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 16893
_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' . . . 16893 1
2 '3D HNCO' . . . 16893 1
3 '3D HNCA' . . . 16893 1
4 '3D HNCACB' . . . 16893 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 $CARA . . 16893 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.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 5 5 ASP H H 1 8.169 0.020 . 1 . . . . 14 ASP H . 16893 1
2 . 1 1 5 5 ASP C C 13 175.966 0.3 . 1 . . . . 14 ASP C . 16893 1
3 . 1 1 5 5 ASP CA C 13 53.949 0.3 . 1 . . . . 14 ASP CA . 16893 1
4 . 1 1 5 5 ASP CB C 13 40.823 0.3 . 1 . . . . 14 ASP CB . 16893 1
5 . 1 1 5 5 ASP N N 15 122.094 0.3 . 1 . . . . 14 ASP N . 16893 1
6 . 1 1 6 6 SER H H 1 8.097 0.020 . 1 . . . . 15 SER H . 16893 1
7 . 1 1 6 6 SER CA C 13 58.419 0.3 . 1 . . . . 15 SER CA . 16893 1
8 . 1 1 6 6 SER CB C 13 62.947 0.3 . 1 . . . . 15 SER CB . 16893 1
9 . 1 1 6 6 SER N N 15 116.621 0.3 . 1 . . . . 15 SER N . 16893 1
10 . 1 1 7 7 ALA H H 1 8.109 0.020 . 1 . . . . 16 ALA H . 16893 1
11 . 1 1 7 7 ALA C C 13 177.455 0.3 . 1 . . . . 16 ALA C . 16893 1
12 . 1 1 7 7 ALA CA C 13 52.378 0.3 . 1 . . . . 16 ALA CA . 16893 1
13 . 1 1 7 7 ALA CB C 13 18.366 0.3 . 1 . . . . 16 ALA CB . 16893 1
14 . 1 1 7 7 ALA N N 15 125.501 0.3 . 1 . . . . 16 ALA N . 16893 1
15 . 1 1 8 8 SER H H 1 7.902 0.020 . 1 . . . . 17 SER H . 16893 1
16 . 1 1 8 8 SER C C 13 173.919 0.3 . 1 . . . . 17 SER C . 16893 1
17 . 1 1 8 8 SER CA C 13 58.103 0.3 . 1 . . . . 17 SER CA . 16893 1
18 . 1 1 8 8 SER CB C 13 62.939 0.3 . 1 . . . . 17 SER CB . 16893 1
19 . 1 1 8 8 SER N N 15 114.23 0.3 . 1 . . . . 17 SER N . 16893 1
20 . 1 1 9 9 ARG H H 1 7.931 0.020 . 1 . . . . 18 ARG H . 16893 1
21 . 1 1 9 9 ARG C C 13 175.383 0.3 . 1 . . . . 18 ARG C . 16893 1
22 . 1 1 9 9 ARG CA C 13 55.461 0.3 . 1 . . . . 18 ARG CA . 16893 1
23 . 1 1 9 9 ARG CB C 13 30.261 0.3 . 1 . . . . 18 ARG CB . 16893 1
24 . 1 1 9 9 ARG N N 15 122.544 0.3 . 1 . . . . 18 ARG N . 16893 1
25 . 1 1 10 10 ILE H H 1 7.865 0.020 . 1 . . . . 19 ILE H . 16893 1
26 . 1 1 10 10 ILE C C 13 175.203 0.3 . 1 . . . . 19 ILE C . 16893 1
27 . 1 1 10 10 ILE CA C 13 60.211 0.3 . 1 . . . . 19 ILE CA . 16893 1
28 . 1 1 10 10 ILE CB C 13 37.821 0.3 . 1 . . . . 19 ILE CB . 16893 1
29 . 1 1 10 10 ILE N N 15 121.495 0.3 . 1 . . . . 19 ILE N . 16893 1
30 . 1 1 11 11 SER H H 1 8.133 0.020 . 1 . . . . 20 SER H . 16893 1
31 . 1 1 11 11 SER CA C 13 55.517 0.3 . 1 . . . . 20 SER CA . 16893 1
32 . 1 1 11 11 SER CB C 13 62.824 0.3 . 1 . . . . 20 SER CB . 16893 1
33 . 1 1 11 11 SER N N 15 121.209 0.3 . 1 . . . . 20 SER N . 16893 1
34 . 1 1 12 12 PRO C C 13 176.931 0.3 . 1 . . . . 21 PRO C . 16893 1
35 . 1 1 12 12 PRO CA C 13 63.288 0.3 . 1 . . . . 21 PRO CA . 16893 1
36 . 1 1 12 12 PRO CB C 13 30.929 0.3 . 1 . . . . 21 PRO CB . 16893 1
37 . 1 1 13 13 GLY H H 1 8.218 0.020 . 1 . . . . 22 GLY H . 16893 1
38 . 1 1 13 13 GLY C C 13 173.612 0.3 . 1 . . . . 22 GLY C . 16893 1
39 . 1 1 13 13 GLY CA C 13 44.599 0.3 . 1 . . . . 22 GLY CA . 16893 1
40 . 1 1 13 13 GLY N N 15 108.47 0.3 . 1 . . . . 22 GLY N . 16893 1
41 . 1 1 14 14 GLN H H 1 7.857 0.020 . 1 . . . . 23 GLN H . 16893 1
42 . 1 1 14 14 GLN C C 13 175.587 0.3 . 1 . . . . 23 GLN C . 16893 1
43 . 1 1 14 14 GLN CA C 13 55.414 0.3 . 1 . . . . 23 GLN CA . 16893 1
44 . 1 1 14 14 GLN CB C 13 29.039 0.3 . 1 . . . . 23 GLN CB . 16893 1
45 . 1 1 14 14 GLN N N 15 119.811 0.3 . 1 . . . . 23 GLN N . 16893 1
46 . 1 1 15 15 ILE H H 1 7.973 0.020 . 1 . . . . 24 ILE H . 16893 1
47 . 1 1 15 15 ILE C C 13 175.128 0.3 . 1 . . . . 24 ILE C . 16893 1
48 . 1 1 15 15 ILE CA C 13 60.632 0.3 . 1 . . . . 24 ILE CA . 16893 1
49 . 1 1 15 15 ILE CB C 13 38.233 0.3 . 1 . . . . 24 ILE CB . 16893 1
50 . 1 1 15 15 ILE N N 15 120.837 0.3 . 1 . . . . 24 ILE N . 16893 1
51 . 1 1 16 16 ASN H H 1 8.234 0.020 . 1 . . . . 25 ASN H . 16893 1
52 . 1 1 16 16 ASN C C 13 174.27 0.3 . 1 . . . . 25 ASN C . 16893 1
53 . 1 1 16 16 ASN CA C 13 52.947 0.3 . 1 . . . . 25 ASN CA . 16893 1
54 . 1 1 16 16 ASN CB C 13 38.488 0.3 . 1 . . . . 25 ASN CB . 16893 1
55 . 1 1 16 16 ASN N N 15 121.578 0.3 . 1 . . . . 25 ASN N . 16893 1
56 . 1 1 17 17 GLN H H 1 8.091 0.020 . 1 . . . . 26 GLN H . 16893 1
57 . 1 1 17 17 GLN C C 13 174.709 0.3 . 1 . . . . 26 GLN C . 16893 1
58 . 1 1 17 17 GLN CA C 13 55.026 0.3 . 1 . . . . 26 GLN CA . 16893 1
59 . 1 1 17 17 GLN CB C 13 31.151 0.3 . 1 . . . . 26 GLN CB . 16893 1
60 . 1 1 17 17 GLN N N 15 119.561 0.3 . 1 . . . . 26 GLN N . 16893 1
61 . 1 1 18 18 VAL H H 1 9.282 0.020 . 1 . . . . 27 VAL H . 16893 1
62 . 1 1 18 18 VAL C C 13 173.216 0.3 . 1 . . . . 27 VAL C . 16893 1
63 . 1 1 18 18 VAL CA C 13 58.503 0.3 . 1 . . . . 27 VAL CA . 16893 1
64 . 1 1 18 18 VAL CB C 13 34.628 0.3 . 1 . . . . 27 VAL CB . 16893 1
65 . 1 1 18 18 VAL N N 15 115.167 0.3 . 1 . . . . 27 VAL N . 16893 1
66 . 1 1 19 19 ARG H H 1 8.733 0.020 . 1 . . . . 28 ARG H . 16893 1
67 . 1 1 19 19 ARG CA C 13 51.909 0.3 . 1 . . . . 28 ARG CA . 16893 1
68 . 1 1 19 19 ARG CB C 13 32.307 0.3 . 1 . . . . 28 ARG CB . 16893 1
69 . 1 1 19 19 ARG N N 15 122.603 0.3 . 1 . . . . 28 ARG N . 16893 1
70 . 1 1 20 20 PRO C C 13 175.777 0.3 . 1 . . . . 29 PRO C . 16893 1
71 . 1 1 20 20 PRO CA C 13 61.391 0.3 . 1 . . . . 29 PRO CA . 16893 1
72 . 1 1 20 20 PRO CB C 13 31.87 0.3 . 1 . . . . 29 PRO CB . 16893 1
73 . 1 1 21 21 LYS H H 1 8.249 0.020 . 1 . . . . 30 LYS H . 16893 1
74 . 1 1 21 21 LYS C C 13 176.786 0.3 . 1 . . . . 30 LYS C . 16893 1
75 . 1 1 21 21 LYS CA C 13 56.542 0.3 . 1 . . . . 30 LYS CA . 16893 1
76 . 1 1 21 21 LYS CB C 13 33.529 0.3 . 1 . . . . 30 LYS CB . 16893 1
77 . 1 1 21 21 LYS N N 15 121.241 0.3 . 1 . . . . 30 LYS N . 16893 1
78 . 1 1 22 22 LEU H H 1 8.454 0.020 . 1 . . . . 31 LEU H . 16893 1
79 . 1 1 22 22 LEU CA C 13 59.351 0.3 . 1 . . . . 31 LEU CA . 16893 1
80 . 1 1 22 22 LEU CB C 13 39.044 0.3 . 1 . . . . 31 LEU CB . 16893 1
81 . 1 1 22 22 LEU N N 15 122.106 0.3 . 1 . . . . 31 LEU N . 16893 1
82 . 1 1 23 23 PRO C C 13 177.612 0.3 . 1 . . . . 32 PRO C . 16893 1
83 . 1 1 24 24 LEU H H 1 6.475 0.020 . 1 . . . . 33 LEU H . 16893 1
84 . 1 1 24 24 LEU C C 13 177.088 0.3 . 1 . . . . 33 LEU C . 16893 1
85 . 1 1 24 24 LEU CA C 13 55.367 0.3 . 1 . . . . 33 LEU CA . 16893 1
86 . 1 1 24 24 LEU CB C 13 40.686 0.3 . 1 . . . . 33 LEU CB . 16893 1
87 . 1 1 24 24 LEU N N 15 113.758 0.3 . 1 . . . . 33 LEU N . 16893 1
88 . 1 1 25 25 LEU H H 1 8.258 0.020 . 1 . . . . 34 LEU H . 16893 1
89 . 1 1 25 25 LEU C C 13 176.936 0.3 . 1 . . . . 34 LEU C . 16893 1
90 . 1 1 25 25 LEU CA C 13 57.359 0.3 . 1 . . . . 34 LEU CA . 16893 1
91 . 1 1 25 25 LEU CB C 13 40.823 0.3 . 1 . . . . 34 LEU CB . 16893 1
92 . 1 1 25 25 LEU N N 15 122.267 0.3 . 1 . . . . 34 LEU N . 16893 1
93 . 1 1 26 26 LYS H H 1 7.898 0.020 . 1 . . . . 35 LYS H . 16893 1
94 . 1 1 26 26 LYS C C 13 179.643 0.3 . 1 . . . . 35 LYS C . 16893 1
95 . 1 1 26 26 LYS CA C 13 59.244 0.3 . 1 . . . . 35 LYS CA . 16893 1
96 . 1 1 26 26 LYS CB C 13 31.291 0.3 . 1 . . . . 35 LYS CB . 16893 1
97 . 1 1 26 26 LYS N N 15 115.766 0.3 . 1 . . . . 35 LYS N . 16893 1
98 . 1 1 27 27 ILE H H 1 6.626 0.020 . 1 . . . . 36 ILE H . 16893 1
99 . 1 1 27 27 ILE C C 13 175.845 0.3 . 1 . . . . 36 ILE C . 16893 1
100 . 1 1 27 27 ILE CA C 13 63.541 0.3 . 1 . . . . 36 ILE CA . 16893 1
101 . 1 1 27 27 ILE CB C 13 36.492 0.3 . 1 . . . . 36 ILE CB . 16893 1
102 . 1 1 27 27 ILE N N 15 120.681 0.3 . 1 . . . . 36 ILE N . 16893 1
103 . 1 1 28 28 LEU H H 1 7.537 0.020 . 1 . . . . 37 LEU H . 16893 1
104 . 1 1 28 28 LEU C C 13 179.574 0.3 . 1 . . . . 37 LEU C . 16893 1
105 . 1 1 28 28 LEU CA C 13 57.014 0.3 . 1 . . . . 37 LEU CA . 16893 1
106 . 1 1 28 28 LEU CB C 13 38.505 0.3 . 1 . . . . 37 LEU CB . 16893 1
107 . 1 1 28 28 LEU N N 15 117.534 0.3 . 1 . . . . 37 LEU N . 16893 1
108 . 1 1 29 29 HIS H H 1 8.843 0.020 . 1 . . . . 38 HIS H . 16893 1
109 . 1 1 29 29 HIS C C 13 179.278 0.3 . 1 . . . . 38 HIS C . 16893 1
110 . 1 1 29 29 HIS CA C 13 56.552 0.3 . 1 . . . . 38 HIS CA . 16893 1
111 . 1 1 29 29 HIS CB C 13 29.483 0.3 . 1 . . . . 38 HIS CB . 16893 1
112 . 1 1 29 29 HIS N N 15 118.315 0.3 . 1 . . . . 38 HIS N . 16893 1
113 . 1 1 30 30 ALA H H 1 7.848 0.020 . 1 . . . . 39 ALA H . 16893 1
114 . 1 1 30 30 ALA C C 13 178.046 0.3 . 1 . . . . 39 ALA C . 16893 1
115 . 1 1 30 30 ALA CA C 13 54.228 0.3 . 1 . . . . 39 ALA CA . 16893 1
116 . 1 1 30 30 ALA CB C 13 16.92 0.3 . 1 . . . . 39 ALA CB . 16893 1
117 . 1 1 30 30 ALA N N 15 124.613 0.3 . 1 . . . . 39 ALA N . 16893 1
118 . 1 1 31 31 ALA H H 1 7.514 0.020 . 1 . . . . 40 ALA H . 16893 1
119 . 1 1 31 31 ALA C C 13 175.571 0.3 . 1 . . . . 40 ALA C . 16893 1
120 . 1 1 31 31 ALA CA C 13 51.192 0.3 . 1 . . . . 40 ALA CA . 16893 1
121 . 1 1 31 31 ALA CB C 13 20.256 0.3 . 1 . . . . 40 ALA CB . 16893 1
122 . 1 1 31 31 ALA N N 15 118.671 0.3 . 1 . . . . 40 ALA N . 16893 1
123 . 1 1 32 32 GLY H H 1 7.545 0.020 . 1 . . . . 41 GLY H . 16893 1
124 . 1 1 32 32 GLY C C 13 173.829 0.3 . 1 . . . . 41 GLY C . 16893 1
125 . 1 1 32 32 GLY CA C 13 44.059 0.3 . 1 . . . . 41 GLY CA . 16893 1
126 . 1 1 32 32 GLY N N 15 104.531 0.3 . 1 . . . . 41 GLY N . 16893 1
127 . 1 1 33 33 ALA H H 1 7.45 0.020 . 1 . . . . 42 ALA H . 16893 1
128 . 1 1 33 33 ALA C C 13 175.399 0.3 . 1 . . . . 42 ALA C . 16893 1
129 . 1 1 33 33 ALA CA C 13 51.856 0.3 . 1 . . . . 42 ALA CA . 16893 1
130 . 1 1 33 33 ALA CB C 13 18.699 0.3 . 1 . . . . 42 ALA CB . 16893 1
131 . 1 1 33 33 ALA N N 15 124.155 0.3 . 1 . . . . 42 ALA N . 16893 1
132 . 1 1 34 34 GLN H H 1 8.427 0.020 . 1 . . . . 43 GLN H . 16893 1
133 . 1 1 34 34 GLN C C 13 174.913 0.3 . 1 . . . . 43 GLN C . 16893 1
134 . 1 1 34 34 GLN CA C 13 53.754 0.3 . 1 . . . . 43 GLN CA . 16893 1
135 . 1 1 34 34 GLN CB C 13 31.484 0.3 . 1 . . . . 43 GLN CB . 16893 1
136 . 1 1 34 34 GLN N N 15 118.232 0.3 . 1 . . . . 43 GLN N . 16893 1
137 . 1 1 35 35 GLY H H 1 8.413 0.020 . 1 . . . . 44 GLY H . 16893 1
138 . 1 1 35 35 GLY C C 13 173.552 0.3 . 1 . . . . 44 GLY C . 16893 1
139 . 1 1 35 35 GLY CA C 13 43.756 0.3 . 1 . . . . 44 GLY CA . 16893 1
140 . 1 1 35 35 GLY N N 15 108.728 0.3 . 1 . . . . 44 GLY N . 16893 1
141 . 1 1 36 36 GLU H H 1 8.16 0.020 . 1 . . . . 45 GLU H . 16893 1
142 . 1 1 36 36 GLU C C 13 173.52 0.3 . 1 . . . . 45 GLU C . 16893 1
143 . 1 1 36 36 GLU CA C 13 55.983 0.3 . 1 . . . . 45 GLU CA . 16893 1
144 . 1 1 36 36 GLU CB C 13 32.263 0.3 . 1 . . . . 45 GLU CB . 16893 1
145 . 1 1 36 36 GLU N N 15 115.178 0.3 . 1 . . . . 45 GLU N . 16893 1
146 . 1 1 37 37 MET H H 1 6.721 0.020 . 1 . . . . 46 MET H . 16893 1
147 . 1 1 37 37 MET C C 13 174.037 0.3 . 1 . . . . 46 MET C . 16893 1
148 . 1 1 37 37 MET CA C 13 53.326 0.3 . 1 . . . . 46 MET CA . 16893 1
149 . 1 1 37 37 MET CB C 13 34.82 0.3 . 1 . . . . 46 MET CB . 16893 1
150 . 1 1 37 37 MET N N 15 116.107 0.3 . 1 . . . . 46 MET N . 16893 1
151 . 1 1 38 38 PHE H H 1 8.465 0.020 . 1 . . . . 47 PHE H . 16893 1
152 . 1 1 38 38 PHE C C 13 175.152 0.3 . 1 . . . . 47 PHE C . 16893 1
153 . 1 1 38 38 PHE CA C 13 56.471 0.3 . 1 . . . . 47 PHE CA . 16893 1
154 . 1 1 38 38 PHE CB C 13 46.048 0.3 . 1 . . . . 47 PHE CB . 16893 1
155 . 1 1 38 38 PHE N N 15 119.307 0.3 . 1 . . . . 47 PHE N . 16893 1
156 . 1 1 39 39 THR H H 1 9.085 0.020 . 1 . . . . 48 THR H . 16893 1
157 . 1 1 39 39 THR C C 13 175.908 0.3 . 1 . . . . 48 THR C . 16893 1
158 . 1 1 39 39 THR CA C 13 60.254 0.3 . 1 . . . . 48 THR CA . 16893 1
159 . 1 1 39 39 THR CB C 13 70.132 0.3 . 1 . . . . 48 THR CB . 16893 1
160 . 1 1 39 39 THR N N 15 111.829 0.3 . 1 . . . . 48 THR N . 16893 1
161 . 1 1 40 40 VAL H H 1 8.953 0.020 . 1 . . . . 49 VAL H . 16893 1
162 . 1 1 40 40 VAL C C 13 177.094 0.3 . 1 . . . . 49 VAL C . 16893 1
163 . 1 1 40 40 VAL CA C 13 67.503 0.3 . 1 . . . . 49 VAL CA . 16893 1
164 . 1 1 40 40 VAL CB C 13 30.321 0.3 . 1 . . . . 49 VAL CB . 16893 1
165 . 1 1 40 40 VAL N N 15 122.421 0.3 . 1 . . . . 49 VAL N . 16893 1
166 . 1 1 41 41 LYS H H 1 8.052 0.020 . 1 . . . . 50 LYS H . 16893 1
167 . 1 1 41 41 LYS C C 13 179.409 0.3 . 1 . . . . 50 LYS C . 16893 1
168 . 1 1 41 41 LYS CA C 13 59.464 0.3 . 1 . . . . 50 LYS CA . 16893 1
169 . 1 1 41 41 LYS CB C 13 31.744 0.3 . 1 . . . . 50 LYS CB . 16893 1
170 . 1 1 41 41 LYS N N 15 118.904 0.3 . 1 . . . . 50 LYS N . 16893 1
171 . 1 1 42 42 GLU H H 1 7.79 0.020 . 1 . . . . 51 GLU H . 16893 1
172 . 1 1 42 42 GLU C C 13 178.102 0.3 . 1 . . . . 51 GLU C . 16893 1
173 . 1 1 42 42 GLU CA C 13 58.955 0.3 . 1 . . . . 51 GLU CA . 16893 1
174 . 1 1 42 42 GLU CB C 13 30.595 0.3 . 1 . . . . 51 GLU CB . 16893 1
175 . 1 1 42 42 GLU N N 15 120.402 0.3 . 1 . . . . 51 GLU N . 16893 1
176 . 1 1 43 43 VAL H H 1 8.237 0.020 . 1 . . . . 52 VAL H . 16893 1
177 . 1 1 43 43 VAL C C 13 177.14 0.3 . 1 . . . . 52 VAL C . 16893 1
178 . 1 1 43 43 VAL CA C 13 67.083 0.3 . 1 . . . . 52 VAL CA . 16893 1
179 . 1 1 43 43 VAL CB C 13 30.373 0.3 . 1 . . . . 52 VAL CB . 16893 1
180 . 1 1 43 43 VAL N N 15 119.701 0.3 . 1 . . . . 52 VAL N . 16893 1
181 . 1 1 44 44 MET H H 1 8.128 0.020 . 1 . . . . 53 MET H . 16893 1
182 . 1 1 44 44 MET C C 13 179.194 0.3 . 1 . . . . 53 MET C . 16893 1
183 . 1 1 44 44 MET CA C 13 56.647 0.3 . 1 . . . . 53 MET CA . 16893 1
184 . 1 1 44 44 MET CB C 13 29.087 0.3 . 1 . . . . 53 MET CB . 16893 1
185 . 1 1 44 44 MET N N 15 115.659 0.3 . 1 . . . . 53 MET N . 16893 1
186 . 1 1 45 45 HIS H H 1 8.085 0.020 . 1 . . . . 54 HIS H . 16893 1
187 . 1 1 45 45 HIS C C 13 177.973 0.3 . 1 . . . . 54 HIS C . 16893 1
188 . 1 1 45 45 HIS CA C 13 59.304 0.3 . 1 . . . . 54 HIS CA . 16893 1
189 . 1 1 45 45 HIS N N 15 121.751 0.3 . 1 . . . . 54 HIS N . 16893 1
190 . 1 1 46 46 TYR H H 1 8.479 0.020 . 1 . . . . 55 TYR H . 16893 1
191 . 1 1 46 46 TYR CA C 13 62.946 0.3 . 1 . . . . 55 TYR CA . 16893 1
192 . 1 1 46 46 TYR CB C 13 38.155 0.3 . 1 . . . . 55 TYR CB . 16893 1
193 . 1 1 46 46 TYR N N 15 118.412 0.3 . 1 . . . . 55 TYR N . 16893 1
194 . 1 1 47 47 LEU C C 13 178.116 0.3 . 1 . . . . 56 LEU C . 16893 1
195 . 1 1 47 47 LEU CA C 13 57.643 0.3 . 1 . . . . 56 LEU CA . 16893 1
196 . 1 1 48 48 GLY H H 1 7.663 0.020 . 1 . . . . 57 GLY H . 16893 1
197 . 1 1 48 48 GLY C C 13 176.421 0.3 . 1 . . . . 57 GLY C . 16893 1
198 . 1 1 48 48 GLY CA C 13 46.654 0.3 . 1 . . . . 57 GLY CA . 16893 1
199 . 1 1 48 48 GLY N N 15 105.294 0.3 . 1 . . . . 57 GLY N . 16893 1
200 . 1 1 49 49 GLN H H 1 7.775 0.020 . 1 . . . . 58 GLN H . 16893 1
201 . 1 1 49 49 GLN C C 13 177.542 0.3 . 1 . . . . 58 GLN C . 16893 1
202 . 1 1 49 49 GLN CA C 13 57.738 0.3 . 1 . . . . 58 GLN CA . 16893 1
203 . 1 1 49 49 GLN CB C 13 28.149 0.3 . 1 . . . . 58 GLN CB . 16893 1
204 . 1 1 49 49 GLN N N 15 121.094 0.3 . 1 . . . . 58 GLN N . 16893 1
205 . 1 1 50 50 TYR H H 1 8.486 0.020 . 1 . . . . 59 TYR H . 16893 1
206 . 1 1 50 50 TYR CA C 13 61.77 0.3 . 1 . . . . 59 TYR CA . 16893 1
207 . 1 1 50 50 TYR CB C 13 37.821 0.3 . 1 . . . . 59 TYR CB . 16893 1
208 . 1 1 50 50 TYR N N 15 121.645 0.3 . 1 . . . . 59 TYR N . 16893 1
209 . 1 1 51 51 ILE C C 13 176.594 0.3 . 1 . . . . 60 ILE C . 16893 1
210 . 1 1 51 51 ILE CA C 13 65.138 0.3 . 1 . . . . 60 ILE CA . 16893 1
211 . 1 1 51 51 ILE CB C 13 37.821 0.3 . 1 . . . . 60 ILE CB . 16893 1
212 . 1 1 52 52 MET H H 1 7.609 0.020 . 1 . . . . 61 MET H . 16893 1
213 . 1 1 52 52 MET CA C 13 59.067 0.3 . 1 . . . . 61 MET CA . 16893 1
214 . 1 1 52 52 MET CB C 13 32.707 0.3 . 1 . . . . 61 MET CB . 16893 1
215 . 1 1 52 52 MET N N 15 116.903 0.3 . 1 . . . . 61 MET N . 16893 1
216 . 1 1 53 53 VAL CA C 13 65.328 0.3 . 1 . . . . 62 VAL CA . 16893 1
217 . 1 1 53 53 VAL CB C 13 30.929 0.3 . 1 . . . . 62 VAL CB . 16893 1
218 . 1 1 54 54 LYS C C 13 174.338 0.3 . 1 . . . . 63 LYS C . 16893 1
219 . 1 1 55 55 GLN H H 1 7.522 0.020 . 1 . . . . 64 GLN H . 16893 1
220 . 1 1 55 55 GLN CA C 13 55.983 0.3 . 1 . . . . 64 GLN CA . 16893 1
221 . 1 1 55 55 GLN CB C 13 25.37 0.3 . 1 . . . . 64 GLN CB . 16893 1
222 . 1 1 55 55 GLN N N 15 115.842 0.3 . 1 . . . . 64 GLN N . 16893 1
223 . 1 1 56 56 LEU CA C 13 54.465 0.3 . 1 . . . . 65 LEU CA . 16893 1
224 . 1 1 56 56 LEU CB C 13 41.49 0.3 . 1 . . . . 65 LEU CB . 16893 1
225 . 1 1 57 57 TYR C C 13 175.3 0.3 . 1 . . . . 66 TYR C . 16893 1
226 . 1 1 58 58 ASP H H 1 8.207 0.020 . 1 . . . . 67 ASP H . 16893 1
227 . 1 1 58 58 ASP CA C 13 53.152 0.3 . 1 . . . . 67 ASP CA . 16893 1
228 . 1 1 58 58 ASP N N 15 126.525 0.3 . 1 . . . . 67 ASP N . 16893 1
229 . 1 1 59 59 GLN CA C 13 58.45 0.3 . 1 . . . . 68 GLN CA . 16893 1
230 . 1 1 59 59 GLN CB C 13 27.758 0.3 . 1 . . . . 68 GLN CB . 16893 1
231 . 1 1 60 60 GLN CA C 13 56.315 0.3 . 1 . . . . 69 GLN CA . 16893 1
232 . 1 1 60 60 GLN CB C 13 29.087 0.3 . 1 . . . . 69 GLN CB . 16893 1
233 . 1 1 61 61 GLU C C 13 175.243 0.3 . 1 . . . . 70 GLU C . 16893 1
234 . 1 1 62 62 GLN H H 1 8.065 0.020 . 1 . . . . 71 GLN H . 16893 1
235 . 1 1 62 62 GLN CA C 13 58.023 0.3 . 1 . . . . 71 GLN CA . 16893 1
236 . 1 1 62 62 GLN N N 15 119.799 0.3 . 1 . . . . 71 GLN N . 16893 1
237 . 1 1 63 63 HIS CA C 13 54.987 0.3 . 1 . . . . 72 HIS CA . 16893 1
238 . 1 1 63 63 HIS CB C 13 30.817 0.3 . 1 . . . . 72 HIS CB . 16893 1
239 . 1 1 64 64 MET CA C 13 52.163 0.3 . 1 . . . . 73 MET CA . 16893 1
240 . 1 1 64 64 MET CB C 13 30.15 0.3 . 1 . . . . 73 MET CB . 16893 1
241 . 1 1 65 65 VAL CA C 13 60.679 0.3 . 1 . . . . 74 VAL CA . 16893 1
242 . 1 1 65 65 VAL CB C 13 31.484 0.3 . 1 . . . . 74 VAL CB . 16893 1
243 . 1 1 66 66 TYR C C 13 176.126 0.3 . 1 . . . . 75 TYR C . 16893 1
244 . 1 1 66 66 TYR CA C 13 57.406 0.3 . 1 . . . . 75 TYR CA . 16893 1
245 . 1 1 67 67 CYS H H 1 8.184 0.020 . 1 . . . . 76 CYS H . 16893 1
246 . 1 1 67 67 CYS CA C 13 56.322 0.3 . 1 . . . . 76 CYS CA . 16893 1
247 . 1 1 67 67 CYS CB C 13 29.261 0.3 . 1 . . . . 76 CYS CB . 16893 1
248 . 1 1 67 67 CYS N N 15 117.1 0.3 . 1 . . . . 76 CYS N . 16893 1
249 . 1 1 68 68 GLY CA C 13 46.354 0.3 . 1 . . . . 77 GLY CA . 16893 1
250 . 1 1 69 69 GLY C C 13 172.332 0.3 . 1 . . . . 78 GLY C . 16893 1
251 . 1 1 69 69 GLY CA C 13 44.883 0.3 . 1 . . . . 78 GLY CA . 16893 1
252 . 1 1 70 70 ASP H H 1 7.627 0.020 . 1 . . . . 79 ASP H . 16893 1
253 . 1 1 70 70 ASP CA C 13 52.426 0.3 . 1 . . . . 79 ASP CA . 16893 1
254 . 1 1 70 70 ASP CB C 13 46.16 0.3 . 1 . . . . 79 ASP CB . 16893 1
255 . 1 1 70 70 ASP N N 15 120.272 0.3 . 1 . . . . 79 ASP N . 16893 1
256 . 1 1 71 71 LEU C C 13 178.501 0.3 . 1 . . . . 80 LEU C . 16893 1
257 . 1 1 71 71 LEU CA C 13 57.691 0.3 . 1 . . . . 80 LEU CA . 16893 1
258 . 1 1 71 71 LEU CB C 13 41.824 0.3 . 1 . . . . 80 LEU CB . 16893 1
259 . 1 1 72 72 LEU H H 1 9.802 0.020 . 1 . . . . 81 LEU H . 16893 1
260 . 1 1 72 72 LEU CA C 13 57.691 0.3 . 1 . . . . 81 LEU CA . 16893 1
261 . 1 1 72 72 LEU CB C 13 41.713 0.3 . 1 . . . . 81 LEU CB . 16893 1
262 . 1 1 72 72 LEU N N 15 119.118 0.3 . 1 . . . . 81 LEU N . 16893 1
263 . 1 1 73 73 GLY C C 13 176.213 0.3 . 1 . . . . 82 GLY C . 16893 1
264 . 1 1 73 73 GLY CA C 13 47.169 0.3 . 1 . . . . 82 GLY CA . 16893 1
265 . 1 1 74 74 GLU H H 1 7.385 0.020 . 1 . . . . 83 GLU H . 16893 1
266 . 1 1 74 74 GLU C C 13 178.517 0.3 . 1 . . . . 83 GLU C . 16893 1
267 . 1 1 74 74 GLU CA C 13 58.121 0.3 . 1 . . . . 83 GLU CA . 16893 1
268 . 1 1 74 74 GLU CB C 13 28.816 0.3 . 1 . . . . 83 GLU CB . 16893 1
269 . 1 1 74 74 GLU N N 15 122.219 0.3 . 1 . . . . 83 GLU N . 16893 1
270 . 1 1 75 75 LEU H H 1 7.618 0.020 . 1 . . . . 84 LEU H . 16893 1
271 . 1 1 75 75 LEU C C 13 178.366 0.3 . 1 . . . . 84 LEU C . 16893 1
272 . 1 1 75 75 LEU CA C 13 56.505 0.3 . 1 . . . . 84 LEU CA . 16893 1
273 . 1 1 75 75 LEU CB C 13 41.601 0.3 . 1 . . . . 84 LEU CB . 16893 1
274 . 1 1 75 75 LEU N N 15 119.012 0.3 . 1 . . . . 84 LEU N . 16893 1
275 . 1 1 76 76 LEU H H 1 7.936 0.020 . 1 . . . . 85 LEU H . 16893 1
276 . 1 1 76 76 LEU C C 13 177.262 0.3 . 1 . . . . 85 LEU C . 16893 1
277 . 1 1 76 76 LEU CA C 13 55.215 0.3 . 1 . . . . 85 LEU CA . 16893 1
278 . 1 1 76 76 LEU CB C 13 43.158 0.3 . 1 . . . . 85 LEU CB . 16893 1
279 . 1 1 76 76 LEU N N 15 115.766 0.3 . 1 . . . . 85 LEU N . 16893 1
280 . 1 1 77 77 GLY H H 1 7.85 0.020 . 1 . . . . 86 GLY H . 16893 1
281 . 1 1 77 77 GLY CA C 13 45.547 0.3 . 1 . . . . 86 GLY CA . 16893 1
282 . 1 1 77 77 GLY N N 15 108.32 0.3 . 1 . . . . 86 GLY N . 16893 1
283 . 1 1 86 86 PRO C C 13 176.637 0.3 . 1 . . . . 95 PRO C . 16893 1
284 . 1 1 86 86 PRO CA C 13 62.599 0.3 . 1 . . . . 95 PRO CA . 16893 1
285 . 1 1 86 86 PRO CB C 13 31.151 0.3 . 1 . . . . 95 PRO CB . 16893 1
286 . 1 1 87 87 SER H H 1 8.037 0.020 . 1 . . . . 96 SER H . 16893 1
287 . 1 1 87 87 SER CA C 13 63.472 0.3 . 1 . . . . 96 SER CA . 16893 1
288 . 1 1 87 87 SER CB C 13 60.946 0.3 . 1 . . . . 96 SER CB . 16893 1
289 . 1 1 87 87 SER N N 15 119.273 0.3 . 1 . . . . 96 SER N . 16893 1
290 . 1 1 88 88 PRO C C 13 177.876 0.3 . 1 . . . . 97 PRO C . 16893 1
291 . 1 1 88 88 PRO CA C 13 64.845 0.3 . 1 . . . . 97 PRO CA . 16893 1
292 . 1 1 89 89 LEU H H 1 7.1 0.020 . 1 . . . . 98 LEU H . 16893 1
293 . 1 1 89 89 LEU C C 13 177.648 0.3 . 1 . . . . 98 LEU C . 16893 1
294 . 1 1 89 89 LEU CA C 13 56.695 0.3 . 1 . . . . 98 LEU CA . 16893 1
295 . 1 1 89 89 LEU CB C 13 40.823 0.3 . 1 . . . . 98 LEU CB . 16893 1
296 . 1 1 89 89 LEU N N 15 115.579 0.3 . 1 . . . . 98 LEU N . 16893 1
297 . 1 1 90 90 TYR H H 1 7.442 0.020 . 1 . . . . 99 TYR H . 16893 1
298 . 1 1 90 90 TYR C C 13 177.974 0.3 . 1 . . . . 99 TYR C . 16893 1
299 . 1 1 90 90 TYR CA C 13 60.822 0.3 . 1 . . . . 99 TYR CA . 16893 1
300 . 1 1 90 90 TYR CB C 13 36.703 0.3 . 1 . . . . 99 TYR CB . 16893 1
301 . 1 1 90 90 TYR N N 15 118.938 0.3 . 1 . . . . 99 TYR N . 16893 1
302 . 1 1 91 91 ASP H H 1 8.097 0.020 . 1 . . . . 100 ASP H . 16893 1
303 . 1 1 91 91 ASP C C 13 177.355 0.3 . 1 . . . . 100 ASP C . 16893 1
304 . 1 1 91 91 ASP CA C 13 56.857 0.3 . 1 . . . . 100 ASP CA . 16893 1
305 . 1 1 91 91 ASP CB C 13 40.267 0.3 . 1 . . . . 100 ASP CB . 16893 1
306 . 1 1 91 91 ASP N N 15 119.977 0.3 . 1 . . . . 100 ASP N . 16893 1
307 . 1 1 92 92 MET H H 1 7.209 0.020 . 1 . . . . 101 MET H . 16893 1
308 . 1 1 92 92 MET C C 13 178.953 0.3 . 1 . . . . 101 MET C . 16893 1
309 . 1 1 92 92 MET CA C 13 58.231 0.3 . 1 . . . . 101 MET CA . 16893 1
310 . 1 1 92 92 MET CB C 13 30.484 0.3 . 1 . . . . 101 MET CB . 16893 1
311 . 1 1 92 92 MET N N 15 119.08 0.3 . 1 . . . . 101 MET N . 16893 1
312 . 1 1 93 93 LEU H H 1 8.198 0.020 . 1 . . . . 102 LEU H . 16893 1
313 . 1 1 93 93 LEU C C 13 178.105 0.3 . 1 . . . . 102 LEU C . 16893 1
314 . 1 1 93 93 LEU CA C 13 58.023 0.3 . 1 . . . . 102 LEU CA . 16893 1
315 . 1 1 93 93 LEU CB C 13 40.712 0.3 . 1 . . . . 102 LEU CB . 16893 1
316 . 1 1 93 93 LEU N N 15 122.464 0.3 . 1 . . . . 102 LEU N . 16893 1
317 . 1 1 94 94 ARG H H 1 7.783 0.020 . 1 . . . . 103 ARG H . 16893 1
318 . 1 1 94 94 ARG C C 13 178.04 0.3 . 1 . . . . 103 ARG C . 16893 1
319 . 1 1 94 94 ARG N N 15 117.29 0.3 . 1 . . . . 103 ARG N . 16893 1
320 . 1 1 95 95 LYS H H 1 7.065 0.020 . 1 . . . . 104 LYS H . 16893 1
321 . 1 1 95 95 LYS C C 13 175.44 0.3 . 1 . . . . 104 LYS C . 16893 1
322 . 1 1 95 95 LYS CA C 13 56.736 0.3 . 1 . . . . 104 LYS CA . 16893 1
323 . 1 1 95 95 LYS N N 15 115.012 0.3 . 1 . . . . 104 LYS N . 16893 1
324 . 1 1 96 96 ASN H H 1 7.609 0.020 . 1 . . . . 105 ASN H . 16893 1
325 . 1 1 96 96 ASN C C 13 172.157 0.3 . 1 . . . . 105 ASN C . 16893 1
326 . 1 1 96 96 ASN CA C 13 53.773 0.3 . 1 . . . . 105 ASN CA . 16893 1
327 . 1 1 96 96 ASN CB C 13 41.045 0.3 . 1 . . . . 105 ASN CB . 16893 1
328 . 1 1 96 96 ASN N N 15 116.842 0.3 . 1 . . . . 105 ASN N . 16893 1
329 . 1 1 97 97 LEU H H 1 7.42 0.020 . 1 . . . . 106 LEU H . 16893 1
330 . 1 1 97 97 LEU CA C 13 53.69 0.3 . 1 . . . . 106 LEU CA . 16893 1
331 . 1 1 97 97 LEU CB C 13 42.491 0.3 . 1 . . . . 106 LEU CB . 16893 1
332 . 1 1 97 97 LEU N N 15 119.049 0.3 . 1 . . . . 106 LEU N . 16893 1
333 . 1 1 99 99 THR C C 13 173.533 0.3 . 1 . . . . 108 THR C . 16893 1
334 . 1 1 99 99 THR CA C 13 61.554 0.3 . 1 . . . . 108 THR CA . 16893 1
335 . 1 1 99 99 THR CB C 13 69.174 0.3 . 1 . . . . 108 THR CB . 16893 1
336 . 1 1 100 100 LEU H H 1 8.186 0.020 . 1 . . . . 109 LEU H . 16893 1
337 . 1 1 100 100 LEU CA C 13 54.276 0.3 . 1 . . . . 109 LEU CA . 16893 1
338 . 1 1 100 100 LEU CB C 13 41.601 0.3 . 1 . . . . 109 LEU CB . 16893 1
339 . 1 1 100 100 LEU N N 15 126.112 0.3 . 1 . . . . 109 LEU N . 16893 1
340 . 1 1 101 101 ALA H H 1 8.124 0.020 . 1 . . . . 110 ALA H . 16893 1
341 . 1 1 101 101 ALA CA C 13 51.667 0.3 . 1 . . . . 110 ALA CA . 16893 1
342 . 1 1 101 101 ALA CB C 13 18.922 0.3 . 1 . . . . 110 ALA CB . 16893 1
343 . 1 1 101 101 ALA N N 15 125.736 0.3 . 1 . . . . 110 ALA N . 16893 1
344 . 1 1 102 102 THR H H 1 7.539 0.020 . 1 . . . . 111 THR H . 16893 1
345 . 1 1 102 102 THR CA C 13 62.432 0.3 . 1 . . . . 111 THR CA . 16893 1
346 . 1 1 102 102 THR CB C 13 70.285 0.3 . 1 . . . . 111 THR CB . 16893 1
347 . 1 1 102 102 THR N N 15 118.891 0.3 . 1 . . . . 111 THR N . 16893 1
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