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 34822
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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-13C HSQC' . . . 34822 1
2 '2D 1H-15N HSQC' . . . 34822 1
3 '3D HNCA' . . . 34822 1
4 '3D CBCA(CO)NH' . . . 34822 1
5 '3D HNCO' . . . 34822 1
6 '3D HNHA' . . . 34822 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 H H 1 8.682 0.000 . 1 . . . . A 2 SER H . 34822 1
2 . 1 . 1 2 2 SER C C 13 174.690 0.000 . 1 . . . . A 2 SER C . 34822 1
3 . 1 . 1 2 2 SER CA C 13 58.870 0.000 . 1 . . . . A 2 SER CA . 34822 1
4 . 1 . 1 2 2 SER CB C 13 63.985 0.000 . 1 . . . . A 2 SER CB . 34822 1
5 . 1 . 1 2 2 SER N N 15 114.229 0.000 . 1 . . . . A 2 SER N . 34822 1
6 . 1 . 1 3 3 GLN H H 1 8.323 0.000 . 1 . . . . A 3 GLN H . 34822 1
7 . 1 . 1 3 3 GLN HA H 1 4.380 0.000 . 1 . . . . A 3 GLN HA . 34822 1
8 . 1 . 1 3 3 GLN C C 13 174.075 0.000 . 1 . . . . A 3 GLN C . 34822 1
9 . 1 . 1 3 3 GLN CA C 13 55.037 0.000 . 1 . . . . A 3 GLN CA . 34822 1
10 . 1 . 1 3 3 GLN CB C 13 31.237 0.000 . 1 . . . . A 3 GLN CB . 34822 1
11 . 1 . 1 3 3 GLN N N 15 123.188 0.000 . 1 . . . . A 3 GLN N . 34822 1
12 . 1 . 1 4 4 ARG H H 1 8.155 0.000 . 1 . . . . A 4 ARG H . 34822 1
13 . 1 . 1 4 4 ARG HA H 1 4.466 0.000 . 1 . . . . A 4 ARG HA . 34822 1
14 . 1 . 1 4 4 ARG C C 13 174.420 0.000 . 1 . . . . A 4 ARG C . 34822 1
15 . 1 . 1 4 4 ARG CA C 13 55.284 0.000 . 1 . . . . A 4 ARG CA . 34822 1
16 . 1 . 1 4 4 ARG CB C 13 31.971 0.000 . 1 . . . . A 4 ARG CB . 34822 1
17 . 1 . 1 4 4 ARG N N 15 120.133 0.000 . 1 . . . . A 4 ARG N . 34822 1
18 . 1 . 1 5 5 ARG H H 1 8.180 0.000 . 1 . . . . A 5 ARG H . 34822 1
19 . 1 . 1 5 5 ARG HA H 1 4.904 0.000 . 1 . . . . A 5 ARG HA . 34822 1
20 . 1 . 1 5 5 ARG CA C 13 55.733 0.000 . 1 . . . . A 5 ARG CA . 34822 1
21 . 1 . 1 5 5 ARG CB C 13 30.999 0.000 . 1 . . . . A 5 ARG CB . 34822 1
22 . 1 . 1 5 5 ARG N N 15 122.620 0.000 . 1 . . . . A 5 ARG N . 34822 1
23 . 1 . 1 6 6 ILE HA H 1 4.379 0.000 . 1 . . . . A 6 ILE HA . 34822 1
24 . 1 . 1 6 6 ILE C C 13 174.358 0.000 . 1 . . . . A 6 ILE C . 34822 1
25 . 1 . 1 6 6 ILE CA C 13 60.221 0.000 . 1 . . . . A 6 ILE CA . 34822 1
26 . 1 . 1 6 6 ILE CB C 13 39.224 0.000 . 1 . . . . A 6 ILE CB . 34822 1
27 . 1 . 1 7 7 ARG H H 1 7.691 0.000 . 1 . . . . A 7 ARG H . 34822 1
28 . 1 . 1 7 7 ARG HA H 1 4.379 0.000 . 1 . . . . A 7 ARG HA . 34822 1
29 . 1 . 1 7 7 ARG C C 13 175.550 0.000 . 1 . . . . A 7 ARG C . 34822 1
30 . 1 . 1 7 7 ARG CA C 13 55.243 0.000 . 1 . . . . A 7 ARG CA . 34822 1
31 . 1 . 1 7 7 ARG CB C 13 31.700 0.000 . 1 . . . . A 7 ARG CB . 34822 1
32 . 1 . 1 7 7 ARG N N 15 119.986 0.000 . 1 . . . . A 7 ARG N . 34822 1
33 . 1 . 1 8 8 THR H H 1 8.391 0.000 . 1 . . . . A 8 THR H . 34822 1
34 . 1 . 1 8 8 THR HA H 1 4.418 0.000 . 1 . . . . A 8 THR HA . 34822 1
35 . 1 . 1 8 8 THR C C 13 173.997 0.000 . 1 . . . . A 8 THR C . 34822 1
36 . 1 . 1 8 8 THR CA C 13 61.684 0.000 . 1 . . . . A 8 THR CA . 34822 1
37 . 1 . 1 8 8 THR CB C 13 71.166 0.000 . 1 . . . . A 8 THR CB . 34822 1
38 . 1 . 1 8 8 THR N N 15 117.991 0.000 . 1 . . . . A 8 THR N . 34822 1
39 . 1 . 1 9 9 THR H H 1 9.380 0.000 . 1 . . . . A 9 THR H . 34822 1
40 . 1 . 1 9 9 THR C C 13 173.852 0.000 . 1 . . . . A 9 THR C . 34822 1
41 . 1 . 1 9 9 THR CA C 13 61.826 0.000 . 1 . . . . A 9 THR CA . 34822 1
42 . 1 . 1 9 9 THR CB C 13 70.910 0.000 . 1 . . . . A 9 THR CB . 34822 1
43 . 1 . 1 9 9 THR N N 15 114.342 0.000 . 1 . . . . A 9 THR N . 34822 1
44 . 1 . 1 10 10 PHE H H 1 8.305 0.000 . 1 . . . . A 10 PHE H . 34822 1
45 . 1 . 1 10 10 PHE HA H 1 4.918 0.000 . 1 . . . . A 10 PHE HA . 34822 1
46 . 1 . 1 10 10 PHE C C 13 175.467 0.000 . 1 . . . . A 10 PHE C . 34822 1
47 . 1 . 1 10 10 PHE CA C 13 56.947 0.000 . 1 . . . . A 10 PHE CA . 34822 1
48 . 1 . 1 10 10 PHE CB C 13 41.275 0.000 . 1 . . . . A 10 PHE CB . 34822 1
49 . 1 . 1 10 10 PHE N N 15 121.667 0.000 . 1 . . . . A 10 PHE N . 34822 1
50 . 1 . 1 11 11 THR H H 1 9.043 0.000 . 1 . . . . A 11 THR H . 34822 1
51 . 1 . 1 11 11 THR HA H 1 4.459 0.000 . 1 . . . . A 11 THR HA . 34822 1
52 . 1 . 1 11 11 THR C C 13 173.898 0.000 . 1 . . . . A 11 THR C . 34822 1
53 . 1 . 1 11 11 THR CA C 13 61.344 0.000 . 1 . . . . A 11 THR CA . 34822 1
54 . 1 . 1 11 11 THR CB C 13 70.950 0.000 . 1 . . . . A 11 THR CB . 34822 1
55 . 1 . 1 11 11 THR N N 15 113.300 0.000 . 1 . . . . A 11 THR N . 34822 1
56 . 1 . 1 13 13 ALA C C 13 180.637 0.000 . 1 . . . . A 13 ALA C . 34822 1
57 . 1 . 1 13 13 ALA CA C 13 55.037 0.000 . 1 . . . . A 13 ALA CA . 34822 1
58 . 1 . 1 13 13 ALA CB C 13 18.424 0.000 . 1 . . . . A 13 ALA CB . 34822 1
59 . 1 . 1 14 14 GLN H H 1 7.706 0.000 . 1 . . . . A 14 GLN H . 34822 1
60 . 1 . 1 14 14 GLN HA H 1 4.044 0.000 . 1 . . . . A 14 GLN HA . 34822 1
61 . 1 . 1 14 14 GLN C C 13 177.600 0.000 . 1 . . . . A 14 GLN C . 34822 1
62 . 1 . 1 14 14 GLN CA C 13 58.740 0.000 . 1 . . . . A 14 GLN CA . 34822 1
63 . 1 . 1 14 14 GLN CB C 13 29.255 0.000 . 1 . . . . A 14 GLN CB . 34822 1
64 . 1 . 1 14 14 GLN N N 15 117.330 0.000 . 1 . . . . A 14 GLN N . 34822 1
65 . 1 . 1 15 15 LEU H H 1 7.758 0.000 . 1 . . . . A 15 LEU H . 34822 1
66 . 1 . 1 15 15 LEU HA H 1 4.246 0.000 . 1 . . . . A 15 LEU HA . 34822 1
67 . 1 . 1 15 15 LEU CA C 13 58.149 0.000 . 1 . . . . A 15 LEU CA . 34822 1
68 . 1 . 1 15 15 LEU CB C 13 39.033 0.000 . 1 . . . . A 15 LEU CB . 34822 1
69 . 1 . 1 15 15 LEU N N 15 107.346 0.000 . 1 . . . . A 15 LEU N . 34822 1
70 . 1 . 1 16 16 LYS H H 1 8.451 0.000 . 1 . . . . A 16 LYS H . 34822 1
71 . 1 . 1 16 16 LYS HA H 1 3.858 0.000 . 1 . . . . A 16 LYS HA . 34822 1
72 . 1 . 1 16 16 LYS C C 13 177.578 0.000 . 1 . . . . A 16 LYS C . 34822 1
73 . 1 . 1 16 16 LYS CA C 13 59.710 0.000 . 1 . . . . A 16 LYS CA . 34822 1
74 . 1 . 1 16 16 LYS CB C 13 30.945 0.000 . 1 . . . . A 16 LYS CB . 34822 1
75 . 1 . 1 16 16 LYS N N 15 118.900 0.000 . 1 . . . . A 16 LYS N . 34822 1
76 . 1 . 1 17 17 GLU H H 1 8.291 0.000 . 1 . . . . A 17 GLU H . 34822 1
77 . 1 . 1 17 17 GLU HA H 1 3.791 0.000 . 1 . . . . A 17 GLU HA . 34822 1
78 . 1 . 1 17 17 GLU C C 13 178.108 0.000 . 1 . . . . A 17 GLU C . 34822 1
79 . 1 . 1 17 17 GLU CA C 13 57.732 0.000 . 1 . . . . A 17 GLU CA . 34822 1
80 . 1 . 1 17 17 GLU CB C 13 29.740 0.000 . 1 . . . . A 17 GLU CB . 34822 1
81 . 1 . 1 17 17 GLU N N 15 117.483 0.000 . 1 . . . . A 17 GLU N . 34822 1
82 . 1 . 1 18 18 LEU H H 1 7.863 0.000 . 1 . . . . A 18 LEU H . 34822 1
83 . 1 . 1 18 18 LEU HA H 1 3.471 0.000 . 1 . . . . A 18 LEU HA . 34822 1
84 . 1 . 1 18 18 LEU C C 13 178.133 0.000 . 1 . . . . A 18 LEU C . 34822 1
85 . 1 . 1 18 18 LEU CA C 13 58.616 0.000 . 1 . . . . A 18 LEU CA . 34822 1
86 . 1 . 1 18 18 LEU CB C 13 39.984 0.000 . 1 . . . . A 18 LEU CB . 34822 1
87 . 1 . 1 18 18 LEU N N 15 121.350 0.000 . 1 . . . . A 18 LEU N . 34822 1
88 . 1 . 1 19 19 GLU H H 1 8.211 0.000 . 1 . . . . A 19 GLU H . 34822 1
89 . 1 . 1 19 19 GLU HA H 1 4.160 0.000 . 1 . . . . A 19 GLU HA . 34822 1
90 . 1 . 1 19 19 GLU C C 13 179.811 0.000 . 1 . . . . A 19 GLU C . 34822 1
91 . 1 . 1 19 19 GLU CA C 13 58.740 0.000 . 1 . . . . A 19 GLU CA . 34822 1
92 . 1 . 1 19 19 GLU CB C 13 28.651 0.000 . 1 . . . . A 19 GLU CB . 34822 1
93 . 1 . 1 19 19 GLU N N 15 115.455 0.000 . 1 . . . . A 19 GLU N . 34822 1
94 . 1 . 1 20 20 ARG H H 1 7.754 0.000 . 1 . . . . A 20 ARG H . 34822 1
95 . 1 . 1 20 20 ARG HA H 1 4.031 0.000 . 1 . . . . A 20 ARG HA . 34822 1
96 . 1 . 1 20 20 ARG C C 13 178.689 0.000 . 1 . . . . A 20 ARG C . 34822 1
97 . 1 . 1 20 20 ARG CA C 13 59.645 0.000 . 1 . . . . A 20 ARG CA . 34822 1
98 . 1 . 1 20 20 ARG CB C 13 29.236 0.000 . 1 . . . . A 20 ARG CB . 34822 1
99 . 1 . 1 20 20 ARG N N 15 122.142 0.000 . 1 . . . . A 20 ARG N . 34822 1
100 . 1 . 1 21 21 VAL CA C 13 66.845 0.000 . 1 . . . . A 21 VAL CA . 34822 1
101 . 1 . 1 21 21 VAL CB C 13 31.660 0.000 . 1 . . . . A 21 VAL CB . 34822 1
102 . 1 . 1 22 22 PHE H H 1 8.860 0.000 . 1 . . . . A 22 PHE H . 34822 1
103 . 1 . 1 22 22 PHE HA H 1 4.419 0.000 . 1 . . . . A 22 PHE HA . 34822 1
104 . 1 . 1 22 22 PHE C C 13 175.555 0.000 . 1 . . . . A 22 PHE C . 34822 1
105 . 1 . 1 22 22 PHE CA C 13 61.126 0.000 . 1 . . . . A 22 PHE CA . 34822 1
106 . 1 . 1 22 22 PHE CB C 13 38.993 0.000 . 1 . . . . A 22 PHE CB . 34822 1
107 . 1 . 1 22 22 PHE N N 15 122.046 0.000 . 1 . . . . A 22 PHE N . 34822 1
108 . 1 . 1 23 23 ALA H H 1 7.778 0.000 . 1 . . . . A 23 ALA H . 34822 1
109 . 1 . 1 23 23 ALA HA H 1 4.098 0.000 . 1 . . . . A 23 ALA HA . 34822 1
110 . 1 . 1 23 23 ALA C C 13 179.243 0.000 . 1 . . . . A 23 ALA C . 34822 1
111 . 1 . 1 23 23 ALA CA C 13 53.885 0.000 . 1 . . . . A 23 ALA CA . 34822 1
112 . 1 . 1 23 23 ALA CB C 13 17.766 0.000 . 1 . . . . A 23 ALA CB . 34822 1
113 . 1 . 1 23 23 ALA N N 15 115.889 0.000 . 1 . . . . A 23 ALA N . 34822 1
114 . 1 . 1 24 24 GLU H H 1 7.726 0.000 . 1 . . . . A 24 GLU H . 34822 1
115 . 1 . 1 24 24 GLU HA H 1 4.305 0.000 . 1 . . . . A 24 GLU HA . 34822 1
116 . 1 . 1 24 24 GLU C C 13 176.986 0.000 . 1 . . . . A 24 GLU C . 34822 1
117 . 1 . 1 24 24 GLU CA C 13 58.029 0.000 . 1 . . . . A 24 GLU CA . 34822 1
118 . 1 . 1 24 24 GLU CB C 13 29.496 0.000 . 1 . . . . A 24 GLU CB . 34822 1
119 . 1 . 1 24 24 GLU N N 15 118.086 0.000 . 1 . . . . A 24 GLU N . 34822 1
120 . 1 . 1 25 25 THR H H 1 8.945 0.000 . 1 . . . . A 25 THR H . 34822 1
121 . 1 . 1 25 25 THR HA H 1 4.312 0.000 . 1 . . . . A 25 THR HA . 34822 1
122 . 1 . 1 25 25 THR C C 13 172.636 0.000 . 1 . . . . A 25 THR C . 34822 1
123 . 1 . 1 25 25 THR CA C 13 61.439 0.000 . 1 . . . . A 25 THR CA . 34822 1
124 . 1 . 1 25 25 THR CB C 13 69.922 0.000 . 1 . . . . A 25 THR CB . 34822 1
125 . 1 . 1 25 25 THR N N 15 115.614 0.000 . 1 . . . . A 25 THR N . 34822 1
126 . 1 . 1 26 26 HIS H H 1 8.467 0.000 . 1 . . . . A 26 HIS H . 34822 1
127 . 1 . 1 26 26 HIS HA H 1 4.730 0.000 . 1 . . . . A 26 HIS HA . 34822 1
128 . 1 . 1 26 26 HIS C C 13 17.284 0.000 . 1 . . . . A 26 HIS C . 34822 1
129 . 1 . 1 26 26 HIS CA C 13 54.379 0.000 . 1 . . . . A 26 HIS CA . 34822 1
130 . 1 . 1 26 26 HIS CB C 13 29.740 0.000 . 1 . . . . A 26 HIS CB . 34822 1
131 . 1 . 1 26 26 HIS N N 15 122.221 0.000 . 1 . . . . A 26 HIS N . 34822 1
132 . 1 . 1 27 27 TYR H H 1 8.185 0.000 . 1 . . . . A 27 TYR H . 34822 1
133 . 1 . 1 27 27 TYR CA C 13 55.201 0.000 . 1 . . . . A 27 TYR CA . 34822 1
134 . 1 . 1 27 27 TYR N N 15 115.373 0.000 . 1 . . . . A 27 TYR N . 34822 1
135 . 1 . 1 28 28 PRO C C 13 175.135 0.000 . 1 . . . . A 28 PRO C . 34822 1
136 . 1 . 1 28 28 PRO CA C 13 62.237 0.000 . 1 . . . . A 28 PRO CA . 34822 1
137 . 1 . 1 28 28 PRO CB C 13 32.999 0.000 . 1 . . . . A 28 PRO CB . 34822 1
138 . 1 . 1 29 29 ASP H H 1 8.678 0.000 . 1 . . . . A 29 ASP H . 34822 1
139 . 1 . 1 29 29 ASP HA H 1 4.505 0.000 . 1 . . . . A 29 ASP HA . 34822 1
140 . 1 . 1 29 29 ASP C C 13 176.196 0.000 . 1 . . . . A 29 ASP C . 34822 1
141 . 1 . 1 29 29 ASP CA C 13 52.774 0.000 . 1 . . . . A 29 ASP CA . 34822 1
142 . 1 . 1 29 29 ASP CB C 13 41.110 0.000 . 1 . . . . A 29 ASP CB . 34822 1
143 . 1 . 1 29 29 ASP N N 15 123.854 0.000 . 1 . . . . A 29 ASP N . 34822 1
144 . 1 . 1 30 30 ILE H H 1 8.508 0.000 . 1 . . . . A 30 ILE H . 34822 1
145 . 1 . 1 30 30 ILE HA H 1 3.951 0.000 . 1 . . . . A 30 ILE HA . 34822 1
146 . 1 . 1 30 30 ILE C C 13 178.196 0.000 . 1 . . . . A 30 ILE C . 34822 1
147 . 1 . 1 30 30 ILE CA C 13 62.129 0.000 . 1 . . . . A 30 ILE CA . 34822 1
148 . 1 . 1 30 30 ILE CB C 13 37.768 0.000 . 1 . . . . A 30 ILE CB . 34822 1
149 . 1 . 1 30 30 ILE N N 15 118.339 0.000 . 1 . . . . A 30 ILE N . 34822 1
150 . 1 . 1 31 31 TYR H H 1 6.950 0.000 . 1 . . . . A 31 TYR H . 34822 1
151 . 1 . 1 31 31 TYR HA H 1 4.480 0.000 . 1 . . . . A 31 TYR HA . 34822 1
152 . 1 . 1 31 31 TYR C C 13 177.935 0.000 . 1 . . . . A 31 TYR C . 34822 1
153 . 1 . 1 31 31 TYR CA C 13 60.468 0.000 . 1 . . . . A 31 TYR CA . 34822 1
154 . 1 . 1 31 31 TYR CB C 13 36.952 0.000 . 1 . . . . A 31 TYR CB . 34822 1
155 . 1 . 1 31 31 TYR N N 15 121.603 0.000 . 1 . . . . A 31 TYR N . 34822 1
156 . 1 . 1 32 32 THR H H 1 8.446 0.000 . 1 . . . . A 32 THR H . 34822 1
157 . 1 . 1 32 32 THR HA H 1 3.871 0.000 . 1 . . . . A 32 THR HA . 34822 1
158 . 1 . 1 32 32 THR C C 13 177.269 0.000 . 1 . . . . A 32 THR C . 34822 1
159 . 1 . 1 32 32 THR CA C 13 64.742 0.000 . 1 . . . . A 32 THR CA . 34822 1
160 . 1 . 1 32 32 THR CB C 13 67.421 0.000 . 1 . . . . A 32 THR CB . 34822 1
161 . 1 . 1 32 32 THR N N 15 118.706 0.000 . 1 . . . . A 32 THR N . 34822 1
162 . 1 . 1 33 33 ARG H H 1 8.618 0.000 . 1 . . . . A 33 ARG H . 34822 1
163 . 1 . 1 33 33 ARG HA H 1 3.800 0.000 . 1 . . . . A 33 ARG HA . 34822 1
164 . 1 . 1 33 33 ARG C C 13 177.935 0.000 . 1 . . . . A 33 ARG C . 34822 1
165 . 1 . 1 33 33 ARG CA C 13 60.290 0.000 . 1 . . . . A 33 ARG CA . 34822 1
166 . 1 . 1 33 33 ARG CB C 13 30.812 0.000 . 1 . . . . A 33 ARG CB . 34822 1
167 . 1 . 1 33 33 ARG N N 15 119.892 0.000 . 1 . . . . A 33 ARG N . 34822 1
168 . 1 . 1 34 34 GLU H H 1 8.722 0.000 . 1 . . . . A 34 GLU H . 34822 1
169 . 1 . 1 34 34 GLU HA H 1 3.924 0.000 . 1 . . . . A 34 GLU HA . 34822 1
170 . 1 . 1 34 34 GLU C C 13 178.972 0.000 . 1 . . . . A 34 GLU C . 34822 1
171 . 1 . 1 34 34 GLU CA C 13 59.768 0.000 . 1 . . . . A 34 GLU CA . 34822 1
172 . 1 . 1 34 34 GLU CB C 13 29.876 0.000 . 1 . . . . A 34 GLU CB . 34822 1
173 . 1 . 1 34 34 GLU N N 15 119.195 0.000 . 1 . . . . A 34 GLU N . 34822 1
174 . 1 . 1 35 35 GLU H H 1 8.059 0.000 . 1 . . . . A 35 GLU H . 34822 1
175 . 1 . 1 35 35 GLU HA H 1 3.884 0.000 . 1 . . . . A 35 GLU HA . 34822 1
176 . 1 . 1 35 35 GLU C C 13 180.329 0.000 . 1 . . . . A 35 GLU C . 34822 1
177 . 1 . 1 35 35 GLU CA C 13 59.316 0.000 . 1 . . . . A 35 GLU CA . 34822 1
178 . 1 . 1 35 35 GLU CB C 13 29.740 0.000 . 1 . . . . A 35 GLU CB . 34822 1
179 . 1 . 1 35 35 GLU N N 15 120.289 0.000 . 1 . . . . A 35 GLU N . 34822 1
180 . 1 . 1 36 36 LEU H H 1 8.043 0.000 . 1 . . . . A 36 LEU H . 34822 1
181 . 1 . 1 36 36 LEU HA H 1 4.031 0.000 . 1 . . . . A 36 LEU HA . 34822 1
182 . 1 . 1 36 36 LEU C C 13 177.590 0.000 . 1 . . . . A 36 LEU C . 34822 1
183 . 1 . 1 36 36 LEU CA C 13 57.670 0.000 . 1 . . . . A 36 LEU CA . 34822 1
184 . 1 . 1 36 36 LEU CB C 13 42.777 0.000 . 1 . . . . A 36 LEU CB . 34822 1
185 . 1 . 1 36 36 LEU N N 15 121.001 0.000 . 1 . . . . A 36 LEU N . 34822 1
186 . 1 . 1 37 37 ALA H H 1 8.379 0.000 . 1 . . . . A 37 ALA H . 34822 1
187 . 1 . 1 37 37 ALA HA H 1 3.964 0.000 . 1 . . . . A 37 ALA HA . 34822 1
188 . 1 . 1 37 37 ALA C C 13 179.379 0.000 . 1 . . . . A 37 ALA C . 34822 1
189 . 1 . 1 37 37 ALA CA C 13 55.777 0.000 . 1 . . . . A 37 ALA CA . 34822 1
190 . 1 . 1 37 37 ALA CB C 13 17.221 0.000 . 1 . . . . A 37 ALA CB . 34822 1
191 . 1 . 1 37 37 ALA N N 15 119.760 0.000 . 1 . . . . A 37 ALA N . 34822 1
192 . 1 . 1 38 38 LEU H H 1 7.603 0.000 . 1 . . . . A 38 LEU H . 34822 1
193 . 1 . 1 38 38 LEU HA H 1 4.205 0.000 . 1 . . . . A 38 LEU HA . 34822 1
194 . 1 . 1 38 38 LEU C C 13 179.885 0.000 . 1 . . . . A 38 LEU C . 34822 1
195 . 1 . 1 38 38 LEU CA C 13 57.135 0.000 . 1 . . . . A 38 LEU CA . 34822 1
196 . 1 . 1 38 38 LEU CB C 13 42.395 0.000 . 1 . . . . A 38 LEU CB . 34822 1
197 . 1 . 1 38 38 LEU N N 15 115.487 0.000 . 1 . . . . A 38 LEU N . 34822 1
198 . 1 . 1 39 39 LYS H H 1 7.861 0.000 . 1 . . . . A 39 LYS H . 34822 1
199 . 1 . 1 39 39 LYS HA H 1 4.130 0.000 . 1 . . . . A 39 LYS HA . 34822 1
200 . 1 . 1 39 39 LYS C C 13 179.256 0.000 . 1 . . . . A 39 LYS C . 34822 1
201 . 1 . 1 39 39 LYS CA C 13 59.110 0.000 . 1 . . . . A 39 LYS CA . 34822 1
202 . 1 . 1 39 39 LYS CB C 13 32.468 0.000 . 1 . . . . A 39 LYS CB . 34822 1
203 . 1 . 1 39 39 LYS N N 15 119.331 0.000 . 1 . . . . A 39 LYS N . 34822 1
204 . 1 . 1 40 40 ILE H H 1 7.872 0.000 . 1 . . . . A 40 ILE H . 34822 1
205 . 1 . 1 40 40 ILE HA H 1 3.978 0.000 . 1 . . . . A 40 ILE HA . 34822 1
206 . 1 . 1 40 40 ILE C C 13 178.034 0.000 . 1 . . . . A 40 ILE C . 34822 1
207 . 1 . 1 40 40 ILE CA C 13 62.968 0.000 . 1 . . . . A 40 ILE CA . 34822 1
208 . 1 . 1 40 40 ILE CB C 13 38.773 0.000 . 1 . . . . A 40 ILE CB . 34822 1
209 . 1 . 1 40 40 ILE N N 15 119.517 0.000 . 1 . . . . A 40 ILE N . 34822 1
210 . 1 . 1 41 41 ASP H H 1 8.422 0.000 . 1 . . . . A 41 ASP H . 34822 1
211 . 1 . 1 41 41 ASP HA H 1 4.277 0.000 . 1 . . . . A 41 ASP HA . 34822 1
212 . 1 . 1 41 41 ASP C C 13 177.465 0.000 . 1 . . . . A 41 ASP C . 34822 1
213 . 1 . 1 41 41 ASP CA C 13 55.480 0.000 . 1 . . . . A 41 ASP CA . 34822 1
214 . 1 . 1 41 41 ASP CB C 13 40.325 0.000 . 1 . . . . A 41 ASP CB . 34822 1
215 . 1 . 1 41 41 ASP N N 15 119.035 0.000 . 1 . . . . A 41 ASP N . 34822 1
216 . 1 . 1 42 42 LEU H H 1 7.040 0.000 . 1 . . . . A 42 LEU H . 34822 1
217 . 1 . 1 42 42 LEU HA H 1 4.458 0.000 . 1 . . . . A 42 LEU HA . 34822 1
218 . 1 . 1 42 42 LEU C C 13 177.145 0.000 . 1 . . . . A 42 LEU C . 34822 1
219 . 1 . 1 42 42 LEU CA C 13 52.876 0.000 . 1 . . . . A 42 LEU CA . 34822 1
220 . 1 . 1 42 42 LEU CB C 13 42.714 0.000 . 1 . . . . A 42 LEU CB . 34822 1
221 . 1 . 1 42 42 LEU N N 15 118.086 0.000 . 1 . . . . A 42 LEU N . 34822 1
222 . 1 . 1 43 43 THR H H 1 7.964 0.000 . 1 . . . . A 43 THR H . 34822 1
223 . 1 . 1 43 43 THR HA H 1 4.804 0.000 . 1 . . . . A 43 THR HA . 34822 1
224 . 1 . 1 43 43 THR C C 13 173.949 0.000 . 1 . . . . A 43 THR C . 34822 1
225 . 1 . 1 43 43 THR CA C 13 61.600 0.000 . 1 . . . . A 43 THR CA . 34822 1
226 . 1 . 1 43 43 THR CB C 13 70.959 0.000 . 1 . . . . A 43 THR CB . 34822 1
227 . 1 . 1 43 43 THR N N 15 117.198 0.000 . 1 . . . . A 43 THR N . 34822 1
228 . 1 . 1 44 44 GLU H H 1 9.369 0.000 . 1 . . . . A 44 GLU H . 34822 1
229 . 1 . 1 44 44 GLU HA H 1 4.350 0.000 . 1 . . . . A 44 GLU HA . 34822 1
230 . 1 . 1 44 44 GLU C C 13 175.874 0.000 . 1 . . . . A 44 GLU C . 34822 1
231 . 1 . 1 44 44 GLU CA C 13 56.085 0.000 . 1 . . . . A 44 GLU CA . 34822 1
232 . 1 . 1 44 44 GLU CB C 13 31.243 0.000 . 1 . . . . A 44 GLU CB . 34822 1
233 . 1 . 1 44 44 GLU N N 15 124.210 0.000 . 1 . . . . A 44 GLU N . 34822 1
234 . 1 . 1 45 45 ALA H H 1 8.339 0.000 . 1 . . . . A 45 ALA H . 34822 1
235 . 1 . 1 45 45 ALA HA H 1 3.970 0.000 . 1 . . . . A 45 ALA HA . 34822 1
236 . 1 . 1 45 45 ALA C C 13 180.798 0.000 . 1 . . . . A 45 ALA C . 34822 1
237 . 1 . 1 45 45 ALA CA C 13 54.164 0.000 . 1 . . . . A 45 ALA CA . 34822 1
238 . 1 . 1 45 45 ALA CB C 13 18.582 0.000 . 1 . . . . A 45 ALA CB . 34822 1
239 . 1 . 1 45 45 ALA N N 15 119.756 0.000 . 1 . . . . A 45 ALA N . 34822 1
240 . 1 . 1 46 46 ARG H H 1 7.626 0.000 . 1 . . . . A 46 ARG H . 34822 1
241 . 1 . 1 46 46 ARG HA H 1 4.058 0.000 . 1 . . . . A 46 ARG HA . 34822 1
242 . 1 . 1 46 46 ARG C C 13 179.663 0.000 . 1 . . . . A 46 ARG C . 34822 1
243 . 1 . 1 46 46 ARG CA C 13 58.822 0.000 . 1 . . . . A 46 ARG CA . 34822 1
244 . 1 . 1 46 46 ARG CB C 13 30.284 0.000 . 1 . . . . A 46 ARG CB . 34822 1
245 . 1 . 1 46 46 ARG N N 15 117.248 0.000 . 1 . . . . A 46 ARG N . 34822 1
246 . 1 . 1 47 47 VAL H H 1 8.097 0.000 . 1 . . . . A 47 VAL H . 34822 1
247 . 1 . 1 47 47 VAL HA H 1 3.664 0.000 . 1 . . . . A 47 VAL HA . 34822 1
248 . 1 . 1 47 47 VAL C C 13 177.479 0.000 . 1 . . . . A 47 VAL C . 34822 1
249 . 1 . 1 47 47 VAL CA C 13 65.297 0.000 . 1 . . . . A 47 VAL CA . 34822 1
250 . 1 . 1 47 47 VAL CB C 13 31.895 0.000 . 1 . . . . A 47 VAL CB . 34822 1
251 . 1 . 1 47 47 VAL N N 15 120.843 0.000 . 1 . . . . A 47 VAL N . 34822 1
252 . 1 . 1 48 48 GLN H H 1 8.844 0.000 . 1 . . . . A 48 GLN H . 34822 1
253 . 1 . 1 48 48 GLN HA H 1 3.670 0.000 . 1 . . . . A 48 GLN HA . 34822 1
254 . 1 . 1 48 48 GLN C C 13 178.589 0.000 . 1 . . . . A 48 GLN C . 34822 1
255 . 1 . 1 48 48 GLN CA C 13 57.809 0.000 . 1 . . . . A 48 GLN CA . 34822 1
256 . 1 . 1 48 48 GLN CB C 13 28.651 0.000 . 1 . . . . A 48 GLN CB . 34822 1
257 . 1 . 1 48 48 GLN N N 15 120.191 0.000 . 1 . . . . A 48 GLN N . 34822 1
258 . 1 . 1 49 49 VAL H H 1 7.922 0.000 . 1 . . . . A 49 VAL H . 34822 1
259 . 1 . 1 49 49 VAL HA H 1 3.777 0.000 . 1 . . . . A 49 VAL HA . 34822 1
260 . 1 . 1 49 49 VAL C C 13 177.812 0.000 . 1 . . . . A 49 VAL C . 34822 1
261 . 1 . 1 49 49 VAL CA C 13 66.476 0.000 . 1 . . . . A 49 VAL CA . 34822 1
262 . 1 . 1 49 49 VAL CB C 13 32.196 0.000 . 1 . . . . A 49 VAL CB . 34822 1
263 . 1 . 1 49 49 VAL N N 15 119.226 0.000 . 1 . . . . A 49 VAL N . 34822 1
264 . 1 . 1 50 50 TRP H H 1 8.215 0.000 . 1 . . . . A 50 TRP H . 34822 1
265 . 1 . 1 50 50 TRP HA H 1 4.060 0.000 . 1 . . . . A 50 TRP HA . 34822 1
266 . 1 . 1 50 50 TRP C C 13 179.650 0.000 . 1 . . . . A 50 TRP C . 34822 1
267 . 1 . 1 50 50 TRP CA C 13 61.244 0.000 . 1 . . . . A 50 TRP CA . 34822 1
268 . 1 . 1 50 50 TRP CB C 13 28.356 0.000 . 1 . . . . A 50 TRP CB . 34822 1
269 . 1 . 1 50 50 TRP N N 15 121.191 0.000 . 1 . . . . A 50 TRP N . 34822 1
270 . 1 . 1 51 51 PHE H H 1 8.780 0.000 . 1 . . . . A 51 PHE H . 34822 1
271 . 1 . 1 51 51 PHE HA H 1 3.970 0.000 . 1 . . . . A 51 PHE HA . 34822 1
272 . 1 . 1 51 51 PHE C C 13 177.898 0.000 . 1 . . . . A 51 PHE C . 34822 1
273 . 1 . 1 51 51 PHE CB C 13 38.238 0.000 . 1 . . . . A 51 PHE CB . 34822 1
274 . 1 . 1 51 51 PHE N N 15 118.402 0.000 . 1 . . . . A 51 PHE N . 34822 1
275 . 1 . 1 52 52 GLN H H 1 8.438 0.000 . 1 . . . . A 52 GLN H . 34822 1
276 . 1 . 1 52 52 GLN HA H 1 3.791 0.000 . 1 . . . . A 52 GLN HA . 34822 1
277 . 1 . 1 52 52 GLN C C 13 179.342 0.000 . 1 . . . . A 52 GLN C . 34822 1
278 . 1 . 1 52 52 GLN CA C 13 59.521 0.000 . 1 . . . . A 52 GLN CA . 34822 1
279 . 1 . 1 52 52 GLN CB C 13 28.274 0.000 . 1 . . . . A 52 GLN CB . 34822 1
280 . 1 . 1 52 52 GLN N N 15 118.941 0.000 . 1 . . . . A 52 GLN N . 34822 1
281 . 1 . 1 53 53 ASN H H 1 8.261 0.000 . 1 . . . . A 53 ASN H . 34822 1
282 . 1 . 1 53 53 ASN HA H 1 4.205 0.000 . 1 . . . . A 53 ASN HA . 34822 1
283 . 1 . 1 53 53 ASN C C 13 177.171 0.000 . 1 . . . . A 53 ASN C . 34822 1
284 . 1 . 1 53 53 ASN CA C 13 55.366 0.000 . 1 . . . . A 53 ASN CA . 34822 1
285 . 1 . 1 53 53 ASN CB C 13 37.904 0.000 . 1 . . . . A 53 ASN CB . 34822 1
286 . 1 . 1 53 53 ASN N N 15 118.529 0.000 . 1 . . . . A 53 ASN N . 34822 1
287 . 1 . 1 54 54 ARG H H 1 8.276 0.000 . 1 . . . . A 54 ARG H . 34822 1
288 . 1 . 1 54 54 ARG HA H 1 4.136 0.000 . 1 . . . . A 54 ARG HA . 34822 1
289 . 1 . 1 54 54 ARG C C 13 179.367 0.000 . 1 . . . . A 54 ARG C . 34822 1
290 . 1 . 1 54 54 ARG CA C 13 59.271 0.000 . 1 . . . . A 54 ARG CA . 34822 1
291 . 1 . 1 54 54 ARG CB C 13 28.515 0.000 . 1 . . . . A 54 ARG CB . 34822 1
292 . 1 . 1 54 54 ARG N N 15 123.707 0.000 . 1 . . . . A 54 ARG N . 34822 1
293 . 1 . 1 55 55 ARG H H 1 8.059 0.000 . 1 . . . . A 55 ARG H . 34822 1
294 . 1 . 1 55 55 ARG HA H 1 4.120 0.000 . 1 . . . . A 55 ARG HA . 34822 1
295 . 1 . 1 55 55 ARG C C 13 178.121 0.000 . 1 . . . . A 55 ARG C . 34822 1
296 . 1 . 1 55 55 ARG CA C 13 59.809 0.000 . 1 . . . . A 55 ARG CA . 34822 1
297 . 1 . 1 55 55 ARG CB C 13 30.509 0.000 . 1 . . . . A 55 ARG CB . 34822 1
298 . 1 . 1 55 55 ARG N N 15 117.612 0.000 . 1 . . . . A 55 ARG N . 34822 1
299 . 1 . 1 56 56 ALA H H 1 7.331 0.000 . 1 . . . . A 56 ALA H . 34822 1
300 . 1 . 1 56 56 ALA HA H 1 4.058 0.000 . 1 . . . . A 56 ALA HA . 34822 1
301 . 1 . 1 56 56 ALA C C 13 179157 0.000 . 1 . . . . A 56 ALA C . 34822 1
302 . 1 . 1 56 56 ALA CA C 13 54.379 0.000 . 1 . . . . A 56 ALA CA . 34822 1
303 . 1 . 1 56 56 ALA CB C 13 18.174 0.000 . 1 . . . . A 56 ALA CB . 34822 1
304 . 1 . 1 56 56 ALA N N 15 121.159 0.000 . 1 . . . . A 56 ALA N . 34822 1
305 . 1 . 1 57 57 LYS H H 1 7.448 0.000 . 1 . . . . A 57 LYS H . 34822 1
306 . 1 . 1 57 57 LYS HA H 1 4.100 0.000 . 1 . . . . A 57 LYS HA . 34822 1
307 . 1 . 1 57 57 LYS C C 13 177.356 0.000 . 1 . . . . A 57 LYS C . 34822 1
308 . 1 . 1 57 57 LYS CA C 13 57.350 0.000 . 1 . . . . A 57 LYS CA . 34822 1
309 . 1 . 1 57 57 LYS CB C 13 32.461 0.000 . 1 . . . . A 57 LYS CB . 34822 1
310 . 1 . 1 57 57 LYS N N 15 117.341 0.000 . 1 . . . . A 57 LYS N . 34822 1
311 . 1 . 1 58 58 PHE H H 1 7.864 0.000 . 1 . . . . A 58 PHE H . 34822 1
312 . 1 . 1 58 58 PHE HA H 1 4.539 0.000 . 1 . . . . A 58 PHE HA . 34822 1
313 . 1 . 1 58 58 PHE C C 13 175.900 0.000 . 1 . . . . A 58 PHE C . 34822 1
314 . 1 . 1 58 58 PHE CA C 13 59.069 0.000 . 1 . . . . A 58 PHE CA . 34822 1
315 . 1 . 1 58 58 PHE CB C 13 39.265 0.000 . 1 . . . . A 58 PHE CB . 34822 1
316 . 1 . 1 58 58 PHE N N 15 120.019 0.000 . 1 . . . . A 58 PHE N . 34822 1
317 . 1 . 1 59 59 ARG H H 1 7.884 0.000 . 1 . . . . A 59 ARG H . 34822 1
318 . 1 . 1 59 59 ARG HA H 1 4.226 0.000 . 1 . . . . A 59 ARG HA . 34822 1
319 . 1 . 1 59 59 ARG C C 13 175.052 0.000 . 1 . . . . A 59 ARG C . 34822 1
320 . 1 . 1 59 59 ARG CA C 13 54.395 0.000 . 1 . . . . A 59 ARG CA . 34822 1
321 . 1 . 1 59 59 ARG CB C 13 31.829 0.000 . 1 . . . . A 59 ARG CB . 34822 1
322 . 1 . 1 59 59 ARG N N 15 120.272 0.000 . 1 . . . . A 59 ARG N . 34822 1
323 . 1 . 1 60 60 LYS H H 1 7.962 0.000 . 1 . . . . A 60 LYS H . 34822 1
324 . 1 . 1 60 60 LYS HA H 1 4.298 0.000 . 1 . . . . A 60 LYS HA . 34822 1
325 . 1 . 1 60 60 LYS C C 13 177.652 0.000 . 1 . . . . A 60 LYS C . 34822 1
326 . 1 . 1 60 60 LYS CA C 13 57.395 0.000 . 1 . . . . A 60 LYS CA . 34822 1
327 . 1 . 1 60 60 LYS CB C 13 31.781 0.000 . 1 . . . . A 60 LYS CB . 34822 1
328 . 1 . 1 60 60 LYS N N 15 121.951 0.000 . 1 . . . . A 60 LYS N . 34822 1
329 . 1 . 1 61 61 GLN H H 1 8.222 0.000 . 1 . . . . A 61 GLN H . 34822 1
330 . 1 . 1 61 61 GLN HA H 1 4.391 0.000 . 1 . . . . A 61 GLN HA . 34822 1
331 . 1 . 1 61 61 GLN C C 13 173.741 0.000 . 1 . . . . A 61 GLN C . 34822 1
332 . 1 . 1 61 61 GLN CA C 13 55.353 0.000 . 1 . . . . A 61 GLN CA . 34822 1
333 . 1 . 1 61 61 GLN CB C 13 30.639 0.000 . 1 . . . . A 61 GLN CB . 34822 1
334 . 1 . 1 61 61 GLN N N 15 121.260 0.000 . 1 . . . . A 61 GLN N . 34822 1
335 . 1 . 1 62 62 GLU H H 1 8.308 0.000 . 1 . . . . A 62 GLU H . 34822 1
336 . 1 . 1 62 62 GLU HA H 1 4.524 0.000 . 1 . . . . A 62 GLU HA . 34822 1
337 . 1 . 1 62 62 GLU C C 13 175.567 0.000 . 1 . . . . A 62 GLU C . 34822 1
338 . 1 . 1 62 62 GLU CA C 13 55.829 0.000 . 1 . . . . A 62 GLU CA . 34822 1
339 . 1 . 1 62 62 GLU CB C 13 32.870 0.000 . 1 . . . . A 62 GLU CB . 34822 1
340 . 1 . 1 62 62 GLU N N 15 121.811 0.000 . 1 . . . . A 62 GLU N . 34822 1
341 . 1 . 1 63 63 ARG H H 1 7.846 0.000 . 1 . . . . A 63 ARG H . 34822 1
342 . 1 . 1 63 63 ARG HA H 1 4.398 0.000 . 1 . . . . A 63 ARG HA . 34822 1
343 . 1 . 1 63 63 ARG C C 13 176.160 0.000 . 1 . . . . A 63 ARG C . 34822 1
344 . 1 . 1 63 63 ARG CA C 13 55.382 0.000 . 1 . . . . A 63 ARG CA . 34822 1
345 . 1 . 1 63 63 ARG CB C 13 32.020 0.000 . 1 . . . . A 63 ARG CB . 34822 1
346 . 1 . 1 63 63 ARG N N 15 126.483 0.000 . 1 . . . . A 63 ARG N . 34822 1
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