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 52877
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name list_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-15N HSQC' . . . 52877 1
2 '3D HNCACB' . . . 52877 1
3 '3D HN(CO)CACB' . . . 52877 1
4 '3D HNCO' . . . 52877 1
5 '3D HN(CA)CO' . . . 52877 1
6 '3D HNCA' . . . 52877 1
7 '3D HN(CO)CA' . . . 52877 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 . . 52877 1
2 $software_2 . . 52877 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 2 2 SER C C 13 174.583 0.3 . 1 . . . . . 0 SER C . 52877 1
2 . 1 . 1 2 2 SER CA C 13 58.224 0.3 . 1 . . . . . 0 SER CA . 52877 1
3 . 1 . 1 2 2 SER CB C 13 63.703 0.3 . 1 . . . . . 0 SER CB . 52877 1
4 . 1 . 1 3 3 MET H H 1 8.469 0.02 . 1 . . . . . 1 MET H . 52877 1
5 . 1 . 1 3 3 MET HA H 1 4.457 0.02 . 1 . . . . . 1 MET HA . 52877 1
6 . 1 . 1 3 3 MET C C 13 176.031 0.3 . 1 . . . . . 1 MET C . 52877 1
7 . 1 . 1 3 3 MET CA C 13 55.774 0.3 . 1 . . . . . 1 MET CA . 52877 1
8 . 1 . 1 3 3 MET CB C 13 32.699 0.3 . 1 . . . . . 1 MET CB . 52877 1
9 . 1 . 1 3 3 MET N N 15 121.662 0.3 . 1 . . . . . 1 MET N . 52877 1
10 . 1 . 1 4 4 GLU H H 1 8.281 0.02 . 1 . . . . . 2 GLU H . 52877 1
11 . 1 . 1 4 4 GLU HA H 1 4.273 0.02 . 1 . . . . . 2 GLU HA . 52877 1
12 . 1 . 1 4 4 GLU C C 13 176.075 0.3 . 1 . . . . . 2 GLU C . 52877 1
13 . 1 . 1 4 4 GLU CA C 13 56.123 0.3 . 1 . . . . . 2 GLU CA . 52877 1
14 . 1 . 1 4 4 GLU CB C 13 30.112 0.3 . 1 . . . . . 2 GLU CB . 52877 1
15 . 1 . 1 4 4 GLU N N 15 121.176 0.3 . 1 . . . . . 2 GLU N . 52877 1
16 . 1 . 1 5 5 GLU H H 1 8.188 0.02 . 1 . . . . . 3 GLU H . 52877 1
17 . 1 . 1 5 5 GLU HA H 1 4.558 0.02 . 1 . . . . . 3 GLU HA . 52877 1
18 . 1 . 1 5 5 GLU CA C 13 54.276 0.3 . 1 . . . . . 3 GLU CA . 52877 1
19 . 1 . 1 5 5 GLU CB C 13 29.973 0.3 . 1 . . . . . 3 GLU CB . 52877 1
20 . 1 . 1 5 5 GLU N N 15 122.839 0.3 . 1 . . . . . 3 GLU N . 52877 1
21 . 1 . 1 6 6 PRO C C 13 176.947 0.3 . 1 . . . . . 4 PRO C . 52877 1
22 . 1 . 1 6 6 PRO CA C 13 63.282 0.3 . 1 . . . . . 4 PRO CA . 52877 1
23 . 1 . 1 6 6 PRO CB C 13 32.025 0.3 . 1 . . . . . 4 PRO CB . 52877 1
24 . 1 . 1 7 7 GLN H H 1 8.423 0.02 . 1 . . . . . 5 GLN H . 52877 1
25 . 1 . 1 7 7 GLN HA H 1 4.322 0.02 . 1 . . . . . 5 GLN HA . 52877 1
26 . 1 . 1 7 7 GLN C C 13 175.957 0.3 . 1 . . . . . 5 GLN C . 52877 1
27 . 1 . 1 7 7 GLN CA C 13 55.447 0.3 . 1 . . . . . 5 GLN CA . 52877 1
28 . 1 . 1 7 7 GLN CB C 13 29.414 0.3 . 1 . . . . . 5 GLN CB . 52877 1
29 . 1 . 1 7 7 GLN N N 15 120.537 0.3 . 1 . . . . . 5 GLN N . 52877 1
30 . 1 . 1 8 8 SER H H 1 8.241 0.02 . 1 . . . . . 6 SER H . 52877 1
31 . 1 . 1 8 8 SER HA H 1 4.413 0.02 . 1 . . . . . 6 SER HA . 52877 1
32 . 1 . 1 8 8 SER C C 13 173.727 0.3 . 1 . . . . . 6 SER C . 52877 1
33 . 1 . 1 8 8 SER CA C 13 58.059 0.3 . 1 . . . . . 6 SER CA . 52877 1
34 . 1 . 1 8 8 SER CB C 13 63.872 0.3 . 1 . . . . . 6 SER CB . 52877 1
35 . 1 . 1 8 8 SER N N 15 117.245 0.3 . 1 . . . . . 6 SER N . 52877 1
36 . 1 . 1 9 9 ASP H H 1 8.293 0.02 . 1 . . . . . 7 ASP H . 52877 1
37 . 1 . 1 9 9 ASP HA H 1 4.882 0.02 . 1 . . . . . 7 ASP HA . 52877 1
38 . 1 . 1 9 9 ASP CA C 13 51.981 0.3 . 1 . . . . . 7 ASP CA . 52877 1
39 . 1 . 1 9 9 ASP CB C 13 41.124 0.3 . 1 . . . . . 7 ASP CB . 52877 1
40 . 1 . 1 9 9 ASP N N 15 123.393 0.3 . 1 . . . . . 7 ASP N . 52877 1
41 . 1 . 1 10 10 PRO C C 13 177.109 0.3 . 1 . . . . . 8 PRO C . 52877 1
42 . 1 . 1 10 10 PRO CA C 13 63.232 0.3 . 1 . . . . . 8 PRO CA . 52877 1
43 . 1 . 1 10 10 PRO CB C 13 32.025 0.3 . 1 . . . . . 8 PRO CB . 52877 1
44 . 1 . 1 11 11 SER H H 1 8.432 0.02 . 1 . . . . . 9 SER H . 52877 1
45 . 1 . 1 11 11 SER HA H 1 4.368 0.02 . 1 . . . . . 9 SER HA . 52877 1
46 . 1 . 1 11 11 SER C C 13 174.539 0.3 . 1 . . . . . 9 SER C . 52877 1
47 . 1 . 1 11 11 SER CA C 13 58.901 0.3 . 1 . . . . . 9 SER CA . 52877 1
48 . 1 . 1 11 11 SER CB C 13 63.788 0.3 . 1 . . . . . 9 SER CB . 52877 1
49 . 1 . 1 11 11 SER N N 15 115.737 0.3 . 1 . . . . . 9 SER N . 52877 1
50 . 1 . 1 12 12 VAL H H 1 7.777 0.02 . 1 . . . . . 10 VAL H . 52877 1
51 . 1 . 1 12 12 VAL HA H 1 4.137 0.02 . 1 . . . . . 10 VAL HA . 52877 1
52 . 1 . 1 12 12 VAL C C 13 175.735 0.3 . 1 . . . . . 10 VAL C . 52877 1
53 . 1 . 1 12 12 VAL CA C 13 62.018 0.3 . 1 . . . . . 10 VAL CA . 52877 1
54 . 1 . 1 12 12 VAL CB C 13 32.615 0.3 . 1 . . . . . 10 VAL CB . 52877 1
55 . 1 . 1 12 12 VAL N N 15 120.741 0.3 . 1 . . . . . 10 VAL N . 52877 1
56 . 1 . 1 13 13 GLU H H 1 8.198 0.02 . 1 . . . . . 11 GLU H . 52877 1
57 . 1 . 1 13 13 GLU HA H 1 4.552 0.02 . 1 . . . . . 11 GLU HA . 52877 1
58 . 1 . 1 13 13 GLU CA C 13 53.866 0.3 . 1 . . . . . 11 GLU CA . 52877 1
59 . 1 . 1 13 13 GLU CB C 13 29.492 0.3 . 1 . . . . . 11 GLU CB . 52877 1
60 . 1 . 1 13 13 GLU N N 15 125.583 0.3 . 1 . . . . . 11 GLU N . 52877 1
61 . 1 . 1 15 15 PRO C C 13 176.932 0.3 . 1 . . . . . 13 PRO C . 52877 1
62 . 1 . 1 15 15 PRO CA C 13 62.719 0.3 . 1 . . . . . 13 PRO CA . 52877 1
63 . 1 . 1 15 15 PRO CB C 13 31.759 0.3 . 1 . . . . . 13 PRO CB . 52877 1
64 . 1 . 1 16 16 LEU H H 1 8.194 0.02 . 1 . . . . . 14 LEU H . 52877 1
65 . 1 . 1 16 16 LEU HA H 1 4.282 0.02 . 1 . . . . . 14 LEU HA . 52877 1
66 . 1 . 1 16 16 LEU C C 13 177.523 0.3 . 1 . . . . . 14 LEU C . 52877 1
67 . 1 . 1 16 16 LEU CA C 13 54.848 0.3 . 1 . . . . . 14 LEU CA . 52877 1
68 . 1 . 1 16 16 LEU CB C 13 42.298 0.3 . 1 . . . . . 14 LEU CB . 52877 1
69 . 1 . 1 16 16 LEU N N 15 122.066 0.3 . 1 . . . . . 14 LEU N . 52877 1
70 . 1 . 1 17 17 SER H H 1 8.196 0.02 . 1 . . . . . 15 SER H . 52877 1
71 . 1 . 1 17 17 SER HA H 1 4.413 0.02 . 1 . . . . . 15 SER HA . 52877 1
72 . 1 . 1 17 17 SER C C 13 174.598 0.3 . 1 . . . . . 15 SER C . 52877 1
73 . 1 . 1 17 17 SER CA C 13 57.974 0.3 . 1 . . . . . 15 SER CA . 52877 1
74 . 1 . 1 17 17 SER CB C 13 63.788 0.3 . 1 . . . . . 15 SER CB . 52877 1
75 . 1 . 1 17 17 SER N N 15 116.261 0.3 . 1 . . . . . 15 SER N . 52877 1
76 . 1 . 1 18 18 GLN H H 1 8.363 0.02 . 1 . . . . . 16 GLN H . 52877 1
77 . 1 . 1 18 18 GLN HA H 1 4.302 0.02 . 1 . . . . . 16 GLN HA . 52877 1
78 . 1 . 1 18 18 GLN C C 13 176.001 0.3 . 1 . . . . . 16 GLN C . 52877 1
79 . 1 . 1 18 18 GLN CA C 13 55.783 0.3 . 1 . . . . . 16 GLN CA . 52877 1
80 . 1 . 1 18 18 GLN CB C 13 29.486 0.3 . 1 . . . . . 16 GLN CB . 52877 1
81 . 1 . 1 18 18 GLN N N 15 122.163 0.3 . 1 . . . . . 16 GLN N . 52877 1
82 . 1 . 1 19 19 GLU H H 1 8.377 0.02 . 1 . . . . . 17 GLU H . 52877 1
83 . 1 . 1 19 19 GLU HA H 1 4.262 0.02 . 1 . . . . . 17 GLU HA . 52877 1
84 . 1 . 1 19 19 GLU C C 13 176.563 0.3 . 1 . . . . . 17 GLU C . 52877 1
85 . 1 . 1 19 19 GLU CA C 13 56.670 0.3 . 1 . . . . . 17 GLU CA . 52877 1
86 . 1 . 1 19 19 GLU CB C 13 29.919 0.3 . 1 . . . . . 17 GLU CB . 52877 1
87 . 1 . 1 19 19 GLU N N 15 121.561 0.3 . 1 . . . . . 17 GLU N . 52877 1
88 . 1 . 1 20 20 THR H H 1 7.993 0.02 . 1 . . . . . 18 THR H . 52877 1
89 . 1 . 1 20 20 THR HA H 1 4.227 0.02 . 1 . . . . . 18 THR HA . 52877 1
90 . 1 . 1 20 20 THR C C 13 174.362 0.3 . 1 . . . . . 18 THR C . 52877 1
91 . 1 . 1 20 20 THR CA C 13 61.934 0.3 . 1 . . . . . 18 THR CA . 52877 1
92 . 1 . 1 20 20 THR CB C 13 69.685 0.3 . 1 . . . . . 18 THR CB . 52877 1
93 . 1 . 1 20 20 THR N N 15 114.488 0.3 . 1 . . . . . 18 THR N . 52877 1
94 . 1 . 1 21 21 PHE H H 1 8.122 0.02 . 1 . . . . . 19 PHE H . 52877 1
95 . 1 . 1 21 21 PHE HA H 1 4.552 0.02 . 1 . . . . . 19 PHE HA . 52877 1
96 . 1 . 1 21 21 PHE C C 13 175.854 0.3 . 1 . . . . . 19 PHE C . 52877 1
97 . 1 . 1 21 21 PHE CA C 13 57.764 0.3 . 1 . . . . . 19 PHE CA . 52877 1
98 . 1 . 1 21 21 PHE N N 15 122.020 0.3 . 1 . . . . . 19 PHE N . 52877 1
99 . 1 . 1 22 22 SER H H 1 8.004 0.02 . 1 . . . . . 20 SER H . 52877 1
100 . 1 . 1 22 22 SER HA H 1 4.276 0.02 . 1 . . . . . 20 SER HA . 52877 1
101 . 1 . 1 22 22 SER C C 13 174.48 0.3 . 1 . . . . . 20 SER C . 52877 1
102 . 1 . 1 22 22 SER CA C 13 58.396 0.3 . 1 . . . . . 20 SER CA . 52877 1
103 . 1 . 1 22 22 SER CB C 13 63.788 0.3 . 1 . . . . . 20 SER CB . 52877 1
104 . 1 . 1 22 22 SER N N 15 116.437 0.3 . 1 . . . . . 20 SER N . 52877 1
105 . 1 . 1 23 23 ASP H H 1 8.174 0.02 . 1 . . . . . 21 ASP H . 52877 1
106 . 1 . 1 23 23 ASP HA H 1 4.504 0.02 . 1 . . . . . 21 ASP HA . 52877 1
107 . 1 . 1 23 23 ASP C C 13 176.732 0.3 . 1 . . . . . 21 ASP C . 52877 1
108 . 1 . 1 23 23 ASP CA C 13 54.826 0.3 . 1 . . . . . 21 ASP CA . 52877 1
109 . 1 . 1 23 23 ASP CB C 13 40.413 0.3 . 1 . . . . . 21 ASP CB . 52877 1
110 . 1 . 1 23 23 ASP N N 15 121.857 0.3 . 1 . . . . . 21 ASP N . 52877 1
111 . 1 . 1 24 24 LEU H H 1 7.860 0.02 . 1 . . . . . 22 LEU H . 52877 1
112 . 1 . 1 24 24 LEU HA H 1 4.037 0.02 . 1 . . . . . 22 LEU HA . 52877 1
113 . 1 . 1 24 24 LEU C C 13 177.859 0.3 . 1 . . . . . 22 LEU C . 52877 1
114 . 1 . 1 24 24 LEU CA C 13 56.795 0.3 . 1 . . . . . 22 LEU CA . 52877 1
115 . 1 . 1 24 24 LEU CB C 13 41.714 0.3 . 1 . . . . . 22 LEU CB . 52877 1
116 . 1 . 1 24 24 LEU N N 15 120.986 0.3 . 1 . . . . . 22 LEU N . 52877 1
117 . 1 . 1 25 25 TRP H H 1 7.762 0.02 . 1 . . . . . 23 TRP H . 52877 1
118 . 1 . 1 25 25 TRP HA H 1 4.512 0.02 . 1 . . . . . 23 TRP HA . 52877 1
119 . 1 . 1 25 25 TRP C C 13 176.592 0.3 . 1 . . . . . 23 TRP C . 52877 1
120 . 1 . 1 25 25 TRP CA C 13 57.300 0.3 . 1 . . . . . 23 TRP CA . 52877 1
121 . 1 . 1 25 25 TRP CB C 13 28.824 0.3 . 1 . . . . . 23 TRP CB . 52877 1
122 . 1 . 1 25 25 TRP N N 15 119.001 0.3 . 1 . . . . . 23 TRP N . 52877 1
123 . 1 . 1 26 26 LYS H H 1 7.533 0.02 . 1 . . . . . 24 LYS H . 52877 1
124 . 1 . 1 26 26 LYS HA H 1 4.040 0.02 . 1 . . . . . 24 LYS HA . 52877 1
125 . 1 . 1 26 26 LYS C C 13 176.119 0.3 . 1 . . . . . 24 LYS C . 52877 1
126 . 1 . 1 26 26 LYS CA C 13 56.795 0.3 . 1 . . . . . 24 LYS CA . 52877 1
127 . 1 . 1 26 26 LYS CB C 13 32.699 0.3 . 1 . . . . . 24 LYS CB . 52877 1
128 . 1 . 1 26 26 LYS N N 15 120.261 0.3 . 1 . . . . . 24 LYS N . 52877 1
129 . 1 . 1 27 27 LEU H H 1 7.767 0.02 . 1 . . . . . 25 LEU H . 52877 1
130 . 1 . 1 27 27 LEU HA H 1 4.225 0.02 . 1 . . . . . 25 LEU HA . 52877 1
131 . 1 . 1 27 27 LEU C C 13 176.917 0.3 . 1 . . . . . 25 LEU C . 52877 1
132 . 1 . 1 27 27 LEU CA C 13 54.908 0.3 . 1 . . . . . 25 LEU CA . 52877 1
133 . 1 . 1 27 27 LEU CB C 13 42.196 0.3 . 1 . . . . . 25 LEU CB . 52877 1
134 . 1 . 1 27 27 LEU N N 15 120.729 0.3 . 1 . . . . . 25 LEU N . 52877 1
135 . 1 . 1 28 28 LEU H H 1 7.829 0.02 . 1 . . . . . 26 LEU H . 52877 1
136 . 1 . 1 28 28 LEU HA H 1 4.556 0.02 . 1 . . . . . 26 LEU HA . 52877 1
137 . 1 . 1 28 28 LEU CA C 13 53.041 0.3 . 1 . . . . . 26 LEU CA . 52877 1
138 . 1 . 1 28 28 LEU CB C 13 41.68 0.3 . 1 . . . . . 26 LEU CB . 52877 1
139 . 1 . 1 28 28 LEU N N 15 123.356 0.3 . 1 . . . . . 26 LEU N . 52877 1
140 . 1 . 1 29 29 PRO C C 13 177.331 0.3 . 1 . . . . . 27 PRO C . 52877 1
141 . 1 . 1 29 29 PRO CA C 13 63.535 0.3 . 1 . . . . . 27 PRO CA . 52877 1
142 . 1 . 1 29 29 PRO CB C 13 31.857 0.3 . 1 . . . . . 27 PRO CB . 52877 1
143 . 1 . 1 30 30 GLU H H 1 8.527 0.02 . 1 . . . . . 28 GLU H . 52877 1
144 . 1 . 1 30 30 GLU HA H 1 4.181 0.02 . 1 . . . . . 28 GLU HA . 52877 1
145 . 1 . 1 30 30 GLU C C 13 176.326 0.3 . 1 . . . . . 28 GLU C . 52877 1
146 . 1 . 1 30 30 GLU CA C 13 56.879 0.3 . 1 . . . . . 28 GLU CA . 52877 1
147 . 1 . 1 30 30 GLU CB C 13 29.751 0.3 . 1 . . . . . 28 GLU CB . 52877 1
148 . 1 . 1 30 30 GLU N N 15 119.619 0.3 . 1 . . . . . 28 GLU N . 52877 1
149 . 1 . 1 31 31 ASN H H 1 8.214 0.02 . 1 . . . . . 29 ASN H . 52877 1
150 . 1 . 1 31 31 ASN HA H 1 4.696 0.02 . 1 . . . . . 29 ASN HA . 52877 1
151 . 1 . 1 31 31 ASN C C 13 174.775 0.3 . 1 . . . . . 29 ASN C . 52877 1
152 . 1 . 1 31 31 ASN CA C 13 52.919 0.3 . 1 . . . . . 29 ASN CA . 52877 1
153 . 1 . 1 31 31 ASN CB C 13 38.850 0.3 . 1 . . . . . 29 ASN CB . 52877 1
154 . 1 . 1 31 31 ASN N N 15 118.622 0.3 . 1 . . . . . 29 ASN N . 52877 1
155 . 1 . 1 32 32 ASN H H 1 8.211 0.02 . 1 . . . . . 30 ASN H . 52877 1
156 . 1 . 1 32 32 ASN HA H 1 4.65 0.02 . 1 . . . . . 30 ASN HA . 52877 1
157 . 1 . 1 32 32 ASN C C 13 174.894 0.3 . 1 . . . . . 30 ASN C . 52877 1
158 . 1 . 1 32 32 ASN CA C 13 53.341 0.3 . 1 . . . . . 30 ASN CA . 52877 1
159 . 1 . 1 32 32 ASN CB C 13 39.271 0.3 . 1 . . . . . 30 ASN CB . 52877 1
160 . 1 . 1 32 32 ASN N N 15 119.238 0.3 . 1 . . . . . 30 ASN N . 52877 1
161 . 1 . 1 33 33 VAL H H 1 7.920 0.02 . 1 . . . . . 31 VAL H . 52877 1
162 . 1 . 1 33 33 VAL HA H 1 4.077 0.02 . 1 . . . . . 31 VAL HA . 52877 1
163 . 1 . 1 33 33 VAL C C 13 175.927 0.3 . 1 . . . . . 31 VAL C . 52877 1
164 . 1 . 1 33 33 VAL CA C 13 62.271 0.3 . 1 . . . . . 31 VAL CA . 52877 1
165 . 1 . 1 33 33 VAL CB C 13 32.483 0.3 . 1 . . . . . 31 VAL CB . 52877 1
166 . 1 . 1 33 33 VAL N N 15 119.712 0.3 . 1 . . . . . 31 VAL N . 52877 1
167 . 1 . 1 34 34 LEU H H 1 8.151 0.02 . 1 . . . . . 32 LEU H . 52877 1
168 . 1 . 1 34 34 LEU HA H 1 4.363 0.02 . 1 . . . . . 32 LEU HA . 52877 1
169 . 1 . 1 34 34 LEU C C 13 176.976 0.3 . 1 . . . . . 32 LEU C . 52877 1
170 . 1 . 1 34 34 LEU CA C 13 54.773 0.3 . 1 . . . . . 32 LEU CA . 52877 1
171 . 1 . 1 34 34 LEU CB C 13 42.304 0.3 . 1 . . . . . 32 LEU CB . 52877 1
172 . 1 . 1 34 34 LEU N N 15 125.066 0.3 . 1 . . . . . 32 LEU N . 52877 1
173 . 1 . 1 35 35 SER H H 1 8.080 0.02 . 1 . . . . . 33 SER H . 52877 1
174 . 1 . 1 35 35 SER HA H 1 4.699 0.02 . 1 . . . . . 33 SER HA . 52877 1
175 . 1 . 1 35 35 SER CA C 13 55.784 0.3 . 1 . . . . . 33 SER CA . 52877 1
176 . 1 . 1 35 35 SER CB C 13 63.366 0.3 . 1 . . . . . 33 SER CB . 52877 1
177 . 1 . 1 35 35 SER N N 15 117.636 0.3 . 1 . . . . . 33 SER N . 52877 1
178 . 1 . 1 36 36 PRO C C 13 176.666 0.3 . 1 . . . . . 34 PRO C . 52877 1
179 . 1 . 1 36 36 PRO CA C 13 62.944 0.3 . 1 . . . . . 34 PRO CA . 52877 1
180 . 1 . 1 36 36 PRO CB C 13 31.809 0.3 . 1 . . . . . 34 PRO CB . 52877 1
181 . 1 . 1 37 37 LEU H H 1 8.149 0.02 . 1 . . . . . 35 LEU H . 52877 1
182 . 1 . 1 37 37 LEU HA H 1 4.552 0.02 . 1 . . . . . 35 LEU HA . 52877 1
183 . 1 . 1 37 37 LEU CA C 13 52.919 0.3 . 1 . . . . . 35 LEU CA . 52877 1
184 . 1 . 1 37 37 LEU CB C 13 41.691 0.3 . 1 . . . . . 35 LEU CB . 52877 1
185 . 1 . 1 37 37 LEU N N 15 123.308 0.3 . 1 . . . . . 35 LEU N . 52877 1
186 . 1 . 1 38 38 PRO C C 13 177.05 0.3 . 1 . . . . . 36 PRO C . 52877 1
187 . 1 . 1 38 38 PRO CA C 13 62.44 0.3 . 1 . . . . . 36 PRO CA . 52877 1
188 . 1 . 1 38 38 PRO CB C 13 31.857 0.3 . 1 . . . . . 36 PRO CB . 52877 1
189 . 1 . 1 39 39 SER H H 1 8.198 0.02 . 1 . . . . . 37 SER H . 52877 1
190 . 1 . 1 39 39 SER HA H 1 4.365 0.02 . 1 . . . . . 37 SER HA . 52877 1
191 . 1 . 1 39 39 SER C C 13 174.716 0.3 . 1 . . . . . 37 SER C . 52877 1
192 . 1 . 1 39 39 SER CA C 13 58.396 0.3 . 1 . . . . . 37 SER CA . 52877 1
193 . 1 . 1 39 39 SER CB C 13 63.872 0.3 . 1 . . . . . 37 SER CB . 52877 1
194 . 1 . 1 39 39 SER N N 15 115.266 0.3 . 1 . . . . . 37 SER N . 52877 1
195 . 1 . 1 40 40 GLN H H 1 8.257 0.02 . 1 . . . . . 38 GLN H . 52877 1
196 . 1 . 1 40 40 GLN HA H 1 4.323 0.02 . 1 . . . . . 38 GLN HA . 52877 1
197 . 1 . 1 40 40 GLN C C 13 175.529 0.3 . 1 . . . . . 38 GLN C . 52877 1
198 . 1 . 1 40 40 GLN CA C 13 55.678 0.3 . 1 . . . . . 38 GLN CA . 52877 1
199 . 1 . 1 40 40 GLN CB C 13 29.485 0.3 . 1 . . . . . 38 GLN CB . 52877 1
200 . 1 . 1 40 40 GLN N N 15 121.833 0.3 . 1 . . . . . 38 GLN N . 52877 1
201 . 1 . 1 41 41 ALA H H 1 8.188 0.02 . 1 . . . . . 39 ALA H . 52877 1
202 . 1 . 1 41 41 ALA HA H 1 4.309 0.02 . 1 . . . . . 39 ALA HA . 52877 1
203 . 1 . 1 41 41 ALA C C 13 177.715 0.3 . 1 . . . . . 39 ALA C . 52877 1
204 . 1 . 1 41 41 ALA CA C 13 52.326 0.3 . 1 . . . . . 39 ALA CA . 52877 1
205 . 1 . 1 41 41 ALA CB C 13 19.182 0.3 . 1 . . . . . 39 ALA CB . 52877 1
206 . 1 . 1 41 41 ALA N N 15 124.809 0.3 . 1 . . . . . 39 ALA N . 52877 1
207 . 1 . 1 42 42 MET H H 1 8.216 0.02 . 1 . . . . . 40 MET H . 52877 1
208 . 1 . 1 42 42 MET HA H 1 4.413 0.02 . 1 . . . . . 40 MET HA . 52877 1
209 . 1 . 1 42 42 MET C C 13 176.149 0.3 . 1 . . . . . 40 MET C . 52877 1
210 . 1 . 1 42 42 MET CA C 13 55.615 0.3 . 1 . . . . . 40 MET CA . 52877 1
211 . 1 . 1 42 42 MET CB C 13 32.868 0.3 . 1 . . . . . 40 MET CB . 52877 1
212 . 1 . 1 42 42 MET N N 15 119.235 0.3 . 1 . . . . . 40 MET N . 52877 1
213 . 1 . 1 43 43 ASP H H 1 8.164 0.02 . 1 . . . . . 41 ASP H . 52877 1
214 . 1 . 1 43 43 ASP HA H 1 4.507 0.02 . 1 . . . . . 41 ASP HA . 52877 1
215 . 1 . 1 43 43 ASP C C 13 176.127 0.3 . 1 . . . . . 41 ASP C . 52877 1
216 . 1 . 1 43 43 ASP CA C 13 54.719 0.3 . 1 . . . . . 41 ASP CA . 52877 1
217 . 1 . 1 43 43 ASP CB C 13 41.040 0.3 . 1 . . . . . 41 ASP CB . 52877 1
218 . 1 . 1 43 43 ASP N N 15 120.685 0.3 . 1 . . . . . 41 ASP N . 52877 1
219 . 1 . 1 44 44 ASP H H 1 8.152 0.02 . 1 . . . . . 42 ASP H . 52877 1
220 . 1 . 1 44 44 ASP HA H 1 4.413 0.02 . 1 . . . . . 42 ASP HA . 52877 1
221 . 1 . 1 44 44 ASP C C 13 176.326 0.3 . 1 . . . . . 42 ASP C . 52877 1
222 . 1 . 1 44 44 ASP CA C 13 54.773 0.3 . 1 . . . . . 42 ASP CA . 52877 1
223 . 1 . 1 44 44 ASP CB C 13 40.872 0.3 . 1 . . . . . 42 ASP CB . 52877 1
224 . 1 . 1 44 44 ASP N N 15 119.979 0.3 . 1 . . . . . 42 ASP N . 52877 1
225 . 1 . 1 45 45 LEU H H 1 7.981 0.02 . 1 . . . . . 43 LEU H . 52877 1
226 . 1 . 1 45 45 LEU HA H 1 4.235 0.02 . 1 . . . . . 43 LEU HA . 52877 1
227 . 1 . 1 45 45 LEU C C 13 177.309 0.3 . 1 . . . . . 43 LEU C . 52877 1
228 . 1 . 1 45 45 LEU CA C 13 55.278 0.3 . 1 . . . . . 43 LEU CA . 52877 1
229 . 1 . 1 45 45 LEU CB C 13 42.135 0.3 . 1 . . . . . 43 LEU CB . 52877 1
230 . 1 . 1 45 45 LEU N N 15 121.457 0.3 . 1 . . . . . 43 LEU N . 52877 1
231 . 1 . 1 46 46 MET H H 1 8.153 0.02 . 1 . . . . . 44 MET H . 52877 1
232 . 1 . 1 46 46 MET HA H 1 4.413 0.02 . 1 . . . . . 44 MET HA . 52877 1
233 . 1 . 1 46 46 MET C C 13 175.839 0.3 . 1 . . . . . 44 MET C . 52877 1
234 . 1 . 1 46 46 MET CA C 13 54.857 0.3 . 1 . . . . . 44 MET CA . 52877 1
235 . 1 . 1 46 46 MET CB C 13 32.447 0.3 . 1 . . . . . 44 MET CB . 52877 1
236 . 1 . 1 46 46 MET N N 15 119.966 0.3 . 1 . . . . . 44 MET N . 52877 1
237 . 1 . 1 47 47 LEU H H 1 7.975 0.02 . 1 . . . . . 45 LEU H . 52877 1
238 . 1 . 1 47 47 LEU HA H 1 4.370 0.02 . 1 . . . . . 45 LEU HA . 52877 1
239 . 1 . 1 47 47 LEU C C 13 176.961 0.3 . 1 . . . . . 45 LEU C . 52877 1
240 . 1 . 1 47 47 LEU CA C 13 54.791 0.3 . 1 . . . . . 45 LEU CA . 52877 1
241 . 1 . 1 47 47 LEU CB C 13 42.635 0.3 . 1 . . . . . 45 LEU CB . 52877 1
242 . 1 . 1 47 47 LEU N N 15 122.864 0.3 . 1 . . . . . 45 LEU N . 52877 1
243 . 1 . 1 48 48 SER H H 1 8.380 0.02 . 1 . . . . . 46 SER H . 52877 1
244 . 1 . 1 48 48 SER HA H 1 4.743 0.02 . 1 . . . . . 46 SER HA . 52877 1
245 . 1 . 1 48 48 SER CA C 13 55.700 0.3 . 1 . . . . . 46 SER CA . 52877 1
246 . 1 . 1 48 48 SER CB C 13 63.535 0.3 . 1 . . . . . 46 SER CB . 52877 1
247 . 1 . 1 48 48 SER N N 15 118.012 0.3 . 1 . . . . . 46 SER N . 52877 1
248 . 1 . 1 49 49 PRO C C 13 176.976 0.3 . 1 . . . . . 47 PRO C . 52877 1
249 . 1 . 1 49 49 PRO CA C 13 63.619 0.3 . 1 . . . . . 47 PRO CA . 52877 1
250 . 1 . 1 49 49 PRO CB C 13 31.941 0.3 . 1 . . . . . 47 PRO CB . 52877 1
251 . 1 . 1 50 50 ASP H H 1 8.129 0.02 . 1 . . . . . 48 ASP H . 52877 1
252 . 1 . 1 50 50 ASP HA H 1 4.508 0.02 . 1 . . . . . 48 ASP HA . 52877 1
253 . 1 . 1 50 50 ASP C C 13 176.223 0.3 . 1 . . . . . 48 ASP C . 52877 1
254 . 1 . 1 50 50 ASP CA C 13 54.604 0.3 . 1 . . . . . 48 ASP CA . 52877 1
255 . 1 . 1 50 50 ASP CB C 13 40.787 0.3 . 1 . . . . . 48 ASP CB . 52877 1
256 . 1 . 1 50 50 ASP N N 15 118.364 0.3 . 1 . . . . . 48 ASP N . 52877 1
257 . 1 . 1 51 51 ASP H H 1 8.020 0.02 . 1 . . . . . 49 ASP H . 52877 1
258 . 1 . 1 51 51 ASP HA H 1 4.601 0.02 . 1 . . . . . 49 ASP HA . 52877 1
259 . 1 . 1 51 51 ASP C C 13 176.311 0.3 . 1 . . . . . 49 ASP C . 52877 1
260 . 1 . 1 51 51 ASP CA C 13 54.52 0.3 . 1 . . . . . 49 ASP CA . 52877 1
261 . 1 . 1 51 51 ASP CB C 13 40.956 0.3 . 1 . . . . . 49 ASP CB . 52877 1
262 . 1 . 1 51 51 ASP N N 15 119.957 0.3 . 1 . . . . . 49 ASP N . 52877 1
263 . 1 . 1 52 52 ILE H H 1 7.752 0.02 . 1 . . . . . 50 ILE H . 52877 1
264 . 1 . 1 52 52 ILE HA H 1 3.996 0.02 . 1 . . . . . 50 ILE HA . 52877 1
265 . 1 . 1 52 52 ILE C C 13 176.385 0.3 . 1 . . . . . 50 ILE C . 52877 1
266 . 1 . 1 52 52 ILE CA C 13 61.674 0.3 . 1 . . . . . 50 ILE CA . 52877 1
267 . 1 . 1 52 52 ILE CB C 13 38.545 0.3 . 1 . . . . . 50 ILE CB . 52877 1
268 . 1 . 1 52 52 ILE N N 15 119.815 0.3 . 1 . . . . . 50 ILE N . 52877 1
269 . 1 . 1 53 53 GLU H H 1 8.213 0.02 . 1 . . . . . 51 GLU H . 52877 1
270 . 1 . 1 53 53 GLU HA H 1 4.134 0.02 . 1 . . . . . 51 GLU HA . 52877 1
271 . 1 . 1 53 53 GLU C C 13 176.577 0.3 . 1 . . . . . 51 GLU C . 52877 1
272 . 1 . 1 53 53 GLU CA C 13 56.648 0.3 . 1 . . . . . 51 GLU CA . 52877 1
273 . 1 . 1 53 53 GLU CB C 13 29.635 0.3 . 1 . . . . . 51 GLU CB . 52877 1
274 . 1 . 1 53 53 GLU N N 15 123.16 0.3 . 1 . . . . . 51 GLU N . 52877 1
275 . 1 . 1 54 54 GLN H H 1 8.018 0.02 . 1 . . . . . 52 GLN H . 52877 1
276 . 1 . 1 54 54 GLN HA H 1 4.180 0.02 . 1 . . . . . 52 GLN HA . 52877 1
277 . 1 . 1 54 54 GLN C C 13 176.001 0.3 . 1 . . . . . 52 GLN C . 52877 1
278 . 1 . 1 54 54 GLN CA C 13 56.128 0.3 . 1 . . . . . 52 GLN CA . 52877 1
279 . 1 . 1 54 54 GLN CB C 13 29.414 0.3 . 1 . . . . . 52 GLN CB . 52877 1
280 . 1 . 1 54 54 GLN N N 15 119.963 0.3 . 1 . . . . . 52 GLN N . 52877 1
281 . 1 . 1 55 55 TRP H H 1 7.858 0.02 . 1 . . . . . 53 TRP H . 52877 1
282 . 1 . 1 55 55 TRP HA H 1 4.269 0.02 . 1 . . . . . 53 TRP HA . 52877 1
283 . 1 . 1 55 55 TRP C C 13 175.754 0.3 . 1 . . . . . 53 TRP C . 52877 1
284 . 1 . 1 55 55 TRP CA C 13 56.851 0.3 . 1 . . . . . 53 TRP CA . 52877 1
285 . 1 . 1 55 55 TRP CB C 13 29.582 0.3 . 1 . . . . . 53 TRP CB . 52877 1
286 . 1 . 1 55 55 TRP N N 15 120.988 0.3 . 1 . . . . . 53 TRP N . 52877 1
287 . 1 . 1 56 56 PHE H H 1 7.858 0.02 . 1 . . . . . 54 PHE H . 52877 1
288 . 1 . 1 56 56 PHE HA H 1 4.604 0.02 . 1 . . . . . 54 PHE HA . 52877 1
289 . 1 . 1 56 56 PHE C C 13 175.425 0.3 . 1 . . . . . 54 PHE C . 52877 1
290 . 1 . 1 56 56 PHE CA C 13 57.216 0.3 . 1 . . . . . 54 PHE CA . 52877 1
291 . 1 . 1 56 56 PHE CB C 13 39.692 0.3 . 1 . . . . . 54 PHE CB . 52877 1
292 . 1 . 1 56 56 PHE N N 15 120.988 0.3 . 1 . . . . . 54 PHE N . 52877 1
293 . 1 . 1 57 57 THR H H 1 7.881 0.02 . 1 . . . . . 55 THR H . 52877 1
294 . 1 . 1 57 57 THR HA H 1 4.232 0.02 . 1 . . . . . 55 THR HA . 52877 1
295 . 1 . 1 57 57 THR C C 13 173.845 0.3 . 1 . . . . . 55 THR C . 52877 1
296 . 1 . 1 57 57 THR CA C 13 61.344 0.3 . 1 . . . . . 55 THR CA . 52877 1
297 . 1 . 1 57 57 THR CB C 13 69.769 0.3 . 1 . . . . . 55 THR CB . 52877 1
298 . 1 . 1 57 57 THR N N 15 115.696 0.3 . 1 . . . . . 55 THR N . 52877 1
299 . 1 . 1 58 58 GLU H H 1 8.187 0.02 . 1 . . . . . 56 GLU H . 52877 1
300 . 1 . 1 58 58 GLU HA H 1 4.228 0.02 . 1 . . . . . 56 GLU HA . 52877 1
301 . 1 . 1 58 58 GLU C C 13 175.647 0.3 . 1 . . . . . 56 GLU C . 52877 1
302 . 1 . 1 58 58 GLU CA C 13 56.205 0.3 . 1 . . . . . 56 GLU CA . 52877 1
303 . 1 . 1 58 58 GLU CB C 13 30.103 0.3 . 1 . . . . . 56 GLU CB . 52877 1
304 . 1 . 1 58 58 GLU N N 15 123.051 0.3 . 1 . . . . . 56 GLU N . 52877 1
305 . 1 . 1 59 59 ASP H H 1 8.300 0.02 . 1 . . . . . 57 ASP H . 52877 1
306 . 1 . 1 59 59 ASP HA H 1 4.828 0.02 . 1 . . . . . 57 ASP HA . 52877 1
307 . 1 . 1 59 59 ASP CA C 13 52.161 0.3 . 1 . . . . . 57 ASP CA . 52877 1
308 . 1 . 1 59 59 ASP CB C 13 41.052 0.3 . 1 . . . . . 57 ASP CB . 52877 1
309 . 1 . 1 59 59 ASP N N 15 123.049 0.3 . 1 . . . . . 57 ASP N . 52877 1
310 . 1 . 1 60 60 PRO C C 13 177.227 0.3 . 1 . . . . . 58 PRO C . 52877 1
311 . 1 . 1 60 60 PRO CA C 13 63.366 0.3 . 1 . . . . . 58 PRO CA . 52877 1
312 . 1 . 1 60 60 PRO CB C 13 31.941 0.3 . 1 . . . . . 58 PRO CB . 52877 1
313 . 1 . 1 60 60 PRO N N 15 123.049 0.3 . 1 . . . . . 58 PRO N . 52877 1
314 . 1 . 1 61 61 GLY H H 1 8.159 0.02 . 1 . . . . . 59 GLY H . 52877 1
315 . 1 . 1 61 61 GLY HA2 H 1 3.996 0.02 . 1 . . . . . 59 GLY HA2 . 52877 1
316 . 1 . 1 61 61 GLY HA3 H 1 3.996 0.02 . 1 . . . . . 59 GLY HA3 . 52877 1
317 . 1 . 1 61 61 GLY CA C 13 44.391 0.3 . 1 . . . . . 59 GLY CA . 52877 1
318 . 1 . 1 61 61 GLY N N 15 109.478 0.3 . 1 . . . . . 59 GLY N . 52877 1
stop_
save_