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 30934
_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 1D . . . 30934 1
2 '2D 1H-1H TOCSY' . . . 30934 1
3 '2D 1H-1H NOESY' . . . 30934 1
4 '2D 1H-13C HSQC' . . . 30934 1
5 '2D 1H-15N HSQC' . . . 30934 1
6 '2D 1H-1H TOCSY' . . . 30934 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 1 1 GLY HA2 H 1 3.831 0.000 . . . . . A A 1 GLY HA2 . 30934 1
2 . 1 . 1 1 1 GLY HA3 H 1 3.831 0.000 . . . . . A A 1 GLY HA3 . 30934 1
3 . 1 . 1 1 1 GLY CA C 13 42.962 0.000 . . . . . A A 1 GLY CA . 30934 1
4 . 1 . 1 2 2 LEU H H 1 8.520 0.000 . . . . . A A 2 LEU H . 30934 1
5 . 1 . 1 2 2 LEU HA H 1 4.346 0.000 . . . . . A A 2 LEU HA . 30934 1
6 . 1 . 1 2 2 LEU HB2 H 1 1.555 0.000 . . . . . A A 2 LEU HB2 . 30934 1
7 . 1 . 1 2 2 LEU HB3 H 1 1.573 0.004 . . . . . A A 2 LEU HB3 . 30934 1
8 . 1 . 1 2 2 LEU HG H 1 1.549 0.000 . . . . . A A 2 LEU HG . 30934 1
9 . 1 . 1 2 2 LEU HD11 H 1 0.897 0.000 . . . . . A A 2 LEU HD11 . 30934 1
10 . 1 . 1 2 2 LEU HD12 H 1 0.897 0.000 . . . . . A A 2 LEU HD12 . 30934 1
11 . 1 . 1 2 2 LEU HD13 H 1 0.897 0.000 . . . . . A A 2 LEU HD13 . 30934 1
12 . 1 . 1 2 2 LEU HD21 H 1 0.871 0.000 . . . . . A A 2 LEU HD21 . 30934 1
13 . 1 . 1 2 2 LEU HD22 H 1 0.871 0.000 . . . . . A A 2 LEU HD22 . 30934 1
14 . 1 . 1 2 2 LEU HD23 H 1 0.871 0.000 . . . . . A A 2 LEU HD23 . 30934 1
15 . 1 . 1 2 2 LEU CA C 13 55.008 0.000 . . . . . A A 2 LEU CA . 30934 1
16 . 1 . 1 2 2 LEU CB C 13 42.925 0.000 . . . . . A A 2 LEU CB . 30934 1
17 . 1 . 1 2 2 LEU CG C 13 26.659 0.000 . . . . . A A 2 LEU CG . 30934 1
18 . 1 . 1 2 2 LEU CD1 C 13 24.805 0.000 . . . . . A A 2 LEU CD1 . 30934 1
19 . 1 . 1 2 2 LEU CD2 C 13 23.840 0.000 . . . . . A A 2 LEU CD2 . 30934 1
20 . 1 . 1 2 2 LEU N N 15 121.713 0.000 . . . . . A A 2 LEU N . 30934 1
21 . 1 . 1 3 3 LEU H H 1 8.272 0.000 . . . . . A A 3 LEU H . 30934 1
22 . 1 . 1 3 3 LEU HA H 1 4.255 0.000 . . . . . A A 3 LEU HA . 30934 1
23 . 1 . 1 3 3 LEU HB2 H 1 1.460 0.000 . . . . . A A 3 LEU HB2 . 30934 1
24 . 1 . 1 3 3 LEU HB3 H 1 1.487 0.004 . . . . . A A 3 LEU HB3 . 30934 1
25 . 1 . 1 3 3 LEU HG H 1 1.443 0.000 . . . . . A A 3 LEU HG . 30934 1
26 . 1 . 1 3 3 LEU HD11 H 1 0.871 0.000 . . . . . A A 3 LEU HD11 . 30934 1
27 . 1 . 1 3 3 LEU HD12 H 1 0.871 0.000 . . . . . A A 3 LEU HD12 . 30934 1
28 . 1 . 1 3 3 LEU HD13 H 1 0.871 0.000 . . . . . A A 3 LEU HD13 . 30934 1
29 . 1 . 1 3 3 LEU HD21 H 1 0.820 0.000 . . . . . A A 3 LEU HD21 . 30934 1
30 . 1 . 1 3 3 LEU HD22 H 1 0.820 0.000 . . . . . A A 3 LEU HD22 . 30934 1
31 . 1 . 1 3 3 LEU HD23 H 1 0.820 0.000 . . . . . A A 3 LEU HD23 . 30934 1
32 . 1 . 1 3 3 LEU CA C 13 54.882 0.000 . . . . . A A 3 LEU CA . 30934 1
33 . 1 . 1 3 3 LEU CB C 13 42.250 0.000 . . . . . A A 3 LEU CB . 30934 1
34 . 1 . 1 3 3 LEU CG C 13 26.825 0.000 . . . . . A A 3 LEU CG . 30934 1
35 . 1 . 1 3 3 LEU CD1 C 13 23.926 0.000 . . . . . A A 3 LEU CD1 . 30934 1
36 . 1 . 1 3 3 LEU CD2 C 13 23.411 0.000 . . . . . A A 3 LEU CD2 . 30934 1
37 . 1 . 1 3 3 LEU N N 15 124.856 0.000 . . . . . A A 3 LEU N . 30934 1
38 . 1 . 1 4 4 CYS H H 1 7.639 0.000 . . . . . A A 4 CYS H . 30934 1
39 . 1 . 1 4 4 CYS HA H 1 4.989 0.000 . . . . . A A 4 CYS HA . 30934 1
40 . 1 . 1 4 4 CYS HB2 H 1 1.704 0.005 . . . . . A A 4 CYS HB2 . 30934 1
41 . 1 . 1 4 4 CYS HB3 H 1 2.757 0.005 . . . . . A A 4 CYS HB3 . 30934 1
42 . 1 . 1 4 4 CYS CA C 13 55.611 0.000 . . . . . A A 4 CYS CA . 30934 1
43 . 1 . 1 4 4 CYS CB C 13 48.735 0.000 . . . . . A A 4 CYS CB . 30934 1
44 . 1 . 1 4 4 CYS N N 15 118.519 0.000 . . . . . A A 4 CYS N . 30934 1
45 . 1 . 1 5 5 TYR H H 1 8.846 0.000 . . . . . A A 5 TYR H . 30934 1
46 . 1 . 1 5 5 TYR HA H 1 4.593 0.000 . . . . . A A 5 TYR HA . 30934 1
47 . 1 . 1 5 5 TYR HB2 H 1 2.389 0.005 . . . . . A A 5 TYR HB2 . 30934 1
48 . 1 . 1 5 5 TYR HB3 H 1 2.924 0.004 . . . . . A A 5 TYR HB3 . 30934 1
49 . 1 . 1 5 5 TYR HD1 H 1 7.028 0.001 . . . . . A A 5 TYR HD1 . 30934 1
50 . 1 . 1 5 5 TYR HD2 H 1 7.028 0.001 . . . . . A A 5 TYR HD2 . 30934 1
51 . 1 . 1 5 5 TYR HE1 H 1 6.720 0.002 . . . . . A A 5 TYR HE1 . 30934 1
52 . 1 . 1 5 5 TYR HE2 H 1 6.720 0.002 . . . . . A A 5 TYR HE2 . 30934 1
53 . 1 . 1 5 5 TYR CA C 13 57.201 0.000 . . . . . A A 5 TYR CA . 30934 1
54 . 1 . 1 5 5 TYR CB C 13 42.630 0.000 . . . . . A A 5 TYR CB . 30934 1
55 . 1 . 1 5 5 TYR N N 15 117.771 0.000 . . . . . A A 5 TYR N . 30934 1
56 . 1 . 1 6 6 CYS H H 1 9.128 0.001 . . . . . A A 6 CYS H . 30934 1
57 . 1 . 1 6 6 CYS HA H 1 5.663 0.005 . . . . . A A 6 CYS HA . 30934 1
58 . 1 . 1 6 6 CYS HB2 H 1 2.885 0.005 . . . . . A A 6 CYS HB2 . 30934 1
59 . 1 . 1 6 6 CYS HB3 H 1 3.005 0.004 . . . . . A A 6 CYS HB3 . 30934 1
60 . 1 . 1 6 6 CYS CA C 13 55.308 0.000 . . . . . A A 6 CYS CA . 30934 1
61 . 1 . 1 6 6 CYS CB C 13 41.055 0.000 . . . . . A A 6 CYS CB . 30934 1
62 . 1 . 1 6 6 CYS N N 15 123.358 0.000 . . . . . A A 6 CYS N . 30934 1
63 . 1 . 1 7 7 ARG H H 1 9.888 0.000 . . . . . A A 7 ARG H . 30934 1
64 . 1 . 1 7 7 ARG HA H 1 4.841 0.000 . . . . . A A 7 ARG HA . 30934 1
65 . 1 . 1 7 7 ARG HB2 H 1 1.646 0.000 . . . . . A A 7 ARG HB2 . 30934 1
66 . 1 . 1 7 7 ARG HB3 H 1 1.728 0.000 . . . . . A A 7 ARG HB3 . 30934 1
67 . 1 . 1 7 7 ARG HG2 H 1 1.401 0.000 . . . . . A A 7 ARG HG2 . 30934 1
68 . 1 . 1 7 7 ARG HG3 H 1 1.742 0.000 . . . . . A A 7 ARG HG3 . 30934 1
69 . 1 . 1 7 7 ARG HD2 H 1 3.221 0.003 . . . . . A A 7 ARG HD2 . 30934 1
70 . 1 . 1 7 7 ARG HD3 H 1 3.221 0.003 . . . . . A A 7 ARG HD3 . 30934 1
71 . 1 . 1 7 7 ARG HE H 1 9.634 0.002 . . . . . A A 7 ARG HE . 30934 1
72 . 1 . 1 7 7 ARG CB C 13 33.235 0.000 . . . . . A A 7 ARG CB . 30934 1
73 . 1 . 1 7 7 ARG CG C 13 28.470 0.000 . . . . . A A 7 ARG CG . 30934 1
74 . 1 . 1 7 7 ARG CD C 13 43.134 0.000 . . . . . A A 7 ARG CD . 30934 1
75 . 1 . 1 7 7 ARG N N 15 126.702 0.000 . . . . . A A 7 ARG N . 30934 1
76 . 1 . 1 7 7 ARG NE N 15 124.657 0.000 . . . . . A A 7 ARG NE . 30934 1
77 . 1 . 1 8 8 LYS H H 1 8.749 0.000 . . . . . A A 8 LYS H . 30934 1
78 . 1 . 1 8 8 LYS HA H 1 3.838 0.000 . . . . . A A 8 LYS HA . 30934 1
79 . 1 . 1 8 8 LYS HB2 H 1 1.297 0.000 . . . . . A A 8 LYS HB2 . 30934 1
80 . 1 . 1 8 8 LYS HB3 H 1 1.603 0.000 . . . . . A A 8 LYS HB3 . 30934 1
81 . 1 . 1 8 8 LYS HG2 H 1 1.022 0.000 . . . . . A A 8 LYS HG2 . 30934 1
82 . 1 . 1 8 8 LYS HG3 H 1 1.022 0.000 . . . . . A A 8 LYS HG3 . 30934 1
83 . 1 . 1 8 8 LYS HD2 H 1 1.487 0.000 . . . . . A A 8 LYS HD2 . 30934 1
84 . 1 . 1 8 8 LYS HD3 H 1 1.487 0.000 . . . . . A A 8 LYS HD3 . 30934 1
85 . 1 . 1 8 8 LYS HE2 H 1 2.827 0.000 . . . . . A A 8 LYS HE2 . 30934 1
86 . 1 . 1 8 8 LYS HE3 H 1 2.827 0.000 . . . . . A A 8 LYS HE3 . 30934 1
87 . 1 . 1 8 8 LYS CA C 13 56.284 0.000 . . . . . A A 8 LYS CA . 30934 1
88 . 1 . 1 8 8 LYS CB C 13 32.762 0.000 . . . . . A A 8 LYS CB . 30934 1
89 . 1 . 1 8 8 LYS CG C 13 24.934 0.000 . . . . . A A 8 LYS CG . 30934 1
90 . 1 . 1 8 8 LYS CD C 13 28.995 0.000 . . . . . A A 8 LYS CD . 30934 1
91 . 1 . 1 8 8 LYS CE C 13 41.808 0.000 . . . . . A A 8 LYS CE . 30934 1
92 . 1 . 1 8 8 LYS N N 15 123.093 0.000 . . . . . A A 8 LYS N . 30934 1
93 . 1 . 1 9 9 GLY H H 1 8.867 0.000 . . . . . A A 9 GLY H . 30934 1
94 . 1 . 1 9 9 GLY HA2 H 1 4.238 0.000 . . . . . A A 9 GLY HA2 . 30934 1
95 . 1 . 1 9 9 GLY HA3 H 1 3.383 0.005 . . . . . A A 9 GLY HA3 . 30934 1
96 . 1 . 1 9 9 GLY CA C 13 47.659 0.000 . . . . . A A 9 GLY CA . 30934 1
97 . 1 . 1 9 9 GLY N N 15 115.685 0.000 . . . . . A A 9 GLY N . 30934 1
98 . 1 . 1 10 10 HIS H H 1 8.081 0.000 . . . . . A A 10 HIS H . 30934 1
99 . 1 . 1 10 10 HIS HA H 1 4.625 0.000 . . . . . A A 10 HIS HA . 30934 1
100 . 1 . 1 10 10 HIS HB2 H 1 3.102 0.000 . . . . . A A 10 HIS HB2 . 30934 1
101 . 1 . 1 10 10 HIS HB3 H 1 3.358 0.000 . . . . . A A 10 HIS HB3 . 30934 1
102 . 1 . 1 10 10 HIS HD2 H 1 7.296 0.000 . . . . . A A 10 HIS HD2 . 30934 1
103 . 1 . 1 10 10 HIS HE1 H 1 8.595 0.000 . . . . . A A 10 HIS HE1 . 30934 1
104 . 1 . 1 10 10 HIS CA C 13 54.991 0.000 . . . . . A A 10 HIS CA . 30934 1
105 . 1 . 1 10 10 HIS CB C 13 31.131 0.000 . . . . . A A 10 HIS CB . 30934 1
106 . 1 . 1 10 10 HIS N N 15 117.072 0.000 . . . . . A A 10 HIS N . 30934 1
107 . 1 . 1 11 11 CYS H H 1 8.911 0.000 . . . . . A A 11 CYS H . 30934 1
108 . 1 . 1 11 11 CYS HA H 1 5.009 0.000 . . . . . A A 11 CYS HA . 30934 1
109 . 1 . 1 11 11 CYS HB2 H 1 2.645 0.006 . . . . . A A 11 CYS HB2 . 30934 1
110 . 1 . 1 11 11 CYS HB3 H 1 3.732 0.000 . . . . . A A 11 CYS HB3 . 30934 1
111 . 1 . 1 11 11 CYS CA C 13 52.299 0.000 . . . . . A A 11 CYS CA . 30934 1
112 . 1 . 1 11 11 CYS CB C 13 36.590 0.007 . . . . . A A 11 CYS CB . 30934 1
113 . 1 . 1 11 11 CYS N N 15 117.771 0.000 . . . . . A A 11 CYS N . 30934 1
114 . 1 . 1 12 12 LYS H H 1 8.602 0.000 . . . . . A A 12 LYS H . 30934 1
115 . 1 . 1 12 12 LYS HA H 1 4.371 0.000 . . . . . A A 12 LYS HA . 30934 1
116 . 1 . 1 12 12 LYS HB2 H 1 1.370 0.000 . . . . . A A 12 LYS HB2 . 30934 1
117 . 1 . 1 12 12 LYS HB3 H 1 1.893 0.000 . . . . . A A 12 LYS HB3 . 30934 1
118 . 1 . 1 12 12 LYS HG2 H 1 1.341 0.000 . . . . . A A 12 LYS HG2 . 30934 1
119 . 1 . 1 12 12 LYS HG3 H 1 1.341 0.000 . . . . . A A 12 LYS HG3 . 30934 1
120 . 1 . 1 12 12 LYS HD2 H 1 1.532 0.000 . . . . . A A 12 LYS HD2 . 30934 1
121 . 1 . 1 12 12 LYS HD3 H 1 1.532 0.000 . . . . . A A 12 LYS HD3 . 30934 1
122 . 1 . 1 12 12 LYS HE2 H 1 2.865 0.004 . . . . . A A 12 LYS HE2 . 30934 1
123 . 1 . 1 12 12 LYS HE3 H 1 2.865 0.004 . . . . . A A 12 LYS HE3 . 30934 1
124 . 1 . 1 12 12 LYS CA C 13 56.343 0.000 . . . . . A A 12 LYS CA . 30934 1
125 . 1 . 1 12 12 LYS CB C 13 33.513 0.000 . . . . . A A 12 LYS CB . 30934 1
126 . 1 . 1 12 12 LYS CG C 13 25.899 0.000 . . . . . A A 12 LYS CG . 30934 1
127 . 1 . 1 12 12 LYS CD C 13 29.116 0.000 . . . . . A A 12 LYS CD . 30934 1
128 . 1 . 1 12 12 LYS CE C 13 41.549 0.000 . . . . . A A 12 LYS CE . 30934 1
129 . 1 . 1 12 12 LYS N N 15 120.565 0.000 . . . . . A A 12 LYS N . 30934 1
130 . 1 . 1 13 13 ARG H H 1 8.533 0.000 . . . . . A A 13 ARG H . 30934 1
131 . 1 . 1 13 13 ARG HA H 1 4.076 0.000 . . . . . A A 13 ARG HA . 30934 1
132 . 1 . 1 13 13 ARG HB2 H 1 1.730 0.000 . . . . . A A 13 ARG HB2 . 30934 1
133 . 1 . 1 13 13 ARG HB3 H 1 1.791 0.000 . . . . . A A 13 ARG HB3 . 30934 1
134 . 1 . 1 13 13 ARG HG2 H 1 1.624 0.005 . . . . . A A 13 ARG HG2 . 30934 1
135 . 1 . 1 13 13 ARG HG3 H 1 1.624 0.005 . . . . . A A 13 ARG HG3 . 30934 1
136 . 1 . 1 13 13 ARG HD2 H 1 3.219 0.004 . . . . . A A 13 ARG HD2 . 30934 1
137 . 1 . 1 13 13 ARG HD3 H 1 3.219 0.004 . . . . . A A 13 ARG HD3 . 30934 1
138 . 1 . 1 13 13 ARG HE H 1 7.216 0.000 . . . . . A A 13 ARG HE . 30934 1
139 . 1 . 1 13 13 ARG CA C 13 58.424 0.000 . . . . . A A 13 ARG CA . 30934 1
140 . 1 . 1 13 13 ARG CB C 13 29.609 0.000 . . . . . A A 13 ARG CB . 30934 1
141 . 1 . 1 13 13 ARG CG C 13 27.712 0.000 . . . . . A A 13 ARG CG . 30934 1
142 . 1 . 1 13 13 ARG CD C 13 43.692 0.000 . . . . . A A 13 ARG CD . 30934 1
143 . 1 . 1 13 13 ARG N N 15 121.563 0.000 . . . . . A A 13 ARG N . 30934 1
144 . 1 . 1 14 14 GLY H H 1 8.925 0.000 . . . . . A A 14 GLY H . 30934 1
145 . 1 . 1 14 14 GLY HA2 H 1 4.203 0.007 . . . . . A A 14 GLY HA2 . 30934 1
146 . 1 . 1 14 14 GLY HA3 H 1 3.792 0.006 . . . . . A A 14 GLY HA3 . 30934 1
147 . 1 . 1 14 14 GLY CA C 13 45.207 0.000 . . . . . A A 14 GLY CA . 30934 1
148 . 1 . 1 14 14 GLY N N 15 112.403 0.000 . . . . . A A 14 GLY N . 30934 1
149 . 1 . 1 15 15 GLU H H 1 7.826 0.000 . . . . . A A 15 GLU H . 30934 1
150 . 1 . 1 15 15 GLU HA H 1 4.745 0.000 . . . . . A A 15 GLU HA . 30934 1
151 . 1 . 1 15 15 GLU HB2 H 1 1.592 0.000 . . . . . A A 15 GLU HB2 . 30934 1
152 . 1 . 1 15 15 GLU HB3 H 1 2.442 0.000 . . . . . A A 15 GLU HB3 . 30934 1
153 . 1 . 1 15 15 GLU HG2 H 1 1.858 0.000 . . . . . A A 15 GLU HG2 . 30934 1
154 . 1 . 1 15 15 GLU HG3 H 1 2.057 0.000 . . . . . A A 15 GLU HG3 . 30934 1
155 . 1 . 1 15 15 GLU CB C 13 32.505 0.000 . . . . . A A 15 GLU CB . 30934 1
156 . 1 . 1 15 15 GLU CG C 13 36.323 0.000 . . . . . A A 15 GLU CG . 30934 1
157 . 1 . 1 15 15 GLU N N 15 118.070 0.000 . . . . . A A 15 GLU N . 30934 1
158 . 1 . 1 16 16 ARG H H 1 9.119 0.000 . . . . . A A 16 ARG H . 30934 1
159 . 1 . 1 16 16 ARG HA H 1 4.702 0.000 . . . . . A A 16 ARG HA . 30934 1
160 . 1 . 1 16 16 ARG HB2 H 1 1.526 0.000 . . . . . A A 16 ARG HB2 . 30934 1
161 . 1 . 1 16 16 ARG HB3 H 1 1.720 0.000 . . . . . A A 16 ARG HB3 . 30934 1
162 . 1 . 1 16 16 ARG HG2 H 1 1.513 0.000 . . . . . A A 16 ARG HG2 . 30934 1
163 . 1 . 1 16 16 ARG HG3 H 1 1.513 0.000 . . . . . A A 16 ARG HG3 . 30934 1
164 . 1 . 1 16 16 ARG HD2 H 1 3.183 0.000 . . . . . A A 16 ARG HD2 . 30934 1
165 . 1 . 1 16 16 ARG HD3 H 1 3.183 0.000 . . . . . A A 16 ARG HD3 . 30934 1
166 . 1 . 1 16 16 ARG HE H 1 7.220 0.000 . . . . . A A 16 ARG HE . 30934 1
167 . 1 . 1 16 16 ARG CB C 13 33.460 0.000 . . . . . A A 16 ARG CB . 30934 1
168 . 1 . 1 16 16 ARG CG C 13 26.930 0.000 . . . . . A A 16 ARG CG . 30934 1
169 . 1 . 1 16 16 ARG CD C 13 43.904 0.000 . . . . . A A 16 ARG CD . 30934 1
170 . 1 . 1 16 16 ARG N N 15 119.318 0.000 . . . . . A A 16 ARG N . 30934 1
171 . 1 . 1 17 17 VAL H H 1 8.778 0.000 . . . . . A A 17 VAL H . 30934 1
172 . 1 . 1 17 17 VAL HA H 1 4.265 0.000 . . . . . A A 17 VAL HA . 30934 1
173 . 1 . 1 17 17 VAL HB H 1 2.168 0.004 . . . . . A A 17 VAL HB . 30934 1
174 . 1 . 1 17 17 VAL HG11 H 1 1.215 0.000 . . . . . A A 17 VAL HG11 . 30934 1
175 . 1 . 1 17 17 VAL HG12 H 1 1.215 0.000 . . . . . A A 17 VAL HG12 . 30934 1
176 . 1 . 1 17 17 VAL HG13 H 1 1.215 0.000 . . . . . A A 17 VAL HG13 . 30934 1
177 . 1 . 1 17 17 VAL HG21 H 1 1.194 0.000 . . . . . A A 17 VAL HG21 . 30934 1
178 . 1 . 1 17 17 VAL HG22 H 1 1.194 0.000 . . . . . A A 17 VAL HG22 . 30934 1
179 . 1 . 1 17 17 VAL HG23 H 1 1.194 0.000 . . . . . A A 17 VAL HG23 . 30934 1
180 . 1 . 1 17 17 VAL CA C 13 63.493 0.000 . . . . . A A 17 VAL CA . 30934 1
181 . 1 . 1 17 17 VAL CB C 13 32.247 0.000 . . . . . A A 17 VAL CB . 30934 1
182 . 1 . 1 17 17 VAL CG1 C 13 23.261 0.000 . . . . . A A 17 VAL CG1 . 30934 1
183 . 1 . 1 17 17 VAL CG2 C 13 22.253 0.000 . . . . . A A 17 VAL CG2 . 30934 1
184 . 1 . 1 17 17 VAL N N 15 124.499 0.000 . . . . . A A 17 VAL N . 30934 1
185 . 1 . 1 18 18 ARG H H 1 9.530 0.000 . . . . . A A 18 ARG H . 30934 1
186 . 1 . 1 18 18 ARG HA H 1 4.711 0.000 . . . . . A A 18 ARG HA . 30934 1
187 . 1 . 1 18 18 ARG HB2 H 1 1.587 0.000 . . . . . A A 18 ARG HB2 . 30934 1
188 . 1 . 1 18 18 ARG HB3 H 1 2.195 0.000 . . . . . A A 18 ARG HB3 . 30934 1
189 . 1 . 1 18 18 ARG HG2 H 1 1.701 0.000 . . . . . A A 18 ARG HG2 . 30934 1
190 . 1 . 1 18 18 ARG HG3 H 1 1.701 0.000 . . . . . A A 18 ARG HG3 . 30934 1
191 . 1 . 1 18 18 ARG HD2 H 1 3.191 0.005 . . . . . A A 18 ARG HD2 . 30934 1
192 . 1 . 1 18 18 ARG HD3 H 1 3.254 0.003 . . . . . A A 18 ARG HD3 . 30934 1
193 . 1 . 1 18 18 ARG HE H 1 7.305 0.000 . . . . . A A 18 ARG HE . 30934 1
194 . 1 . 1 18 18 ARG CB C 13 31.392 0.000 . . . . . A A 18 ARG CB . 30934 1
195 . 1 . 1 18 18 ARG CG C 13 26.988 0.000 . . . . . A A 18 ARG CG . 30934 1
196 . 1 . 1 18 18 ARG CD C 13 42.466 0.000 . . . . . A A 18 ARG CD . 30934 1
197 . 1 . 1 18 18 ARG N N 15 128.898 0.000 . . . . . A A 18 ARG N . 30934 1
198 . 1 . 1 19 19 DAL H H 1 7.830 0.001 . . . . . A A 19 DAL H . 30934 1
199 . 1 . 1 19 19 DAL N N 15 121.613 0.000 . . . . . A A 19 DAL N . 30934 1
200 . 1 . 1 19 19 DAL CB C 13 22.390 0.000 . . . . . A A 19 DAL CB . 30934 1
201 . 1 . 1 19 19 DAL HA H 1 4.821 0.000 . . . . . A A 19 DAL HA . 30934 1
202 . 1 . 1 19 19 DAL HB1 H 1 1.502 0.000 . . . . . A A 19 DAL HB1 . 30934 1
203 . 1 . 1 19 19 DAL HB2 H 1 1.502 0.000 . . . . . A A 19 DAL HB2 . 30934 1
204 . 1 . 1 19 19 DAL HB3 H 1 1.502 0.000 . . . . . A A 19 DAL HB3 . 30934 1
205 . 1 . 1 20 20 THR H H 1 8.733 0.000 . . . . . A A 20 THR H . 30934 1
206 . 1 . 1 20 20 THR HA H 1 5.094 0.000 . . . . . A A 20 THR HA . 30934 1
207 . 1 . 1 20 20 THR HB H 1 4.531 0.008 . . . . . A A 20 THR HB . 30934 1
208 . 1 . 1 20 20 THR HG21 H 1 1.219 0.006 . . . . . A A 20 THR HG21 . 30934 1
209 . 1 . 1 20 20 THR HG22 H 1 1.219 0.006 . . . . . A A 20 THR HG22 . 30934 1
210 . 1 . 1 20 20 THR HG23 H 1 1.219 0.006 . . . . . A A 20 THR HG23 . 30934 1
211 . 1 . 1 20 20 THR CA C 13 59.943 0.000 . . . . . A A 20 THR CA . 30934 1
212 . 1 . 1 20 20 THR CB C 13 71.589 0.000 . . . . . A A 20 THR CB . 30934 1
213 . 1 . 1 20 20 THR CG2 C 13 21.502 0.000 . . . . . A A 20 THR CG2 . 30934 1
214 . 1 . 1 20 20 THR N N 15 112.325 0.000 . . . . . A A 20 THR N . 30934 1
215 . 1 . 1 21 21 CYS H H 1 8.070 0.000 . . . . . A A 21 CYS H . 30934 1
216 . 1 . 1 21 21 CYS HA H 1 4.890 0.002 . . . . . A A 21 CYS HA . 30934 1
217 . 1 . 1 21 21 CYS HB2 H 1 3.218 0.006 . . . . . A A 21 CYS HB2 . 30934 1
218 . 1 . 1 21 21 CYS HB3 H 1 3.366 0.005 . . . . . A A 21 CYS HB3 . 30934 1
219 . 1 . 1 21 21 CYS CB C 13 45.147 0.000 . . . . . A A 21 CYS CB . 30934 1
220 . 1 . 1 21 21 CYS N N 15 117.621 0.000 . . . . . A A 21 CYS N . 30934 1
221 . 1 . 1 22 22 GLY H H 1 8.306 0.000 . . . . . A A 22 GLY H . 30934 1
222 . 1 . 1 22 22 GLY HA2 H 1 4.011 0.003 . . . . . A A 22 GLY HA2 . 30934 1
223 . 1 . 1 22 22 GLY HA3 H 1 3.780 0.005 . . . . . A A 22 GLY HA3 . 30934 1
224 . 1 . 1 22 22 GLY CA C 13 45.297 0.000 . . . . . A A 22 GLY CA . 30934 1
225 . 1 . 1 22 22 GLY N N 15 109.488 0.000 . . . . . A A 22 GLY N . 30934 1
226 . 1 . 1 23 23 ILE H H 1 8.266 0.000 . . . . . A A 23 ILE H . 30934 1
227 . 1 . 1 23 23 ILE HA H 1 4.058 0.000 . . . . . A A 23 ILE HA . 30934 1
228 . 1 . 1 23 23 ILE HB H 1 1.878 0.004 . . . . . A A 23 ILE HB . 30934 1
229 . 1 . 1 23 23 ILE HG12 H 1 1.186 0.005 . . . . . A A 23 ILE HG12 . 30934 1
230 . 1 . 1 23 23 ILE HG13 H 1 1.454 0.005 . . . . . A A 23 ILE HG13 . 30934 1
231 . 1 . 1 23 23 ILE HG21 H 1 0.918 0.000 . . . . . A A 23 ILE HG21 . 30934 1
232 . 1 . 1 23 23 ILE HG22 H 1 0.918 0.000 . . . . . A A 23 ILE HG22 . 30934 1
233 . 1 . 1 23 23 ILE HG23 H 1 0.918 0.000 . . . . . A A 23 ILE HG23 . 30934 1
234 . 1 . 1 23 23 ILE HD11 H 1 0.866 0.000 . . . . . A A 23 ILE HD11 . 30934 1
235 . 1 . 1 23 23 ILE HD12 H 1 0.866 0.000 . . . . . A A 23 ILE HD12 . 30934 1
236 . 1 . 1 23 23 ILE HD13 H 1 0.866 0.000 . . . . . A A 23 ILE HD13 . 30934 1
237 . 1 . 1 23 23 ILE CA C 13 62.389 0.000 . . . . . A A 23 ILE CA . 30934 1
238 . 1 . 1 23 23 ILE CB C 13 37.331 0.000 . . . . . A A 23 ILE CB . 30934 1
239 . 1 . 1 23 23 ILE CG1 C 13 27.381 0.000 . . . . . A A 23 ILE CG1 . 30934 1
240 . 1 . 1 23 23 ILE CG2 C 13 17.556 0.000 . . . . . A A 23 ILE CG2 . 30934 1
241 . 1 . 1 23 23 ILE CD1 C 13 12.654 0.000 . . . . . A A 23 ILE CD1 . 30934 1
242 . 1 . 1 23 23 ILE N N 15 120.415 0.000 . . . . . A A 23 ILE N . 30934 1
243 . 1 . 1 24 24 ARG H H 1 8.469 0.000 . . . . . A A 24 ARG H . 30934 1
244 . 1 . 1 24 24 ARG HA H 1 4.018 0.000 . . . . . A A 24 ARG HA . 30934 1
245 . 1 . 1 24 24 ARG HB2 H 1 1.785 0.005 . . . . . A A 24 ARG HB2 . 30934 1
246 . 1 . 1 24 24 ARG HB3 H 1 1.849 0.005 . . . . . A A 24 ARG HB3 . 30934 1
247 . 1 . 1 24 24 ARG HG2 H 1 1.557 0.005 . . . . . A A 24 ARG HG2 . 30934 1
248 . 1 . 1 24 24 ARG HG3 H 1 1.557 0.005 . . . . . A A 24 ARG HG3 . 30934 1
249 . 1 . 1 24 24 ARG HD2 H 1 3.135 0.005 . . . . . A A 24 ARG HD2 . 30934 1
250 . 1 . 1 24 24 ARG HD3 H 1 3.202 0.003 . . . . . A A 24 ARG HD3 . 30934 1
251 . 1 . 1 24 24 ARG HE H 1 7.210 0.000 . . . . . A A 24 ARG HE . 30934 1
252 . 1 . 1 24 24 ARG CA C 13 57.425 0.000 . . . . . A A 24 ARG CA . 30934 1
253 . 1 . 1 24 24 ARG CB C 13 29.116 0.000 . . . . . A A 24 ARG CB . 30934 1
254 . 1 . 1 24 24 ARG CG C 13 28.001 0.000 . . . . . A A 24 ARG CG . 30934 1
255 . 1 . 1 24 24 ARG CD C 13 43.336 0.000 . . . . . A A 24 ARG CD . 30934 1
256 . 1 . 1 24 24 ARG N N 15 117.871 0.000 . . . . . A A 24 ARG N . 30934 1
257 . 1 . 1 25 25 PHE H H 1 7.774 0.001 . . . . . A A 25 PHE H . 30934 1
258 . 1 . 1 25 25 PHE HA H 1 5.067 0.000 . . . . . A A 25 PHE HA . 30934 1
259 . 1 . 1 25 25 PHE HB2 H 1 2.877 0.015 . . . . . A A 25 PHE HB2 . 30934 1
260 . 1 . 1 25 25 PHE HB3 H 1 3.029 0.000 . . . . . A A 25 PHE HB3 . 30934 1
261 . 1 . 1 25 25 PHE HD1 H 1 7.119 0.011 . . . . . A A 25 PHE HD1 . 30934 1
262 . 1 . 1 25 25 PHE HD2 H 1 7.119 0.011 . . . . . A A 25 PHE HD2 . 30934 1
263 . 1 . 1 25 25 PHE HE1 H 1 7.371 0.001 . . . . . A A 25 PHE HE1 . 30934 1
264 . 1 . 1 25 25 PHE HE2 H 1 7.371 0.001 . . . . . A A 25 PHE HE2 . 30934 1
265 . 1 . 1 25 25 PHE HZ H 1 7.343 0.000 . . . . . A A 25 PHE HZ . 30934 1
266 . 1 . 1 25 25 PHE CA C 13 56.247 0.000 . . . . . A A 25 PHE CA . 30934 1
267 . 1 . 1 25 25 PHE CB C 13 41.587 0.000 . . . . . A A 25 PHE CB . 30934 1
268 . 1 . 1 25 25 PHE N N 15 117.471 0.000 . . . . . A A 25 PHE N . 30934 1
269 . 1 . 1 26 26 LEU H H 1 9.366 0.000 . . . . . A A 26 LEU H . 30934 1
270 . 1 . 1 26 26 LEU HA H 1 4.729 0.000 . . . . . A A 26 LEU HA . 30934 1
271 . 1 . 1 26 26 LEU HB2 H 1 1.400 0.000 . . . . . A A 26 LEU HB2 . 30934 1
272 . 1 . 1 26 26 LEU HB3 H 1 1.643 0.004 . . . . . A A 26 LEU HB3 . 30934 1
273 . 1 . 1 26 26 LEU HG H 1 1.657 0.000 . . . . . A A 26 LEU HG . 30934 1
274 . 1 . 1 26 26 LEU HD11 H 1 0.871 0.000 . . . . . A A 26 LEU HD11 . 30934 1
275 . 1 . 1 26 26 LEU HD12 H 1 0.871 0.000 . . . . . A A 26 LEU HD12 . 30934 1
276 . 1 . 1 26 26 LEU HD13 H 1 0.871 0.000 . . . . . A A 26 LEU HD13 . 30934 1
277 . 1 . 1 26 26 LEU HD21 H 1 0.815 0.000 . . . . . A A 26 LEU HD21 . 30934 1
278 . 1 . 1 26 26 LEU HD22 H 1 0.815 0.000 . . . . . A A 26 LEU HD22 . 30934 1
279 . 1 . 1 26 26 LEU HD23 H 1 0.815 0.000 . . . . . A A 26 LEU HD23 . 30934 1
280 . 1 . 1 26 26 LEU CB C 13 44.656 0.000 . . . . . A A 26 LEU CB . 30934 1
281 . 1 . 1 26 26 LEU CG C 13 27.486 0.000 . . . . . A A 26 LEU CG . 30934 1
282 . 1 . 1 26 26 LEU CD1 C 13 24.505 0.000 . . . . . A A 26 LEU CD1 . 30934 1
283 . 1 . 1 26 26 LEU CD2 C 13 25.427 0.000 . . . . . A A 26 LEU CD2 . 30934 1
284 . 1 . 1 26 26 LEU N N 15 123.577 0.000 . . . . . A A 26 LEU N . 30934 1
285 . 1 . 1 27 27 TYR H H 1 8.385 0.000 . . . . . A A 27 TYR H . 30934 1
286 . 1 . 1 27 27 TYR HA H 1 5.026 0.005 . . . . . A A 27 TYR HA . 30934 1
287 . 1 . 1 27 27 TYR HB2 H 1 2.268 0.004 . . . . . A A 27 TYR HB2 . 30934 1
288 . 1 . 1 27 27 TYR HB3 H 1 2.684 0.000 . . . . . A A 27 TYR HB3 . 30934 1
289 . 1 . 1 27 27 TYR HD1 H 1 6.859 0.002 . . . . . A A 27 TYR HD1 . 30934 1
290 . 1 . 1 27 27 TYR HD2 H 1 6.859 0.002 . . . . . A A 27 TYR HD2 . 30934 1
291 . 1 . 1 27 27 TYR HE1 H 1 6.654 0.010 . . . . . A A 27 TYR HE1 . 30934 1
292 . 1 . 1 27 27 TYR HE2 H 1 6.654 0.010 . . . . . A A 27 TYR HE2 . 30934 1
293 . 1 . 1 27 27 TYR CA C 13 56.676 0.000 . . . . . A A 27 TYR CA . 30934 1
294 . 1 . 1 27 27 TYR CB C 13 38.947 0.000 . . . . . A A 27 TYR CB . 30934 1
295 . 1 . 1 27 27 TYR N N 15 124.357 0.000 . . . . . A A 27 TYR N . 30934 1
296 . 1 . 1 28 28 CYS H H 1 9.038 0.000 . . . . . A A 28 CYS H . 30934 1
297 . 1 . 1 28 28 CYS HA H 1 5.102 0.000 . . . . . A A 28 CYS HA . 30934 1
298 . 1 . 1 28 28 CYS HB2 H 1 2.929 0.000 . . . . . A A 28 CYS HB2 . 30934 1
299 . 1 . 1 28 28 CYS HB3 H 1 3.200 0.000 . . . . . A A 28 CYS HB3 . 30934 1
300 . 1 . 1 28 28 CYS CA C 13 54.310 0.000 . . . . . A A 28 CYS CA . 30934 1
301 . 1 . 1 28 28 CYS CB C 13 43.413 0.000 . . . . . A A 28 CYS CB . 30934 1
302 . 1 . 1 28 28 CYS N N 15 127.343 0.000 . . . . . A A 28 CYS N . 30934 1
303 . 1 . 1 29 29 CYS H H 1 9.086 0.000 . . . . . A A 29 CYS H . 30934 1
304 . 1 . 1 29 29 CYS HA H 1 5.326 0.005 . . . . . A A 29 CYS HA . 30934 1
305 . 1 . 1 29 29 CYS HB2 H 1 2.470 0.007 . . . . . A A 29 CYS HB2 . 30934 1
306 . 1 . 1 29 29 CYS HB3 H 1 3.089 0.006 . . . . . A A 29 CYS HB3 . 30934 1
307 . 1 . 1 29 29 CYS CA C 13 52.003 0.000 . . . . . A A 29 CYS CA . 30934 1
308 . 1 . 1 29 29 CYS CB C 13 44.789 0.000 . . . . . A A 29 CYS CB . 30934 1
309 . 1 . 1 29 29 CYS N N 15 120.717 0.000 . . . . . A A 29 CYS N . 30934 1
310 . 1 . 1 30 30 PRO HA H 1 4.635 0.000 . . . . . A A 30 PRO HA . 30934 1
311 . 1 . 1 30 30 PRO HB2 H 1 2.043 0.000 . . . . . A A 30 PRO HB2 . 30934 1
312 . 1 . 1 30 30 PRO HB3 H 1 2.479 0.000 . . . . . A A 30 PRO HB3 . 30934 1
313 . 1 . 1 30 30 PRO HG2 H 1 2.158 0.000 . . . . . A A 30 PRO HG2 . 30934 1
314 . 1 . 1 30 30 PRO HG3 H 1 2.256 0.000 . . . . . A A 30 PRO HG3 . 30934 1
315 . 1 . 1 30 30 PRO HD2 H 1 3.743 0.005 . . . . . A A 30 PRO HD2 . 30934 1
316 . 1 . 1 30 30 PRO HD3 H 1 3.970 0.000 . . . . . A A 30 PRO HD3 . 30934 1
317 . 1 . 1 30 30 PRO CA C 13 63.473 0.000 . . . . . A A 30 PRO CA . 30934 1
318 . 1 . 1 30 30 PRO CB C 13 32.419 0.000 . . . . . A A 30 PRO CB . 30934 1
319 . 1 . 1 30 30 PRO CG C 13 27.894 0.000 . . . . . A A 30 PRO CG . 30934 1
320 . 1 . 1 30 30 PRO CD C 13 51.341 0.000 . . . . . A A 30 PRO CD . 30934 1
321 . 1 . 1 31 31 ARG H H 1 8.458 0.001 . . . . . A A 31 ARG H . 30934 1
322 . 1 . 1 31 31 ARG HA H 1 4.114 0.000 . . . . . A A 31 ARG HA . 30934 1
323 . 1 . 1 31 31 ARG HB2 H 1 1.700 0.005 . . . . . A A 31 ARG HB2 . 30934 1
324 . 1 . 1 31 31 ARG HB3 H 1 1.796 0.005 . . . . . A A 31 ARG HB3 . 30934 1
325 . 1 . 1 31 31 ARG HG2 H 1 1.580 0.005 . . . . . A A 31 ARG HG2 . 30934 1
326 . 1 . 1 31 31 ARG HG3 H 1 1.580 0.005 . . . . . A A 31 ARG HG3 . 30934 1
327 . 1 . 1 31 31 ARG HD2 H 1 3.168 0.004 . . . . . A A 31 ARG HD2 . 30934 1
328 . 1 . 1 31 31 ARG HD3 H 1 3.168 0.004 . . . . . A A 31 ARG HD3 . 30934 1
329 . 1 . 1 31 31 ARG HE H 1 7.213 0.000 . . . . . A A 31 ARG HE . 30934 1
330 . 1 . 1 31 31 ARG CA C 13 57.152 0.000 . . . . . A A 31 ARG CA . 30934 1
331 . 1 . 1 31 31 ARG CB C 13 30.789 0.000 . . . . . A A 31 ARG CB . 30934 1
332 . 1 . 1 31 31 ARG CG C 13 28.215 0.000 . . . . . A A 31 ARG CG . 30934 1
333 . 1 . 1 31 31 ARG CD C 13 43.318 0.000 . . . . . A A 31 ARG CD . 30934 1
334 . 1 . 1 31 31 ARG N N 15 121.563 0.000 . . . . . A A 31 ARG N . 30934 1
335 . 1 . 1 32 32 ARG H H 1 7.880 0.000 . . . . . A A 32 ARG H . 30934 1
336 . 1 . 1 32 32 ARG HA H 1 4.173 0.000 . . . . . A A 32 ARG HA . 30934 1
337 . 1 . 1 32 32 ARG HB2 H 1 1.704 0.004 . . . . . A A 32 ARG HB2 . 30934 1
338 . 1 . 1 32 32 ARG HB3 H 1 1.832 0.006 . . . . . A A 32 ARG HB3 . 30934 1
339 . 1 . 1 32 32 ARG HG2 H 1 1.554 0.000 . . . . . A A 32 ARG HG2 . 30934 1
340 . 1 . 1 32 32 ARG HG3 H 1 1.554 0.000 . . . . . A A 32 ARG HG3 . 30934 1
341 . 1 . 1 32 32 ARG HD2 H 1 3.178 0.000 . . . . . A A 32 ARG HD2 . 30934 1
342 . 1 . 1 32 32 ARG HD3 H 1 3.178 0.000 . . . . . A A 32 ARG HD3 . 30934 1
343 . 1 . 1 32 32 ARG HE H 1 7.226 0.000 . . . . . A A 32 ARG HE . 30934 1
344 . 1 . 1 32 32 ARG CA C 13 57.141 0.000 . . . . . A A 32 ARG CA . 30934 1
345 . 1 . 1 32 32 ARG CB C 13 31.668 0.000 . . . . . A A 32 ARG CB . 30934 1
346 . 1 . 1 32 32 ARG CG C 13 27.937 0.000 . . . . . A A 32 ARG CG . 30934 1
347 . 1 . 1 32 32 ARG CD C 13 43.536 0.000 . . . . . A A 32 ARG CD . 30934 1
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