Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 12026
_Assigned_chem_shift_list.ID 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 $chemical_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' 1 $sample_1 isotropic 12026 1
2 '3D HNCO' 1 $sample_1 isotropic 12026 1
3 '3D HN(CA)CO' 1 $sample_1 isotropic 12026 1
4 '3D CBCA(CO)NH' 1 $sample_1 isotropic 12026 1
5 '3D HNCACB' 1 $sample_1 isotropic 12026 1
6 '3D HNCA' 1 $sample_1 isotropic 12026 1
7 '3D HN(CO)CA' 1 $sample_1 isotropic 12026 1
8 '3D (H)CC(CO)NH' 1 $sample_1 isotropic 12026 1
9 '3D 15N NOESY-HSQC' 1 $sample_1 isotropic 12026 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_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 8.259 0.030 . 1 . . . . . 1 GLY H . 12026 1
2 . 1 1 1 1 GLY C C 13 172.859 0.300 . 1 . . . . . 1 GLY C . 12026 1
3 . 1 1 1 1 GLY CA C 13 45.103 0.300 . 1 . . . . . 1 GLY CA . 12026 1
4 . 1 1 1 1 GLY N N 15 109.241 0.300 . 1 . . . . . 1 GLY N . 12026 1
5 . 1 1 2 2 PRO C C 13 177.060 0.300 . 1 . . . . . 2 PRO C . 12026 1
6 . 1 1 2 2 PRO CA C 13 63.209 0.300 . 1 . . . . . 2 PRO CA . 12026 1
7 . 1 1 2 2 PRO CB C 13 32.229 0.300 . 1 . . . . . 2 PRO CB . 12026 1
8 . 1 1 3 3 LEU H H 1 8.543 0.030 . 1 . . . . . 3 LEU H . 12026 1
9 . 1 1 3 3 LEU C C 13 177.967 0.300 . 1 . . . . . 3 LEU C . 12026 1
10 . 1 1 3 3 LEU CA C 13 55.468 0.300 . 1 . . . . . 3 LEU CA . 12026 1
11 . 1 1 3 3 LEU CB C 13 42.188 0.300 . 1 . . . . . 3 LEU CB . 12026 1
12 . 1 1 3 3 LEU N N 15 122.450 0.300 . 1 . . . . . 3 LEU N . 12026 1
13 . 1 1 4 4 GLY H H 1 8.416 0.030 . 1 . . . . . 4 GLY H . 12026 1
14 . 1 1 4 4 GLY C C 13 173.912 0.300 . 1 . . . . . 4 GLY C . 12026 1
15 . 1 1 4 4 GLY CA C 13 45.104 0.300 . 1 . . . . . 4 GLY CA . 12026 1
16 . 1 1 4 4 GLY N N 15 109.784 0.300 . 1 . . . . . 4 GLY N . 12026 1
17 . 1 1 5 5 SER H H 1 8.134 0.030 . 1 . . . . . 5 SER H . 12026 1
18 . 1 1 5 5 SER C C 13 172.652 0.300 . 1 . . . . . 5 SER C . 12026 1
19 . 1 1 5 5 SER CA C 13 56.574 0.300 . 1 . . . . . 5 SER CA . 12026 1
20 . 1 1 5 5 SER CB C 13 63.199 0.300 . 1 . . . . . 5 SER CB . 12026 1
21 . 1 1 5 5 SER N N 15 116.952 0.300 . 1 . . . . . 5 SER N . 12026 1
22 . 1 1 6 6 PRO C C 13 176.766 0.300 . 1 . . . . . 6 PRO C . 12026 1
23 . 1 1 6 6 PRO CA C 13 63.080 0.300 . 1 . . . . . 6 PRO CA . 12026 1
24 . 1 1 6 6 PRO CB C 13 31.931 0.300 . 1 . . . . . 6 PRO CB . 12026 1
25 . 1 1 7 7 GLU H H 1 8.447 0.030 . 1 . . . . . 7 GLU H . 12026 1
26 . 1 1 7 7 GLU C C 13 174.668 0.300 . 1 . . . . . 7 GLU C . 12026 1
27 . 1 1 7 7 GLU CA C 13 54.409 0.300 . 1 . . . . . 7 GLU CA . 12026 1
28 . 1 1 7 7 GLU CB C 13 29.817 0.300 . 1 . . . . . 7 GLU CB . 12026 1
29 . 1 1 7 7 GLU N N 15 122.963 0.300 . 1 . . . . . 7 GLU N . 12026 1
30 . 1 1 8 8 PRO C C 13 176.343 0.300 . 1 . . . . . 8 PRO C . 12026 1
31 . 1 1 8 8 PRO CA C 13 62.980 0.300 . 1 . . . . . 8 PRO CA . 12026 1
32 . 1 1 8 8 PRO CB C 13 31.931 0.300 . 1 . . . . . 8 PRO CB . 12026 1
33 . 1 1 9 9 VAL H H 1 8.209 0.030 . 1 . . . . . 9 VAL H . 12026 1
34 . 1 1 9 9 VAL C C 13 175.629 0.300 . 1 . . . . . 9 VAL C . 12026 1
35 . 1 1 9 9 VAL CA C 13 62.195 0.300 . 1 . . . . . 9 VAL CA . 12026 1
36 . 1 1 9 9 VAL CB C 13 32.773 0.300 . 1 . . . . . 9 VAL CB . 12026 1
37 . 1 1 9 9 VAL N N 15 121.087 0.300 . 1 . . . . . 9 VAL N . 12026 1
38 . 1 1 10 10 GLY H H 1 7.941 0.030 . 1 . . . . . 10 GLY H . 12026 1
39 . 1 1 10 10 GLY C C 13 172.096 0.300 . 1 . . . . . 10 GLY C . 12026 1
40 . 1 1 10 10 GLY CA C 13 44.759 0.300 . 1 . . . . . 10 GLY CA . 12026 1
41 . 1 1 10 10 GLY N N 15 111.703 0.300 . 1 . . . . . 10 GLY N . 12026 1
42 . 1 1 11 11 TRP H H 1 7.612 0.030 . 1 . . . . . 11 TRP H . 12026 1
43 . 1 1 11 11 TRP C C 13 174.892 0.300 . 1 . . . . . 11 TRP C . 12026 1
44 . 1 1 11 11 TRP CA C 13 52.462 0.300 . 1 . . . . . 11 TRP CA . 12026 1
45 . 1 1 11 11 TRP CB C 13 28.508 0.300 . 1 . . . . . 11 TRP CB . 12026 1
46 . 1 1 11 11 TRP N N 15 115.125 0.300 . 1 . . . . . 11 TRP N . 12026 1
47 . 1 1 12 12 GLN H H 1 8.885 0.030 . 1 . . . . . 12 GLN H . 12026 1
48 . 1 1 12 12 GLN C C 13 175.322 0.300 . 1 . . . . . 12 GLN C . 12026 1
49 . 1 1 12 12 GLN CA C 13 55.126 0.300 . 1 . . . . . 12 GLN CA . 12026 1
50 . 1 1 12 12 GLN CB C 13 28.923 0.300 . 1 . . . . . 12 GLN CB . 12026 1
51 . 1 1 12 12 GLN N N 15 125.028 0.300 . 1 . . . . . 12 GLN N . 12026 1
52 . 1 1 13 13 CYS H H 1 9.020 0.030 . 1 . . . . . 13 CYS H . 12026 1
53 . 1 1 13 13 CYS CA C 13 57.608 0.300 . 1 . . . . . 13 CYS CA . 12026 1
54 . 1 1 13 13 CYS N N 15 133.700 0.300 . 1 . . . . . 13 CYS N . 12026 1
55 . 1 1 14 14 PRO C C 13 176.852 0.300 . 1 . . . . . 14 PRO C . 12026 1
56 . 1 1 14 14 PRO CA C 13 63.960 0.300 . 1 . . . . . 14 PRO CA . 12026 1
57 . 1 1 14 14 PRO CB C 13 32.229 0.300 . 1 . . . . . 14 PRO CB . 12026 1
58 . 1 1 15 15 GLY H H 1 9.659 0.030 . 1 . . . . . 15 GLY H . 12026 1
59 . 1 1 15 15 GLY C C 13 173.716 0.300 . 1 . . . . . 15 GLY C . 12026 1
60 . 1 1 15 15 GLY CA C 13 46.189 0.300 . 1 . . . . . 15 GLY CA . 12026 1
61 . 1 1 15 15 GLY N N 15 111.038 0.300 . 1 . . . . . 15 GLY N . 12026 1
62 . 1 1 16 16 CYS H H 1 8.517 0.030 . 1 . . . . . 16 CYS H . 12026 1
63 . 1 1 16 16 CYS C C 13 176.566 0.300 . 1 . . . . . 16 CYS C . 12026 1
64 . 1 1 16 16 CYS CA C 13 58.913 0.300 . 1 . . . . . 16 CYS CA . 12026 1
65 . 1 1 16 16 CYS N N 15 121.547 0.300 . 1 . . . . . 16 CYS N . 12026 1
66 . 1 1 17 17 THR H H 1 7.515 0.030 . 1 . . . . . 17 THR H . 12026 1
67 . 1 1 17 17 THR C C 13 172.426 0.300 . 1 . . . . . 17 THR C . 12026 1
68 . 1 1 17 17 THR CA C 13 65.721 0.300 . 1 . . . . . 17 THR CA . 12026 1
69 . 1 1 17 17 THR CB C 13 69.066 0.300 . 1 . . . . . 17 THR CB . 12026 1
70 . 1 1 17 17 THR N N 15 113.878 0.300 . 1 . . . . . 17 THR N . 12026 1
71 . 1 1 18 18 PHE H H 1 9.037 0.030 . 1 . . . . . 18 PHE H . 12026 1
72 . 1 1 18 18 PHE C C 13 174.464 0.300 . 1 . . . . . 18 PHE C . 12026 1
73 . 1 1 18 18 PHE CA C 13 60.294 0.300 . 1 . . . . . 18 PHE CA . 12026 1
74 . 1 1 18 18 PHE CB C 13 41.591 0.300 . 1 . . . . . 18 PHE CB . 12026 1
75 . 1 1 18 18 PHE N N 15 126.472 0.300 . 1 . . . . . 18 PHE N . 12026 1
76 . 1 1 19 19 ILE H H 1 7.189 0.030 . 1 . . . . . 19 ILE H . 12026 1
77 . 1 1 19 19 ILE CA C 13 60.774 0.300 . 1 . . . . . 19 ILE CA . 12026 1
78 . 1 1 19 19 ILE N N 15 125.904 0.300 . 1 . . . . . 19 ILE N . 12026 1
79 . 1 1 22 22 PRO C C 13 175.933 0.300 . 1 . . . . . 22 PRO C . 12026 1
80 . 1 1 22 22 PRO CA C 13 66.532 0.300 . 1 . . . . . 22 PRO CA . 12026 1
81 . 1 1 23 23 THR H H 1 6.844 0.030 . 1 . . . . . 23 THR H . 12026 1
82 . 1 1 23 23 THR C C 13 175.248 0.300 . 1 . . . . . 23 THR C . 12026 1
83 . 1 1 23 23 THR CA C 13 61.291 0.300 . 1 . . . . . 23 THR CA . 12026 1
84 . 1 1 23 23 THR CB C 13 68.602 0.300 . 1 . . . . . 23 THR CB . 12026 1
85 . 1 1 23 23 THR N N 15 96.548 0.300 . 1 . . . . . 23 THR N . 12026 1
86 . 1 1 24 24 ARG H H 1 8.240 0.030 . 1 . . . . . 24 ARG H . 12026 1
87 . 1 1 24 24 ARG CA C 13 54.376 0.300 . 1 . . . . . 24 ARG CA . 12026 1
88 . 1 1 24 24 ARG N N 15 127.541 0.300 . 1 . . . . . 24 ARG N . 12026 1
89 . 1 1 25 25 PRO C C 13 176.672 0.300 . 1 . . . . . 25 PRO C . 12026 1
90 . 1 1 25 25 PRO CA C 13 64.353 0.300 . 1 . . . . . 25 PRO CA . 12026 1
91 . 1 1 26 26 GLY H H 1 7.317 0.030 . 1 . . . . . 26 GLY H . 12026 1
92 . 1 1 26 26 GLY C C 13 172.535 0.300 . 1 . . . . . 26 GLY C . 12026 1
93 . 1 1 26 26 GLY CA C 13 44.199 0.300 . 1 . . . . . 26 GLY CA . 12026 1
94 . 1 1 26 26 GLY N N 15 109.712 0.300 . 1 . . . . . 26 GLY N . 12026 1
95 . 1 1 27 27 CYS H H 1 9.727 0.030 . 1 . . . . . 27 CYS H . 12026 1
96 . 1 1 27 27 CYS C C 13 177.932 0.300 . 1 . . . . . 27 CYS C . 12026 1
97 . 1 1 27 27 CYS CA C 13 59.461 0.300 . 1 . . . . . 27 CYS CA . 12026 1
98 . 1 1 27 27 CYS N N 15 125.692 0.300 . 1 . . . . . 27 CYS N . 12026 1
99 . 1 1 28 28 GLU H H 1 9.266 0.030 . 1 . . . . . 28 GLU H . 12026 1
100 . 1 1 28 28 GLU C C 13 175.514 0.300 . 1 . . . . . 28 GLU C . 12026 1
101 . 1 1 28 28 GLU CA C 13 59.156 0.300 . 1 . . . . . 28 GLU CA . 12026 1
102 . 1 1 28 28 GLU N N 15 132.679 0.300 . 1 . . . . . 28 GLU N . 12026 1
103 . 1 1 29 29 MET H H 1 9.118 0.030 . 1 . . . . . 29 MET H . 12026 1
104 . 1 1 29 29 MET C C 13 177.664 0.300 . 1 . . . . . 29 MET C . 12026 1
105 . 1 1 29 29 MET CA C 13 55.111 0.300 . 1 . . . . . 29 MET CA . 12026 1
106 . 1 1 29 29 MET CB C 13 31.965 0.300 . 1 . . . . . 29 MET CB . 12026 1
107 . 1 1 29 29 MET N N 15 116.372 0.300 . 1 . . . . . 29 MET N . 12026 1
108 . 1 1 30 30 CYS H H 1 8.259 0.030 . 1 . . . . . 30 CYS H . 12026 1
109 . 1 1 30 30 CYS C C 13 176.713 0.300 . 1 . . . . . 30 CYS C . 12026 1
110 . 1 1 30 30 CYS CA C 13 59.530 0.300 . 1 . . . . . 30 CYS CA . 12026 1
111 . 1 1 30 30 CYS N N 15 118.078 0.300 . 1 . . . . . 30 CYS N . 12026 1
112 . 1 1 31 31 CYS H H 1 7.851 0.030 . 1 . . . . . 31 CYS H . 12026 1
113 . 1 1 31 31 CYS C C 13 172.296 0.300 . 1 . . . . . 31 CYS C . 12026 1
114 . 1 1 31 31 CYS CA C 13 62.487 0.300 . 1 . . . . . 31 CYS CA . 12026 1
115 . 1 1 31 31 CYS N N 15 113.428 0.300 . 1 . . . . . 31 CYS N . 12026 1
116 . 1 1 32 32 ARG H H 1 8.572 0.030 . 1 . . . . . 32 ARG H . 12026 1
117 . 1 1 32 32 ARG C C 13 175.950 0.300 . 1 . . . . . 32 ARG C . 12026 1
118 . 1 1 32 32 ARG CA C 13 57.597 0.300 . 1 . . . . . 32 ARG CA . 12026 1
119 . 1 1 32 32 ARG CB C 13 31.312 0.300 . 1 . . . . . 32 ARG CB . 12026 1
120 . 1 1 32 32 ARG N N 15 124.813 0.300 . 1 . . . . . 32 ARG N . 12026 1
121 . 1 1 33 33 ALA H H 1 8.685 0.030 . 1 . . . . . 33 ALA H . 12026 1
122 . 1 1 33 33 ALA C C 13 176.304 0.300 . 1 . . . . . 33 ALA C . 12026 1
123 . 1 1 33 33 ALA CA C 13 53.128 0.300 . 1 . . . . . 33 ALA CA . 12026 1
124 . 1 1 33 33 ALA CB C 13 19.388 0.300 . 1 . . . . . 33 ALA CB . 12026 1
125 . 1 1 33 33 ALA N N 15 126.771 0.300 . 1 . . . . . 33 ALA N . 12026 1
126 . 1 1 34 34 ARG H H 1 6.953 0.030 . 1 . . . . . 34 ARG H . 12026 1
127 . 1 1 34 34 ARG CA C 13 53.213 0.300 . 1 . . . . . 34 ARG CA . 12026 1
128 . 1 1 34 34 ARG N N 15 122.968 0.300 . 1 . . . . . 34 ARG N . 12026 1
129 . 1 1 35 35 PRO C C 13 178.412 0.300 . 1 . . . . . 35 PRO C . 12026 1
130 . 1 1 35 35 PRO CA C 13 63.437 0.300 . 1 . . . . . 35 PRO CA . 12026 1
131 . 1 1 36 36 GLU H H 1 9.235 0.030 . 1 . . . . . 36 GLU H . 12026 1
132 . 1 1 36 36 GLU C C 13 176.634 0.300 . 1 . . . . . 36 GLU C . 12026 1
133 . 1 1 36 36 GLU CA C 13 58.978 0.300 . 1 . . . . . 36 GLU CA . 12026 1
134 . 1 1 36 36 GLU CB C 13 29.255 0.300 . 1 . . . . . 36 GLU CB . 12026 1
135 . 1 1 36 36 GLU N N 15 125.476 0.300 . 1 . . . . . 36 GLU N . 12026 1
136 . 1 1 37 37 THR H H 1 7.261 0.030 . 1 . . . . . 37 THR H . 12026 1
137 . 1 1 37 37 THR C C 13 174.899 0.300 . 1 . . . . . 37 THR C . 12026 1
138 . 1 1 37 37 THR CA C 13 61.383 0.300 . 1 . . . . . 37 THR CA . 12026 1
139 . 1 1 37 37 THR CB C 13 68.796 0.300 . 1 . . . . . 37 THR CB . 12026 1
140 . 1 1 37 37 THR N N 15 104.221 0.300 . 1 . . . . . 37 THR N . 12026 1
141 . 1 1 38 38 TYR H H 1 7.171 0.030 . 1 . . . . . 38 TYR H . 12026 1
142 . 1 1 38 38 TYR C C 13 174.254 0.300 . 1 . . . . . 38 TYR C . 12026 1
143 . 1 1 38 38 TYR CA C 13 59.108 0.300 . 1 . . . . . 38 TYR CA . 12026 1
144 . 1 1 38 38 TYR CB C 13 37.994 0.300 . 1 . . . . . 38 TYR CB . 12026 1
145 . 1 1 38 38 TYR N N 15 122.890 0.300 . 1 . . . . . 38 TYR N . 12026 1
146 . 1 1 39 39 GLN H H 1 7.694 0.030 . 1 . . . . . 39 GLN H . 12026 1
147 . 1 1 39 39 GLN C C 13 173.750 0.300 . 1 . . . . . 39 GLN C . 12026 1
148 . 1 1 39 39 GLN CA C 13 53.340 0.300 . 1 . . . . . 39 GLN CA . 12026 1
149 . 1 1 39 39 GLN CB C 13 29.722 0.300 . 1 . . . . . 39 GLN CB . 12026 1
150 . 1 1 39 39 GLN N N 15 128.801 0.300 . 1 . . . . . 39 GLN N . 12026 1
151 . 1 1 40 40 ILE H H 1 8.276 0.030 . 1 . . . . . 40 ILE H . 12026 1
152 . 1 1 40 40 ILE C C 13 174.973 0.300 . 1 . . . . . 40 ILE C . 12026 1
153 . 1 1 40 40 ILE CA C 13 59.902 0.300 . 1 . . . . . 40 ILE CA . 12026 1
154 . 1 1 40 40 ILE N N 15 126.532 0.300 . 1 . . . . . 40 ILE N . 12026 1
155 . 1 1 41 41 PRO C C 13 177.848 0.300 . 1 . . . . . 41 PRO C . 12026 1
156 . 1 1 41 41 PRO CA C 13 63.110 0.300 . 1 . . . . . 41 PRO CA . 12026 1
157 . 1 1 41 41 PRO CB C 13 32.154 0.300 . 1 . . . . . 41 PRO CB . 12026 1
158 . 1 1 42 42 ALA H H 1 8.766 0.030 . 1 . . . . . 42 ALA H . 12026 1
159 . 1 1 42 42 ALA C C 13 178.647 0.300 . 1 . . . . . 42 ALA C . 12026 1
160 . 1 1 42 42 ALA CA C 13 54.607 0.300 . 1 . . . . . 42 ALA CA . 12026 1
161 . 1 1 42 42 ALA CB C 13 18.390 0.300 . 1 . . . . . 42 ALA CB . 12026 1
162 . 1 1 42 42 ALA N N 15 127.195 0.300 . 1 . . . . . 42 ALA N . 12026 1
163 . 1 1 43 43 SER H H 1 8.055 0.030 . 1 . . . . . 43 SER H . 12026 1
164 . 1 1 43 43 SER C C 13 174.727 0.300 . 1 . . . . . 43 SER C . 12026 1
165 . 1 1 43 43 SER CA C 13 58.279 0.300 . 1 . . . . . 43 SER CA . 12026 1
166 . 1 1 43 43 SER CB C 13 63.139 0.300 . 1 . . . . . 43 SER CB . 12026 1
167 . 1 1 43 43 SER N N 15 108.847 0.300 . 1 . . . . . 43 SER N . 12026 1
168 . 1 1 44 44 TYR H H 1 7.627 0.030 . 1 . . . . . 44 TYR H . 12026 1
169 . 1 1 44 44 TYR C C 13 174.593 0.300 . 1 . . . . . 44 TYR C . 12026 1
170 . 1 1 44 44 TYR CA C 13 59.075 0.300 . 1 . . . . . 44 TYR CA . 12026 1
171 . 1 1 44 44 TYR CB C 13 38.764 0.300 . 1 . . . . . 44 TYR CB . 12026 1
172 . 1 1 44 44 TYR N N 15 122.097 0.300 . 1 . . . . . 44 TYR N . 12026 1
173 . 1 1 45 45 GLN H H 1 7.814 0.030 . 1 . . . . . 45 GLN H . 12026 1
174 . 1 1 45 45 GLN C C 13 180.540 0.300 . 1 . . . . . 45 GLN C . 12026 1
175 . 1 1 45 45 GLN CA C 13 51.953 0.300 . 1 . . . . . 45 GLN CA . 12026 1
176 . 1 1 45 45 GLN CB C 13 29.285 0.300 . 1 . . . . . 45 GLN CB . 12026 1
177 . 1 1 45 45 GLN N N 15 127.990 0.300 . 1 . . . . . 45 GLN N . 12026 1
178 . 1 1 46 46 PRO C C 13 176.388 0.300 . 1 . . . . . 46 PRO C . 12026 1
179 . 1 1 46 46 PRO CA C 13 62.522 0.300 . 1 . . . . . 46 PRO CA . 12026 1
180 . 1 1 46 46 PRO CB C 13 32.127 0.300 . 1 . . . . . 46 PRO CB . 12026 1
181 . 1 1 47 47 ASP H H 1 7.968 0.030 . 1 . . . . . 47 ASP H . 12026 1
182 . 1 1 47 47 ASP C C 13 175.520 0.300 . 1 . . . . . 47 ASP C . 12026 1
183 . 1 1 47 47 ASP CA C 13 53.193 0.300 . 1 . . . . . 47 ASP CA . 12026 1
184 . 1 1 47 47 ASP CB C 13 41.001 0.300 . 1 . . . . . 47 ASP CB . 12026 1
185 . 1 1 47 47 ASP N N 15 120.744 0.300 . 1 . . . . . 47 ASP N . 12026 1
186 . 1 1 48 48 GLU H H 1 8.719 0.030 . 1 . . . . . 48 GLU H . 12026 1
187 . 1 1 48 48 GLU C C 13 178.963 0.300 . 1 . . . . . 48 GLU C . 12026 1
188 . 1 1 48 48 GLU CA C 13 60.277 0.300 . 1 . . . . . 48 GLU CA . 12026 1
189 . 1 1 48 48 GLU CB C 13 29.572 0.300 . 1 . . . . . 48 GLU CB . 12026 1
190 . 1 1 48 48 GLU N N 15 118.489 0.300 . 1 . . . . . 48 GLU N . 12026 1
191 . 1 1 49 49 GLU H H 1 8.365 0.030 . 1 . . . . . 49 GLU H . 12026 1
192 . 1 1 49 49 GLU C C 13 179.488 0.300 . 1 . . . . . 49 GLU C . 12026 1
193 . 1 1 49 49 GLU CA C 13 59.752 0.300 . 1 . . . . . 49 GLU CA . 12026 1
194 . 1 1 49 49 GLU CB C 13 29.668 0.300 . 1 . . . . . 49 GLU CB . 12026 1
195 . 1 1 49 49 GLU N N 15 120.369 0.300 . 1 . . . . . 49 GLU N . 12026 1
196 . 1 1 50 50 GLU H H 1 8.451 0.030 . 1 . . . . . 50 GLU H . 12026 1
197 . 1 1 50 50 GLU C C 13 178.628 0.300 . 1 . . . . . 50 GLU C . 12026 1
198 . 1 1 50 50 GLU CA C 13 58.456 0.300 . 1 . . . . . 50 GLU CA . 12026 1
199 . 1 1 50 50 GLU N N 15 123.199 0.300 . 1 . . . . . 50 GLU N . 12026 1
200 . 1 1 51 51 ARG H H 1 9.054 0.030 . 1 . . . . . 51 ARG H . 12026 1
201 . 1 1 51 51 ARG C C 13 179.434 0.300 . 1 . . . . . 51 ARG C . 12026 1
202 . 1 1 51 51 ARG CA C 13 60.076 0.300 . 1 . . . . . 51 ARG CA . 12026 1
203 . 1 1 51 51 ARG N N 15 119.812 0.300 . 1 . . . . . 51 ARG N . 12026 1
204 . 1 1 52 52 ALA H H 1 7.948 0.030 . 1 . . . . . 52 ALA H . 12026 1
205 . 1 1 52 52 ALA C C 13 180.497 0.300 . 1 . . . . . 52 ALA C . 12026 1
206 . 1 1 52 52 ALA CA C 13 55.003 0.300 . 1 . . . . . 52 ALA CA . 12026 1
207 . 1 1 52 52 ALA CB C 13 17.881 0.300 . 1 . . . . . 52 ALA CB . 12026 1
208 . 1 1 52 52 ALA N N 15 121.957 0.300 . 1 . . . . . 52 ALA N . 12026 1
209 . 1 1 53 53 ARG H H 1 8.060 0.030 . 1 . . . . . 53 ARG H . 12026 1
210 . 1 1 53 53 ARG C C 13 180.083 0.300 . 1 . . . . . 53 ARG C . 12026 1
211 . 1 1 53 53 ARG CA C 13 59.644 0.300 . 1 . . . . . 53 ARG CA . 12026 1
212 . 1 1 53 53 ARG N N 15 122.064 0.300 . 1 . . . . . 53 ARG N . 12026 1
213 . 1 1 54 54 LEU H H 1 8.652 0.030 . 1 . . . . . 54 LEU H . 12026 1
214 . 1 1 54 54 LEU C C 13 179.622 0.300 . 1 . . . . . 54 LEU C . 12026 1
215 . 1 1 54 54 LEU CA C 13 57.807 0.300 . 1 . . . . . 54 LEU CA . 12026 1
216 . 1 1 54 54 LEU CB C 13 41.894 0.300 . 1 . . . . . 54 LEU CB . 12026 1
217 . 1 1 54 54 LEU N N 15 121.090 0.300 . 1 . . . . . 54 LEU N . 12026 1
218 . 1 1 55 55 ALA H H 1 8.178 0.030 . 1 . . . . . 55 ALA H . 12026 1
219 . 1 1 55 55 ALA C C 13 180.703 0.300 . 1 . . . . . 55 ALA C . 12026 1
220 . 1 1 55 55 ALA CA C 13 54.818 0.300 . 1 . . . . . 55 ALA CA . 12026 1
221 . 1 1 55 55 ALA CB C 13 17.949 0.300 . 1 . . . . . 55 ALA CB . 12026 1
222 . 1 1 55 55 ALA N N 15 122.325 0.300 . 1 . . . . . 55 ALA N . 12026 1
223 . 1 1 56 56 GLY H H 1 8.139 0.030 . 1 . . . . . 56 GLY H . 12026 1
224 . 1 1 56 56 GLY C C 13 176.462 0.300 . 1 . . . . . 56 GLY C . 12026 1
225 . 1 1 56 56 GLY CA C 13 46.624 0.300 . 1 . . . . . 56 GLY CA . 12026 1
226 . 1 1 56 56 GLY N N 15 106.471 0.300 . 1 . . . . . 56 GLY N . 12026 1
227 . 1 1 57 57 GLU H H 1 8.014 0.030 . 1 . . . . . 57 GLU H . 12026 1
228 . 1 1 57 57 GLU C C 13 177.958 0.300 . 1 . . . . . 57 GLU C . 12026 1
229 . 1 1 57 57 GLU CA C 13 58.884 0.300 . 1 . . . . . 57 GLU CA . 12026 1
230 . 1 1 57 57 GLU CB C 13 30.120 0.300 . 1 . . . . . 57 GLU CB . 12026 1
231 . 1 1 57 57 GLU N N 15 122.895 0.300 . 1 . . . . . 57 GLU N . 12026 1
232 . 1 1 58 58 GLU H H 1 8.031 0.030 . 1 . . . . . 58 GLU H . 12026 1
233 . 1 1 58 58 GLU C C 13 178.667 0.300 . 1 . . . . . 58 GLU C . 12026 1
234 . 1 1 58 58 GLU CA C 13 58.750 0.300 . 1 . . . . . 58 GLU CA . 12026 1
235 . 1 1 58 58 GLU CB C 13 29.610 0.300 . 1 . . . . . 58 GLU CB . 12026 1
236 . 1 1 58 58 GLU N N 15 119.445 0.300 . 1 . . . . . 58 GLU N . 12026 1
237 . 1 1 59 59 GLU H H 1 8.125 0.030 . 1 . . . . . 59 GLU H . 12026 1
238 . 1 1 59 59 GLU C C 13 178.056 0.300 . 1 . . . . . 59 GLU C . 12026 1
239 . 1 1 59 59 GLU CA C 13 58.363 0.300 . 1 . . . . . 59 GLU CA . 12026 1
240 . 1 1 59 59 GLU CB C 13 29.732 0.300 . 1 . . . . . 59 GLU CB . 12026 1
241 . 1 1 59 59 GLU N N 15 120.022 0.300 . 1 . . . . . 59 GLU N . 12026 1
242 . 1 1 60 60 ALA H H 1 7.948 0.030 . 1 . . . . . 60 ALA H . 12026 1
243 . 1 1 60 60 ALA C C 13 179.457 0.300 . 1 . . . . . 60 ALA C . 12026 1
244 . 1 1 60 60 ALA CA C 13 54.184 0.300 . 1 . . . . . 60 ALA CA . 12026 1
245 . 1 1 60 60 ALA CB C 13 18.662 0.300 . 1 . . . . . 60 ALA CB . 12026 1
246 . 1 1 60 60 ALA N N 15 121.964 0.300 . 1 . . . . . 60 ALA N . 12026 1
247 . 1 1 61 61 LEU H H 1 7.828 0.030 . 1 . . . . . 61 LEU H . 12026 1
248 . 1 1 61 61 LEU C C 13 178.358 0.300 . 1 . . . . . 61 LEU C . 12026 1
249 . 1 1 61 61 LEU CA C 13 56.242 0.300 . 1 . . . . . 61 LEU CA . 12026 1
250 . 1 1 61 61 LEU CB C 13 41.642 0.300 . 1 . . . . . 61 LEU CB . 12026 1
251 . 1 1 61 61 LEU N N 15 118.147 0.300 . 1 . . . . . 61 LEU N . 12026 1
252 . 1 1 62 62 ARG H H 1 7.785 0.030 . 1 . . . . . 62 ARG H . 12026 1
253 . 1 1 62 62 ARG C C 13 177.473 0.300 . 1 . . . . . 62 ARG C . 12026 1
254 . 1 1 62 62 ARG CA C 13 57.896 0.300 . 1 . . . . . 62 ARG CA . 12026 1
255 . 1 1 62 62 ARG CB C 13 30.220 0.300 . 1 . . . . . 62 ARG CB . 12026 1
256 . 1 1 62 62 ARG N N 15 119.447 0.300 . 1 . . . . . 62 ARG N . 12026 1
257 . 1 1 63 63 GLN H H 1 7.918 0.030 . 1 . . . . . 63 GLN H . 12026 1
258 . 1 1 63 63 GLN C C 13 176.049 0.300 . 1 . . . . . 63 GLN C . 12026 1
259 . 1 1 63 63 GLN CA C 13 56.568 0.300 . 1 . . . . . 63 GLN CA . 12026 1
260 . 1 1 63 63 GLN CB C 13 29.112 0.300 . 1 . . . . . 63 GLN CB . 12026 1
261 . 1 1 63 63 GLN N N 15 117.578 0.300 . 1 . . . . . 63 GLN N . 12026 1
262 . 1 1 64 64 TYR H H 1 7.793 0.030 . 1 . . . . . 64 TYR H . 12026 1
263 . 1 1 64 64 TYR C C 13 175.241 0.300 . 1 . . . . . 64 TYR C . 12026 1
264 . 1 1 64 64 TYR CA C 13 58.108 0.300 . 1 . . . . . 64 TYR CA . 12026 1
265 . 1 1 64 64 TYR CB C 13 38.748 0.300 . 1 . . . . . 64 TYR CB . 12026 1
266 . 1 1 64 64 TYR N N 15 119.499 0.300 . 1 . . . . . 64 TYR N . 12026 1
267 . 1 1 65 65 GLN H H 1 7.969 0.030 . 1 . . . . . 65 GLN H . 12026 1
268 . 1 1 65 65 GLN C C 13 174.648 0.300 . 1 . . . . . 65 GLN C . 12026 1
269 . 1 1 65 65 GLN CA C 13 55.842 0.300 . 1 . . . . . 65 GLN CA . 12026 1
270 . 1 1 65 65 GLN CB C 13 29.684 0.300 . 1 . . . . . 65 GLN CB . 12026 1
271 . 1 1 65 65 GLN N N 15 121.647 0.300 . 1 . . . . . 65 GLN N . 12026 1
272 . 1 1 66 66 GLN H H 1 7.806 0.030 . 1 . . . . . 66 GLN H . 12026 1
273 . 1 1 66 66 GLN C C 13 180.573 0.300 . 1 . . . . . 66 GLN C . 12026 1
274 . 1 1 66 66 GLN CA C 13 57.478 0.300 . 1 . . . . . 66 GLN CA . 12026 1
275 . 1 1 66 66 GLN CB C 13 30.413 0.300 . 1 . . . . . 66 GLN CB . 12026 1
276 . 1 1 66 66 GLN N N 15 126.235 0.300 . 1 . . . . . 66 GLN N . 12026 1
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