . 1 27 27 VAL CB C 13 31.348 0.055 . 1 . . . . . 27 VAL CB . 52514 1
109 . 1 . 1 27 27 VAL N N 15 117.383 0.017 . 1 . . . . . 27 VAL N . 52514 1
110 . 1 . 1 28 28 TRP H H 1 8.522 0.002 . 1 . . . . . 28 TRP H . 52514 1
111 . 1 . 1 28 28 TRP HA H 1 4.213 0.000 . 1 . . . . . 28 TRP HA . 52514 1
112 . 1 . 1 28 28 TRP C C 13 179.067 0.005 . 1 . . . . . 28 TRP C . 52514 1
113 . 1 . 1 28 28 TRP CA C 13 61.373 0.021 . 1 . . . . . 28 TRP CA . 52514 1
114 . 1 . 1 28 28 TRP CB C 13 29.026 0.057 . 1 . . . . . 28 TRP CB . 52514 1
115 . 1 . 1 28 28 TRP N N 15 119.499 0.046 . 1 . . . . . 28 TRP N . 52514 1
116 . 1 . 1 29 29 ILE H H 1 8.566 0.004 . 1 . . . . . 29 ILE H . 52514 1
117 . 1 . 1 29 29 ILE HA H 1 3.417 0.000 . 1 . . . . . 29 ILE HA . 52514 1
118 . 1 . 1 29 29 ILE HB H 1 2.066 0.000 . 1 . . . . . 29 ILE HB . 52514 1
119 . 1 . 1 29 29 ILE C C 13 177.846 0.007 . 1 . . . . . 29 ILE C . 52514 1
120 . 1 . 1 29 29 ILE CA C 13 65.557 0.026 . 1 . . . . . 29 ILE CA . 52514 1
121 . 1 . 1 29 29 ILE CB C 13 37.677 0.057 . 1 . . . . . 29 ILE CB . 52514 1
122 . 1 . 1 29 29 ILE N N 15 119.601 0.034 . 1 . . . . . 29 ILE N . 52514 1
123 . 1 . 1 30 30 ILE H H 1 8.152 0.002 . 1 . . . . . 30 ILE H . 52514 1
124 . 1 . 1 30 30 ILE HA H 1 3.771 0.000 . 1 . . . . . 30 ILE HA . 52514 1
125 . 1 . 1 30 30 ILE C C 13 178.676 0.003 . 1 . . . . . 30 ILE C . 52514 1
126 . 1 . 1 30 30 ILE CA C 13 64.031 0.009 . 1 . . . . . 30 ILE CA . 52514 1
127 . 1 . 1 30 30 ILE CB C 13 36.933 0.050 . 1 . . . . . 30 ILE CB . 52514 1
128 . 1 . 1 30 30 ILE N N 15 118.393 0.033 . 1 . . . . . 30 ILE N . 52514 1
129 . 1 . 1 31 31 LEU H H 1 8.209 0.001 . 1 . . . . . 31 LEU H . 52514 1
130 . 1 . 1 31 31 LEU HA H 1 4.159 0.000 . 1 . . . . . 31 LEU HA . 52514 1
131 . 1 . 1 31 31 LEU C C 13 178.446 0.001 . 1 . . . . . 31 LEU C . 52514 1
132 . 1 . 1 31 31 LEU CA C 13 56.987 0.000 . 1 . . . . . 31 LEU CA . 52514 1
133 . 1 . 1 31 31 LEU CB C 13 42.315 0.000 . 1 . . . . . 31 LEU CB . 52514 1
134 . 1 . 1 31 31 LEU N N 15 118.520 0.040 . 1 . . . . . 31 LEU N . 52514 1
135 . 1 . 1 32 32 THR H H 1 7.669 0.002 . 1 . . . . . 32 THR H . 52514 1
136 . 1 . 1 32 32 THR C C 13 175.461 0.000 . 1 . . . . . 32 THR C . 52514 1
137 . 1 . 1 32 32 THR CA C 13 64.581 0.012 . 1 . . . . . 32 THR CA . 52514 1
138 . 1 . 1 32 32 THR CB C 13 69.603 0.000 . 1 . . . . . 32 THR CB . 52514 1
139 . 1 . 1 32 32 THR N N 15 111.523 0.031 . 1 . . . . . 32 THR N . 52514 1
140 . 1 . 1 33 33 VAL H H 1 7.860 0.002 . 1 . . . . . 33 VAL H . 52514 1
141 . 1 . 1 33 33 VAL HA H 1 4.162 0.000 . 1 . . . . . 33 VAL HA . 52514 1
142 . 1 . 1 33 33 VAL HB H 1 2.219 0.000 . 1 . . . . . 33 VAL HB . 52514 1
143 . 1 . 1 33 33 VAL HG11 H 1 0.887 0.000 . 1 . . . . . 33 VAL HG11 . 52514 1
144 . 1 . 1 33 33 VAL HG12 H 1 0.887 0.000 . 1 . . . . . 33 VAL HG12 . 52514 1
145 . 1 . 1 33 33 VAL HG13 H 1 0.887 0.000 . 1 . . . . . 33 VAL HG13 . 52514 1
146 . 1 . 1 33 33 VAL C C 13 175.862 0.006 . 1 . . . . . 33 VAL C . 52514 1
147 . 1 . 1 33 33 VAL CA C 13 62.982 0.005 . 1 . . . . . 33 VAL CA . 52514 1
148 . 1 . 1 33 33 VAL CB C 13 32.104 0.029 . 1 . . . . . 33 VAL CB . 52514 1
149 . 1 . 1 33 33 VAL N N 15 118.688 0.058 . 1 . . . . . 33 VAL N . 52514 1
150 . 1 . 1 34 34 THR H H 1 7.687 0.002 . 1 . . . . . 34 THR H . 52514 1
151 . 1 . 1 34 34 THR HA H 1 4.289 0.000 . 1 . . . . . 34 THR HA . 52514 1
152 . 1 . 1 34 34 THR HB H 1 4.126 0.000 . 1 . . . . . 34 THR HB . 52514 1
153 . 1 . 1 34 34 THR HG21 H 1 1.090 0.000 . 1 . . . . . 34 THR HG21 . 52514 1
154 . 1 . 1 34 34 THR HG22 H 1 1.090 0.000 . 1 . . . . . 34 THR HG22 . 52514 1
155 . 1 . 1 34 34 THR HG23 H 1 1.090 0.000 . 1 . . . . . 34 THR HG23 . 52514 1
156 . 1 . 1 34 34 THR C C 13 173.218 0.008 . 1 . . . . . 34 THR C . 52514 1
157 . 1 . 1 34 34 THR CA C 13 62.335 0.013 . 1 . . . . . 34 THR CA . 52514 1
158 . 1 . 1 34 34 THR CB C 13 70.032 0.006 . 1 . . . . . 34 THR CB . 52514 1
159 . 1 . 1 34 34 THR N N 15 115.512 0.043 . 1 . . . . . 34 THR N . 52514 1
160 . 1 . 1 35 35 TYR H H 1 7.533 0.002 . 1 . . . . . 35 TYR H . 52514 1
161 . 1 . 1 35 35 TYR HA H 1 4.363 0.000 . 1 . . . . . 35 TYR HA . 52514 1
162 . 1 . 1 35 35 TYR HB2 H 1 2.906 0.000 . 2 . . . . . 35 TYR HB2 . 52514 1
163 . 1 . 1 35 35 TYR HB3 H 1 3.046 0.000 . 2 . . . . . 35 TYR HB3 . 52514 1
164 . 1 . 1 35 35 TYR C C 13 180.168 0.000 . 1 . . . . . 35 TYR C . 52514 1
165 . 1 . 1 35 35 TYR CA C 13 59.622 0.000 . 1 . . . . . 35 TYR CA . 52514 1
166 . 1 . 1 35 35 TYR CB C 13 39.640 0.000 . 1 . . . . . 35 TYR CB . 52514 1
167 . 1 . 1 35 35 TYR N N 15 127.310 0.051 . 1 . . . . . 35 TYR N . 52514 1
stop_
save_