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 31028
_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 TOCSY . . . 31028 1
2 '2D 1H-1H NOESY' . . . 31028 1
3 '2D DQF-COSY' . . . 31028 1
4 '2D 1H-13C HSQC' . . . 31028 1
5 HMBC . . . 31028 1
6 '3D 1H-13C TOCSY' . . . 31028 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 LYS HG2 H 1 1.334 0.020 . 1 . . . . A 1 LYS HG2 . 31028 1
2 . 1 . 1 1 1 LYS HG3 H 1 1.334 0.020 . 1 . . . . A 1 LYS HG3 . 31028 1
3 . 1 . 1 1 1 LYS HE3 H 1 2.830 0.020 . 1 . . . . A 1 LYS HE3 . 31028 1
4 . 1 . 1 1 1 LYS CA C 13 51.650 0.3 . 1 . . . . A 1 LYS CA . 31028 1
5 . 1 . 1 1 1 LYS CB C 13 29.270 0.3 . 1 . . . . A 1 LYS CB . 31028 1
6 . 1 . 1 1 1 LYS CG C 13 21.018 0.3 . 1 . . . . A 1 LYS CG . 31028 1
7 . 1 . 1 1 1 LYS CD C 13 26.130 0.3 . 1 . . . . A 1 LYS CD . 31028 1
8 . 1 . 1 1 1 LYS CE C 13 39.360 0.3 . 1 . . . . A 1 LYS CE . 31028 1
9 . 1 . 1 2 2 PRO HA H 1 4.248 0.020 . 1 . . . . A 2 PRO HA . 31028 1
10 . 1 . 1 2 2 PRO HB2 H 1 1.975 0.020 . 2 . . . . A 2 PRO HB2 . 31028 1
11 . 1 . 1 2 2 PRO HB3 H 1 1.302 0.020 . 2 . . . . A 2 PRO HB3 . 31028 1
12 . 1 . 1 2 2 PRO HG2 H 1 1.791 0.020 . 2 . . . . A 2 PRO HG2 . 31028 1
13 . 1 . 1 2 2 PRO HG3 H 1 1.715 0.020 . 2 . . . . A 2 PRO HG3 . 31028 1
14 . 1 . 1 2 2 PRO HD2 H 1 3.584 0.020 . 2 . . . . A 2 PRO HD2 . 31028 1
15 . 1 . 1 2 2 PRO HD3 H 1 3.337 0.020 . 2 . . . . A 2 PRO HD3 . 31028 1
16 . 1 . 1 2 2 PRO CA C 13 60.293 0.3 . 1 . . . . A 2 PRO CA . 31028 1
17 . 1 . 1 2 2 PRO CB C 13 29.142 0.3 . 1 . . . . A 2 PRO CB . 31028 1
18 . 1 . 1 2 2 PRO CG C 13 24.830 0.3 . 1 . . . . A 2 PRO CG . 31028 1
19 . 1 . 1 2 2 PRO CD C 13 47.733 0.3 . 1 . . . . A 2 PRO CD . 31028 1
20 . 1 . 1 3 3 ALA H H 1 8.212 0.020 . 1 . . . . A 3 ALA H . 31028 1
21 . 1 . 1 3 3 ALA HA H 1 4.204 0.020 . 1 . . . . A 3 ALA HA . 31028 1
22 . 1 . 1 3 3 ALA HB1 H 1 1.380 0.020 . 1 . . . . A 3 ALA HB1 . 31028 1
23 . 1 . 1 3 3 ALA HB2 H 1 1.380 0.020 . 1 . . . . A 3 ALA HB2 . 31028 1
24 . 1 . 1 3 3 ALA HB3 H 1 1.380 0.020 . 1 . . . . A 3 ALA HB3 . 31028 1
25 . 1 . 1 3 3 ALA CA C 13 50.797 0.3 . 1 . . . . A 3 ALA CA . 31028 1
26 . 1 . 1 3 3 ALA CB C 13 16.016 0.3 . 1 . . . . A 3 ALA CB . 31028 1
27 . 1 . 1 3 3 ALA N N 15 124.546 0.3 . 1 . . . . A 3 ALA N . 31028 1
28 . 1 . 1 4 4 TRP H H 1 7.611 0.020 . 1 . . . . A 4 TRP H . 31028 1
29 . 1 . 1 4 4 TRP HA H 1 4.430 0.020 . 1 . . . . A 4 TRP HA . 31028 1
30 . 1 . 1 4 4 TRP HB2 H 1 3.281 0.020 . 2 . . . . A 4 TRP HB2 . 31028 1
31 . 1 . 1 4 4 TRP HB3 H 1 3.180 0.020 . 2 . . . . A 4 TRP HB3 . 31028 1
32 . 1 . 1 4 4 TRP HD1 H 1 7.217 0.020 . 1 . . . . A 4 TRP HD1 . 31028 1
33 . 1 . 1 4 4 TRP HE1 H 1 10.006 0.020 . 1 . . . . A 4 TRP HE1 . 31028 1
34 . 1 . 1 4 4 TRP HE3 H 1 7.407 0.020 . 1 . . . . A 4 TRP HE3 . 31028 1
35 . 1 . 1 4 4 TRP HZ2 H 1 7.337 0.020 . 1 . . . . A 4 TRP HZ2 . 31028 1
36 . 1 . 1 4 4 TRP HZ3 H 1 6.940 0.020 . 1 . . . . A 4 TRP HZ3 . 31028 1
37 . 1 . 1 4 4 TRP HH2 H 1 7.014 0.020 . 1 . . . . A 4 TRP HH2 . 31028 1
38 . 1 . 1 4 4 TRP CA C 13 56.284 0.3 . 1 . . . . A 4 TRP CA . 31028 1
39 . 1 . 1 4 4 TRP CB C 13 26.298 0.3 . 1 . . . . A 4 TRP CB . 31028 1
40 . 1 . 1 4 4 TRP CD1 C 13 124.714 0.3 . 1 . . . . A 4 TRP CD1 . 31028 1
41 . 1 . 1 4 4 TRP CE3 C 13 118.022 0.3 . 1 . . . . A 4 TRP CE3 . 31028 1
42 . 1 . 1 4 4 TRP CZ2 C 13 111.812 0.3 . 1 . . . . A 4 TRP CZ2 . 31028 1
43 . 1 . 1 4 4 TRP CZ3 C 13 119.083 0.3 . 1 . . . . A 4 TRP CZ3 . 31028 1
44 . 1 . 1 4 4 TRP CH2 C 13 121.566 0.3 . 1 . . . . A 4 TRP CH2 . 31028 1
45 . 1 . 1 4 4 TRP N N 15 116.287 0.3 . 1 . . . . A 4 TRP N . 31028 1
46 . 1 . 1 4 4 TRP NE1 N 15 129.680 0.3 . 1 . . . . A 4 TRP NE1 . 31028 1
47 . 1 . 1 5 5 CYS H H 1 7.935 0.020 . 1 . . . . A 5 CYS H . 31028 1
48 . 1 . 1 5 5 CYS HA H 1 4.232 0.020 . 1 . . . . A 5 CYS HA . 31028 1
49 . 1 . 1 5 5 CYS HB2 H 1 2.675 0.020 . 2 . . . . A 5 CYS HB2 . 31028 1
50 . 1 . 1 5 5 CYS HB3 H 1 2.459 0.020 . 2 . . . . A 5 CYS HB3 . 31028 1
51 . 1 . 1 5 5 CYS CA C 13 55.191 0.3 . 1 . . . . A 5 CYS CA . 31028 1
52 . 1 . 1 5 5 CYS CB C 13 36.503 0.3 . 1 . . . . A 5 CYS CB . 31028 1
53 . 1 . 1 5 5 CYS N N 15 117.636 0.3 . 1 . . . . A 5 CYS N . 31028 1
54 . 1 . 1 6 6 TRP H H 1 7.536 0.020 . 1 . . . . A 6 TRP H . 31028 1
55 . 1 . 1 6 6 TRP HA H 1 4.385 0.020 . 1 . . . . A 6 TRP HA . 31028 1
56 . 1 . 1 6 6 TRP HB2 H 1 3.229 0.020 . 2 . . . . A 6 TRP HB2 . 31028 1
57 . 1 . 1 6 6 TRP HB3 H 1 3.126 0.020 . 2 . . . . A 6 TRP HB3 . 31028 1
58 . 1 . 1 6 6 TRP HD1 H 1 7.034 0.020 . 1 . . . . A 6 TRP HD1 . 31028 1
59 . 1 . 1 6 6 TRP HE1 H 1 9.867 0.020 . 1 . . . . A 6 TRP HE1 . 31028 1
60 . 1 . 1 6 6 TRP HE3 H 1 7.399 0.020 . 1 . . . . A 6 TRP HE3 . 31028 1
61 . 1 . 1 6 6 TRP HZ2 H 1 7.372 0.020 . 1 . . . . A 6 TRP HZ2 . 31028 1
62 . 1 . 1 6 6 TRP HZ3 H 1 6.961 0.020 . 1 . . . . A 6 TRP HZ3 . 31028 1
63 . 1 . 1 6 6 TRP HH2 H 1 7.115 0.020 . 1 . . . . A 6 TRP HH2 . 31028 1
64 . 1 . 1 6 6 TRP CA C 13 57.014 0.3 . 1 . . . . A 6 TRP CA . 31028 1
65 . 1 . 1 6 6 TRP CB C 13 26.653 0.3 . 1 . . . . A 6 TRP CB . 31028 1
66 . 1 . 1 6 6 TRP CD1 C 13 124.354 0.3 . 1 . . . . A 6 TRP CD1 . 31028 1
67 . 1 . 1 6 6 TRP CE3 C 13 118.011 0.3 . 1 . . . . A 6 TRP CE3 . 31028 1
68 . 1 . 1 6 6 TRP CZ2 C 13 111.730 0.3 . 1 . . . . A 6 TRP CZ2 . 31028 1
69 . 1 . 1 6 6 TRP CZ3 C 13 119.190 0.3 . 1 . . . . A 6 TRP CZ3 . 31028 1
70 . 1 . 1 6 6 TRP CH2 C 13 121.675 0.3 . 1 . . . . A 6 TRP CH2 . 31028 1
71 . 1 . 1 6 6 TRP N N 15 120.114 0.3 . 1 . . . . A 6 TRP N . 31028 1
72 . 1 . 1 6 6 TRP NE1 N 15 128.354 0.3 . 1 . . . . A 6 TRP NE1 . 31028 1
73 . 1 . 1 7 7 TYR H H 1 7.732 0.020 . 1 . . . . A 7 TYR H . 31028 1
74 . 1 . 1 7 7 TYR HA H 1 4.267 0.020 . 1 . . . . A 7 TYR HA . 31028 1
75 . 1 . 1 7 7 TYR HB2 H 1 3.042 0.020 . 2 . . . . A 7 TYR HB2 . 31028 1
76 . 1 . 1 7 7 TYR HB3 H 1 2.916 0.020 . 2 . . . . A 7 TYR HB3 . 31028 1
77 . 1 . 1 7 7 TYR HD1 H 1 7.075 0.020 . 3 . . . . A 7 TYR HD1 . 31028 1
78 . 1 . 1 7 7 TYR HD2 H 1 7.025 0.020 . 3 . . . . A 7 TYR HD2 . 31028 1
79 . 1 . 1 7 7 TYR HE1 H 1 6.742 0.020 . 1 . . . . A 7 TYR HE1 . 31028 1
80 . 1 . 1 7 7 TYR CA C 13 57.576 0.3 . 1 . . . . A 7 TYR CA . 31028 1
81 . 1 . 1 7 7 TYR CB C 13 35.917 0.3 . 1 . . . . A 7 TYR CB . 31028 1
82 . 1 . 1 7 7 TYR CD1 C 13 130.292 0.3 . 1 . . . . A 7 TYR CD1 . 31028 1
83 . 1 . 1 7 7 TYR CE1 C 13 115.478 0.3 . 1 . . . . A 7 TYR CE1 . 31028 1
84 . 1 . 1 7 7 TYR N N 15 117.656 0.3 . 1 . . . . A 7 TYR N . 31028 1
85 . 1 . 1 8 8 THR H H 1 7.825 0.020 . 1 . . . . A 8 THR H . 31028 1
86 . 1 . 1 8 8 THR HA H 1 3.826 0.020 . 1 . . . . A 8 THR HA . 31028 1
87 . 1 . 1 8 8 THR HB H 1 4.085 0.020 . 1 . . . . A 8 THR HB . 31028 1
88 . 1 . 1 8 8 THR HG21 H 1 1.116 0.020 . 1 . . . . A 8 THR HG21 . 31028 1
89 . 1 . 1 8 8 THR HG22 H 1 1.116 0.020 . 1 . . . . A 8 THR HG22 . 31028 1
90 . 1 . 1 8 8 THR HG23 H 1 1.116 0.020 . 1 . . . . A 8 THR HG23 . 31028 1
91 . 1 . 1 8 8 THR CA C 13 63.259 0.3 . 1 . . . . A 8 THR CA . 31028 1
92 . 1 . 1 8 8 THR CB C 13 66.034 0.3 . 1 . . . . A 8 THR CB . 31028 1
93 . 1 . 1 8 8 THR CG2 C 13 19.581 0.3 . 1 . . . . A 8 THR CG2 . 31028 1
94 . 1 . 1 8 8 THR N N 15 113.774 0.3 . 1 . . . . A 8 THR N . 31028 1
95 . 1 . 1 9 9 LEU H H 1 7.740 0.020 . 1 . . . . A 9 LEU H . 31028 1
96 . 1 . 1 9 9 LEU HA H 1 3.949 0.020 . 1 . . . . A 9 LEU HA . 31028 1
97 . 1 . 1 9 9 LEU HB2 H 1 1.698 0.020 . 2 . . . . A 9 LEU HB2 . 31028 1
98 . 1 . 1 9 9 LEU HB3 H 1 1.645 0.020 . 2 . . . . A 9 LEU HB3 . 31028 1
99 . 1 . 1 9 9 LEU HG H 1 1.592 0.020 . 1 . . . . A 9 LEU HG . 31028 1
100 . 1 . 1 9 9 LEU HD11 H 1 0.791 0.020 . 1 . . . . A 9 LEU HD11 . 31028 1
101 . 1 . 1 9 9 LEU HD12 H 1 0.791 0.020 . 1 . . . . A 9 LEU HD12 . 31028 1
102 . 1 . 1 9 9 LEU HD13 H 1 0.791 0.020 . 1 . . . . A 9 LEU HD13 . 31028 1
103 . 1 . 1 9 9 LEU HD21 H 1 0.767 0.020 . 1 . . . . A 9 LEU HD21 . 31028 1
104 . 1 . 1 9 9 LEU HD22 H 1 0.767 0.020 . 1 . . . . A 9 LEU HD22 . 31028 1
105 . 1 . 1 9 9 LEU HD23 H 1 0.767 0.020 . 1 . . . . A 9 LEU HD23 . 31028 1
106 . 1 . 1 9 9 LEU CA C 13 55.527 0.3 . 1 . . . . A 9 LEU CA . 31028 1
107 . 1 . 1 9 9 LEU CB C 13 38.780 0.3 . 1 . . . . A 9 LEU CB . 31028 1
108 . 1 . 1 9 9 LEU CG C 13 24.375 0.3 . 1 . . . . A 9 LEU CG . 31028 1
109 . 1 . 1 9 9 LEU CD1 C 13 21.782 0.3 . 1 . . . . A 9 LEU CD1 . 31028 1
110 . 1 . 1 9 9 LEU N N 15 121.689 0.3 . 1 . . . . A 9 LEU N . 31028 1
111 . 1 . 1 10 10 ALA H H 1 7.595 0.020 . 1 . . . . A 10 ALA H . 31028 1
112 . 1 . 1 10 10 ALA HA H 1 4.013 0.020 . 1 . . . . A 10 ALA HA . 31028 1
113 . 1 . 1 10 10 ALA HB1 H 1 1.300 0.020 . 1 . . . . A 10 ALA HB1 . 31028 1
114 . 1 . 1 10 10 ALA HB2 H 1 1.300 0.020 . 1 . . . . A 10 ALA HB2 . 31028 1
115 . 1 . 1 10 10 ALA HB3 H 1 1.300 0.020 . 1 . . . . A 10 ALA HB3 . 31028 1
116 . 1 . 1 10 10 ALA CA C 13 51.832 0.3 . 1 . . . . A 10 ALA CA . 31028 1
117 . 1 . 1 10 10 ALA CB C 13 15.590 0.3 . 1 . . . . A 10 ALA CB . 31028 1
118 . 1 . 1 10 10 ALA N N 15 120.318 0.3 . 1 . . . . A 10 ALA N . 31028 1
119 . 1 . 1 11 11 MET H H 1 7.785 0.020 . 1 . . . . A 11 MET H . 31028 1
120 . 1 . 1 11 11 MET HA H 1 4.247 0.020 . 1 . . . . A 11 MET HA . 31028 1
121 . 1 . 1 11 11 MET HB2 H 1 1.958 0.020 . 2 . . . . A 11 MET HB2 . 31028 1
122 . 1 . 1 11 11 MET HB3 H 1 1.910 0.020 . 2 . . . . A 11 MET HB3 . 31028 1
123 . 1 . 1 11 11 MET HG2 H 1 2.440 0.020 . 2 . . . . A 11 MET HG2 . 31028 1
124 . 1 . 1 11 11 MET HG3 H 1 2.335 0.020 . 2 . . . . A 11 MET HG3 . 31028 1
125 . 1 . 1 11 11 MET HE1 H 1 1.971 0.020 . 1 . . . . A 11 MET HE1 . 31028 1
126 . 1 . 1 11 11 MET HE2 H 1 1.971 0.020 . 1 . . . . A 11 MET HE2 . 31028 1
127 . 1 . 1 11 11 MET HE3 H 1 1.971 0.020 . 1 . . . . A 11 MET HE3 . 31028 1
128 . 1 . 1 11 11 MET CA C 13 54.307 0.3 . 1 . . . . A 11 MET CA . 31028 1
129 . 1 . 1 11 11 MET CB C 13 30.148 0.3 . 1 . . . . A 11 MET CB . 31028 1
130 . 1 . 1 11 11 MET CG C 13 29.563 0.3 . 1 . . . . A 11 MET CG . 31028 1
131 . 1 . 1 11 11 MET CE C 13 0.507 0.3 . 1 . . . . A 11 MET CE . 31028 1
132 . 1 . 1 11 11 MET N N 15 114.918 0.3 . 1 . . . . A 11 MET N . 31028 1
133 . 1 . 1 12 12 CYS H H 1 8.137 0.020 . 1 . . . . A 12 CYS H . 31028 1
134 . 1 . 1 12 12 CYS HA H 1 4.536 0.020 . 1 . . . . A 12 CYS HA . 31028 1
135 . 1 . 1 12 12 CYS HB2 H 1 3.094 0.020 . 2 . . . . A 12 CYS HB2 . 31028 1
136 . 1 . 1 12 12 CYS HB3 H 1 2.974 0.020 . 2 . . . . A 12 CYS HB3 . 31028 1
137 . 1 . 1 12 12 CYS CA C 13 55.531 0.3 . 1 . . . . A 12 CYS CA . 31028 1
138 . 1 . 1 12 12 CYS CB C 13 38.231 0.3 . 1 . . . . A 12 CYS CB . 31028 1
139 . 1 . 1 12 12 CYS N N 15 117.249 0.3 . 1 . . . . A 12 CYS N . 31028 1
140 . 1 . 1 13 13 GLY H H 1 8.091 0.020 . 1 . . . . A 13 GLY H . 31028 1
141 . 1 . 1 13 13 GLY HA2 H 1 3.877 0.020 . 2 . . . . A 13 GLY HA2 . 31028 1
142 . 1 . 1 13 13 GLY HA3 H 1 3.816 0.020 . 2 . . . . A 13 GLY HA3 . 31028 1
143 . 1 . 1 13 13 GLY CA C 13 43.443 0.3 . 1 . . . . A 13 GLY CA . 31028 1
144 . 1 . 1 13 13 GLY N N 15 108.555 0.3 . 1 . . . . A 13 GLY N . 31028 1
145 . 1 . 1 14 14 ALA H H 1 7.632 0.020 . 1 . . . . A 14 ALA H . 31028 1
146 . 1 . 1 14 14 ALA HA H 1 4.308 0.020 . 1 . . . . A 14 ALA HA . 31028 1
147 . 1 . 1 14 14 ALA HB1 H 1 1.357 0.020 . 1 . . . . A 14 ALA HB1 . 31028 1
148 . 1 . 1 14 14 ALA HB2 H 1 1.357 0.020 . 1 . . . . A 14 ALA HB2 . 31028 1
149 . 1 . 1 14 14 ALA HB3 H 1 1.357 0.020 . 1 . . . . A 14 ALA HB3 . 31028 1
150 . 1 . 1 14 14 ALA CA C 13 49.554 0.3 . 1 . . . . A 14 ALA CA . 31028 1
151 . 1 . 1 14 14 ALA CB C 13 16.417 0.3 . 1 . . . . A 14 ALA CB . 31028 1
152 . 1 . 1 14 14 ALA N N 15 121.244 0.3 . 1 . . . . A 14 ALA N . 31028 1
153 . 1 . 1 15 15 GLY H H 1 7.704 0.020 . 1 . . . . A 15 GLY H . 31028 1
154 . 1 . 1 15 15 GLY HA2 H 1 3.931 0.020 . 2 . . . . A 15 GLY HA2 . 31028 1
155 . 1 . 1 15 15 GLY HA3 H 1 3.681 0.020 . 2 . . . . A 15 GLY HA3 . 31028 1
156 . 1 . 1 15 15 GLY CA C 13 42.837 0.3 . 1 . . . . A 15 GLY CA . 31028 1
157 . 1 . 1 15 15 GLY N N 15 104.796 0.3 . 1 . . . . A 15 GLY N . 31028 1
158 . 1 . 1 16 16 TYR H H 1 7.574 0.020 . 1 . . . . A 16 TYR H . 31028 1
159 . 1 . 1 16 16 TYR HA H 1 4.454 0.020 . 1 . . . . A 16 TYR HA . 31028 1
160 . 1 . 1 16 16 TYR HB2 H 1 2.949 0.020 . 2 . . . . A 16 TYR HB2 . 31028 1
161 . 1 . 1 16 16 TYR HB3 H 1 2.856 0.020 . 2 . . . . A 16 TYR HB3 . 31028 1
162 . 1 . 1 16 16 TYR HD1 H 1 6.998 0.020 . 1 . . . . A 16 TYR HD1 . 31028 1
163 . 1 . 1 16 16 TYR HE1 H 1 6.714 0.020 . 1 . . . . A 16 TYR HE1 . 31028 1
164 . 1 . 1 16 16 TYR CA C 13 55.264 0.3 . 1 . . . . A 16 TYR CA . 31028 1
165 . 1 . 1 16 16 TYR CB C 13 36.133 0.3 . 1 . . . . A 16 TYR CB . 31028 1
166 . 1 . 1 16 16 TYR CD1 C 13 130.428 0.3 . 1 . . . . A 16 TYR CD1 . 31028 1
167 . 1 . 1 16 16 TYR CE1 C 13 115.445 0.3 . 1 . . . . A 16 TYR CE1 . 31028 1
168 . 1 . 1 16 16 TYR N N 15 118.288 0.3 . 1 . . . . A 16 TYR N . 31028 1
169 . 1 . 1 17 17 ASP H H 1 8.119 0.020 . 1 . . . . A 17 ASP H . 31028 1
170 . 1 . 1 17 17 ASP HA H 1 4.496 0.020 . 1 . . . . A 17 ASP HA . 31028 1
171 . 1 . 1 17 17 ASP HB2 H 1 2.945 0.020 . 2 . . . . A 17 ASP HB2 . 31028 1
172 . 1 . 1 17 17 ASP HB3 H 1 2.671 0.020 . 2 . . . . A 17 ASP HB3 . 31028 1
173 . 1 . 1 17 17 ASP CA C 13 50.518 0.3 . 1 . . . . A 17 ASP CA . 31028 1
174 . 1 . 1 17 17 ASP CB C 13 34.872 0.3 . 1 . . . . A 17 ASP CB . 31028 1
175 . 1 . 1 17 17 ASP N N 15 117.908 0.3 . 1 . . . . A 17 ASP N . 31028 1
176 . 1 . 1 18 18 EW6 H H 1 8.106 0.020 . 1 . . . . A 18 EW6 H . 31028 1
177 . 1 . 1 18 18 EW6 N N 15 127.060 0.3 . 1 . . . . A 18 EW6 N . 31028 1
178 . 1 . 1 18 18 EW6 CA C 13 55.567 0.3 . 1 . . . . A 18 EW6 CA . 31028 1
179 . 1 . 1 18 18 EW6 CB C 13 71.140 0.3 . 1 . . . . A 18 EW6 CB . 31028 1
180 . 1 . 1 18 18 EW6 HB2 H 1 3.913 0.020 . 2 . . . . A 18 EW6 HB2 . 31028 1
181 . 1 . 1 18 18 EW6 HB3 H 1 3.626 0.020 . 2 . . . . A 18 EW6 HB3 . 31028 1
182 . 1 . 1 19 19 GLY H H 1 8.044 0.020 . 1 . . . . A 19 GLY H . 31028 1
183 . 1 . 1 19 19 GLY HA2 H 1 3.901 0.020 . 2 . . . . A 19 GLY HA2 . 31028 1
184 . 1 . 1 19 19 GLY HA3 H 1 3.775 0.020 . 2 . . . . A 19 GLY HA3 . 31028 1
185 . 1 . 1 19 19 GLY CA C 13 44.695 0.3 . 1 . . . . A 19 GLY CA . 31028 1
186 . 1 . 1 19 19 GLY N N 15 107.214 0.3 . 1 . . . . A 19 GLY N . 31028 1
187 . 1 . 1 20 20 THR H H 1 7.862 0.020 . 1 . . . . A 20 THR H . 31028 1
188 . 1 . 1 20 20 THR HA H 1 4.081 0.020 . 1 . . . . A 20 THR HA . 31028 1
189 . 1 . 1 20 20 THR HB H 1 4.097 0.020 . 1 . . . . A 20 THR HB . 31028 1
190 . 1 . 1 20 20 THR HG21 H 1 1.183 0.020 . 1 . . . . A 20 THR HG21 . 31028 1
191 . 1 . 1 20 20 THR HG22 H 1 1.183 0.020 . 1 . . . . A 20 THR HG22 . 31028 1
192 . 1 . 1 20 20 THR HG23 H 1 1.183 0.020 . 1 . . . . A 20 THR HG23 . 31028 1
193 . 1 . 1 20 20 THR CA C 13 62.859 0.3 . 1 . . . . A 20 THR CA . 31028 1
194 . 1 . 1 20 20 THR CB C 13 66.086 0.3 . 1 . . . . A 20 THR CB . 31028 1
195 . 1 . 1 20 20 THR CG2 C 13 19.693 0.3 . 1 . . . . A 20 THR CG2 . 31028 1
196 . 1 . 1 20 20 THR N N 15 117.032 0.3 . 1 . . . . A 20 THR N . 31028 1
197 . 1 . 1 21 21 CYS H H 1 8.046 0.020 . 1 . . . . A 21 CYS H . 31028 1
198 . 1 . 1 21 21 CYS HA H 1 4.248 0.020 . 1 . . . . A 21 CYS HA . 31028 1
199 . 1 . 1 21 21 CYS HB2 H 1 3.113 0.020 . 2 . . . . A 21 CYS HB2 . 31028 1
200 . 1 . 1 21 21 CYS HB3 H 1 2.962 0.020 . 2 . . . . A 21 CYS HB3 . 31028 1
201 . 1 . 1 21 21 CYS CA C 13 56.965 0.3 . 1 . . . . A 21 CYS CA . 31028 1
202 . 1 . 1 21 21 CYS CB C 13 38.055 0.3 . 1 . . . . A 21 CYS CB . 31028 1
203 . 1 . 1 21 21 CYS N N 15 119.678 0.3 . 1 . . . . A 21 CYS N . 31028 1
204 . 1 . 1 22 22 ASP H H 1 8.566 0.020 . 1 . . . . A 22 ASP H . 31028 1
205 . 1 . 1 22 22 ASP HA H 1 4.464 0.020 . 1 . . . . A 22 ASP HA . 31028 1
206 . 1 . 1 22 22 ASP HB2 H 1 2.973 0.020 . 2 . . . . A 22 ASP HB2 . 31028 1
207 . 1 . 1 22 22 ASP HB3 H 1 2.862 0.020 . 2 . . . . A 22 ASP HB3 . 31028 1
208 . 1 . 1 22 22 ASP CA C 13 53.920 0.3 . 1 . . . . A 22 ASP CA . 31028 1
209 . 1 . 1 22 22 ASP CB C 13 34.891 0.3 . 1 . . . . A 22 ASP CB . 31028 1
210 . 1 . 1 22 22 ASP N N 15 118.937 0.3 . 1 . . . . A 22 ASP N . 31028 1
211 . 1 . 1 23 23 TYR H H 1 8.098 0.020 . 1 . . . . A 23 TYR H . 31028 1
212 . 1 . 1 23 23 TYR HA H 1 4.185 0.020 . 1 . . . . A 23 TYR HA . 31028 1
213 . 1 . 1 23 23 TYR HB2 H 1 3.174 0.020 . 2 . . . . A 23 TYR HB2 . 31028 1
214 . 1 . 1 23 23 TYR HB3 H 1 3.107 0.020 . 2 . . . . A 23 TYR HB3 . 31028 1
215 . 1 . 1 23 23 TYR HD1 H 1 6.985 0.020 . 3 . . . . A 23 TYR HD1 . 31028 1
216 . 1 . 1 23 23 TYR HD2 H 1 6.963 0.020 . 3 . . . . A 23 TYR HD2 . 31028 1
217 . 1 . 1 23 23 TYR HE1 H 1 6.570 0.020 . 1 . . . . A 23 TYR HE1 . 31028 1
218 . 1 . 1 23 23 TYR CA C 13 59.002 0.3 . 1 . . . . A 23 TYR CA . 31028 1
219 . 1 . 1 23 23 TYR CB C 13 35.688 0.3 . 1 . . . . A 23 TYR CB . 31028 1
220 . 1 . 1 23 23 TYR CD1 C 13 130.310 0.3 . 1 . . . . A 23 TYR CD1 . 31028 1
221 . 1 . 1 23 23 TYR CE1 C 13 115.315 0.3 . 1 . . . . A 23 TYR CE1 . 31028 1
222 . 1 . 1 23 23 TYR N N 15 121.690 0.3 . 1 . . . . A 23 TYR N . 31028 1
223 . 1 . 1 24 24 MET H H 1 8.392 0.020 . 1 . . . . A 24 MET H . 31028 1
224 . 1 . 1 24 24 MET HA H 1 4.112 0.020 . 1 . . . . A 24 MET HA . 31028 1
225 . 1 . 1 24 24 MET HB2 H 1 2.247 0.020 . 2 . . . . A 24 MET HB2 . 31028 1
226 . 1 . 1 24 24 MET HB3 H 1 2.178 0.020 . 2 . . . . A 24 MET HB3 . 31028 1
227 . 1 . 1 24 24 MET HG2 H 1 2.677 0.020 . 2 . . . . A 24 MET HG2 . 31028 1
228 . 1 . 1 24 24 MET HG3 H 1 2.549 0.020 . 2 . . . . A 24 MET HG3 . 31028 1
229 . 1 . 1 24 24 MET HE1 H 1 1.816 0.020 . 1 . . . . A 24 MET HE1 . 31028 1
230 . 1 . 1 24 24 MET HE2 H 1 1.816 0.020 . 1 . . . . A 24 MET HE2 . 31028 1
231 . 1 . 1 24 24 MET HE3 H 1 1.816 0.020 . 1 . . . . A 24 MET HE3 . 31028 1
232 . 1 . 1 24 24 MET CA C 13 56.336 0.3 . 1 . . . . A 24 MET CA . 31028 1
233 . 1 . 1 24 24 MET CB C 13 29.014 0.3 . 1 . . . . A 24 MET CB . 31028 1
234 . 1 . 1 24 24 MET CG C 13 29.491 0.3 . 1 . . . . A 24 MET CG . 31028 1
235 . 1 . 1 24 24 MET CE C 13 14.459 0.3 . 1 . . . . A 24 MET CE . 31028 1
236 . 1 . 1 24 24 MET N N 15 120.159 0.3 . 1 . . . . A 24 MET N . 31028 1
237 . 1 . 1 25 25 TYR H H 1 8.871 0.020 . 1 . . . . A 25 TYR H . 31028 1
238 . 1 . 1 25 25 TYR HA H 1 4.152 0.020 . 1 . . . . A 25 TYR HA . 31028 1
239 . 1 . 1 25 25 TYR HB2 H 1 3.109 0.020 . 2 . . . . A 25 TYR HB2 . 31028 1
240 . 1 . 1 25 25 TYR HB3 H 1 3.048 0.020 . 2 . . . . A 25 TYR HB3 . 31028 1
241 . 1 . 1 25 25 TYR HD1 H 1 6.974 0.020 . 3 . . . . A 25 TYR HD1 . 31028 1
242 . 1 . 1 25 25 TYR HD2 H 1 6.966 0.020 . 3 . . . . A 25 TYR HD2 . 31028 1
243 . 1 . 1 25 25 TYR HE1 H 1 6.496 0.020 . 1 . . . . A 25 TYR HE1 . 31028 1
244 . 1 . 1 25 25 TYR CA C 13 59.497 0.3 . 1 . . . . A 25 TYR CA . 31028 1
245 . 1 . 1 25 25 TYR CB C 13 35.622 0.3 . 1 . . . . A 25 TYR CB . 31028 1
246 . 1 . 1 25 25 TYR CD1 C 13 130.426 0.3 . 1 . . . . A 25 TYR CD1 . 31028 1
247 . 1 . 1 25 25 TYR CE1 C 13 115.170 0.3 . 1 . . . . A 25 TYR CE1 . 31028 1
248 . 1 . 1 25 25 TYR N N 15 119.978 0.3 . 1 . . . . A 25 TYR N . 31028 1
249 . 1 . 1 26 26 SER H H 1 7.981 0.020 . 1 . . . . A 26 SER H . 31028 1
250 . 1 . 1 26 26 SER HA H 1 4.120 0.020 . 1 . . . . A 26 SER HA . 31028 1
251 . 1 . 1 26 26 SER HB2 H 1 3.801 0.020 . 1 . . . . A 26 SER HB2 . 31028 1
252 . 1 . 1 26 26 SER HB3 H 1 3.801 0.020 . 1 . . . . A 26 SER HB3 . 31028 1
253 . 1 . 1 26 26 SER CA C 13 58.249 0.3 . 1 . . . . A 26 SER CA . 31028 1
254 . 1 . 1 26 26 SER CB C 13 60.635 0.3 . 1 . . . . A 26 SER CB . 31028 1
255 . 1 . 1 26 26 SER N N 15 112.443 0.3 . 1 . . . . A 26 SER N . 31028 1
256 . 1 . 1 27 27 HIS H H 1 7.832 0.020 . 1 . . . . A 27 HIS H . 31028 1
257 . 1 . 1 27 27 HIS HA H 1 4.277 0.020 . 1 . . . . A 27 HIS HA . 31028 1
258 . 1 . 1 27 27 HIS HB2 H 1 3.080 0.020 . 2 . . . . A 27 HIS HB2 . 31028 1
259 . 1 . 1 27 27 HIS HB3 H 1 2.706 0.020 . 2 . . . . A 27 HIS HB3 . 31028 1
260 . 1 . 1 27 27 HIS HD2 H 1 6.962 0.020 . 1 . . . . A 27 HIS HD2 . 31028 1
261 . 1 . 1 27 27 HIS HE1 H 1 8.194 0.020 . 1 . . . . A 27 HIS HE1 . 31028 1
262 . 1 . 1 27 27 HIS CA C 13 55.604 0.3 . 1 . . . . A 27 HIS CA . 31028 1
263 . 1 . 1 27 27 HIS CB C 13 25.678 0.3 . 1 . . . . A 27 HIS CB . 31028 1
264 . 1 . 1 27 27 HIS CD2 C 13 116.965 0.3 . 1 . . . . A 27 HIS CD2 . 31028 1
265 . 1 . 1 27 27 HIS CE1 C 13 133.511 0.3 . 1 . . . . A 27 HIS CE1 . 31028 1
266 . 1 . 1 27 27 HIS N N 15 116.390 0.3 . 1 . . . . A 27 HIS N . 31028 1
267 . 1 . 1 28 28 CYS H H 1 8.104 0.020 . 1 . . . . A 28 CYS H . 31028 1
268 . 1 . 1 28 28 CYS HA H 1 4.269 0.020 . 1 . . . . A 28 CYS HA . 31028 1
269 . 1 . 1 28 28 CYS HB2 H 1 2.749 0.020 . 2 . . . . A 28 CYS HB2 . 31028 1
270 . 1 . 1 28 28 CYS HB3 H 1 1.947 0.020 . 2 . . . . A 28 CYS HB3 . 31028 1
271 . 1 . 1 28 28 CYS CA C 13 55.370 0.3 . 1 . . . . A 28 CYS CA . 31028 1
272 . 1 . 1 28 28 CYS CB C 13 39.569 0.3 . 1 . . . . A 28 CYS CB . 31028 1
273 . 1 . 1 28 28 CYS N N 15 115.707 0.3 . 1 . . . . A 28 CYS N . 31028 1
274 . 1 . 1 29 29 PHE H H 1 7.652 0.020 . 1 . . . . A 29 PHE H . 31028 1
275 . 1 . 1 29 29 PHE HA H 1 4.598 0.020 . 1 . . . . A 29 PHE HA . 31028 1
276 . 1 . 1 29 29 PHE HB2 H 1 3.145 0.020 . 2 . . . . A 29 PHE HB2 . 31028 1
277 . 1 . 1 29 29 PHE HB3 H 1 2.559 0.020 . 2 . . . . A 29 PHE HB3 . 31028 1
278 . 1 . 1 29 29 PHE HD1 H 1 6.999 0.020 . 3 . . . . A 29 PHE HD1 . 31028 1
279 . 1 . 1 29 29 PHE HD2 H 1 6.986 0.020 . 3 . . . . A 29 PHE HD2 . 31028 1
280 . 1 . 1 29 29 PHE HE1 H 1 7.034 0.020 . 3 . . . . A 29 PHE HE1 . 31028 1
281 . 1 . 1 29 29 PHE HE2 H 1 6.997 0.020 . 3 . . . . A 29 PHE HE2 . 31028 1
282 . 1 . 1 29 29 PHE HZ H 1 6.770 0.020 . 1 . . . . A 29 PHE HZ . 31028 1
283 . 1 . 1 29 29 PHE CA C 13 55.052 0.3 . 1 . . . . A 29 PHE CA . 31028 1
284 . 1 . 1 29 29 PHE CB C 13 37.714 0.3 . 1 . . . . A 29 PHE CB . 31028 1
285 . 1 . 1 29 29 PHE CD1 C 13 129.461 0.3 . 1 . . . . A 29 PHE CD1 . 31028 1
286 . 1 . 1 29 29 PHE CE1 C 13 128.377 0.3 . 1 . . . . A 29 PHE CE1 . 31028 1
287 . 1 . 1 29 29 PHE CZ C 13 126.635 0.3 . 1 . . . . A 29 PHE CZ . 31028 1
288 . 1 . 1 29 29 PHE N N 15 116.028 0.3 . 1 . . . . A 29 PHE N . 31028 1
289 . 1 . 1 30 30 GLY H H 1 7.627 0.020 . 1 . . . . A 30 GLY H . 31028 1
290 . 1 . 1 30 30 GLY HA2 H 1 3.862 0.020 . 1 . . . . A 30 GLY HA2 . 31028 1
291 . 1 . 1 30 30 GLY CA C 13 43.102 0.3 . 1 . . . . A 30 GLY CA . 31028 1
292 . 1 . 1 30 30 GLY N N 15 107.954 0.3 . 1 . . . . A 30 GLY N . 31028 1
293 . 1 . 1 31 31 ILE H H 1 7.603 0.020 . 1 . . . . A 31 ILE H . 31028 1
294 . 1 . 1 31 31 ILE HA H 1 4.057 0.020 . 1 . . . . A 31 ILE HA . 31028 1
295 . 1 . 1 31 31 ILE HB H 1 1.704 0.020 . 1 . . . . A 31 ILE HB . 31028 1
296 . 1 . 1 31 31 ILE HG12 H 1 1.360 0.020 . 2 . . . . A 31 ILE HG12 . 31028 1
297 . 1 . 1 31 31 ILE HG13 H 1 1.044 0.020 . 2 . . . . A 31 ILE HG13 . 31028 1
298 . 1 . 1 31 31 ILE HG21 H 1 0.733 0.020 . 1 . . . . A 31 ILE HG21 . 31028 1
299 . 1 . 1 31 31 ILE HG22 H 1 0.733 0.020 . 1 . . . . A 31 ILE HG22 . 31028 1
300 . 1 . 1 31 31 ILE HG23 H 1 0.733 0.020 . 1 . . . . A 31 ILE HG23 . 31028 1
301 . 1 . 1 31 31 ILE HD11 H 1 0.754 0.020 . 1 . . . . A 31 ILE HD11 . 31028 1
302 . 1 . 1 31 31 ILE HD12 H 1 0.754 0.020 . 1 . . . . A 31 ILE HD12 . 31028 1
303 . 1 . 1 31 31 ILE HD13 H 1 0.754 0.020 . 1 . . . . A 31 ILE HD13 . 31028 1
304 . 1 . 1 31 31 ILE CA C 13 58.173 0.3 . 1 . . . . A 31 ILE CA . 31028 1
305 . 1 . 1 31 31 ILE CB C 13 36.282 0.3 . 1 . . . . A 31 ILE CB . 31028 1
306 . 1 . 1 31 31 ILE CG1 C 13 24.557 0.3 . 1 . . . . A 31 ILE CG1 . 31028 1
307 . 1 . 1 31 31 ILE CG2 C 13 14.636 0.3 . 1 . . . . A 31 ILE CG2 . 31028 1
308 . 1 . 1 31 31 ILE CD1 C 13 10.279 0.3 . 1 . . . . A 31 ILE CD1 . 31028 1
309 . 1 . 1 31 31 ILE N N 15 118.552 0.3 . 1 . . . . A 31 ILE N . 31028 1
310 . 1 . 1 32 32 LYS H H 1 7.978 0.020 . 1 . . . . A 32 LYS H . 31028 1
311 . 1 . 1 32 32 LYS HA H 1 4.196 0.020 . 1 . . . . A 32 LYS HA . 31028 1
312 . 1 . 1 32 32 LYS HB2 H 1 1.615 0.020 . 2 . . . . A 32 LYS HB2 . 31028 1
313 . 1 . 1 32 32 LYS HB3 H 1 1.567 0.020 . 2 . . . . A 32 LYS HB3 . 31028 1
314 . 1 . 1 32 32 LYS HG2 H 1 1.275 0.020 . 2 . . . . A 32 LYS HG2 . 31028 1
315 . 1 . 1 32 32 LYS HG3 H 1 1.236 0.020 . 2 . . . . A 32 LYS HG3 . 31028 1
316 . 1 . 1 32 32 LYS HD2 H 1 1.523 0.020 . 1 . . . . A 32 LYS HD2 . 31028 1
317 . 1 . 1 32 32 LYS HD3 H 1 1.523 0.020 . 1 . . . . A 32 LYS HD3 . 31028 1
318 . 1 . 1 32 32 LYS HE2 H 1 2.835 0.020 . 1 . . . . A 32 LYS HE2 . 31028 1
319 . 1 . 1 32 32 LYS HE3 H 1 2.835 0.020 . 1 . . . . A 32 LYS HE3 . 31028 1
320 . 1 . 1 32 32 LYS CA C 13 53.219 0.3 . 1 . . . . A 32 LYS CA . 31028 1
321 . 1 . 1 32 32 LYS CB C 13 30.445 0.3 . 1 . . . . A 32 LYS CB . 31028 1
322 . 1 . 1 32 32 LYS CG C 13 22.087 0.3 . 1 . . . . A 32 LYS CG . 31028 1
323 . 1 . 1 32 32 LYS CD C 13 26.244 0.3 . 1 . . . . A 32 LYS CD . 31028 1
324 . 1 . 1 32 32 LYS CE C 13 39.397 0.3 . 1 . . . . A 32 LYS CE . 31028 1
325 . 1 . 1 32 32 LYS N N 15 124.045 0.3 . 1 . . . . A 32 LYS N . 31028 1
326 . 1 . 1 33 33 HIS H H 1 8.129 0.020 . 1 . . . . A 33 HIS H . 31028 1
327 . 1 . 1 33 33 HIS HA H 1 4.537 0.020 . 1 . . . . A 33 HIS HA . 31028 1
328 . 1 . 1 33 33 HIS HB2 H 1 3.085 0.020 . 2 . . . . A 33 HIS HB2 . 31028 1
329 . 1 . 1 33 33 HIS HB3 H 1 2.976 0.020 . 2 . . . . A 33 HIS HB3 . 31028 1
330 . 1 . 1 33 33 HIS HD2 H 1 7.151 0.020 . 1 . . . . A 33 HIS HD2 . 31028 1
331 . 1 . 1 33 33 HIS HE1 H 1 8.454 0.020 . 1 . . . . A 33 HIS HE1 . 31028 1
332 . 1 . 1 33 33 HIS CA C 13 52.379 0.3 . 1 . . . . A 33 HIS CA . 31028 1
333 . 1 . 1 33 33 HIS CB C 13 26.588 0.3 . 1 . . . . A 33 HIS CB . 31028 1
334 . 1 . 1 33 33 HIS CD2 C 13 117.453 0.3 . 1 . . . . A 33 HIS CD2 . 31028 1
335 . 1 . 1 33 33 HIS CE1 C 13 133.744 0.3 . 1 . . . . A 33 HIS CE1 . 31028 1
336 . 1 . 1 33 33 HIS N N 15 118.613 0.3 . 1 . . . . A 33 HIS N . 31028 1
337 . 1 . 1 34 34 HIS H H 1 8.259 0.020 . 1 . . . . A 34 HIS H . 31028 1
338 . 1 . 1 34 34 HIS HA H 1 4.610 0.020 . 1 . . . . A 34 HIS HA . 31028 1
339 . 1 . 1 34 34 HIS HB2 H 1 3.129 0.020 . 2 . . . . A 34 HIS HB2 . 31028 1
340 . 1 . 1 34 34 HIS HB3 H 1 3.034 0.020 . 2 . . . . A 34 HIS HB3 . 31028 1
341 . 1 . 1 34 34 HIS HD2 H 1 7.195 0.020 . 1 . . . . A 34 HIS HD2 . 31028 1
342 . 1 . 1 34 34 HIS HE1 H 1 8.491 0.020 . 1 . . . . A 34 HIS HE1 . 31028 1
343 . 1 . 1 34 34 HIS CA C 13 52.461 0.3 . 1 . . . . A 34 HIS CA . 31028 1
344 . 1 . 1 34 34 HIS CB C 13 26.653 0.3 . 1 . . . . A 34 HIS CB . 31028 1
345 . 1 . 1 34 34 HIS CD2 C 13 117.630 0.3 . 1 . . . . A 34 HIS CD2 . 31028 1
346 . 1 . 1 34 34 HIS CE1 C 13 133.783 0.3 . 1 . . . . A 34 HIS CE1 . 31028 1
347 . 1 . 1 34 34 HIS N N 15 119.756 0.3 . 1 . . . . A 34 HIS N . 31028 1
348 . 1 . 1 35 35 SER H H 1 8.191 0.020 . 1 . . . . A 35 SER H . 31028 1
349 . 1 . 1 35 35 SER HA H 1 4.405 0.020 . 1 . . . . A 35 SER HA . 31028 1
350 . 1 . 1 35 35 SER HB2 H 1 3.797 0.020 . 2 . . . . A 35 SER HB2 . 31028 1
351 . 1 . 1 35 35 SER HB3 H 1 3.746 0.020 . 2 . . . . A 35 SER HB3 . 31028 1
352 . 1 . 1 35 35 SER CA C 13 55.413 0.3 . 1 . . . . A 35 SER CA . 31028 1
353 . 1 . 1 35 35 SER CB C 13 61.326 0.3 . 1 . . . . A 35 SER CB . 31028 1
354 . 1 . 1 35 35 SER N N 15 117.374 0.3 . 1 . . . . A 35 SER N . 31028 1
355 . 1 . 1 36 36 SER H H 1 8.214 0.020 . 1 . . . . A 36 SER H . 31028 1
356 . 1 . 1 36 36 SER HA H 1 4.410 0.020 . 1 . . . . A 36 SER HA . 31028 1
357 . 1 . 1 36 36 SER HB2 H 1 3.817 0.020 . 2 . . . . A 36 SER HB2 . 31028 1
358 . 1 . 1 36 36 SER HB3 H 1 3.784 0.020 . 2 . . . . A 36 SER HB3 . 31028 1
359 . 1 . 1 36 36 SER CA C 13 55.682 0.3 . 1 . . . . A 36 SER CA . 31028 1
360 . 1 . 1 36 36 SER CB C 13 61.326 0.3 . 1 . . . . A 36 SER CB . 31028 1
361 . 1 . 1 36 36 SER N N 15 117.344 0.3 . 1 . . . . A 36 SER N . 31028 1
362 . 1 . 1 37 37 GLY H H 1 8.187 0.020 . 1 . . . . A 37 GLY H . 31028 1
363 . 1 . 1 37 37 GLY HA2 H 1 3.930 0.020 . 2 . . . . A 37 GLY HA2 . 31028 1
364 . 1 . 1 37 37 GLY HA3 H 1 3.918 0.020 . 2 . . . . A 37 GLY HA3 . 31028 1
365 . 1 . 1 37 37 GLY CA C 13 42.622 0.3 . 1 . . . . A 37 GLY CA . 31028 1
366 . 1 . 1 37 37 GLY N N 15 109.822 0.3 . 1 . . . . A 37 GLY N . 31028 1
367 . 1 . 1 38 38 SER H H 1 7.991 0.020 . 1 . . . . A 38 SER H . 31028 1
368 . 1 . 1 38 38 SER HA H 1 4.407 0.020 . 1 . . . . A 38 SER HA . 31028 1
369 . 1 . 1 38 38 SER HB2 H 1 3.802 0.020 . 2 . . . . A 38 SER HB2 . 31028 1
370 . 1 . 1 38 38 SER HB3 H 1 3.737 0.020 . 2 . . . . A 38 SER HB3 . 31028 1
371 . 1 . 1 38 38 SER CA C 13 55.595 0.3 . 1 . . . . A 38 SER CA . 31028 1
372 . 1 . 1 38 38 SER CB C 13 61.326 0.3 . 1 . . . . A 38 SER CB . 31028 1
373 . 1 . 1 38 38 SER N N 15 114.874 0.3 . 1 . . . . A 38 SER N . 31028 1
374 . 1 . 1 39 39 SER H H 1 8.097 0.020 . 1 . . . . A 39 SER H . 31028 1
375 . 1 . 1 39 39 SER HA H 1 4.399 0.020 . 1 . . . . A 39 SER HA . 31028 1
376 . 1 . 1 39 39 SER HB2 H 1 3.809 0.020 . 2 . . . . A 39 SER HB2 . 31028 1
377 . 1 . 1 39 39 SER HB3 H 1 3.745 0.020 . 2 . . . . A 39 SER HB3 . 31028 1
378 . 1 . 1 39 39 SER CA C 13 55.782 0.3 . 1 . . . . A 39 SER CA . 31028 1
379 . 1 . 1 39 39 SER CB C 13 61.203 0.3 . 1 . . . . A 39 SER CB . 31028 1
380 . 1 . 1 39 39 SER N N 15 116.896 0.3 . 1 . . . . A 39 SER N . 31028 1
381 . 1 . 1 40 40 SER H H 1 7.940 0.020 . 1 . . . . A 40 SER H . 31028 1
382 . 1 . 1 40 40 SER HA H 1 4.320 0.020 . 1 . . . . A 40 SER HA . 31028 1
383 . 1 . 1 40 40 SER HB2 H 1 3.664 0.020 . 2 . . . . A 40 SER HB2 . 31028 1
384 . 1 . 1 40 40 SER HB3 H 1 3.676 0.020 . 2 . . . . A 40 SER HB3 . 31028 1
385 . 1 . 1 40 40 SER CA C 13 55.691 0.3 . 1 . . . . A 40 SER CA . 31028 1
386 . 1 . 1 40 40 SER CB C 13 61.070 0.3 . 1 . . . . A 40 SER CB . 31028 1
387 . 1 . 1 40 40 SER N N 15 116.337 0.3 . 1 . . . . A 40 SER N . 31028 1
388 . 1 . 1 41 41 TYR H H 1 7.798 0.020 . 1 . . . . A 41 TYR H . 31028 1
389 . 1 . 1 41 41 TYR HA H 1 4.433 0.020 . 1 . . . . A 41 TYR HA . 31028 1
390 . 1 . 1 41 41 TYR HB2 H 1 2.926 0.020 . 2 . . . . A 41 TYR HB2 . 31028 1
391 . 1 . 1 41 41 TYR HB3 H 1 2.801 0.020 . 2 . . . . A 41 TYR HB3 . 31028 1
392 . 1 . 1 41 41 TYR HD1 H 1 7.037 0.020 . 3 . . . . A 41 TYR HD1 . 31028 1
393 . 1 . 1 41 41 TYR HD2 H 1 7.027 0.020 . 3 . . . . A 41 TYR HD2 . 31028 1
394 . 1 . 1 41 41 TYR CA C 13 55.197 0.3 . 1 . . . . A 41 TYR CA . 31028 1
395 . 1 . 1 41 41 TYR CB C 13 36.080 0.3 . 1 . . . . A 41 TYR CB . 31028 1
396 . 1 . 1 41 41 TYR CD2 C 13 130.170 0.3 . 1 . . . . A 41 TYR CD2 . 31028 1
397 . 1 . 1 41 41 TYR N N 15 120.673 0.3 . 1 . . . . A 41 TYR N . 31028 1
398 . 1 . 1 42 42 HIS H H 1 7.869 0.020 . 1 . . . . A 42 HIS H . 31028 1
399 . 1 . 1 42 42 HIS HA H 1 4.624 0.020 . 1 . . . . A 42 HIS HA . 31028 1
400 . 1 . 1 42 42 HIS HB2 H 1 3.146 0.020 . 2 . . . . A 42 HIS HB2 . 31028 1
401 . 1 . 1 42 42 HIS HB3 H 1 3.054 0.020 . 2 . . . . A 42 HIS HB3 . 31028 1
402 . 1 . 1 42 42 HIS HD2 H 1 7.122 0.020 . 1 . . . . A 42 HIS HD2 . 31028 1
403 . 1 . 1 42 42 HIS CA C 13 52.073 0.3 . 1 . . . . A 42 HIS CA . 31028 1
404 . 1 . 1 42 42 HIS CB C 13 27.006 0.3 . 1 . . . . A 42 HIS CB . 31028 1
405 . 1 . 1 42 42 HIS N N 15 118.572 0.3 . 1 . . . . A 42 HIS N . 31028 1
406 . 1 . 1 43 43 CYS H H 1 7.949 0.020 . 1 . . . . A 43 CYS H . 31028 1
407 . 1 . 1 43 43 CYS HA H 1 4.421 0.020 . 1 . . . . A 43 CYS HA . 31028 1
408 . 1 . 1 43 43 CYS HB2 H 1 3.197 0.020 . 2 . . . . A 43 CYS HB2 . 31028 1
409 . 1 . 1 43 43 CYS HB3 H 1 2.904 0.020 . 2 . . . . A 43 CYS HB3 . 31028 1
410 . 1 . 1 43 43 CYS CA C 13 53.684 0.3 . 1 . . . . A 43 CYS CA . 31028 1
411 . 1 . 1 43 43 CYS CB C 13 31.310 0.3 . 1 . . . . A 43 CYS CB . 31028 1
412 . 1 . 1 43 43 CYS N N 15 122.219 0.3 . 1 . . . . A 43 CYS N . 31028 1
stop_
save_