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 51259
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name IAPP_assignment
_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' . . . 51259 1
2 '3D HNCO' . . . 51259 1
3 '3D HNCA' . . . 51259 1
4 '3D HN(CA)CO' . . . 51259 1
5 '3D HN(CO)CACB' . . . 51259 1
6 '3D HN(CA)CB' . . . 51259 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 . . 51259 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 ASN C C 13 174.970 0.000 . 1 . . . . . 3 ASN C . 51259 1
2 . 1 . 1 3 3 ASN CA C 13 52.868 0.000 . 1 . . . . . 3 ASN CA . 51259 1
3 . 1 . 1 3 3 ASN CB C 13 39.402 0.000 . 1 . . . . . 3 ASN CB . 51259 1
4 . 1 . 1 4 4 THR H H 1 7.616 0.001 . 1 . . . . . 4 THR H . 51259 1
5 . 1 . 1 4 4 THR C C 13 174.773 0.003 . 1 . . . . . 4 THR C . 51259 1
6 . 1 . 1 4 4 THR CA C 13 61.093 0.000 . 1 . . . . . 4 THR CA . 51259 1
7 . 1 . 1 4 4 THR CB C 13 70.942 0.036 . 1 . . . . . 4 THR CB . 51259 1
8 . 1 . 1 4 4 THR N N 15 110.957 0.052 . 1 . . . . . 4 THR N . 51259 1
9 . 1 . 1 5 5 ALA H H 1 8.714 0.002 . 1 . . . . . 5 ALA H . 51259 1
10 . 1 . 1 5 5 ALA C C 13 179.546 0.004 . 1 . . . . . 5 ALA C . 51259 1
11 . 1 . 1 5 5 ALA CA C 13 54.742 0.013 . 1 . . . . . 5 ALA CA . 51259 1
12 . 1 . 1 5 5 ALA CB C 13 18.546 0.017 . 1 . . . . . 5 ALA CB . 51259 1
13 . 1 . 1 5 5 ALA N N 15 122.826 0.043 . 1 . . . . . 5 ALA N . 51259 1
14 . 1 . 1 6 6 THR H H 1 7.934 0.002 . 1 . . . . . 6 THR H . 51259 1
15 . 1 . 1 6 6 THR C C 13 175.208 0.002 . 1 . . . . . 6 THR C . 51259 1
16 . 1 . 1 6 6 THR CA C 13 62.802 0.007 . 1 . . . . . 6 THR CA . 51259 1
17 . 1 . 1 6 6 THR CB C 13 69.365 0.011 . 1 . . . . . 6 THR CB . 51259 1
18 . 1 . 1 6 6 THR N N 15 109.318 0.059 . 1 . . . . . 6 THR N . 51259 1
19 . 1 . 1 7 7 CYS H H 1 8.108 0.002 . 1 . . . . . 7 CYS H . 51259 1
20 . 1 . 1 7 7 CYS C C 13 174.984 0.005 . 1 . . . . . 7 CYS C . 51259 1
21 . 1 . 1 7 7 CYS CA C 13 56.288 0.001 . 1 . . . . . 7 CYS CA . 51259 1
22 . 1 . 1 7 7 CYS CB C 13 41.100 0.085 . 1 . . . . . 7 CYS CB . 51259 1
23 . 1 . 1 7 7 CYS N N 15 120.517 0.045 . 1 . . . . . 7 CYS N . 51259 1
24 . 1 . 1 8 8 ALA H H 1 8.201 0.001 . 1 . . . . . 8 ALA H . 51259 1
25 . 1 . 1 8 8 ALA C C 13 178.434 0.006 . 1 . . . . . 8 ALA C . 51259 1
26 . 1 . 1 8 8 ALA CA C 13 53.533 0.015 . 1 . . . . . 8 ALA CA . 51259 1
27 . 1 . 1 8 8 ALA CB C 13 18.829 0.004 . 1 . . . . . 8 ALA CB . 51259 1
28 . 1 . 1 8 8 ALA N N 15 124.517 0.042 . 1 . . . . . 8 ALA N . 51259 1
29 . 1 . 1 9 9 THR H H 1 8.132 0.002 . 1 . . . . . 9 THR H . 51259 1
30 . 1 . 1 9 9 THR C C 13 175.064 0.000 . 1 . . . . . 9 THR C . 51259 1
31 . 1 . 1 9 9 THR CA C 13 62.876 0.003 . 1 . . . . . 9 THR CA . 51259 1
32 . 1 . 1 9 9 THR CB C 13 69.457 0.007 . 1 . . . . . 9 THR CB . 51259 1
33 . 1 . 1 9 9 THR N N 15 113.557 0.052 . 1 . . . . . 9 THR N . 51259 1
34 . 1 . 1 10 10 GLN H H 1 8.251 0.002 . 1 . . . . . 10 GLN H . 51259 1
35 . 1 . 1 10 10 GLN C C 13 176.126 0.002 . 1 . . . . . 10 GLN C . 51259 1
36 . 1 . 1 10 10 GLN CA C 13 56.359 0.012 . 1 . . . . . 10 GLN CA . 51259 1
37 . 1 . 1 10 10 GLN CB C 13 29.132 0.070 . 1 . . . . . 10 GLN CB . 51259 1
38 . 1 . 1 10 10 GLN N N 15 122.737 0.052 . 1 . . . . . 10 GLN N . 51259 1
39 . 1 . 1 11 11 ARG H H 1 8.314 0.001 . 1 . . . . . 11 ARG H . 51259 1
40 . 1 . 1 11 11 ARG C C 13 176.570 0.010 . 1 . . . . . 11 ARG C . 51259 1
41 . 1 . 1 11 11 ARG CA C 13 56.590 0.046 . 1 . . . . . 11 ARG CA . 51259 1
42 . 1 . 1 11 11 ARG CB C 13 30.418 0.178 . 1 . . . . . 11 ARG CB . 51259 1
43 . 1 . 1 11 11 ARG N N 15 122.116 0.045 . 1 . . . . . 11 ARG N . 51259 1
44 . 1 . 1 12 12 LEU H H 1 8.198 0.001 . 1 . . . . . 12 LEU H . 51259 1
45 . 1 . 1 12 12 LEU C C 13 177.350 0.005 . 1 . . . . . 12 LEU C . 51259 1
46 . 1 . 1 12 12 LEU CA C 13 55.281 0.007 . 1 . . . . . 12 LEU CA . 51259 1
47 . 1 . 1 12 12 LEU CB C 13 42.240 0.048 . 1 . . . . . 12 LEU CB . 51259 1
48 . 1 . 1 12 12 LEU N N 15 123.013 0.051 . 1 . . . . . 12 LEU N . 51259 1
49 . 1 . 1 13 13 ALA H H 1 8.228 0.001 . 1 . . . . . 13 ALA H . 51259 1
50 . 1 . 1 13 13 ALA C C 13 177.614 0.001 . 1 . . . . . 13 ALA C . 51259 1
51 . 1 . 1 13 13 ALA CA C 13 52.885 0.017 . 1 . . . . . 13 ALA CA . 51259 1
52 . 1 . 1 13 13 ALA CB C 13 18.953 0.022 . 1 . . . . . 13 ALA CB . 51259 1
53 . 1 . 1 13 13 ALA N N 15 124.005 0.042 . 1 . . . . . 13 ALA N . 51259 1
54 . 1 . 1 14 14 ASN H H 1 8.247 0.001 . 1 . . . . . 14 ASN H . 51259 1
55 . 1 . 1 14 14 ASN C C 13 175.061 0.003 . 1 . . . . . 14 ASN C . 51259 1
56 . 1 . 1 14 14 ASN CA C 13 53.364 0.005 . 1 . . . . . 14 ASN CA . 51259 1
57 . 1 . 1 14 14 ASN CB C 13 38.534 0.006 . 1 . . . . . 14 ASN CB . 51259 1
58 . 1 . 1 14 14 ASN N N 15 116.955 0.048 . 1 . . . . . 14 ASN N . 51259 1
59 . 1 . 1 15 15 PHE H H 1 8.035 0.001 . 1 . . . . . 15 PHE H . 51259 1
60 . 1 . 1 15 15 PHE C C 13 175.558 0.012 . 1 . . . . . 15 PHE C . 51259 1
61 . 1 . 1 15 15 PHE CA C 13 58.087 0.004 . 1 . . . . . 15 PHE CA . 51259 1
62 . 1 . 1 15 15 PHE CB C 13 39.207 0.138 . 1 . . . . . 15 PHE CB . 51259 1
63 . 1 . 1 15 15 PHE N N 15 120.120 0.044 . 1 . . . . . 15 PHE N . 51259 1
64 . 1 . 1 16 16 LEU H H 1 8.076 0.001 . 1 . . . . . 16 LEU H . 51259 1
65 . 1 . 1 16 16 LEU C C 13 176.982 0.004 . 1 . . . . . 16 LEU C . 51259 1
66 . 1 . 1 16 16 LEU CA C 13 55.127 0.003 . 1 . . . . . 16 LEU CA . 51259 1
67 . 1 . 1 16 16 LEU CB C 13 42.229 0.063 . 1 . . . . . 16 LEU CB . 51259 1
68 . 1 . 1 16 16 LEU N N 15 123.080 0.065 . 1 . . . . . 16 LEU N . 51259 1
69 . 1 . 1 17 17 VAL H H 1 7.984 0.001 . 1 . . . . . 17 VAL H . 51259 1
70 . 1 . 1 17 17 VAL C C 13 175.944 0.008 . 1 . . . . . 17 VAL C . 51259 1
71 . 1 . 1 17 17 VAL CA C 13 62.518 0.015 . 1 . . . . . 17 VAL CA . 51259 1
72 . 1 . 1 17 17 VAL CB C 13 32.637 0.003 . 1 . . . . . 17 VAL CB . 51259 1
73 . 1 . 1 17 17 VAL N N 15 121.073 0.044 . 1 . . . . . 17 VAL N . 51259 1
74 . 1 . 1 18 18 HIS H H 1 8.418 0.001 . 1 . . . . . 18 HIS H . 51259 1
75 . 1 . 1 18 18 HIS C C 13 175.218 0.000 . 1 . . . . . 18 HIS C . 51259 1
76 . 1 . 1 18 18 HIS CA C 13 56.089 0.019 . 1 . . . . . 18 HIS CA . 51259 1
77 . 1 . 1 18 18 HIS CB C 13 30.641 0.156 . 1 . . . . . 18 HIS CB . 51259 1
78 . 1 . 1 18 18 HIS N N 15 123.237 0.046 . 1 . . . . . 18 HIS N . 51259 1
79 . 1 . 1 19 19 SER H H 1 8.301 0.005 . 1 . . . . . 19 SER H . 51259 1
80 . 1 . 1 19 19 SER C C 13 174.567 0.002 . 1 . . . . . 19 SER C . 51259 1
81 . 1 . 1 19 19 SER CA C 13 58.290 0.004 . 1 . . . . . 19 SER CA . 51259 1
82 . 1 . 1 19 19 SER CB C 13 63.819 0.027 . 1 . . . . . 19 SER CB . 51259 1
83 . 1 . 1 19 19 SER N N 15 117.518 0.087 . 1 . . . . . 19 SER N . 51259 1
84 . 1 . 1 20 20 SER H H 1 8.498 0.001 . 1 . . . . . 20 SER H . 51259 1
85 . 1 . 1 20 20 SER C C 13 174.209 0.018 . 1 . . . . . 20 SER C . 51259 1
86 . 1 . 1 20 20 SER CA C 13 58.492 0.015 . 1 . . . . . 20 SER CA . 51259 1
87 . 1 . 1 20 20 SER CB C 13 63.729 0.001 . 1 . . . . . 20 SER CB . 51259 1
88 . 1 . 1 20 20 SER N N 15 117.904 0.039 . 1 . . . . . 20 SER N . 51259 1
89 . 1 . 1 21 21 ASN H H 1 8.391 0.017 . 1 . . . . . 21 ASN H . 51259 1
90 . 1 . 1 21 21 ASN C C 13 174.761 0.002 . 1 . . . . . 21 ASN C . 51259 1
91 . 1 . 1 21 21 ASN CA C 13 53.128 0.023 . 1 . . . . . 21 ASN CA . 51259 1
92 . 1 . 1 21 21 ASN CB C 13 38.644 0.033 . 1 . . . . . 21 ASN CB . 51259 1
93 . 1 . 1 21 21 ASN N N 15 120.188 0.140 . 1 . . . . . 21 ASN N . 51259 1
94 . 1 . 1 22 22 ASN H H 1 8.287 0.002 . 1 . . . . . 22 ASN H . 51259 1
95 . 1 . 1 22 22 ASN C C 13 175.053 0.001 . 1 . . . . . 22 ASN C . 51259 1
96 . 1 . 1 22 22 ASN CA C 13 53.097 0.028 . 1 . . . . . 22 ASN CA . 51259 1
97 . 1 . 1 22 22 ASN CB C 13 38.529 0.034 . 1 . . . . . 22 ASN CB . 51259 1
98 . 1 . 1 22 22 ASN N N 15 118.781 0.047 . 1 . . . . . 22 ASN N . 51259 1
99 . 1 . 1 23 23 PHE H H 1 8.253 0.001 . 1 . . . . . 23 PHE H . 51259 1
100 . 1 . 1 23 23 PHE C C 13 176.368 0.001 . 1 . . . . . 23 PHE C . 51259 1
101 . 1 . 1 23 23 PHE CA C 13 58.252 0.002 . 1 . . . . . 23 PHE CA . 51259 1
102 . 1 . 1 23 23 PHE CB C 13 38.856 0.106 . 1 . . . . . 23 PHE CB . 51259 1
103 . 1 . 1 23 23 PHE N N 15 120.466 0.049 . 1 . . . . . 23 PHE N . 51259 1
104 . 1 . 1 24 24 GLY H H 1 8.324 0.002 . 1 . . . . . 24 GLY H . 51259 1
105 . 1 . 1 24 24 GLY C C 13 173.713 0.002 . 1 . . . . . 24 GLY C . 51259 1
106 . 1 . 1 24 24 GLY CA C 13 45.202 0.019 . 1 . . . . . 24 GLY CA . 51259 1
107 . 1 . 1 24 24 GLY N N 15 110.271 0.054 . 1 . . . . . 24 GLY N . 51259 1
108 . 1 . 1 25 25 ALA H H 1 8.001 0.001 . 1 . . . . . 25 ALA H . 51259 1
109 . 1 . 1 25 25 ALA C C 13 177.646 0.002 . 1 . . . . . 25 ALA C . 51259 1
110 . 1 . 1 25 25 ALA CA C 13 52.434 0.006 . 1 . . . . . 25 ALA CA . 51259 1
111 . 1 . 1 25 25 ALA CB C 13 19.181 0.043 . 1 . . . . . 25 ALA CB . 51259 1
112 . 1 . 1 25 25 ALA N N 15 123.644 0.041 . 1 . . . . . 25 ALA N . 51259 1
113 . 1 . 1 26 26 ILE H H 1 8.202 0.002 . 1 . . . . . 26 ILE H . 51259 1
114 . 1 . 1 26 26 ILE C C 13 176.433 0.007 . 1 . . . . . 26 ILE C . 51259 1
115 . 1 . 1 26 26 ILE CA C 13 61.068 0.004 . 1 . . . . . 26 ILE CA . 51259 1
116 . 1 . 1 26 26 ILE CB C 13 38.481 0.066 . 1 . . . . . 26 ILE CB . 51259 1
117 . 1 . 1 26 26 ILE N N 15 120.684 0.050 . 1 . . . . . 26 ILE N . 51259 1
118 . 1 . 1 27 27 LEU H H 1 8.432 0.001 . 1 . . . . . 27 LEU H . 51259 1
119 . 1 . 1 27 27 LEU C C 13 177.282 0.008 . 1 . . . . . 27 LEU C . 51259 1
120 . 1 . 1 27 27 LEU CA C 13 54.990 0.002 . 1 . . . . . 27 LEU CA . 51259 1
121 . 1 . 1 27 27 LEU CB C 13 42.209 0.050 . 1 . . . . . 27 LEU CB . 51259 1
122 . 1 . 1 27 27 LEU N N 15 127.079 0.042 . 1 . . . . . 27 LEU N . 51259 1
123 . 1 . 1 28 28 SER H H 1 8.382 0.001 . 1 . . . . . 28 SER H . 51259 1
124 . 1 . 1 28 28 SER C C 13 174.643 0.003 . 1 . . . . . 28 SER C . 51259 1
125 . 1 . 1 28 28 SER CA C 13 58.204 0.006 . 1 . . . . . 28 SER CA . 51259 1
126 . 1 . 1 28 28 SER CB C 13 63.785 0.008 . 1 . . . . . 28 SER CB . 51259 1
127 . 1 . 1 28 28 SER N N 15 116.977 0.055 . 1 . . . . . 28 SER N . 51259 1
128 . 1 . 1 29 29 SER H H 1 8.443 0.001 . 1 . . . . . 29 SER H . 51259 1
129 . 1 . 1 29 29 SER C C 13 174.727 0.025 . 1 . . . . . 29 SER C . 51259 1
130 . 1 . 1 29 29 SER CA C 13 58.404 0.008 . 1 . . . . . 29 SER CA . 51259 1
131 . 1 . 1 29 29 SER CB C 13 63.728 0.014 . 1 . . . . . 29 SER CB . 51259 1
132 . 1 . 1 29 29 SER N N 15 117.909 0.041 . 1 . . . . . 29 SER N . 51259 1
133 . 1 . 1 30 30 THR H H 1 8.183 0.001 . 1 . . . . . 30 THR H . 51259 1
134 . 1 . 1 30 30 THR C C 13 174.201 0.002 . 1 . . . . . 30 THR C . 51259 1
135 . 1 . 1 30 30 THR CA C 13 61.886 0.011 . 1 . . . . . 30 THR CA . 51259 1
136 . 1 . 1 30 30 THR CB C 13 69.615 0.036 . 1 . . . . . 30 THR CB . 51259 1
137 . 1 . 1 30 30 THR N N 15 115.207 0.051 . 1 . . . . . 30 THR N . 51259 1
138 . 1 . 1 31 31 ASN H H 1 8.430 0.001 . 1 . . . . . 31 ASN H . 51259 1
139 . 1 . 1 31 31 ASN C C 13 175.152 0.004 . 1 . . . . . 31 ASN C . 51259 1
140 . 1 . 1 31 31 ASN CA C 13 53.213 0.002 . 1 . . . . . 31 ASN CA . 51259 1
141 . 1 . 1 31 31 ASN CB C 13 38.708 0.001 . 1 . . . . . 31 ASN CB . 51259 1
142 . 1 . 1 31 31 ASN N N 15 121.483 0.046 . 1 . . . . . 31 ASN N . 51259 1
143 . 1 . 1 32 32 VAL H H 1 8.202 0.002 . 1 . . . . . 32 VAL H . 51259 1
144 . 1 . 1 32 32 VAL C C 13 176.726 0.005 . 1 . . . . . 32 VAL C . 51259 1
145 . 1 . 1 32 32 VAL CA C 13 62.629 0.008 . 1 . . . . . 32 VAL CA . 51259 1
146 . 1 . 1 32 32 VAL CB C 13 32.437 0.043 . 1 . . . . . 32 VAL CB . 51259 1
147 . 1 . 1 32 32 VAL N N 15 120.681 0.064 . 1 . . . . . 32 VAL N . 51259 1
148 . 1 . 1 33 33 GLY H H 1 8.549 0.002 . 1 . . . . . 33 GLY H . 51259 1
149 . 1 . 1 33 33 GLY C C 13 174.119 0.003 . 1 . . . . . 33 GLY C . 51259 1
150 . 1 . 1 33 33 GLY CA C 13 45.191 0.018 . 1 . . . . . 33 GLY CA . 51259 1
151 . 1 . 1 33 33 GLY N N 15 112.576 0.053 . 1 . . . . . 33 GLY N . 51259 1
152 . 1 . 1 34 34 SER H H 1 8.243 0.001 . 1 . . . . . 34 SER H . 51259 1
153 . 1 . 1 34 34 SER C C 13 174.243 0.031 . 1 . . . . . 34 SER C . 51259 1
154 . 1 . 1 34 34 SER CA C 13 58.205 0.004 . 1 . . . . . 34 SER CA . 51259 1
155 . 1 . 1 34 34 SER CB C 13 63.794 0.005 . 1 . . . . . 34 SER CB . 51259 1
156 . 1 . 1 34 34 SER N N 15 115.543 0.054 . 1 . . . . . 34 SER N . 51259 1
157 . 1 . 1 35 35 ASN H H 1 8.544 0.001 . 1 . . . . . 35 ASN H . 51259 1
158 . 1 . 1 35 35 ASN C C 13 174.995 0.005 . 1 . . . . . 35 ASN C . 51259 1
159 . 1 . 1 35 35 ASN CA C 13 53.246 0.014 . 1 . . . . . 35 ASN CA . 51259 1
160 . 1 . 1 35 35 ASN CB C 13 38.795 0.026 . 1 . . . . . 35 ASN CB . 51259 1
161 . 1 . 1 35 35 ASN N N 15 120.716 0.046 . 1 . . . . . 35 ASN N . 51259 1
162 . 1 . 1 36 36 THR H H 1 8.060 0.001 . 1 . . . . . 36 THR H . 51259 1
163 . 1 . 1 36 36 THR C C 13 173.166 0.002 . 1 . . . . . 36 THR C . 51259 1
164 . 1 . 1 36 36 THR CA C 13 61.632 0.014 . 1 . . . . . 36 THR CA . 51259 1
165 . 1 . 1 36 36 THR CB C 13 69.877 0.077 . 1 . . . . . 36 THR CB . 51259 1
166 . 1 . 1 36 36 THR N N 15 114.035 0.040 . 1 . . . . . 36 THR N . 51259 1
167 . 1 . 1 37 37 TYR H H 1 7.777 0.001 . 1 . . . . . 37 TYR H . 51259 1
168 . 1 . 1 37 37 TYR C C 13 180.329 0.000 . 1 . . . . . 37 TYR C . 51259 1
169 . 1 . 1 37 37 TYR CA C 13 59.048 0.000 . 1 . . . . . 37 TYR CA . 51259 1
170 . 1 . 1 37 37 TYR CB C 13 39.339 0.000 . 1 . . . . . 37 TYR CB . 51259 1
171 . 1 . 1 37 37 TYR N N 15 127.036 0.043 . 1 . . . . . 37 TYR N . 51259 1
stop_
save_