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 30810
_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-15N HSQC' . . . 30810 1
2 '3D HNCACB' . . . 30810 1
3 '3D HNCA' . . . 30810 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 LEU H H 1 8.362 0.020 . 1 . . . . A 958 LEU H . 30810 1
2 . 1 . 1 3 3 LEU CA C 13 55.283 0.3 . 1 . . . . A 958 LEU CA . 30810 1
3 . 1 . 1 3 3 LEU CB C 13 40.655 0.3 . 1 . . . . A 958 LEU CB . 30810 1
4 . 1 . 1 3 3 LEU N N 15 120.618 0.3 . 1 . . . . A 958 LEU N . 30810 1
5 . 1 . 1 4 4 GLU H H 1 8.292 0.020 . 1 . . . . A 959 GLU H . 30810 1
6 . 1 . 1 4 4 GLU CA C 13 56.278 0.3 . 1 . . . . A 959 GLU CA . 30810 1
7 . 1 . 1 4 4 GLU CB C 13 29.133 0.3 . 1 . . . . A 959 GLU CB . 30810 1
8 . 1 . 1 4 4 GLU N N 15 121.205 0.3 . 1 . . . . A 959 GLU N . 30810 1
9 . 1 . 1 5 5 GLU H H 1 8.208 0.020 . 1 . . . . A 960 GLU H . 30810 1
10 . 1 . 1 5 5 GLU CA C 13 56.356 0.3 . 1 . . . . A 960 GLU CA . 30810 1
11 . 1 . 1 5 5 GLU CB C 13 29.343 0.3 . 1 . . . . A 960 GLU CB . 30810 1
12 . 1 . 1 5 5 GLU N N 15 121.124 0.3 . 1 . . . . A 960 GLU N . 30810 1
13 . 1 . 1 6 6 ARG H H 1 8.204 0.020 . 1 . . . . A 961 ARG H . 30810 1
14 . 1 . 1 6 6 ARG CA C 13 56.330 0.3 . 1 . . . . A 961 ARG CA . 30810 1
15 . 1 . 1 6 6 ARG CB C 13 29.395 0.3 . 1 . . . . A 961 ARG CB . 30810 1
16 . 1 . 1 6 6 ARG N N 15 122.713 0.3 . 1 . . . . A 961 ARG N . 30810 1
17 . 1 . 1 8 8 GLY H H 1 8.198 0.020 . 1 . . . . A 963 GLY H . 30810 1
18 . 1 . 1 8 8 GLY CA C 13 44.217 0.3 . 1 . . . . A 963 GLY CA . 30810 1
19 . 1 . 1 8 8 GLY N N 15 110.397 0.3 . 1 . . . . A 963 GLY N . 30810 1
20 . 1 . 1 9 9 ILE H H 1 8.256 0.020 . 1 . . . . A 964 ILE H . 30810 1
21 . 1 . 1 9 9 ILE CA C 13 56.906 0.3 . 1 . . . . A 964 ILE CA . 30810 1
22 . 1 . 1 9 9 ILE CB C 13 37.356 0.3 . 1 . . . . A 964 ILE CB . 30810 1
23 . 1 . 1 9 9 ILE N N 15 122.243 0.3 . 1 . . . . A 964 ILE N . 30810 1
24 . 1 . 1 10 10 PRO CA C 13 61.541 0.3 . 1 . . . . A 965 PRO CA . 30810 1
25 . 1 . 1 10 10 PRO CB C 13 31.490 0.3 . 1 . . . . A 965 PRO CB . 30810 1
26 . 1 . 1 11 11 ILE H H 1 8.766 0.020 . 1 . . . . A 966 ILE H . 30810 1
27 . 1 . 1 11 11 ILE CA C 13 63.165 0.3 . 1 . . . . A 966 ILE CA . 30810 1
28 . 1 . 1 11 11 ILE CB C 13 36.360 0.3 . 1 . . . . A 966 ILE CB . 30810 1
29 . 1 . 1 11 11 ILE N N 15 123.834 0.3 . 1 . . . . A 966 ILE N . 30810 1
30 . 1 . 1 12 12 TRP H H 1 8.177 0.020 . 1 . . . . A 967 TRP H . 30810 1
31 . 1 . 1 12 12 TRP CA C 13 59.289 0.3 . 1 . . . . A 967 TRP CA . 30810 1
32 . 1 . 1 12 12 TRP CB C 13 27.510 0.3 . 1 . . . . A 967 TRP CB . 30810 1
33 . 1 . 1 12 12 TRP N N 15 117.797 0.3 . 1 . . . . A 967 TRP N . 30810 1
34 . 1 . 1 13 13 VAL H H 1 6.572 0.020 . 1 . . . . A 968 VAL H . 30810 1
35 . 1 . 1 13 13 VAL HB H 1 1.733 0.020 . 1 . . . . A 968 VAL HB . 30810 1
36 . 1 . 1 13 13 VAL HG11 H 1 0.634 0.020 . 1 . . . . A 968 VAL HG11 . 30810 1
37 . 1 . 1 13 13 VAL HG12 H 1 0.634 0.020 . 1 . . . . A 968 VAL HG12 . 30810 1
38 . 1 . 1 13 13 VAL HG13 H 1 0.634 0.020 . 1 . . . . A 968 VAL HG13 . 30810 1
39 . 1 . 1 13 13 VAL HG21 H 1 0.976 0.020 . 1 . . . . A 968 VAL HG21 . 30810 1
40 . 1 . 1 13 13 VAL HG22 H 1 0.976 0.020 . 1 . . . . A 968 VAL HG22 . 30810 1
41 . 1 . 1 13 13 VAL HG23 H 1 0.976 0.020 . 1 . . . . A 968 VAL HG23 . 30810 1
42 . 1 . 1 13 13 VAL CA C 13 65.574 0.3 . 1 . . . . A 968 VAL CA . 30810 1
43 . 1 . 1 13 13 VAL CB C 13 29.866 0.3 . 1 . . . . A 968 VAL CB . 30810 1
44 . 1 . 1 13 13 VAL N N 15 121.495 0.3 . 1 . . . . A 968 VAL N . 30810 1
45 . 1 . 1 14 14 VAL H H 1 6.923 0.020 . 1 . . . . A 969 VAL H . 30810 1
46 . 1 . 1 14 14 VAL CA C 13 65.970 0.3 . 1 . . . . A 969 VAL CA . 30810 1
47 . 1 . 1 14 14 VAL CB C 13 30.297 0.3 . 1 . . . . A 969 VAL CB . 30810 1
48 . 1 . 1 14 14 VAL N N 15 118.857 0.3 . 1 . . . . A 969 VAL N . 30810 1
49 . 1 . 1 15 15 LEU H H 1 7.853 0.020 . 1 . . . . A 970 LEU H . 30810 1
50 . 1 . 1 15 15 LEU CA C 13 58.029 0.3 . 1 . . . . A 970 LEU CA . 30810 1
51 . 1 . 1 15 15 LEU CB C 13 40.279 0.3 . 1 . . . . A 970 LEU CB . 30810 1
52 . 1 . 1 15 15 LEU N N 15 117.668 0.3 . 1 . . . . A 970 LEU N . 30810 1
53 . 1 . 1 16 16 VAL H H 1 8.472 0.020 . 1 . . . . A 971 VAL H . 30810 1
54 . 1 . 1 16 16 VAL CA C 13 66.621 0.3 . 1 . . . . A 971 VAL CA . 30810 1
55 . 1 . 1 16 16 VAL CB C 13 29.971 0.3 . 1 . . . . A 971 VAL CB . 30810 1
56 . 1 . 1 16 16 VAL N N 15 118.414 0.3 . 1 . . . . A 971 VAL N . 30810 1
57 . 1 . 1 17 17 GLY H H 1 8.263 0.020 . 1 . . . . A 972 GLY H . 30810 1
58 . 1 . 1 17 17 GLY HA2 H 1 3.786 0.020 . 2 . . . . A 972 GLY HA2 . 30810 1
59 . 1 . 1 17 17 GLY HA3 H 1 3.552 0.020 . 2 . . . . A 972 GLY HA3 . 30810 1
60 . 1 . 1 17 17 GLY CA C 13 47.118 0.3 . 1 . . . . A 972 GLY CA . 30810 1
61 . 1 . 1 17 17 GLY N N 15 108.479 0.3 . 1 . . . . A 972 GLY N . 30810 1
62 . 1 . 1 18 18 VAL H H 1 8.396 0.020 . 1 . . . . A 973 VAL H . 30810 1
63 . 1 . 1 18 18 VAL CA C 13 65.816 0.3 . 1 . . . . A 973 VAL CA . 30810 1
64 . 1 . 1 18 18 VAL CB C 13 30.238 0.3 . 1 . . . . A 973 VAL CB . 30810 1
65 . 1 . 1 18 18 VAL N N 15 122.704 0.3 . 1 . . . . A 973 VAL N . 30810 1
66 . 1 . 1 19 19 LEU H H 1 8.172 0.020 . 1 . . . . A 974 LEU H . 30810 1
67 . 1 . 1 19 19 LEU CA C 13 57.889 0.3 . 1 . . . . A 974 LEU CA . 30810 1
68 . 1 . 1 19 19 LEU CB C 13 40.342 0.3 . 1 . . . . A 974 LEU CB . 30810 1
69 . 1 . 1 19 19 LEU N N 15 119.294 0.3 . 1 . . . . A 974 LEU N . 30810 1
70 . 1 . 1 20 20 GLY H H 1 9.083 0.020 . 1 . . . . A 975 GLY H . 30810 1
71 . 1 . 1 20 20 GLY CA C 13 47.019 0.3 . 1 . . . . A 975 GLY CA . 30810 1
72 . 1 . 1 20 20 GLY N N 15 105.840 0.3 . 1 . . . . A 975 GLY N . 30810 1
73 . 1 . 1 21 21 GLY H H 1 8.560 0.020 . 1 . . . . A 976 GLY H . 30810 1
74 . 1 . 1 21 21 GLY CA C 13 47.244 0.3 . 1 . . . . A 976 GLY CA . 30810 1
75 . 1 . 1 21 21 GLY N N 15 109.223 0.3 . 1 . . . . A 976 GLY N . 30810 1
76 . 1 . 1 22 22 LEU H H 1 8.499 0.020 . 1 . . . . A 977 LEU H . 30810 1
77 . 1 . 1 22 22 LEU CA C 13 57.378 0.3 . 1 . . . . A 977 LEU CA . 30810 1
78 . 1 . 1 22 22 LEU CB C 13 40.617 0.3 . 1 . . . . A 977 LEU CB . 30810 1
79 . 1 . 1 22 22 LEU N N 15 120.878 0.3 . 1 . . . . A 977 LEU N . 30810 1
80 . 1 . 1 23 23 LEU H H 1 8.496 0.020 . 1 . . . . A 978 LEU H . 30810 1
81 . 1 . 1 23 23 LEU CA C 13 58.146 0.3 . 1 . . . . A 978 LEU CA . 30810 1
82 . 1 . 1 23 23 LEU CB C 13 40.454 0.3 . 1 . . . . A 978 LEU CB . 30810 1
83 . 1 . 1 23 23 LEU N N 15 123.099 0.3 . 1 . . . . A 978 LEU N . 30810 1
84 . 1 . 1 24 24 LEU H H 1 8.127 0.020 . 1 . . . . A 979 LEU H . 30810 1
85 . 1 . 1 24 24 LEU CA C 13 57.801 0.3 . 1 . . . . A 979 LEU CA . 30810 1
86 . 1 . 1 24 24 LEU CB C 13 40.707 0.3 . 1 . . . . A 979 LEU CB . 30810 1
87 . 1 . 1 24 24 LEU N N 15 118.426 0.3 . 1 . . . . A 979 LEU N . 30810 1
88 . 1 . 1 25 25 LEU H H 1 8.386 0.020 . 1 . . . . A 980 LEU H . 30810 1
89 . 1 . 1 25 25 LEU HA H 1 3.948 0.020 . 1 . . . . A 980 LEU HA . 30810 1
90 . 1 . 1 25 25 LEU HB2 H 1 1.832 0.020 . 1 . . . . A 980 LEU HB2 . 30810 1
91 . 1 . 1 25 25 LEU HB3 H 1 1.832 0.020 . 1 . . . . A 980 LEU HB3 . 30810 1
92 . 1 . 1 25 25 LEU HG H 1 1.624 0.020 . 1 . . . . A 980 LEU HG . 30810 1
93 . 1 . 1 25 25 LEU CA C 13 57.168 0.3 . 1 . . . . A 980 LEU CA . 30810 1
94 . 1 . 1 25 25 LEU CB C 13 40.760 0.3 . 1 . . . . A 980 LEU CB . 30810 1
95 . 1 . 1 25 25 LEU N N 15 118.683 0.3 . 1 . . . . A 980 LEU N . 30810 1
96 . 1 . 1 26 26 THR H H 1 8.062 0.020 . 1 . . . . A 981 THR H . 30810 1
97 . 1 . 1 26 26 THR HG1 H 1 4.128 0.020 . 1 . . . . A 981 THR HG1 . 30810 1
98 . 1 . 1 26 26 THR CA C 13 68.119 0.3 . 1 . . . . A 981 THR CA . 30810 1
99 . 1 . 1 26 26 THR CB C 13 67.074 0.3 . 1 . . . . A 981 THR CB . 30810 1
100 . 1 . 1 26 26 THR N N 15 116.689 0.3 . 1 . . . . A 981 THR N . 30810 1
101 . 1 . 1 27 27 ILE H H 1 7.670 0.020 . 1 . . . . A 982 ILE H . 30810 1
102 . 1 . 1 27 27 ILE CA C 13 64.984 0.3 . 1 . . . . A 982 ILE CA . 30810 1
103 . 1 . 1 27 27 ILE CB C 13 36.269 0.3 . 1 . . . . A 982 ILE CB . 30810 1
104 . 1 . 1 27 27 ILE N N 15 120.051 0.3 . 1 . . . . A 982 ILE N . 30810 1
105 . 1 . 1 28 28 LEU H H 1 7.991 0.020 . 1 . . . . A 983 LEU H . 30810 1
106 . 1 . 1 28 28 LEU HB2 H 1 1.624 0.020 . 1 . . . . A 983 LEU HB2 . 30810 1
107 . 1 . 1 28 28 LEU HB3 H 1 1.624 0.020 . 1 . . . . A 983 LEU HB3 . 30810 1
108 . 1 . 1 28 28 LEU CA C 13 57.991 0.3 . 1 . . . . A 983 LEU CA . 30810 1
109 . 1 . 1 28 28 LEU CB C 13 40.445 0.3 . 1 . . . . A 983 LEU CB . 30810 1
110 . 1 . 1 28 28 LEU N N 15 119.805 0.3 . 1 . . . . A 983 LEU N . 30810 1
111 . 1 . 1 29 29 VAL H H 1 8.774 0.020 . 1 . . . . A 984 VAL H . 30810 1
112 . 1 . 1 29 29 VAL CA C 13 66.813 0.3 . 1 . . . . A 984 VAL CA . 30810 1
113 . 1 . 1 29 29 VAL CB C 13 30.238 0.3 . 1 . . . . A 984 VAL CB . 30810 1
114 . 1 . 1 29 29 VAL N N 15 119.196 0.3 . 1 . . . . A 984 VAL N . 30810 1
115 . 1 . 1 30 30 LEU H H 1 8.322 0.020 . 1 . . . . A 985 LEU H . 30810 1
116 . 1 . 1 30 30 LEU CA C 13 58.088 0.3 . 1 . . . . A 985 LEU CA . 30810 1
117 . 1 . 1 30 30 LEU CB C 13 40.655 0.3 . 1 . . . . A 985 LEU CB . 30810 1
118 . 1 . 1 30 30 LEU N N 15 120.898 0.3 . 1 . . . . A 985 LEU N . 30810 1
119 . 1 . 1 31 31 ALA H H 1 8.318 0.020 . 1 . . . . A 986 ALA H . 30810 1
120 . 1 . 1 31 31 ALA CA C 13 55.163 0.3 . 1 . . . . A 986 ALA CA . 30810 1
121 . 1 . 1 31 31 ALA CB C 13 17.210 0.3 . 1 . . . . A 986 ALA CB . 30810 1
122 . 1 . 1 31 31 ALA N N 15 121.776 0.3 . 1 . . . . A 986 ALA N . 30810 1
123 . 1 . 1 32 32 MET H H 1 8.637 0.020 . 1 . . . . A 987 MET H . 30810 1
124 . 1 . 1 32 32 MET CA C 13 58.502 0.3 . 1 . . . . A 987 MET CA . 30810 1
125 . 1 . 1 32 32 MET CB C 13 32.340 0.3 . 1 . . . . A 987 MET CB . 30810 1
126 . 1 . 1 32 32 MET N N 15 116.395 0.3 . 1 . . . . A 987 MET N . 30810 1
127 . 1 . 1 33 33 TRP H H 1 9.280 0.020 . 1 . . . . A 988 TRP H . 30810 1
128 . 1 . 1 33 33 TRP CA C 13 60.026 0.3 . 1 . . . . A 988 TRP CA . 30810 1
129 . 1 . 1 33 33 TRP CB C 13 27.611 0.3 . 1 . . . . A 988 TRP CB . 30810 1
130 . 1 . 1 33 33 TRP N N 15 122.293 0.3 . 1 . . . . A 988 TRP N . 30810 1
131 . 1 . 1 34 34 LYS H H 1 8.413 0.020 . 1 . . . . A 989 LYS H . 30810 1
132 . 1 . 1 34 34 LYS CA C 13 57.940 0.3 . 1 . . . . A 989 LYS CA . 30810 1
133 . 1 . 1 34 34 LYS CB C 13 31.019 0.3 . 1 . . . . A 989 LYS CB . 30810 1
134 . 1 . 1 34 34 LYS N N 15 121.492 0.3 . 1 . . . . A 989 LYS N . 30810 1
135 . 1 . 1 35 35 VAL H H 1 7.577 0.020 . 1 . . . . A 990 VAL H . 30810 1
136 . 1 . 1 35 35 VAL CA C 13 61.161 0.3 . 1 . . . . A 990 VAL CA . 30810 1
137 . 1 . 1 35 35 VAL CB C 13 30.530 0.3 . 1 . . . . A 990 VAL CB . 30810 1
138 . 1 . 1 35 35 VAL N N 15 110.015 0.3 . 1 . . . . A 990 VAL N . 30810 1
139 . 1 . 1 36 36 GLY H H 1 7.534 0.020 . 1 . . . . A 991 GLY H . 30810 1
140 . 1 . 1 36 36 GLY CA C 13 45.644 0.3 . 1 . . . . A 991 GLY CA . 30810 1
141 . 1 . 1 36 36 GLY N N 15 107.160 0.3 . 1 . . . . A 991 GLY N . 30810 1
142 . 1 . 1 37 37 PHE H H 1 8.248 0.020 . 1 . . . . A 992 PHE H . 30810 1
143 . 1 . 1 37 37 PHE CA C 13 61.033 0.3 . 1 . . . . A 992 PHE CA . 30810 1
144 . 1 . 1 37 37 PHE CB C 13 40.550 0.3 . 1 . . . . A 992 PHE CB . 30810 1
145 . 1 . 1 37 37 PHE N N 15 120.961 0.3 . 1 . . . . A 992 PHE N . 30810 1
146 . 1 . 1 38 38 PHE H H 1 8.455 0.020 . 1 . . . . A 993 PHE H . 30810 1
147 . 1 . 1 38 38 PHE HE1 H 1 7.091 0.020 . 1 . . . . A 993 PHE HE1 . 30810 1
148 . 1 . 1 38 38 PHE HE2 H 1 7.091 0.020 . 1 . . . . A 993 PHE HE2 . 30810 1
149 . 1 . 1 38 38 PHE CA C 13 57.464 0.3 . 1 . . . . A 993 PHE CA . 30810 1
150 . 1 . 1 38 38 PHE CB C 13 37.769 0.3 . 1 . . . . A 993 PHE CB . 30810 1
151 . 1 . 1 38 38 PHE N N 15 111.983 0.3 . 1 . . . . A 993 PHE N . 30810 1
152 . 1 . 1 39 39 LYS H H 1 7.078 0.020 . 1 . . . . A 994 LYS H . 30810 1
153 . 1 . 1 39 39 LYS CA C 13 56.678 0.3 . 1 . . . . A 994 LYS CA . 30810 1
154 . 1 . 1 39 39 LYS CB C 13 31.961 0.3 . 1 . . . . A 994 LYS CB . 30810 1
155 . 1 . 1 39 39 LYS N N 15 120.235 0.3 . 1 . . . . A 994 LYS N . 30810 1
156 . 1 . 1 40 40 ARG H H 1 8.425 0.020 . 1 . . . . A 995 ARG H . 30810 1
157 . 1 . 1 40 40 ARG CA C 13 54.386 0.3 . 1 . . . . A 995 ARG CA . 30810 1
158 . 1 . 1 40 40 ARG CB C 13 31.385 0.3 . 1 . . . . A 995 ARG CB . 30810 1
159 . 1 . 1 40 40 ARG N N 15 123.257 0.3 . 1 . . . . A 995 ARG N . 30810 1
160 . 2 . 2 7 7 GLY H H 1 8.449 0.020 . 1 . . . . B 690 GLY H . 30810 1
161 . 2 . 2 7 7 GLY CA C 13 46.230 0.3 . 1 . . . . B 690 GLY CA . 30810 1
162 . 2 . 2 7 7 GLY N N 15 110.103 0.3 . 1 . . . . B 690 GLY N . 30810 1
163 . 2 . 2 8 8 PRO CA C 13 63.688 0.3 . 1 . . . . B 691 PRO CA . 30810 1
164 . 2 . 2 8 8 PRO CB C 13 30.914 0.3 . 1 . . . . B 691 PRO CB . 30810 1
165 . 2 . 2 9 9 ASP H H 1 8.149 0.020 . 1 . . . . B 692 ASP H . 30810 1
166 . 2 . 2 9 9 ASP CA C 13 55.597 0.3 . 1 . . . . B 692 ASP CA . 30810 1
167 . 2 . 2 9 9 ASP CB C 13 40.445 0.3 . 1 . . . . B 692 ASP CB . 30810 1
168 . 2 . 2 9 9 ASP N N 15 118.879 0.3 . 1 . . . . B 692 ASP N . 30810 1
169 . 2 . 2 10 10 ILE H H 1 8.248 0.020 . 1 . . . . B 693 ILE H . 30810 1
170 . 2 . 2 10 10 ILE CA C 13 64.448 0.3 . 1 . . . . B 693 ILE CA . 30810 1
171 . 2 . 2 10 10 ILE CB C 13 36.518 0.3 . 1 . . . . B 693 ILE CB . 30810 1
172 . 2 . 2 10 10 ILE N N 15 121.198 0.3 . 1 . . . . B 693 ILE N . 30810 1
173 . 2 . 2 11 11 LEU H H 1 8.281 0.020 . 1 . . . . B 694 LEU H . 30810 1
174 . 2 . 2 11 11 LEU CA C 13 57.639 0.3 . 1 . . . . B 694 LEU CA . 30810 1
175 . 2 . 2 11 11 LEU CB C 13 40.445 0.3 . 1 . . . . B 694 LEU CB . 30810 1
176 . 2 . 2 11 11 LEU N N 15 120.624 0.3 . 1 . . . . B 694 LEU N . 30810 1
177 . 2 . 2 12 12 VAL H H 1 7.853 0.020 . 1 . . . . B 695 VAL H . 30810 1
178 . 2 . 2 12 12 VAL CA C 13 66.542 0.3 . 1 . . . . B 695 VAL CA . 30810 1
179 . 2 . 2 12 12 VAL CB C 13 30.603 0.3 . 1 . . . . B 695 VAL CB . 30810 1
180 . 2 . 2 12 12 VAL N N 15 118.330 0.3 . 1 . . . . B 695 VAL N . 30810 1
181 . 2 . 2 13 13 VAL H H 1 7.923 0.020 . 1 . . . . B 696 VAL H . 30810 1
182 . 2 . 2 13 13 VAL CA C 13 66.971 0.3 . 1 . . . . B 696 VAL CA . 30810 1
183 . 2 . 2 13 13 VAL CB C 13 30.540 0.3 . 1 . . . . B 696 VAL CB . 30810 1
184 . 2 . 2 13 13 VAL N N 15 122.113 0.3 . 1 . . . . B 696 VAL N . 30810 1
185 . 2 . 2 14 14 LEU H H 1 8.327 0.020 . 1 . . . . B 697 LEU H . 30810 1
186 . 2 . 2 14 14 LEU HA H 1 3.759 0.020 . 1 . . . . B 697 LEU HA . 30810 1
187 . 2 . 2 14 14 LEU HB2 H 1 2.084 0.020 . 2 . . . . B 697 LEU HB2 . 30810 1
188 . 2 . 2 14 14 LEU HB3 H 1 1.877 0.020 . 2 . . . . B 697 LEU HB3 . 30810 1
189 . 2 . 2 14 14 LEU HG H 1 1.724 0.020 . 1 . . . . B 697 LEU HG . 30810 1
190 . 2 . 2 14 14 LEU CA C 13 58.818 0.3 . 1 . . . . B 697 LEU CA . 30810 1
191 . 2 . 2 14 14 LEU CB C 13 41.336 0.3 . 1 . . . . B 697 LEU CB . 30810 1
192 . 2 . 2 14 14 LEU N N 15 119.937 0.3 . 1 . . . . B 697 LEU N . 30810 1
193 . 2 . 2 15 15 LEU H H 1 8.378 0.020 . 1 . . . . B 698 LEU H . 30810 1
194 . 2 . 2 15 15 LEU CA C 13 57.378 0.3 . 1 . . . . B 698 LEU CA . 30810 1
195 . 2 . 2 15 15 LEU CB C 13 40.864 0.3 . 1 . . . . B 698 LEU CB . 30810 1
196 . 2 . 2 15 15 LEU N N 15 116.034 0.3 . 1 . . . . B 698 LEU N . 30810 1
197 . 2 . 2 16 16 SER H H 1 8.164 0.020 . 1 . . . . B 699 SER H . 30810 1
198 . 2 . 2 16 16 SER HG H 1 4.047 0.020 . 1 . . . . B 699 SER HG . 30810 1
199 . 2 . 2 16 16 SER CA C 13 63.059 0.3 . 1 . . . . B 699 SER CA . 30810 1
200 . 2 . 2 16 16 SER CB C 13 62.210 0.3 . 1 . . . . B 699 SER CB . 30810 1
201 . 2 . 2 16 16 SER N N 15 116.199 0.3 . 1 . . . . B 699 SER N . 30810 1
202 . 2 . 2 17 17 VAL H H 1 8.216 0.020 . 1 . . . . B 700 VAL H . 30810 1
203 . 2 . 2 17 17 VAL CA C 13 66.595 0.3 . 1 . . . . B 700 VAL CA . 30810 1
204 . 2 . 2 17 17 VAL CB C 13 30.914 0.3 . 1 . . . . B 700 VAL CB . 30810 1
205 . 2 . 2 17 17 VAL N N 15 121.542 0.3 . 1 . . . . B 700 VAL N . 30810 1
206 . 2 . 2 18 18 MET H H 1 7.925 0.020 . 1 . . . . B 701 MET H . 30810 1
207 . 2 . 2 18 18 MET HA H 1 3.813 0.020 . 1 . . . . B 701 MET HA . 30810 1
208 . 2 . 2 18 18 MET HB3 H 1 2.228 0.020 . 1 . . . . B 701 MET HB3 . 30810 1
209 . 2 . 2 18 18 MET HG2 H 1 2.876 0.020 . 2 . . . . B 701 MET HG2 . 30810 1
210 . 2 . 2 18 18 MET HG3 H 1 2.723 0.020 . 2 . . . . B 701 MET HG3 . 30810 1
211 . 2 . 2 18 18 MET HE1 H 1 1.895 0.020 . 1 . . . . B 701 MET HE1 . 30810 1
212 . 2 . 2 18 18 MET HE2 H 1 1.895 0.020 . 1 . . . . B 701 MET HE2 . 30810 1
213 . 2 . 2 18 18 MET HE3 H 1 1.895 0.020 . 1 . . . . B 701 MET HE3 . 30810 1
214 . 2 . 2 18 18 MET CA C 13 59.970 0.3 . 1 . . . . B 701 MET CA . 30810 1
215 . 2 . 2 18 18 MET CB C 13 33.031 0.3 . 1 . . . . B 701 MET CB . 30810 1
216 . 2 . 2 18 18 MET N N 15 116.921 0.3 . 1 . . . . B 701 MET N . 30810 1
217 . 2 . 2 19 19 GLY H H 1 8.711 0.020 . 1 . . . . B 702 GLY H . 30810 1
218 . 2 . 2 19 19 GLY CA C 13 46.612 0.3 . 1 . . . . B 702 GLY CA . 30810 1
219 . 2 . 2 19 19 GLY N N 15 104.700 0.3 . 1 . . . . B 702 GLY N . 30810 1
220 . 2 . 2 20 20 ALA H H 1 8.385 0.020 . 1 . . . . B 703 ALA H . 30810 1
221 . 2 . 2 20 20 ALA CA C 13 55.267 0.3 . 1 . . . . B 703 ALA CA . 30810 1
222 . 2 . 2 20 20 ALA CB C 13 17.271 0.3 . 1 . . . . B 703 ALA CB . 30810 1
223 . 2 . 2 20 20 ALA N N 15 123.509 0.3 . 1 . . . . B 703 ALA N . 30810 1
224 . 2 . 2 21 21 ILE H H 1 7.675 0.020 . 1 . . . . B 704 ILE H . 30810 1
225 . 2 . 2 21 21 ILE HB H 1 1.733 0.020 . 1 . . . . B 704 ILE HB . 30810 1
226 . 2 . 2 21 21 ILE HG13 H 1 1.462 0.020 . 1 . . . . B 704 ILE HG13 . 30810 1
227 . 2 . 2 21 21 ILE CA C 13 63.680 0.3 . 1 . . . . B 704 ILE CA . 30810 1
228 . 2 . 2 21 21 ILE CB C 13 36.112 0.3 . 1 . . . . B 704 ILE CB . 30810 1
229 . 2 . 2 21 21 ILE N N 15 116.398 0.3 . 1 . . . . B 704 ILE N . 30810 1
230 . 2 . 2 22 22 LEU H H 1 7.798 0.020 . 1 . . . . B 705 LEU H . 30810 1
231 . 2 . 2 22 22 LEU CA C 13 57.770 0.3 . 1 . . . . B 705 LEU CA . 30810 1
232 . 2 . 2 22 22 LEU CB C 13 41.074 0.3 . 1 . . . . B 705 LEU CB . 30810 1
233 . 2 . 2 22 22 LEU N N 15 118.984 0.3 . 1 . . . . B 705 LEU N . 30810 1
234 . 2 . 2 23 23 LEU H H 1 8.391 0.020 . 1 . . . . B 706 LEU H . 30810 1
235 . 2 . 2 23 23 LEU CA C 13 57.820 0.3 . 1 . . . . B 706 LEU CA . 30810 1
236 . 2 . 2 23 23 LEU CB C 13 40.864 0.3 . 1 . . . . B 706 LEU CB . 30810 1
237 . 2 . 2 23 23 LEU N N 15 117.501 0.3 . 1 . . . . B 706 LEU N . 30810 1
238 . 2 . 2 24 24 ILE H H 1 8.284 0.020 . 1 . . . . B 707 ILE H . 30810 1
239 . 2 . 2 24 24 ILE CA C 13 64.788 0.3 . 1 . . . . B 707 ILE CA . 30810 1
240 . 2 . 2 24 24 ILE CB C 13 36.425 0.3 . 1 . . . . B 707 ILE CB . 30810 1
241 . 2 . 2 24 24 ILE N N 15 118.489 0.3 . 1 . . . . B 707 ILE N . 30810 1
242 . 2 . 2 25 25 GLY H H 1 8.329 0.020 . 1 . . . . B 708 GLY H . 30810 1
243 . 2 . 2 25 25 GLY CA C 13 47.118 0.3 . 1 . . . . B 708 GLY CA . 30810 1
244 . 2 . 2 25 25 GLY N N 15 106.140 0.3 . 1 . . . . B 708 GLY N . 30810 1
245 . 2 . 2 26 26 LEU H H 1 8.581 0.020 . 1 . . . . B 709 LEU H . 30810 1
246 . 2 . 2 26 26 LEU CA C 13 57.614 0.3 . 1 . . . . B 709 LEU CA . 30810 1
247 . 2 . 2 26 26 LEU CB C 13 40.742 0.3 . 1 . . . . B 709 LEU CB . 30810 1
248 . 2 . 2 26 26 LEU N N 15 120.913 0.3 . 1 . . . . B 709 LEU N . 30810 1
249 . 2 . 2 27 27 ALA H H 1 8.498 0.020 . 1 . . . . B 710 ALA H . 30810 1
250 . 2 . 2 27 27 ALA CA C 13 55.298 0.3 . 1 . . . . B 710 ALA CA . 30810 1
251 . 2 . 2 27 27 ALA CB C 13 16.833 0.3 . 1 . . . . B 710 ALA CB . 30810 1
252 . 2 . 2 27 27 ALA N N 15 120.458 0.3 . 1 . . . . B 710 ALA N . 30810 1
253 . 2 . 2 28 28 ALA H H 1 8.236 0.020 . 1 . . . . B 711 ALA H . 30810 1
254 . 2 . 2 28 28 ALA CA C 13 55.267 0.3 . 1 . . . . B 711 ALA CA . 30810 1
255 . 2 . 2 28 28 ALA CB C 13 17.021 0.3 . 1 . . . . B 711 ALA CB . 30810 1
256 . 2 . 2 28 28 ALA N N 15 118.670 0.3 . 1 . . . . B 711 ALA N . 30810 1
257 . 2 . 2 29 29 LEU H H 1 8.039 0.020 . 1 . . . . B 712 LEU H . 30810 1
258 . 2 . 2 29 29 LEU CA C 13 57.976 0.3 . 1 . . . . B 712 LEU CA . 30810 1
259 . 2 . 2 29 29 LEU CB C 13 41.073 0.3 . 1 . . . . B 712 LEU CB . 30810 1
260 . 2 . 2 29 29 LEU N N 15 117.186 0.3 . 1 . . . . B 712 LEU N . 30810 1
261 . 2 . 2 30 30 LEU H H 1 8.461 0.020 . 1 . . . . B 713 LEU H . 30810 1
262 . 2 . 2 30 30 LEU CA C 13 57.849 0.3 . 1 . . . . B 713 LEU CA . 30810 1
263 . 2 . 2 30 30 LEU CB C 13 40.445 0.3 . 1 . . . . B 713 LEU CB . 30810 1
264 . 2 . 2 30 30 LEU N N 15 118.986 0.3 . 1 . . . . B 713 LEU N . 30810 1
265 . 2 . 2 31 31 ILE H H 1 8.534 0.020 . 1 . . . . B 714 ILE H . 30810 1
266 . 2 . 2 31 31 ILE CA C 13 65.078 0.3 . 1 . . . . B 714 ILE CA . 30810 1
267 . 2 . 2 31 31 ILE CB C 13 36.112 0.3 . 1 . . . . B 714 ILE CB . 30810 1
268 . 2 . 2 31 31 ILE N N 15 119.811 0.3 . 1 . . . . B 714 ILE N . 30810 1
269 . 2 . 2 32 32 TRP H H 1 8.574 0.020 . 1 . . . . B 715 TRP H . 30810 1
270 . 2 . 2 32 32 TRP CA C 13 62.117 0.3 . 1 . . . . B 715 TRP CA . 30810 1
271 . 2 . 2 32 32 TRP CB C 13 27.667 0.3 . 1 . . . . B 715 TRP CB . 30810 1
272 . 2 . 2 32 32 TRP N N 15 120.832 0.3 . 1 . . . . B 715 TRP N . 30810 1
273 . 2 . 2 33 33 LYS H H 1 8.288 0.020 . 1 . . . . B 716 LYS H . 30810 1
274 . 2 . 2 33 33 LYS CA C 13 56.472 0.3 . 1 . . . . B 716 LYS CA . 30810 1
275 . 2 . 2 33 33 LYS CB C 13 31.280 0.3 . 1 . . . . B 716 LYS CB . 30810 1
276 . 2 . 2 33 33 LYS N N 15 117.703 0.3 . 1 . . . . B 716 LYS N . 30810 1
277 . 2 . 2 34 34 LEU H H 1 8.448 0.020 . 1 . . . . B 717 LEU H . 30810 1
278 . 2 . 2 34 34 LEU CA C 13 58.084 0.3 . 1 . . . . B 717 LEU CA . 30810 1
279 . 2 . 2 34 34 LEU CB C 13 40.930 0.3 . 1 . . . . B 717 LEU CB . 30810 1
280 . 2 . 2 34 34 LEU N N 15 122.578 0.3 . 1 . . . . B 717 LEU N . 30810 1
281 . 2 . 2 35 35 LEU H H 1 8.265 0.020 . 1 . . . . B 718 LEU H . 30810 1
282 . 2 . 2 35 35 LEU CA C 13 57.639 0.3 . 1 . . . . B 718 LEU CA . 30810 1
283 . 2 . 2 35 35 LEU CB C 13 40.445 0.3 . 1 . . . . B 718 LEU CB . 30810 1
284 . 2 . 2 35 35 LEU N N 15 118.098 0.3 . 1 . . . . B 718 LEU N . 30810 1
285 . 2 . 2 36 36 ILE H H 1 8.394 0.020 . 1 . . . . B 719 ILE H . 30810 1
286 . 2 . 2 36 36 ILE CA C 13 62.091 0.3 . 1 . . . . B 719 ILE CA . 30810 1
287 . 2 . 2 36 36 ILE CB C 13 36.151 0.3 . 1 . . . . B 719 ILE CB . 30810 1
288 . 2 . 2 36 36 ILE N N 15 118.411 0.3 . 1 . . . . B 719 ILE N . 30810 1
289 . 2 . 2 37 37 THR H H 1 7.511 0.020 . 1 . . . . B 720 THR H . 30810 1
290 . 2 . 2 37 37 THR CA C 13 66.333 0.3 . 1 . . . . B 720 THR CA . 30810 1
291 . 2 . 2 37 37 THR CB C 13 68.030 0.3 . 1 . . . . B 720 THR CB . 30810 1
292 . 2 . 2 37 37 THR N N 15 118.258 0.3 . 1 . . . . B 720 THR N . 30810 1
293 . 2 . 2 38 38 ILE H H 1 7.683 0.020 . 1 . . . . B 721 ILE H . 30810 1
294 . 2 . 2 38 38 ILE CA C 13 64.268 0.3 . 1 . . . . B 721 ILE CA . 30810 1
295 . 2 . 2 38 38 ILE CB C 13 36.948 0.3 . 1 . . . . B 721 ILE CB . 30810 1
296 . 2 . 2 38 38 ILE N N 15 120.401 0.3 . 1 . . . . B 721 ILE N . 30810 1
297 . 2 . 2 39 39 HIS H H 1 8.100 0.020 . 1 . . . . B 722 HIS H . 30810 1
298 . 2 . 2 39 39 HIS CA C 13 55.992 0.3 . 1 . . . . B 722 HIS CA . 30810 1
299 . 2 . 2 39 39 HIS CB C 13 29.429 0.3 . 1 . . . . B 722 HIS CB . 30810 1
300 . 2 . 2 39 39 HIS N N 15 119.703 0.3 . 1 . . . . B 722 HIS N . 30810 1
301 . 2 . 2 41 41 ARG H H 1 7.544 0.020 . 1 . . . . B 724 ARG H . 30810 1
302 . 2 . 2 41 41 ARG CA C 13 56.173 0.3 . 1 . . . . B 724 ARG CA . 30810 1
303 . 2 . 2 41 41 ARG CB C 13 29.395 0.3 . 1 . . . . B 724 ARG CB . 30810 1
304 . 2 . 2 41 41 ARG N N 15 119.603 0.3 . 1 . . . . B 724 ARG N . 30810 1
305 . 2 . 2 42 42 LYS H H 1 7.792 0.020 . 1 . . . . B 725 LYS H . 30810 1
306 . 2 . 2 42 42 LYS CA C 13 56.199 0.3 . 1 . . . . B 725 LYS CA . 30810 1
307 . 2 . 2 42 42 LYS CB C 13 31.647 0.3 . 1 . . . . B 725 LYS CB . 30810 1
308 . 2 . 2 42 42 LYS N N 15 120.885 0.3 . 1 . . . . B 725 LYS N . 30810 1
309 . 2 . 2 43 43 GLU H H 1 8.029 0.020 . 1 . . . . B 726 GLU H . 30810 1
310 . 2 . 2 43 43 GLU CA C 13 56.042 0.3 . 1 . . . . B 726 GLU CA . 30810 1
311 . 2 . 2 43 43 GLU CB C 13 29.552 0.3 . 1 . . . . B 726 GLU CB . 30810 1
312 . 2 . 2 43 43 GLU N N 15 121.182 0.3 . 1 . . . . B 726 GLU N . 30810 1
313 . 2 . 2 44 44 PHE H H 1 7.555 0.020 . 1 . . . . B 727 PHE H . 30810 1
314 . 2 . 2 44 44 PHE CA C 13 58.635 0.3 . 1 . . . . B 727 PHE CA . 30810 1
315 . 2 . 2 44 44 PHE CB C 13 39.555 0.3 . 1 . . . . B 727 PHE CB . 30810 1
316 . 2 . 2 44 44 PHE N N 15 125.210 0.3 . 1 . . . . B 727 PHE N . 30810 1
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