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 50784
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name assigned_chemical_shifts
_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' . . . 50784 1
2 '3D HNCA' . . . 50784 1
3 '3D HN(CO)CA' . . . 50784 1
4 '3D HNCACB' . . . 50784 1
5 '3D CBCA(CO)NH' . . . 50784 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
2 $software_2 . . 50784 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 MET H H 1 8.755 0.020 . 1 . . . . . 1 MET H . 50784 1
2 . 1 . 1 3 3 MET CA C 13 55.678 0.3 . 1 . . . . . 1 MET CA . 50784 1
3 . 1 . 1 3 3 MET CB C 13 33.902 0.3 . 1 . . . . . 1 MET CB . 50784 1
4 . 1 . 1 3 3 MET N N 15 122.645 0.3 . 1 . . . . . 1 MET N . 50784 1
5 . 1 . 1 4 4 LYS H H 1 8.343 0.020 . 1 . . . . . 2 LYS H . 50784 1
6 . 1 . 1 4 4 LYS CA C 13 55.078 0.3 . 1 . . . . . 2 LYS CA . 50784 1
7 . 1 . 1 4 4 LYS CB C 13 33.242 0.3 . 1 . . . . . 2 LYS CB . 50784 1
8 . 1 . 1 4 4 LYS N N 15 124.344 0.3 . 1 . . . . . 2 LYS N . 50784 1
9 . 1 . 1 5 5 CYS H H 1 8.335 0.020 . 1 . . . . . 3 CYS H . 50784 1
10 . 1 . 1 5 5 CYS CA C 13 57.178 0.3 . 1 . . . . . 3 CYS CA . 50784 1
11 . 1 . 1 5 5 CYS CB C 13 33.482 0.3 . 1 . . . . . 3 CYS CB . 50784 1
12 . 1 . 1 5 5 CYS N N 15 126.800 0.3 . 1 . . . . . 3 CYS N . 50784 1
13 . 1 . 1 7 7 VAL H H 1 9.091 0.020 . 1 . . . . . 5 VAL H . 50784 1
14 . 1 . 1 7 7 VAL CA C 13 65.096 0.3 . 1 . . . . . 5 VAL CA . 50784 1
15 . 1 . 1 7 7 VAL CB C 13 32.762 0.3 . 1 . . . . . 5 VAL CB . 50784 1
16 . 1 . 1 7 7 VAL N N 15 122.977 0.3 . 1 . . . . . 5 VAL N . 50784 1
17 . 1 . 1 8 8 CYS H H 1 8.988 0.020 . 1 . . . . . 6 CYS H . 50784 1
18 . 1 . 1 8 8 CYS CA C 13 58.977 0.3 . 1 . . . . . 6 CYS CA . 50784 1
19 . 1 . 1 8 8 CYS CB C 13 31.022 0.3 . 1 . . . . . 6 CYS CB . 50784 1
20 . 1 . 1 8 8 CYS N N 15 120.265 0.3 . 1 . . . . . 6 CYS N . 50784 1
21 . 1 . 1 9 9 HIS H H 1 7.140 0.020 . 1 . . . . . 7 HIS H . 50784 1
22 . 1 . 1 9 9 HIS CA C 13 58.018 0.3 . 1 . . . . . 7 HIS CA . 50784 1
23 . 1 . 1 9 9 HIS CB C 13 27.303 0.3 . 1 . . . . . 7 HIS CB . 50784 1
24 . 1 . 1 9 9 HIS N N 15 115.368 0.3 . 1 . . . . . 7 HIS N . 50784 1
25 . 1 . 1 10 10 GLN H H 1 8.949 0.020 . 1 . . . . . 8 GLN H . 50784 1
26 . 1 . 1 10 10 GLN CA C 13 56.218 0.3 . 1 . . . . . 8 GLN CA . 50784 1
27 . 1 . 1 10 10 GLN CB C 13 30.842 0.3 . 1 . . . . . 8 GLN CB . 50784 1
28 . 1 . 1 10 10 GLN N N 15 119.654 0.3 . 1 . . . . . 8 GLN N . 50784 1
29 . 1 . 1 11 11 GLY H H 1 7.322 0.020 . 1 . . . . . 9 GLY H . 50784 1
30 . 1 . 1 11 11 GLY CA C 13 45.120 0.3 . 1 . . . . . 9 GLY CA . 50784 1
31 . 1 . 1 11 11 GLY N N 15 106.388 0.3 . 1 . . . . . 9 GLY N . 50784 1
32 . 1 . 1 12 12 GLU H H 1 7.665 0.020 . 1 . . . . . 10 GLU H . 50784 1
33 . 1 . 1 12 12 GLU CA C 13 55.498 0.3 . 1 . . . . . 10 GLU CA . 50784 1
34 . 1 . 1 12 12 GLU CB C 13 31.142 0.3 . 1 . . . . . 10 GLU CB . 50784 1
35 . 1 . 1 12 12 GLU N N 15 119.967 0.3 . 1 . . . . . 10 GLU N . 50784 1
36 . 1 . 1 13 13 MET H H 1 8.226 0.020 . 1 . . . . . 11 MET H . 50784 1
37 . 1 . 1 13 13 MET CA C 13 53.398 0.3 . 1 . . . . . 11 MET CA . 50784 1
38 . 1 . 1 13 13 MET CB C 13 32.762 0.3 . 1 . . . . . 11 MET CB . 50784 1
39 . 1 . 1 13 13 MET N N 15 118.365 0.3 . 1 . . . . . 11 MET N . 50784 1
40 . 1 . 1 14 14 VAL H H 1 8.531 0.020 . 1 . . . . . 12 VAL H . 50784 1
41 . 1 . 1 14 14 VAL CA C 13 60.417 0.3 . 1 . . . . . 12 VAL CA . 50784 1
42 . 1 . 1 14 14 VAL CB C 13 35.281 0.3 . 1 . . . . . 12 VAL CB . 50784 1
43 . 1 . 1 14 14 VAL N N 15 121.479 0.3 . 1 . . . . . 12 VAL N . 50784 1
44 . 1 . 1 15 15 SER H H 1 8.813 0.020 . 1 . . . . . 13 SER H . 50784 1
45 . 1 . 1 15 15 SER CA C 13 58.797 0.3 . 1 . . . . . 13 SER CA . 50784 1
46 . 1 . 1 15 15 SER CB C 13 63.297 0.3 . 1 . . . . . 13 SER CB . 50784 1
47 . 1 . 1 15 15 SER N N 15 123.340 0.3 . 1 . . . . . 13 SER N . 50784 1
48 . 1 . 1 16 16 GLY H H 1 8.826 0.020 . 1 . . . . . 14 GLY H . 50784 1
49 . 1 . 1 16 16 GLY CA C 13 45.480 0.3 . 1 . . . . . 14 GLY CA . 50784 1
50 . 1 . 1 16 16 GLY N N 15 113.183 0.3 . 1 . . . . . 14 GLY N . 50784 1
51 . 1 . 1 17 17 ILE H H 1 8.038 0.020 . 1 . . . . . 15 ILE H . 50784 1
52 . 1 . 1 17 17 ILE CA C 13 60.237 0.3 . 1 . . . . . 15 ILE CA . 50784 1
53 . 1 . 1 17 17 ILE CB C 13 41.160 0.3 . 1 . . . . . 15 ILE CB . 50784 1
54 . 1 . 1 17 17 ILE N N 15 117.750 0.3 . 1 . . . . . 15 ILE N . 50784 1
55 . 1 . 1 18 18 LYS H H 1 7.954 0.020 . 1 . . . . . 16 LYS H . 50784 1
56 . 1 . 1 18 18 LYS CA C 13 55.138 0.3 . 1 . . . . . 16 LYS CA . 50784 1
57 . 1 . 1 18 18 LYS CB C 13 37.021 0.3 . 1 . . . . . 16 LYS CB . 50784 1
58 . 1 . 1 18 18 LYS N N 15 124.422 0.3 . 1 . . . . . 16 LYS N . 50784 1
59 . 1 . 1 19 19 ASP H H 1 8.097 0.020 . 1 . . . . . 17 ASP H . 50784 1
60 . 1 . 1 19 19 ASP CA C 13 52.558 0.3 . 1 . . . . . 17 ASP CA . 50784 1
61 . 1 . 1 19 19 ASP CB C 13 40.081 0.3 . 1 . . . . . 17 ASP CB . 50784 1
62 . 1 . 1 19 19 ASP N N 15 122.892 0.3 . 1 . . . . . 17 ASP N . 50784 1
63 . 1 . 1 20 20 ILE H H 1 8.846 0.020 . 1 . . . . . 18 ILE H . 50784 1
64 . 1 . 1 20 20 ILE CA C 13 57.658 0.3 . 1 . . . . . 18 ILE CA . 50784 1
65 . 1 . 1 20 20 ILE CB C 13 41.100 0.3 . 1 . . . . . 18 ILE CB . 50784 1
66 . 1 . 1 20 20 ILE N N 15 126.171 0.3 . 1 . . . . . 18 ILE N . 50784 1
67 . 1 . 1 22 22 TYR H H 1 8.403 0.020 . 1 . . . . . 20 TYR H . 50784 1
68 . 1 . 1 22 22 TYR CA C 13 58.617 0.3 . 1 . . . . . 20 TYR CA . 50784 1
69 . 1 . 1 22 22 TYR CB C 13 42.780 0.3 . 1 . . . . . 20 TYR CB . 50784 1
70 . 1 . 1 22 22 TYR N N 15 123.720 0.3 . 1 . . . . . 20 TYR N . 50784 1
71 . 1 . 1 23 23 THR H H 1 7.206 0.020 . 1 . . . . . 21 THR H . 50784 1
72 . 1 . 1 23 23 THR CA C 13 60.057 0.3 . 1 . . . . . 21 THR CA . 50784 1
73 . 1 . 1 23 23 THR CB C 13 70.915 0.3 . 1 . . . . . 21 THR CB . 50784 1
74 . 1 . 1 23 23 THR N N 15 120.870 0.3 . 1 . . . . . 21 THR N . 50784 1
75 . 1 . 1 24 24 PHE H H 1 8.883 0.020 . 1 . . . . . 22 PHE H . 50784 1
76 . 1 . 1 24 24 PHE CA C 13 57.418 0.3 . 1 . . . . . 22 PHE CA . 50784 1
77 . 1 . 1 24 24 PHE CB C 13 42.900 0.3 . 1 . . . . . 22 PHE CB . 50784 1
78 . 1 . 1 24 24 PHE N N 15 124.461 0.3 . 1 . . . . . 22 PHE N . 50784 1
79 . 1 . 1 25 25 ARG H H 1 8.883 0.020 . 1 . . . . . 23 ARG H . 50784 1
80 . 1 . 1 25 25 ARG CA C 13 57.358 0.3 . 1 . . . . . 23 ARG CA . 50784 1
81 . 1 . 1 25 25 ARG CB C 13 27.723 0.3 . 1 . . . . . 23 ARG CB . 50784 1
82 . 1 . 1 25 25 ARG N N 15 125.847 0.3 . 1 . . . . . 23 ARG N . 50784 1
83 . 1 . 1 26 26 GLY H H 1 8.306 0.020 . 1 . . . . . 24 GLY H . 50784 1
84 . 1 . 1 26 26 GLY CA C 13 45.240 0.3 . 1 . . . . . 24 GLY CA . 50784 1
85 . 1 . 1 26 26 GLY N N 15 103.291 0.3 . 1 . . . . . 24 GLY N . 50784 1
86 . 1 . 1 27 27 ARG H H 1 8.050 0.020 . 1 . . . . . 25 ARG H . 50784 1
87 . 1 . 1 27 27 ARG CA C 13 54.538 0.3 . 1 . . . . . 25 ARG CA . 50784 1
88 . 1 . 1 27 27 ARG CB C 13 30.902 0.3 . 1 . . . . . 25 ARG CB . 50784 1
89 . 1 . 1 27 27 ARG N N 15 122.381 0.3 . 1 . . . . . 25 ARG N . 50784 1
90 . 1 . 1 28 28 LYS H H 1 8.618 0.020 . 1 . . . . . 26 LYS H . 50784 1
91 . 1 . 1 28 28 LYS CA C 13 55.498 0.3 . 1 . . . . . 26 LYS CA . 50784 1
92 . 1 . 1 28 28 LYS CB C 13 35.341 0.3 . 1 . . . . . 26 LYS CB . 50784 1
93 . 1 . 1 28 28 LYS N N 15 122.613 0.3 . 1 . . . . . 26 LYS N . 50784 1
94 . 1 . 1 29 29 THR H H 1 8.693 0.020 . 1 . . . . . 27 THR H . 50784 1
95 . 1 . 1 29 29 THR CA C 13 58.977 0.3 . 1 . . . . . 27 THR CA . 50784 1
96 . 1 . 1 29 29 THR CB C 13 70.255 0.3 . 1 . . . . . 27 THR CB . 50784 1
97 . 1 . 1 29 29 THR N N 15 117.794 0.3 . 1 . . . . . 27 THR N . 50784 1
98 . 1 . 1 30 30 VAL H H 1 7.697 0.020 . 1 . . . . . 28 VAL H . 50784 1
99 . 1 . 1 30 30 VAL CA C 13 61.677 0.3 . 1 . . . . . 28 VAL CA . 50784 1
100 . 1 . 1 30 30 VAL CB C 13 34.262 0.3 . 1 . . . . . 28 VAL CB . 50784 1
101 . 1 . 1 30 30 VAL N N 15 121.865 0.3 . 1 . . . . . 28 VAL N . 50784 1
102 . 1 . 1 31 31 LEU H H 1 9.065 0.020 . 1 . . . . . 29 LEU H . 50784 1
103 . 1 . 1 31 31 LEU CA C 13 53.338 0.3 . 1 . . . . . 29 LEU CA . 50784 1
104 . 1 . 1 31 31 LEU CB C 13 39.781 0.3 . 1 . . . . . 29 LEU CB . 50784 1
105 . 1 . 1 31 31 LEU N N 15 129.673 0.3 . 1 . . . . . 29 LEU N . 50784 1
106 . 1 . 1 32 32 LYS H H 1 8.323 0.020 . 1 . . . . . 30 LYS H . 50784 1
107 . 1 . 1 32 32 LYS CA C 13 56.098 0.3 . 1 . . . . . 30 LYS CA . 50784 1
108 . 1 . 1 32 32 LYS CB C 13 33.482 0.3 . 1 . . . . . 30 LYS CB . 50784 1
109 . 1 . 1 32 32 LYS N N 15 123.746 0.3 . 1 . . . . . 30 LYS N . 50784 1
110 . 1 . 1 33 33 GLY H H 1 8.742 0.020 . 1 . . . . . 31 GLY H . 50784 1
111 . 1 . 1 33 33 GLY CA C 13 47.939 0.3 . 1 . . . . . 31 GLY CA . 50784 1
112 . 1 . 1 33 33 GLY N N 15 110.316 0.3 . 1 . . . . . 31 GLY N . 50784 1
113 . 1 . 1 34 34 ILE H H 1 8.657 0.020 . 1 . . . . . 32 ILE H . 50784 1
114 . 1 . 1 34 34 ILE CA C 13 58.806 0.3 . 1 . . . . . 32 ILE CA . 50784 1
115 . 1 . 1 34 34 ILE CB C 13 34.742 0.3 . 1 . . . . . 32 ILE CB . 50784 1
116 . 1 . 1 34 34 ILE N N 15 120.262 0.3 . 1 . . . . . 32 ILE N . 50784 1
117 . 1 . 1 35 35 HIS H H 1 8.936 0.020 . 1 . . . . . 33 HIS H . 50784 1
118 . 1 . 1 35 35 HIS CA C 13 56.698 0.3 . 1 . . . . . 33 HIS CA . 50784 1
119 . 1 . 1 35 35 HIS CB C 13 29.882 0.3 . 1 . . . . . 33 HIS CB . 50784 1
120 . 1 . 1 35 35 HIS N N 15 133.158 0.3 . 1 . . . . . 33 HIS N . 50784 1
121 . 1 . 1 36 36 GLY H H 1 7.961 0.020 . 1 . . . . . 34 GLY H . 50784 1
122 . 1 . 1 36 36 GLY CA C 13 45.180 0.3 . 1 . . . . . 34 GLY CA . 50784 1
123 . 1 . 1 36 36 GLY N N 15 107.214 0.3 . 1 . . . . . 34 GLY N . 50784 1
124 . 1 . 1 37 37 LEU H H 1 7.622 0.020 . 1 . . . . . 35 LEU H . 50784 1
125 . 1 . 1 37 37 LEU CA C 13 53.518 0.3 . 1 . . . . . 35 LEU CA . 50784 1
126 . 1 . 1 37 37 LEU CB C 13 43.860 0.3 . 1 . . . . . 35 LEU CB . 50784 1
127 . 1 . 1 37 37 LEU N N 15 118.848 0.3 . 1 . . . . . 35 LEU N . 50784 1
128 . 1 . 1 42 42 CYS H H 1 9.757 0.020 . 1 . . . . . 40 CYS H . 50784 1
129 . 1 . 1 42 42 CYS CA C 13 58.399 0.3 . 1 . . . . . 40 CYS CA . 50784 1
130 . 1 . 1 42 42 CYS CB C 13 31.802 0.3 . 1 . . . . . 40 CYS CB . 50784 1
131 . 1 . 1 42 42 CYS N N 15 125.174 0.3 . 1 . . . . . 40 CYS N . 50784 1
132 . 1 . 1 43 43 GLU H H 1 7.637 0.020 . 1 . . . . . 41 GLU H . 50784 1
133 . 1 . 1 43 43 GLU CA C 13 58.219 0.3 . 1 . . . . . 41 GLU CA . 50784 1
134 . 1 . 1 43 43 GLU CB C 13 28.323 0.3 . 1 . . . . . 41 GLU CB . 50784 1
135 . 1 . 1 43 43 GLU N N 15 115.098 0.3 . 1 . . . . . 41 GLU N . 50784 1
136 . 1 . 1 44 44 GLU H H 1 8.705 0.020 . 1 . . . . . 42 GLU H . 50784 1
137 . 1 . 1 44 44 GLU CA C 13 58.399 0.3 . 1 . . . . . 42 GLU CA . 50784 1
138 . 1 . 1 44 44 GLU CB C 13 30.242 0.3 . 1 . . . . . 42 GLU CB . 50784 1
139 . 1 . 1 44 44 GLU N N 15 124.550 0.3 . 1 . . . . . 42 GLU N . 50784 1
140 . 1 . 1 45 45 SER H H 1 7.965 0.020 . 1 . . . . . 43 SER H . 50784 1
141 . 1 . 1 45 45 SER CA C 13 55.498 0.3 . 1 . . . . . 43 SER CA . 50784 1
142 . 1 . 1 45 45 SER CB C 13 67.856 0.3 . 1 . . . . . 43 SER CB . 50784 1
143 . 1 . 1 45 45 SER N N 15 116.539 0.3 . 1 . . . . . 43 SER N . 50784 1
144 . 1 . 1 46 46 ILE H H 1 8.589 0.020 . 1 . . . . . 44 ILE H . 50784 1
145 . 1 . 1 46 46 ILE CA C 13 61.257 0.3 . 1 . . . . . 44 ILE CA . 50784 1
146 . 1 . 1 46 46 ILE CB C 13 41.700 0.3 . 1 . . . . . 44 ILE CB . 50784 1
147 . 1 . 1 46 46 ILE N N 15 121.864 0.3 . 1 . . . . . 44 ILE N . 50784 1
148 . 1 . 1 47 47 MET H H 1 8.615 0.020 . 1 . . . . . 45 MET H . 50784 1
149 . 1 . 1 47 47 MET CA C 13 54.418 0.3 . 1 . . . . . 45 MET CA . 50784 1
150 . 1 . 1 47 47 MET CB C 13 36.781 0.3 . 1 . . . . . 45 MET CB . 50784 1
151 . 1 . 1 47 47 MET N N 15 127.485 0.3 . 1 . . . . . 45 MET N . 50784 1
152 . 1 . 1 48 48 ASN H H 1 9.247 0.020 . 1 . . . . . 46 ASN H . 50784 1
153 . 1 . 1 48 48 ASN CA C 13 51.299 0.3 . 1 . . . . . 46 ASN CA . 50784 1
154 . 1 . 1 48 48 ASN CB C 13 37.381 0.3 . 1 . . . . . 46 ASN CB . 50784 1
155 . 1 . 1 48 48 ASN N N 15 122.815 0.3 . 1 . . . . . 46 ASN N . 50784 1
156 . 1 . 1 49 49 LYS H H 1 8.273 0.020 . 1 . . . . . 47 LYS H . 50784 1
157 . 1 . 1 49 49 LYS CA C 13 60.477 0.3 . 1 . . . . . 47 LYS CA . 50784 1
158 . 1 . 1 49 49 LYS CB C 13 32.222 0.3 . 1 . . . . . 47 LYS CB . 50784 1
159 . 1 . 1 49 49 LYS N N 15 119.600 0.3 . 1 . . . . . 47 LYS N . 50784 1
160 . 1 . 1 50 50 GLU H H 1 8.103 0.020 . 1 . . . . . 48 GLU H . 50784 1
161 . 1 . 1 50 50 GLU CA C 13 60.225 0.3 . 1 . . . . . 48 GLU CA . 50784 1
162 . 1 . 1 50 50 GLU CB C 13 28.923 0.3 . 1 . . . . . 48 GLU CB . 50784 1
163 . 1 . 1 50 50 GLU N N 15 119.343 0.3 . 1 . . . . . 48 GLU N . 50784 1
164 . 1 . 1 51 51 GLU H H 1 8.777 0.020 . 1 . . . . . 49 GLU H . 50784 1
165 . 1 . 1 51 51 GLU CA C 13 58.497 0.3 . 1 . . . . . 49 GLU CA . 50784 1
166 . 1 . 1 51 51 GLU CB C 13 29.522 0.3 . 1 . . . . . 49 GLU CB . 50784 1
167 . 1 . 1 51 51 GLU N N 15 121.668 0.3 . 1 . . . . . 49 GLU N . 50784 1
168 . 1 . 1 52 52 SER H H 1 9.125 0.020 . 1 . . . . . 50 SER H . 50784 1
169 . 1 . 1 52 52 SER CA C 13 61.677 0.3 . 1 . . . . . 50 SER CA . 50784 1
170 . 1 . 1 52 52 SER CB C 13 62.817 0.3 . 1 . . . . . 50 SER CB . 50784 1
171 . 1 . 1 52 52 SER N N 15 117.997 0.3 . 1 . . . . . 50 SER N . 50784 1
172 . 1 . 1 53 53 ASP H H 1 8.640 0.020 . 1 . . . . . 51 ASP H . 50784 1
173 . 1 . 1 53 53 ASP CA C 13 57.598 0.3 . 1 . . . . . 51 ASP CA . 50784 1
174 . 1 . 1 53 53 ASP CB C 13 39.661 0.3 . 1 . . . . . 51 ASP CB . 50784 1
175 . 1 . 1 53 53 ASP N N 15 122.922 0.3 . 1 . . . . . 51 ASP N . 50784 1
176 . 1 . 1 54 54 ALA H H 1 7.835 0.020 . 1 . . . . . 52 ALA H . 50784 1
177 . 1 . 1 54 54 ALA CA C 13 55.260 0.3 . 1 . . . . . 52 ALA CA . 50784 1
178 . 1 . 1 54 54 ALA CB C 13 17.944 0.3 . 1 . . . . . 52 ALA CB . 50784 1
179 . 1 . 1 54 54 ALA N N 15 123.718 0.3 . 1 . . . . . 52 ALA N . 50784 1
180 . 1 . 1 55 55 PHE H H 1 8.154 0.020 . 1 . . . . . 53 PHE H . 50784 1
181 . 1 . 1 55 55 PHE CA C 13 61.257 0.3 . 1 . . . . . 53 PHE CA . 50784 1
182 . 1 . 1 55 55 PHE CB C 13 39.661 0.3 . 1 . . . . . 53 PHE CB . 50784 1
183 . 1 . 1 55 55 PHE N N 15 120.793 0.3 . 1 . . . . . 53 PHE N . 50784 1
184 . 1 . 1 56 56 MET H H 1 8.924 0.020 . 1 . . . . . 54 MET H . 50784 1
185 . 1 . 1 56 56 MET CA C 13 56.218 0.3 . 1 . . . . . 54 MET CA . 50784 1
186 . 1 . 1 56 56 MET CB C 13 30.542 0.3 . 1 . . . . . 54 MET CB . 50784 1
187 . 1 . 1 56 56 MET N N 15 117.038 0.3 . 1 . . . . . 54 MET N . 50784 1
188 . 1 . 1 57 57 ALA H H 1 8.164 0.020 . 1 . . . . . 55 ALA H . 50784 1
189 . 1 . 1 57 57 ALA CA C 13 55.447 0.3 . 1 . . . . . 55 ALA CA . 50784 1
190 . 1 . 1 57 57 ALA CB C 13 17.644 0.3 . 1 . . . . . 55 ALA CB . 50784 1
191 . 1 . 1 57 57 ALA N N 15 122.164 0.3 . 1 . . . . . 55 ALA N . 50784 1
192 . 1 . 1 58 58 GLN H H 1 7.228 0.020 . 1 . . . . . 56 GLN H . 50784 1
193 . 1 . 1 58 58 GLN CA C 13 59.577 0.3 . 1 . . . . . 56 GLN CA . 50784 1
194 . 1 . 1 58 58 GLN CB C 13 29.282 0.3 . 1 . . . . . 56 GLN CB . 50784 1
195 . 1 . 1 58 58 GLN N N 15 117.632 0.3 . 1 . . . . . 56 GLN N . 50784 1
196 . 1 . 1 59 59 VAL H H 1 7.796 0.020 . 1 . . . . . 57 VAL H . 50784 1
197 . 1 . 1 59 59 VAL CA C 13 67.136 0.3 . 1 . . . . . 57 VAL CA . 50784 1
198 . 1 . 1 59 59 VAL CB C 13 31.682 0.3 . 1 . . . . . 57 VAL CB . 50784 1
199 . 1 . 1 59 59 VAL N N 15 122.853 0.3 . 1 . . . . . 57 VAL N . 50784 1
200 . 1 . 1 60 60 LYS H H 1 8.695 0.020 . 1 . . . . . 58 LYS H . 50784 1
201 . 1 . 1 60 60 LYS CA C 13 60.357 0.3 . 1 . . . . . 58 LYS CA . 50784 1
202 . 1 . 1 60 60 LYS CB C 13 31.982 0.3 . 1 . . . . . 58 LYS CB . 50784 1
203 . 1 . 1 60 60 LYS N N 15 118.648 0.3 . 1 . . . . . 58 LYS N . 50784 1
204 . 1 . 1 61 61 ALA H H 1 7.510 0.020 . 1 . . . . . 59 ALA H . 50784 1
205 . 1 . 1 61 61 ALA CA C 13 54.838 0.3 . 1 . . . . . 59 ALA CA . 50784 1
206 . 1 . 1 61 61 ALA CB C 13 17.824 0.3 . 1 . . . . . 59 ALA CB . 50784 1
207 . 1 . 1 61 61 ALA N N 15 121.253 0.3 . 1 . . . . . 59 ALA N . 50784 1
208 . 1 . 1 62 62 PHE H H 1 7.768 0.020 . 1 . . . . . 60 PHE H . 50784 1
209 . 1 . 1 62 62 PHE CA C 13 60.777 0.3 . 1 . . . . . 60 PHE CA . 50784 1
210 . 1 . 1 62 62 PHE CB C 13 38.521 0.3 . 1 . . . . . 60 PHE CB . 50784 1
211 . 1 . 1 62 62 PHE N N 15 120.182 0.3 . 1 . . . . . 60 PHE N . 50784 1
212 . 1 . 1 63 63 ARG H H 1 8.560 0.020 . 1 . . . . . 61 ARG H . 50784 1
213 . 1 . 1 63 63 ARG CA C 13 60.020 0.3 . 1 . . . . . 61 ARG CA . 50784 1
214 . 1 . 1 63 63 ARG CB C 13 30.362 0.3 . 1 . . . . . 61 ARG CB . 50784 1
215 . 1 . 1 63 63 ARG N N 15 118.388 0.3 . 1 . . . . . 61 ARG N . 50784 1
216 . 1 . 1 64 64 ALA H H 1 7.792 0.020 . 1 . . . . . 62 ALA H . 50784 1
217 . 1 . 1 64 64 ALA CA C 13 54.838 0.3 . 1 . . . . . 62 ALA CA . 50784 1
218 . 1 . 1 64 64 ALA CB C 13 17.644 0.3 . 1 . . . . . 62 ALA CB . 50784 1
219 . 1 . 1 64 64 ALA N N 15 118.498 0.3 . 1 . . . . . 62 ALA N . 50784 1
220 . 1 . 1 65 65 SER H H 1 7.625 0.020 . 1 . . . . . 63 SER H . 50784 1
221 . 1 . 1 65 65 SER CA C 13 61.437 0.3 . 1 . . . . . 63 SER CA . 50784 1
222 . 1 . 1 65 65 SER CB C 13 62.877 0.3 . 1 . . . . . 63 SER CB . 50784 1
223 . 1 . 1 65 65 SER N N 15 115.352 0.3 . 1 . . . . . 63 SER N . 50784 1
224 . 1 . 1 66 66 VAL H H 1 7.722 0.020 . 1 . . . . . 64 VAL H . 50784 1
225 . 1 . 1 66 66 VAL CA C 13 65.696 0.3 . 1 . . . . . 64 VAL CA . 50784 1
226 . 1 . 1 66 66 VAL CB C 13 31.802 0.3 . 1 . . . . . 64 VAL CB . 50784 1
227 . 1 . 1 66 66 VAL N N 15 122.862 0.3 . 1 . . . . . 64 VAL N . 50784 1
228 . 1 . 1 67 67 ASN H H 1 8.402 0.020 . 1 . . . . . 65 ASN H . 50784 1
229 . 1 . 1 67 67 ASN CA C 13 54.898 0.3 . 1 . . . . . 65 ASN CA . 50784 1
230 . 1 . 1 67 67 ASN CB C 13 38.101 0.3 . 1 . . . . . 65 ASN CB . 50784 1
231 . 1 . 1 67 67 ASN N N 15 118.793 0.3 . 1 . . . . . 65 ASN N . 50784 1
232 . 1 . 1 68 68 ALA H H 1 7.639 0.020 . 1 . . . . . 66 ALA H . 50784 1
233 . 1 . 1 68 68 ALA CA C 13 53.218 0.3 . 1 . . . . . 66 ALA CA . 50784 1
234 . 1 . 1 68 68 ALA CB C 13 18.604 0.3 . 1 . . . . . 66 ALA CB . 50784 1
235 . 1 . 1 68 68 ALA N N 15 120.961 0.3 . 1 . . . . . 66 ALA N . 50784 1
236 . 1 . 1 69 69 GLU H H 1 7.630 0.020 . 1 . . . . . 67 GLU H . 50784 1
237 . 1 . 1 69 69 GLU CA C 13 57.267 0.3 . 1 . . . . . 67 GLU CA . 50784 1
238 . 1 . 1 69 69 GLU CB C 13 30.182 0.3 . 1 . . . . . 67 GLU CB . 50784 1
239 . 1 . 1 69 69 GLU N N 15 117.638 0.3 . 1 . . . . . 67 GLU N . 50784 1
240 . 1 . 1 70 70 THR H H 1 7.881 0.020 . 1 . . . . . 68 THR H . 50784 1
241 . 1 . 1 70 70 THR CA C 13 62.037 0.3 . 1 . . . . . 68 THR CA . 50784 1
242 . 1 . 1 70 70 THR CB C 13 69.896 0.3 . 1 . . . . . 68 THR CB . 50784 1
243 . 1 . 1 70 70 THR N N 15 113.942 0.3 . 1 . . . . . 68 THR N . 50784 1
244 . 1 . 1 71 71 VAL H H 1 7.922 0.020 . 1 . . . . . 69 VAL H . 50784 1
245 . 1 . 1 71 71 VAL CA C 13 61.977 0.3 . 1 . . . . . 69 VAL CA . 50784 1
246 . 1 . 1 71 71 VAL CB C 13 32.702 0.3 . 1 . . . . . 69 VAL CB . 50784 1
247 . 1 . 1 71 71 VAL N N 15 122.585 0.3 . 1 . . . . . 69 VAL N . 50784 1
248 . 1 . 1 72 72 ALA H H 1 8.283 0.020 . 1 . . . . . 70 ALA H . 50784 1
249 . 1 . 1 72 72 ALA CA C 13 50.579 0.3 . 1 . . . . . 70 ALA CA . 50784 1
250 . 1 . 1 72 72 ALA CB C 13 18.004 0.3 . 1 . . . . . 70 ALA CB . 50784 1
251 . 1 . 1 72 72 ALA N N 15 129.248 0.3 . 1 . . . . . 70 ALA N . 50784 1
252 . 1 . 1 74 74 GLU H H 1 8.473 0.020 . 1 . . . . . 72 GLU H . 50784 1
253 . 1 . 1 74 74 GLU CA C 13 57.178 0.3 . 1 . . . . . 72 GLU CA . 50784 1
254 . 1 . 1 74 74 GLU CB C 13 29.882 0.3 . 1 . . . . . 72 GLU CB . 50784 1
255 . 1 . 1 74 74 GLU N N 15 119.735 0.3 . 1 . . . . . 72 GLU N . 50784 1
256 . 1 . 1 75 75 PHE H H 1 8.031 0.020 . 1 . . . . . 73 PHE H . 50784 1
257 . 1 . 1 75 75 PHE CA C 13 57.267 0.3 . 1 . . . . . 73 PHE CA . 50784 1
258 . 1 . 1 75 75 PHE CB C 13 39.601 0.3 . 1 . . . . . 73 PHE CB . 50784 1
259 . 1 . 1 75 75 PHE N N 15 120.381 0.3 . 1 . . . . . 73 PHE N . 50784 1
260 . 1 . 1 76 76 ILE H H 1 7.815 0.020 . 1 . . . . . 74 ILE H . 50784 1
261 . 1 . 1 76 76 ILE CA C 13 60.791 0.3 . 1 . . . . . 74 ILE CA . 50784 1
262 . 1 . 1 76 76 ILE CB C 13 38.701 0.3 . 1 . . . . . 74 ILE CB . 50784 1
263 . 1 . 1 76 76 ILE N N 15 123.439 0.3 . 1 . . . . . 74 ILE N . 50784 1
264 . 1 . 1 77 77 VAL H H 1 8.143 0.020 . 1 . . . . . 75 VAL H . 50784 1
265 . 1 . 1 77 77 VAL CA C 13 62.747 0.3 . 1 . . . . . 75 VAL CA . 50784 1
266 . 1 . 1 77 77 VAL CB C 13 32.522 0.3 . 1 . . . . . 75 VAL CB . 50784 1
267 . 1 . 1 77 77 VAL N N 15 126.294 0.3 . 1 . . . . . 75 VAL N . 50784 1
268 . 1 . 1 78 78 LYS H H 1 7.880 0.020 . 1 . . . . . 76 LYS H . 50784 1
269 . 1 . 1 78 78 LYS CA C 13 57.598 0.3 . 1 . . . . . 76 LYS CA . 50784 1
270 . 1 . 1 78 78 LYS CB C 13 33.842 0.3 . 1 . . . . . 76 LYS CB . 50784 1
271 . 1 . 1 78 78 LYS N N 15 131.165 0.3 . 1 . . . . . 76 LYS N . 50784 1
stop_
save_