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 30827
_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 . . . 30827 1
2 '2D 1H-1H TOCSY' . . . 30827 1
3 '2D 1H-1H NOESY' . . . 30827 1
4 '2D 1H-15N HSQC' . . . 30827 1
5 '2D 1H-13C HSQC' . . . 30827 1
6 '2D 1H-1H TOCSY' . . . 30827 1
7 '2D 1H-1H TOCSY' . . . 30827 1
8 '2D 1H-1H TOCSY' . . . 30827 1
9 '2D 1H-1H TOCSY' . . . 30827 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 H H 1 7.737 0.000 . . . . . A A 1 GLY H1 . 30827 1
2 . 1 . 1 1 1 GLY HA2 H 1 3.534 0.000 . . . . . A A 1 GLY HA2 . 30827 1
3 . 1 . 1 1 1 GLY HA3 H 1 4.499 0.000 . . . . . A A 1 GLY HA3 . 30827 1
4 . 1 . 1 1 1 GLY CA C 13 44.204 0.000 . . . . . A A 1 GLY CA . 30827 1
5 . 1 . 1 1 1 GLY N N 15 107.236 0.000 . . . . . A A 1 GLY N . 30827 1
6 . 1 . 1 2 2 PHE H H 1 7.562 0.000 . . . . . A A 2 PHE H . 30827 1
7 . 1 . 1 2 2 PHE HA H 1 4.510 0.000 . . . . . A A 2 PHE HA . 30827 1
8 . 1 . 1 2 2 PHE HB2 H 1 2.253 0.000 . . . . . A A 2 PHE HB2 . 30827 1
9 . 1 . 1 2 2 PHE HB3 H 1 1.754 0.000 . . . . . A A 2 PHE HB3 . 30827 1
10 . 1 . 1 2 2 PHE HD1 H 1 6.318 0.000 . . . . . A A 2 PHE HD1 . 30827 1
11 . 1 . 1 2 2 PHE HD2 H 1 6.318 0.000 . . . . . A A 2 PHE HD2 . 30827 1
12 . 1 . 1 2 2 PHE HE1 H 1 6.731 0.000 . . . . . A A 2 PHE HE1 . 30827 1
13 . 1 . 1 2 2 PHE HE2 H 1 6.731 0.000 . . . . . A A 2 PHE HE2 . 30827 1
14 . 1 . 1 2 2 PHE CA C 13 58.582 0.000 . . . . . A A 2 PHE CA . 30827 1
15 . 1 . 1 2 2 PHE CB C 13 42.008 0.000 . . . . . A A 2 PHE CB . 30827 1
16 . 1 . 1 2 2 PHE N N 15 118.484 0.000 . . . . . A A 2 PHE N . 30827 1
17 . 1 . 1 3 3 CYS H H 1 7.519 0.000 . . . . . A A 3 CYS H . 30827 1
18 . 1 . 1 3 3 CYS HA H 1 5.137 0.000 . . . . . A A 3 CYS HA . 30827 1
19 . 1 . 1 3 3 CYS HB2 H 1 2.616 0.000 . . . . . A A 3 CYS HB2 . 30827 1
20 . 1 . 1 3 3 CYS HB3 H 1 2.369 0.000 . . . . . A A 3 CYS HB3 . 30827 1
21 . 1 . 1 3 3 CYS CA C 13 55.085 0.000 . . . . . A A 3 CYS CA . 30827 1
22 . 1 . 1 3 3 CYS N N 15 124.000 0.000 . . . . . A A 3 CYS N . 30827 1
23 . 1 . 1 4 4 TRP H H 1 8.773 0.000 . . . . . A A 4 TRP H . 30827 1
24 . 1 . 1 4 4 TRP HA H 1 4.495 0.000 . . . . . A A 4 TRP HA . 30827 1
25 . 1 . 1 4 4 TRP HB2 H 1 2.775 0.000 . . . . . A A 4 TRP HB2 . 30827 1
26 . 1 . 1 4 4 TRP HB3 H 1 2.712 0.000 . . . . . A A 4 TRP HB3 . 30827 1
27 . 1 . 1 4 4 TRP HD1 H 1 6.687 0.000 . . . . . A A 4 TRP HD1 . 30827 1
28 . 1 . 1 4 4 TRP HE1 H 1 9.865 0.000 . . . . . A A 4 TRP HE1 . 30827 1
29 . 1 . 1 4 4 TRP HE3 H 1 7.662 0.000 . . . . . A A 4 TRP HE3 . 30827 1
30 . 1 . 1 4 4 TRP HZ2 H 1 7.616 0.000 . . . . . A A 4 TRP HZ2 . 30827 1
31 . 1 . 1 4 4 TRP HZ3 H 1 7.363 0.000 . . . . . A A 4 TRP HZ3 . 30827 1
32 . 1 . 1 4 4 TRP HH2 H 1 7.522 0.000 . . . . . A A 4 TRP HH2 . 30827 1
33 . 1 . 1 4 4 TRP CA C 13 56.056 0.000 . . . . . A A 4 TRP CA . 30827 1
34 . 1 . 1 4 4 TRP CB C 13 32.972 0.000 . . . . . A A 4 TRP CB . 30827 1
35 . 1 . 1 4 4 TRP N N 15 122.710 0.000 . . . . . A A 4 TRP N . 30827 1
36 . 1 . 1 5 5 HIS H H 1 8.685 0.000 . . . . . A A 5 HIS H . 30827 1
37 . 1 . 1 5 5 HIS HA H 1 3.725 0.000 . . . . . A A 5 HIS HA . 30827 1
38 . 1 . 1 5 5 HIS HB2 H 1 3.092 0.000 . . . . . A A 5 HIS HB2 . 30827 1
39 . 1 . 1 5 5 HIS HB3 H 1 2.931 0.000 . . . . . A A 5 HIS HB3 . 30827 1
40 . 1 . 1 5 5 HIS HD2 H 1 6.298 0.000 . . . . . A A 5 HIS HD2 . 30827 1
41 . 1 . 1 5 5 HIS HE1 H 1 8.497 0.000 . . . . . A A 5 HIS HE1 . 30827 1
42 . 1 . 1 5 5 HIS CA C 13 55.730 0.000 . . . . . A A 5 HIS CA . 30827 1
43 . 1 . 1 5 5 HIS CB C 13 26.323 0.003 . . . . . A A 5 HIS CB . 30827 1
44 . 1 . 1 5 5 HIS N N 15 123.749 0.000 . . . . . A A 5 HIS N . 30827 1
45 . 1 . 1 6 6 HIS H H 1 8.611 0.000 . . . . . A A 6 HIS H . 30827 1
46 . 1 . 1 6 6 HIS HA H 1 4.049 0.000 . . . . . A A 6 HIS HA . 30827 1
47 . 1 . 1 6 6 HIS HB2 H 1 3.446 0.002 . . . . . A A 6 HIS HB2 . 30827 1
48 . 1 . 1 6 6 HIS HB3 H 1 3.446 0.002 . . . . . A A 6 HIS HB3 . 30827 1
49 . 1 . 1 6 6 HIS HD2 H 1 7.110 0.004 . . . . . A A 6 HIS HD2 . 30827 1
50 . 1 . 1 6 6 HIS HE1 H 1 8.498 0.000 . . . . . A A 6 HIS HE1 . 30827 1
51 . 1 . 1 6 6 HIS CA C 13 57.183 0.000 . . . . . A A 6 HIS CA . 30827 1
52 . 1 . 1 6 6 HIS CB C 13 26.878 0.000 . . . . . A A 6 HIS CB . 30827 1
53 . 1 . 1 6 6 HIS N N 15 109.069 0.000 . . . . . A A 6 HIS N . 30827 1
54 . 1 . 1 7 7 SER H H 1 7.672 0.000 . . . . . A A 7 SER H . 30827 1
55 . 1 . 1 7 7 SER HA H 1 4.682 0.000 . . . . . A A 7 SER HA . 30827 1
56 . 1 . 1 7 7 SER HB2 H 1 3.657 0.000 . . . . . A A 7 SER HB2 . 30827 1
57 . 1 . 1 7 7 SER HB3 H 1 3.559 0.000 . . . . . A A 7 SER HB3 . 30827 1
58 . 1 . 1 7 7 SER CB C 13 64.633 0.000 . . . . . A A 7 SER CB . 30827 1
59 . 1 . 1 7 7 SER N N 15 116.755 0.000 . . . . . A A 7 SER N . 30827 1
60 . 1 . 1 8 8 CYS H H 1 8.540 0.000 . . . . . A A 8 CYS H . 30827 1
61 . 1 . 1 8 8 CYS HA H 1 5.629 0.000 . . . . . A A 8 CYS HA . 30827 1
62 . 1 . 1 8 8 CYS HB2 H 1 2.843 0.000 . . . . . A A 8 CYS HB2 . 30827 1
63 . 1 . 1 8 8 CYS HB3 H 1 2.843 0.000 . . . . . A A 8 CYS HB3 . 30827 1
64 . 1 . 1 8 8 CYS CA C 13 55.629 0.000 . . . . . A A 8 CYS CA . 30827 1
65 . 1 . 1 8 8 CYS N N 15 121.898 0.000 . . . . . A A 8 CYS N . 30827 1
66 . 1 . 1 9 9 VAL H H 1 8.934 0.001 . . . . . A A 9 VAL H . 30827 1
67 . 1 . 1 9 9 VAL HA H 1 4.839 0.000 . . . . . A A 9 VAL HA . 30827 1
68 . 1 . 1 9 9 VAL HB H 1 2.513 0.000 . . . . . A A 9 VAL HB . 30827 1
69 . 1 . 1 9 9 VAL HG11 H 1 0.992 0.000 . . . . . A A 9 VAL HG11 . 30827 1
70 . 1 . 1 9 9 VAL HG12 H 1 0.992 0.000 . . . . . A A 9 VAL HG12 . 30827 1
71 . 1 . 1 9 9 VAL HG13 H 1 0.992 0.000 . . . . . A A 9 VAL HG13 . 30827 1
72 . 1 . 1 9 9 VAL HG21 H 1 0.975 0.000 . . . . . A A 9 VAL HG21 . 30827 1
73 . 1 . 1 9 9 VAL HG22 H 1 0.975 0.000 . . . . . A A 9 VAL HG22 . 30827 1
74 . 1 . 1 9 9 VAL HG23 H 1 0.975 0.000 . . . . . A A 9 VAL HG23 . 30827 1
75 . 1 . 1 9 9 VAL N N 15 113.314 0.000 . . . . . A A 9 VAL N . 30827 1
76 . 1 . 1 10 10 PRO HA H 1 4.645 0.000 . . . . . A A 10 PRO HA . 30827 1
77 . 1 . 1 10 10 PRO HB2 H 1 2.456 0.000 . . . . . A A 10 PRO HB2 . 30827 1
78 . 1 . 1 10 10 PRO HB3 H 1 2.113 0.000 . . . . . A A 10 PRO HB3 . 30827 1
79 . 1 . 1 10 10 PRO HG2 H 1 2.134 0.000 . . . . . A A 10 PRO HG2 . 30827 1
80 . 1 . 1 10 10 PRO HG3 H 1 2.009 0.000 . . . . . A A 10 PRO HG3 . 30827 1
81 . 1 . 1 10 10 PRO HD2 H 1 3.916 0.000 . . . . . A A 10 PRO HD2 . 30827 1
82 . 1 . 1 10 10 PRO HD3 H 1 3.683 0.000 . . . . . A A 10 PRO HD3 . 30827 1
83 . 1 . 1 10 10 PRO CB C 13 32.393 0.000 . . . . . A A 10 PRO CB . 30827 1
84 . 1 . 1 10 10 PRO CG C 13 27.330 0.000 . . . . . A A 10 PRO CG . 30827 1
85 . 1 . 1 10 10 PRO CD C 13 51.466 0.000 . . . . . A A 10 PRO CD . 30827 1
86 . 1 . 1 11 11 SER H H 1 8.814 0.000 . . . . . A A 11 SER H . 30827 1
87 . 1 . 1 11 11 SER HA H 1 4.129 0.000 . . . . . A A 11 SER HA . 30827 1
88 . 1 . 1 11 11 SER HB2 H 1 3.959 0.000 . . . . . A A 11 SER HB2 . 30827 1
89 . 1 . 1 11 11 SER HB3 H 1 3.917 0.000 . . . . . A A 11 SER HB3 . 30827 1
90 . 1 . 1 11 11 SER CA C 13 60.244 0.000 . . . . . A A 11 SER CA . 30827 1
91 . 1 . 1 11 11 SER CB C 13 63.238 0.000 . . . . . A A 11 SER CB . 30827 1
92 . 1 . 1 11 11 SER N N 15 117.186 0.000 . . . . . A A 11 SER N . 30827 1
93 . 1 . 1 12 12 GLY H H 1 8.641 0.000 . . . . . A A 12 GLY H . 30827 1
94 . 1 . 1 12 12 GLY HA2 H 1 3.659 0.000 . . . . . A A 12 GLY HA2 . 30827 1
95 . 1 . 1 12 12 GLY HA3 H 1 4.366 0.000 . . . . . A A 12 GLY HA3 . 30827 1
96 . 1 . 1 12 12 GLY CA C 13 44.996 0.000 . . . . . A A 12 GLY CA . 30827 1
97 . 1 . 1 12 12 GLY N N 15 112.720 0.000 . . . . . A A 12 GLY N . 30827 1
98 . 1 . 1 13 13 THR H H 1 7.601 0.000 . . . . . A A 13 THR H . 30827 1
99 . 1 . 1 13 13 THR HA H 1 4.239 0.000 . . . . . A A 13 THR HA . 30827 1
100 . 1 . 1 13 13 THR HB H 1 4.129 0.000 . . . . . A A 13 THR HB . 30827 1
101 . 1 . 1 13 13 THR HG21 H 1 1.429 0.000 . . . . . A A 13 THR HG21 . 30827 1
102 . 1 . 1 13 13 THR HG22 H 1 1.429 0.000 . . . . . A A 13 THR HG22 . 30827 1
103 . 1 . 1 13 13 THR HG23 H 1 1.429 0.000 . . . . . A A 13 THR HG23 . 30827 1
104 . 1 . 1 13 13 THR CA C 13 64.320 0.000 . . . . . A A 13 THR CA . 30827 1
105 . 1 . 1 13 13 THR CB C 13 70.417 0.000 . . . . . A A 13 THR CB . 30827 1
106 . 1 . 1 13 13 THR N N 15 115.185 0.000 . . . . . A A 13 THR N . 30827 1
107 . 1 . 1 14 14 CYS H H 1 8.702 0.000 . . . . . A A 14 CYS H . 30827 1
108 . 1 . 1 14 14 CYS HA H 1 5.450 0.000 . . . . . A A 14 CYS HA . 30827 1
109 . 1 . 1 14 14 CYS HB2 H 1 3.025 0.000 . . . . . A A 14 CYS HB2 . 30827 1
110 . 1 . 1 14 14 CYS HB3 H 1 1.936 0.005 . . . . . A A 14 CYS HB3 . 30827 1
111 . 1 . 1 14 14 CYS CA C 13 55.990 0.000 . . . . . A A 14 CYS CA . 30827 1
112 . 1 . 1 14 14 CYS CB C 13 49.734 0.000 . . . . . A A 14 CYS CB . 30827 1
113 . 1 . 1 14 14 CYS N N 15 122.013 0.000 . . . . . A A 14 CYS N . 30827 1
114 . 1 . 1 15 15 ALA H H 1 8.960 0.000 . . . . . A A 15 ALA H . 30827 1
115 . 1 . 1 15 15 ALA HA H 1 4.339 0.000 . . . . . A A 15 ALA HA . 30827 1
116 . 1 . 1 15 15 ALA HB1 H 1 0.280 0.000 . . . . . A A 15 ALA HB1 . 30827 1
117 . 1 . 1 15 15 ALA HB2 H 1 0.280 0.000 . . . . . A A 15 ALA HB2 . 30827 1
118 . 1 . 1 15 15 ALA HB3 H 1 0.280 0.000 . . . . . A A 15 ALA HB3 . 30827 1
119 . 1 . 1 15 15 ALA CA C 13 50.749 0.000 . . . . . A A 15 ALA CA . 30827 1
120 . 1 . 1 15 15 ALA CB C 13 22.934 0.000 . . . . . A A 15 ALA CB . 30827 1
121 . 1 . 1 15 15 ALA N N 15 122.232 0.000 . . . . . A A 15 ALA N . 30827 1
122 . 1 . 1 16 16 ASP H H 1 8.090 0.000 . . . . . A A 16 ASP H . 30827 1
123 . 1 . 1 16 16 ASP HA H 1 5.003 0.000 . . . . . A A 16 ASP HA . 30827 1
124 . 1 . 1 16 16 ASP HB2 H 1 2.575 0.000 . . . . . A A 16 ASP HB2 . 30827 1
125 . 1 . 1 16 16 ASP HB3 H 1 2.451 0.000 . . . . . A A 16 ASP HB3 . 30827 1
126 . 1 . 1 16 16 ASP CA C 13 54.080 0.000 . . . . . A A 16 ASP CA . 30827 1
127 . 1 . 1 16 16 ASP CB C 13 41.601 0.000 . . . . . A A 16 ASP CB . 30827 1
128 . 1 . 1 16 16 ASP N N 15 118.181 0.000 . . . . . A A 16 ASP N . 30827 1
129 . 1 . 1 17 17 PHE H H 1 8.332 0.000 . . . . . A A 17 PHE H . 30827 1
130 . 1 . 1 17 17 PHE HA H 1 4.645 0.000 . . . . . A A 17 PHE HA . 30827 1
131 . 1 . 1 17 17 PHE HB2 H 1 3.322 0.000 . . . . . A A 17 PHE HB2 . 30827 1
132 . 1 . 1 17 17 PHE HB3 H 1 2.908 0.000 . . . . . A A 17 PHE HB3 . 30827 1
133 . 1 . 1 17 17 PHE HD1 H 1 7.004 0.000 . . . . . A A 17 PHE HD1 . 30827 1
134 . 1 . 1 17 17 PHE HD2 H 1 7.004 0.000 . . . . . A A 17 PHE HD2 . 30827 1
135 . 1 . 1 17 17 PHE HE1 H 1 6.483 0.000 . . . . . A A 17 PHE HE1 . 30827 1
136 . 1 . 1 17 17 PHE HE2 H 1 6.483 0.000 . . . . . A A 17 PHE HE2 . 30827 1
137 . 1 . 1 17 17 PHE HZ H 1 6.248 0.000 . . . . . A A 17 PHE HZ . 30827 1
138 . 1 . 1 17 17 PHE CB C 13 41.129 0.000 . . . . . A A 17 PHE CB . 30827 1
139 . 1 . 1 17 17 PHE N N 15 124.075 0.000 . . . . . A A 17 PHE N . 30827 1
140 . 1 . 1 18 18 PRO HA H 1 4.713 0.000 . . . . . A A 18 PRO HA . 30827 1
141 . 1 . 1 18 18 PRO HB2 H 1 2.646 0.000 . . . . . A A 18 PRO HB2 . 30827 1
142 . 1 . 1 18 18 PRO HB3 H 1 2.110 0.000 . . . . . A A 18 PRO HB3 . 30827 1
143 . 1 . 1 18 18 PRO HG2 H 1 2.300 0.000 . . . . . A A 18 PRO HG2 . 30827 1
144 . 1 . 1 18 18 PRO HG3 H 1 2.238 0.000 . . . . . A A 18 PRO HG3 . 30827 1
145 . 1 . 1 18 18 PRO HD2 H 1 4.129 0.000 . . . . . A A 18 PRO HD2 . 30827 1
146 . 1 . 1 18 18 PRO HD3 H 1 3.600 0.000 . . . . . A A 18 PRO HD3 . 30827 1
147 . 1 . 1 18 18 PRO CB C 13 32.231 0.000 . . . . . A A 18 PRO CB . 30827 1
148 . 1 . 1 18 18 PRO CG C 13 28.062 0.000 . . . . . A A 18 PRO CG . 30827 1
149 . 1 . 1 18 18 PRO CD C 13 50.488 0.003 . . . . . A A 18 PRO CD . 30827 1
150 . 1 . 1 19 19 TRP H H 1 8.882 0.000 . . . . . A A 19 TRP H . 30827 1
151 . 1 . 1 19 19 TRP HA H 1 4.259 0.000 . . . . . A A 19 TRP HA . 30827 1
152 . 1 . 1 19 19 TRP HB2 H 1 3.412 0.000 . . . . . A A 19 TRP HB2 . 30827 1
153 . 1 . 1 19 19 TRP HB3 H 1 3.266 0.000 . . . . . A A 19 TRP HB3 . 30827 1
154 . 1 . 1 19 19 TRP HD1 H 1 7.359 0.000 . . . . . A A 19 TRP HD1 . 30827 1
155 . 1 . 1 19 19 TRP HE1 H 1 10.312 0.000 . . . . . A A 19 TRP HE1 . 30827 1
156 . 1 . 1 19 19 TRP HE3 H 1 7.497 0.000 . . . . . A A 19 TRP HE3 . 30827 1
157 . 1 . 1 19 19 TRP HZ2 H 1 7.556 0.000 . . . . . A A 19 TRP HZ2 . 30827 1
158 . 1 . 1 19 19 TRP HZ3 H 1 7.192 0.000 . . . . . A A 19 TRP HZ3 . 30827 1
159 . 1 . 1 19 19 TRP HH2 H 1 7.285 0.000 . . . . . A A 19 TRP HH2 . 30827 1
160 . 1 . 1 19 19 TRP CA C 13 57.671 0.000 . . . . . A A 19 TRP CA . 30827 1
161 . 1 . 1 19 19 TRP CB C 13 29.132 0.000 . . . . . A A 19 TRP CB . 30827 1
162 . 1 . 1 19 19 TRP N N 15 125.491 0.000 . . . . . A A 19 TRP N . 30827 1
163 . 1 . 1 20 20 PRO HA H 1 3.327 0.000 . . . . . A A 20 PRO HA . 30827 1
164 . 1 . 1 20 20 PRO HB2 H 1 1.578 0.000 . . . . . A A 20 PRO HB2 . 30827 1
165 . 1 . 1 20 20 PRO HB3 H 1 0.491 0.000 . . . . . A A 20 PRO HB3 . 30827 1
166 . 1 . 1 20 20 PRO HG2 H 1 1.237 0.000 . . . . . A A 20 PRO HG2 . 30827 1
167 . 1 . 1 20 20 PRO HG3 H 1 1.564 0.000 . . . . . A A 20 PRO HG3 . 30827 1
168 . 1 . 1 20 20 PRO HD2 H 1 3.386 0.000 . . . . . A A 20 PRO HD2 . 30827 1
169 . 1 . 1 20 20 PRO HD3 H 1 3.223 0.000 . . . . . A A 20 PRO HD3 . 30827 1
170 . 1 . 1 20 20 PRO CA C 13 62.897 0.000 . . . . . A A 20 PRO CA . 30827 1
171 . 1 . 1 20 20 PRO CB C 13 33.375 0.000 . . . . . A A 20 PRO CB . 30827 1
172 . 1 . 1 20 20 PRO CG C 13 24.538 0.000 . . . . . A A 20 PRO CG . 30827 1
173 . 1 . 1 20 20 PRO CD C 13 50.493 0.002 . . . . . A A 20 PRO CD . 30827 1
174 . 1 . 1 21 21 LEU H H 1 7.610 0.000 . . . . . A A 21 LEU H . 30827 1
175 . 1 . 1 21 21 LEU HA H 1 4.115 0.000 . . . . . A A 21 LEU HA . 30827 1
176 . 1 . 1 21 21 LEU HB2 H 1 1.396 0.000 . . . . . A A 21 LEU HB2 . 30827 1
177 . 1 . 1 21 21 LEU HB3 H 1 1.125 0.000 . . . . . A A 21 LEU HB3 . 30827 1
178 . 1 . 1 21 21 LEU HG H 1 1.182 0.000 . . . . . A A 21 LEU HG . 30827 1
179 . 1 . 1 21 21 LEU HD11 H 1 0.558 0.000 . . . . . A A 21 LEU HD11 . 30827 1
180 . 1 . 1 21 21 LEU HD12 H 1 0.558 0.000 . . . . . A A 21 LEU HD12 . 30827 1
181 . 1 . 1 21 21 LEU HD13 H 1 0.558 0.000 . . . . . A A 21 LEU HD13 . 30827 1
182 . 1 . 1 21 21 LEU HD21 H 1 0.453 0.000 . . . . . A A 21 LEU HD21 . 30827 1
183 . 1 . 1 21 21 LEU HD22 H 1 0.453 0.000 . . . . . A A 21 LEU HD22 . 30827 1
184 . 1 . 1 21 21 LEU HD23 H 1 0.453 0.000 . . . . . A A 21 LEU HD23 . 30827 1
185 . 1 . 1 21 21 LEU CA C 13 57.235 0.000 . . . . . A A 21 LEU CA . 30827 1
186 . 1 . 1 21 21 LEU CB C 13 43.329 0.000 . . . . . A A 21 LEU CB . 30827 1
187 . 1 . 1 21 21 LEU CG C 13 27.858 0.000 . . . . . A A 21 LEU CG . 30827 1
188 . 1 . 1 21 21 LEU N N 15 126.273 0.000 . . . . . A A 21 LEU N . 30827 1
189 . 1 . 1 22 22 GLY H H 1 7.050 0.000 . . . . . A A 22 GLY H . 30827 1
190 . 1 . 1 22 22 GLY HA2 H 1 3.916 0.000 . . . . . A A 22 GLY HA2 . 30827 1
191 . 1 . 1 22 22 GLY HA3 H 1 3.681 0.000 . . . . . A A 22 GLY HA3 . 30827 1
192 . 1 . 1 22 22 GLY CA C 13 46.155 0.000 . . . . . A A 22 GLY CA . 30827 1
193 . 1 . 1 22 22 GLY N N 15 106.261 0.000 . . . . . A A 22 GLY N . 30827 1
194 . 1 . 1 23 23 HIS H H 1 8.548 0.000 . . . . . A A 23 HIS H . 30827 1
195 . 1 . 1 23 23 HIS HA H 1 5.029 0.000 . . . . . A A 23 HIS HA . 30827 1
196 . 1 . 1 23 23 HIS HB2 H 1 3.285 0.000 . . . . . A A 23 HIS HB2 . 30827 1
197 . 1 . 1 23 23 HIS HB3 H 1 3.087 0.000 . . . . . A A 23 HIS HB3 . 30827 1
198 . 1 . 1 23 23 HIS HD2 H 1 7.249 0.000 . . . . . A A 23 HIS HD2 . 30827 1
199 . 1 . 1 23 23 HIS HE1 H 1 8.588 0.000 . . . . . A A 23 HIS HE1 . 30827 1
200 . 1 . 1 23 23 HIS CA C 13 56.496 0.000 . . . . . A A 23 HIS CA . 30827 1
201 . 1 . 1 23 23 HIS CB C 13 29.235 0.000 . . . . . A A 23 HIS CB . 30827 1
202 . 1 . 1 23 23 HIS N N 15 123.275 0.000 . . . . . A A 23 HIS N . 30827 1
203 . 1 . 1 24 24 GLN H H 1 8.605 0.000 . . . . . A A 24 GLN H . 30827 1
204 . 1 . 1 24 24 GLN HA H 1 4.319 0.000 . . . . . A A 24 GLN HA . 30827 1
205 . 1 . 1 24 24 GLN HB2 H 1 1.395 0.000 . . . . . A A 24 GLN HB2 . 30827 1
206 . 1 . 1 24 24 GLN HB3 H 1 1.602 0.000 . . . . . A A 24 GLN HB3 . 30827 1
207 . 1 . 1 24 24 GLN HG2 H 1 1.944 0.000 . . . . . A A 24 GLN HG2 . 30827 1
208 . 1 . 1 24 24 GLN HG3 H 1 1.401 0.000 . . . . . A A 24 GLN HG3 . 30827 1
209 . 1 . 1 24 24 GLN HE21 H 1 7.731 0.000 . . . . . A A 24 GLN HE21 . 30827 1
210 . 1 . 1 24 24 GLN HE22 H 1 6.703 0.000 . . . . . A A 24 GLN HE22 . 30827 1
211 . 1 . 1 24 24 GLN CA C 13 53.801 0.000 . . . . . A A 24 GLN CA . 30827 1
212 . 1 . 1 24 24 GLN CB C 13 32.301 0.000 . . . . . A A 24 GLN CB . 30827 1
213 . 1 . 1 24 24 GLN CG C 13 32.969 0.000 . . . . . A A 24 GLN CG . 30827 1
214 . 1 . 1 24 24 GLN N N 15 127.548 0.000 . . . . . A A 24 GLN N . 30827 1
215 . 1 . 1 25 25 CYS H H 1 8.311 0.000 . . . . . A A 25 CYS H . 30827 1
216 . 1 . 1 25 25 CYS HA H 1 4.921 0.000 . . . . . A A 25 CYS HA . 30827 1
217 . 1 . 1 25 25 CYS HB2 H 1 2.737 0.000 . . . . . A A 25 CYS HB2 . 30827 1
218 . 1 . 1 25 25 CYS HB3 H 1 2.692 0.000 . . . . . A A 25 CYS HB3 . 30827 1
219 . 1 . 1 25 25 CYS CB C 13 46.662 0.008 . . . . . A A 25 CYS CB . 30827 1
220 . 1 . 1 25 25 CYS N N 15 118.939 0.000 . . . . . A A 25 CYS N . 30827 1
221 . 1 . 1 26 26 PHE H H 1 8.579 0.000 . . . . . A A 26 PHE H . 30827 1
222 . 1 . 1 26 26 PHE HA H 1 5.114 0.000 . . . . . A A 26 PHE HA . 30827 1
223 . 1 . 1 26 26 PHE HB2 H 1 2.935 0.000 . . . . . A A 26 PHE HB2 . 30827 1
224 . 1 . 1 26 26 PHE HB3 H 1 2.838 0.000 . . . . . A A 26 PHE HB3 . 30827 1
225 . 1 . 1 26 26 PHE HD1 H 1 6.886 0.000 . . . . . A A 26 PHE HD1 . 30827 1
226 . 1 . 1 26 26 PHE HD2 H 1 6.886 0.000 . . . . . A A 26 PHE HD2 . 30827 1
227 . 1 . 1 26 26 PHE HE1 H 1 5.963 0.000 . . . . . A A 26 PHE HE1 . 30827 1
228 . 1 . 1 26 26 PHE HE2 H 1 5.963 0.000 . . . . . A A 26 PHE HE2 . 30827 1
229 . 1 . 1 26 26 PHE HZ H 1 6.140 0.000 . . . . . A A 26 PHE HZ . 30827 1
230 . 1 . 1 26 26 PHE CA C 13 55.969 0.000 . . . . . A A 26 PHE CA . 30827 1
231 . 1 . 1 26 26 PHE CB C 13 38.409 0.000 . . . . . A A 26 PHE CB . 30827 1
232 . 1 . 1 26 26 PHE N N 15 119.649 0.000 . . . . . A A 26 PHE N . 30827 1
233 . 1 . 1 27 27 PRO HA H 1 4.383 0.000 . . . . . A A 27 PRO HA . 30827 1
234 . 1 . 1 27 27 PRO HB2 H 1 2.469 0.000 . . . . . A A 27 PRO HB2 . 30827 1
235 . 1 . 1 27 27 PRO HB3 H 1 2.106 0.001 . . . . . A A 27 PRO HB3 . 30827 1
236 . 1 . 1 27 27 PRO HG2 H 1 2.187 0.000 . . . . . A A 27 PRO HG2 . 30827 1
237 . 1 . 1 27 27 PRO HG3 H 1 2.153 0.000 . . . . . A A 27 PRO HG3 . 30827 1
238 . 1 . 1 27 27 PRO HD2 H 1 4.228 0.000 . . . . . A A 27 PRO HD2 . 30827 1
239 . 1 . 1 27 27 PRO HD3 H 1 3.932 0.000 . . . . . A A 27 PRO HD3 . 30827 1
240 . 1 . 1 27 27 PRO CA C 13 65.583 0.000 . . . . . A A 27 PRO CA . 30827 1
241 . 1 . 1 27 27 PRO CB C 13 33.707 0.000 . . . . . A A 27 PRO CB . 30827 1
242 . 1 . 1 27 27 PRO CG C 13 27.356 0.000 . . . . . A A 27 PRO CG . 30827 1
243 . 1 . 1 27 27 PRO CD C 13 51.530 0.000 . . . . . A A 27 PRO CD . 30827 1
244 . 1 . 1 28 28 ASP H H 1 9.213 0.000 . . . . . A A 28 ASP H . 30827 1
245 . 1 . 1 28 28 ASP HA H 1 5.277 0.000 . . . . . A A 28 ASP HA . 30827 1
246 . 1 . 1 28 28 ASP HB2 H 1 3.170 0.000 . . . . . A A 28 ASP HB2 . 30827 1
247 . 1 . 1 28 28 ASP HB3 H 1 2.752 0.000 . . . . . A A 28 ASP HB3 . 30827 1
248 . 1 . 1 28 28 ASP CA C 13 52.917 0.000 . . . . . A A 28 ASP CA . 30827 1
249 . 1 . 1 28 28 ASP CB C 13 40.974 0.000 . . . . . A A 28 ASP CB . 30827 1
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