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 31063
_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-1H NOESY' . . . 31063 1
2 '2D 1H-1H COSY' . . . 31063 1
3 '2D 1H-1H TOCSY' . . . 31063 1
4 '2D 1H-13C HSQC' . . . 31063 1
5 '2D 1H-15N HSQC' . . . 31063 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 GLU HA H 1 4.162 0.020 . 1 . . . . A 1 GLU HA . 31063 1
2 . 1 . 1 1 1 GLU HB2 H 1 2.199 0.020 . 2 . . . . A 1 GLU HB2 . 31063 1
3 . 1 . 1 1 1 GLU HB3 H 1 2.199 0.020 . 2 . . . . A 1 GLU HB3 . 31063 1
4 . 1 . 1 1 1 GLU HG2 H 1 2.628 0.020 . 2 . . . . A 1 GLU HG2 . 31063 1
5 . 1 . 1 1 1 GLU HG3 H 1 2.628 0.020 . 2 . . . . A 1 GLU HG3 . 31063 1
6 . 1 . 1 1 1 GLU CA C 13 52.706 0.400 . 1 . . . . A 1 GLU CA . 31063 1
7 . 1 . 1 1 1 GLU CB C 13 26.535 0.400 . 1 . . . . A 1 GLU CB . 31063 1
8 . 1 . 1 1 1 GLU CG C 13 30.390 0.400 . 1 . . . . A 1 GLU CG . 31063 1
9 . 1 . 1 2 2 CYS H H 1 8.768 0.020 . 1 . . . . A 2 CYS H . 31063 1
10 . 1 . 1 2 2 CYS HA H 1 4.668 0.020 . 1 . . . . A 2 CYS HA . 31063 1
11 . 1 . 1 2 2 CYS HB2 H 1 3.128 0.020 . 2 . . . . A 2 CYS HB2 . 31063 1
12 . 1 . 1 2 2 CYS HB3 H 1 2.802 0.020 . 2 . . . . A 2 CYS HB3 . 31063 1
13 . 1 . 1 2 2 CYS N N 15 121.117 0.400 . 1 . . . . A 2 CYS N . 31063 1
14 . 1 . 1 3 3 ARG H H 1 9.110 0.020 . 1 . . . . A 3 ARG H . 31063 1
15 . 1 . 1 3 3 ARG HA H 1 4.469 0.020 . 1 . . . . A 3 ARG HA . 31063 1
16 . 1 . 1 3 3 ARG HB2 H 1 1.988 0.020 . 2 . . . . A 3 ARG HB2 . 31063 1
17 . 1 . 1 3 3 ARG HB3 H 1 1.988 0.020 . 2 . . . . A 3 ARG HB3 . 31063 1
18 . 1 . 1 3 3 ARG HG2 H 1 1.793 0.020 . 2 . . . . A 3 ARG HG2 . 31063 1
19 . 1 . 1 3 3 ARG HG3 H 1 1.690 0.020 . 2 . . . . A 3 ARG HG3 . 31063 1
20 . 1 . 1 3 3 ARG HD2 H 1 3.231 0.020 . 2 . . . . A 3 ARG HD2 . 31063 1
21 . 1 . 1 3 3 ARG HD3 H 1 3.231 0.020 . 2 . . . . A 3 ARG HD3 . 31063 1
22 . 1 . 1 3 3 ARG HE H 1 7.223 0.020 . 1 . . . . A 3 ARG HE . 31063 1
23 . 1 . 1 3 3 ARG N N 15 121.485 0.400 . 1 . . . . A 3 ARG N . 31063 1
24 . 1 . 1 4 4 TRP H H 1 8.361 0.020 . 1 . . . . A 4 TRP H . 31063 1
25 . 1 . 1 4 4 TRP HA H 1 4.468 0.020 . 1 . . . . A 4 TRP HA . 31063 1
26 . 1 . 1 4 4 TRP HB2 H 1 3.488 0.020 . 2 . . . . A 4 TRP HB2 . 31063 1
27 . 1 . 1 4 4 TRP HB3 H 1 3.250 0.020 . 2 . . . . A 4 TRP HB3 . 31063 1
28 . 1 . 1 4 4 TRP HD1 H 1 7.461 0.020 . 1 . . . . A 4 TRP HD1 . 31063 1
29 . 1 . 1 4 4 TRP HE1 H 1 10.480 0.020 . 1 . . . . A 4 TRP HE1 . 31063 1
30 . 1 . 1 4 4 TRP HE3 H 1 7.569 0.020 . 1 . . . . A 4 TRP HE3 . 31063 1
31 . 1 . 1 4 4 TRP HZ2 H 1 7.703 0.020 . 1 . . . . A 4 TRP HZ2 . 31063 1
32 . 1 . 1 4 4 TRP HZ3 H 1 7.294 0.020 . 1 . . . . A 4 TRP HZ3 . 31063 1
33 . 1 . 1 4 4 TRP HH2 H 1 7.418 0.020 . 1 . . . . A 4 TRP HH2 . 31063 1
34 . 1 . 1 4 4 TRP CD1 C 13 124.867 0.400 . 1 . . . . A 4 TRP CD1 . 31063 1
35 . 1 . 1 4 4 TRP CE3 C 13 118.049 0.400 . 1 . . . . A 4 TRP CE3 . 31063 1
36 . 1 . 1 4 4 TRP CZ2 C 13 113.101 0.400 . 1 . . . . A 4 TRP CZ2 . 31063 1
37 . 1 . 1 4 4 TRP CZ3 C 13 119.932 0.400 . 1 . . . . A 4 TRP CZ3 . 31063 1
38 . 1 . 1 4 4 TRP CH2 C 13 122.858 0.400 . 1 . . . . A 4 TRP CH2 . 31063 1
39 . 1 . 1 4 4 TRP N N 15 122.776 0.400 . 1 . . . . A 4 TRP N . 31063 1
40 . 1 . 1 4 4 TRP NE1 N 15 130.734 0.400 . 1 . . . . A 4 TRP NE1 . 31063 1
41 . 1 . 1 5 5 PHE H H 1 6.655 0.020 . 1 . . . . A 5 PHE H . 31063 1
42 . 1 . 1 5 5 PHE HA H 1 3.648 0.020 . 1 . . . . A 5 PHE HA . 31063 1
43 . 1 . 1 5 5 PHE HB2 H 1 2.515 0.020 . 2 . . . . A 5 PHE HB2 . 31063 1
44 . 1 . 1 5 5 PHE HB3 H 1 2.285 0.020 . 2 . . . . A 5 PHE HB3 . 31063 1
45 . 1 . 1 5 5 PHE HD1 H 1 6.738 0.020 . 1 . . . . A 5 PHE HD1 . 31063 1
46 . 1 . 1 5 5 PHE HD2 H 1 6.738 0.020 . 1 . . . . A 5 PHE HD2 . 31063 1
47 . 1 . 1 5 5 PHE HE1 H 1 7.318 0.020 . 1 . . . . A 5 PHE HE1 . 31063 1
48 . 1 . 1 5 5 PHE HE2 H 1 7.318 0.020 . 1 . . . . A 5 PHE HE2 . 31063 1
49 . 1 . 1 5 5 PHE CA C 13 56.214 0.400 . 1 . . . . A 5 PHE CA . 31063 1
50 . 1 . 1 5 5 PHE CD2 C 13 128.805 0.400 . 3 . . . . A 5 PHE CD2 . 31063 1
51 . 1 . 1 5 5 PHE CE2 C 13 128.866 0.400 . 3 . . . . A 5 PHE CE2 . 31063 1
52 . 1 . 1 5 5 PHE N N 15 119.902 0.400 . 1 . . . . A 5 PHE N . 31063 1
53 . 1 . 1 6 6 TRP H H 1 9.361 0.020 . 1 . . . . A 6 TRP H . 31063 1
54 . 1 . 1 6 6 TRP HA H 1 3.454 0.020 . 1 . . . . A 6 TRP HA . 31063 1
55 . 1 . 1 6 6 TRP HB2 H 1 3.443 0.020 . 2 . . . . A 6 TRP HB2 . 31063 1
56 . 1 . 1 6 6 TRP HB3 H 1 3.033 0.020 . 2 . . . . A 6 TRP HB3 . 31063 1
57 . 1 . 1 6 6 TRP HD1 H 1 6.477 0.020 . 1 . . . . A 6 TRP HD1 . 31063 1
58 . 1 . 1 6 6 TRP HE1 H 1 9.853 0.020 . 1 . . . . A 6 TRP HE1 . 31063 1
59 . 1 . 1 6 6 TRP HZ2 H 1 7.367 0.020 . 1 . . . . A 6 TRP HZ2 . 31063 1
60 . 1 . 1 6 6 TRP HZ3 H 1 7.040 0.020 . 1 . . . . A 6 TRP HZ3 . 31063 1
61 . 1 . 1 6 6 TRP HH2 H 1 7.151 0.020 . 1 . . . . A 6 TRP HH2 . 31063 1
62 . 1 . 1 6 6 TRP CA C 13 57.602 0.400 . 1 . . . . A 6 TRP CA . 31063 1
63 . 1 . 1 6 6 TRP CD1 C 13 123.532 0.400 . 1 . . . . A 6 TRP CD1 . 31063 1
64 . 1 . 1 6 6 TRP CZ2 C 13 111.447 0.400 . 1 . . . . A 6 TRP CZ2 . 31063 1
65 . 1 . 1 6 6 TRP N N 15 124.706 0.400 . 1 . . . . A 6 TRP N . 31063 1
66 . 1 . 1 6 6 TRP NE1 N 15 128.092 0.400 . 1 . . . . A 6 TRP NE1 . 31063 1
67 . 1 . 1 7 7 GLY H H 1 8.723 0.020 . 1 . . . . A 7 GLY H . 31063 1
68 . 1 . 1 7 7 GLY HA2 H 1 4.164 0.020 . 2 . . . . A 7 GLY HA2 . 31063 1
69 . 1 . 1 7 7 GLY HA3 H 1 3.397 0.020 . 2 . . . . A 7 GLY HA3 . 31063 1
70 . 1 . 1 7 7 GLY CA C 13 42.163 0.400 . 1 . . . . A 7 GLY CA . 31063 1
71 . 1 . 1 7 7 GLY N N 15 108.228 0.400 . 1 . . . . A 7 GLY N . 31063 1
72 . 1 . 1 8 8 GLY H H 1 8.614 0.020 . 1 . . . . A 8 GLY H . 31063 1
73 . 1 . 1 8 8 GLY HA2 H 1 4.235 0.020 . 2 . . . . A 8 GLY HA2 . 31063 1
74 . 1 . 1 8 8 GLY HA3 H 1 3.671 0.020 . 2 . . . . A 8 GLY HA3 . 31063 1
75 . 1 . 1 8 8 GLY CA C 13 43.159 0.400 . 1 . . . . A 8 GLY CA . 31063 1
76 . 1 . 1 8 8 GLY N N 15 109.169 0.400 . 1 . . . . A 8 GLY N . 31063 1
77 . 1 . 1 9 9 CYS H H 1 7.862 0.020 . 1 . . . . A 9 CYS H . 31063 1
78 . 1 . 1 9 9 CYS HA H 1 4.829 0.020 . 1 . . . . A 9 CYS HA . 31063 1
79 . 1 . 1 9 9 CYS HB2 H 1 3.147 0.020 . 2 . . . . A 9 CYS HB2 . 31063 1
80 . 1 . 1 9 9 CYS HB3 H 1 3.069 0.020 . 2 . . . . A 9 CYS HB3 . 31063 1
81 . 1 . 1 10 10 ASN H H 1 9.488 0.020 . 1 . . . . A 10 ASN H . 31063 1
82 . 1 . 1 10 10 ASN HA H 1 4.766 0.020 . 1 . . . . A 10 ASN HA . 31063 1
83 . 1 . 1 10 10 ASN HB2 H 1 2.714 0.020 . 2 . . . . A 10 ASN HB2 . 31063 1
84 . 1 . 1 10 10 ASN HB3 H 1 2.714 0.020 . 2 . . . . A 10 ASN HB3 . 31063 1
85 . 1 . 1 10 10 ASN HD21 H 1 7.852 0.020 . 2 . . . . A 10 ASN HD21 . 31063 1
86 . 1 . 1 10 10 ASN HD22 H 1 6.963 0.020 . 2 . . . . A 10 ASN HD22 . 31063 1
87 . 1 . 1 10 10 ASN N N 15 115.829 0.400 . 1 . . . . A 10 ASN N . 31063 1
88 . 1 . 1 10 10 ASN ND2 N 15 115.220 0.400 . 1 . . . . A 10 ASN ND2 . 31063 1
89 . 1 . 1 11 11 ASN H H 1 8.081 0.020 . 1 . . . . A 11 ASN H . 31063 1
90 . 1 . 1 11 11 ASN HA H 1 4.603 0.020 . 1 . . . . A 11 ASN HA . 31063 1
91 . 1 . 1 11 11 ASN HB2 H 1 2.883 0.020 . 2 . . . . A 11 ASN HB2 . 31063 1
92 . 1 . 1 11 11 ASN HB3 H 1 2.883 0.020 . 2 . . . . A 11 ASN HB3 . 31063 1
93 . 1 . 1 11 11 ASN HD21 H 1 7.614 0.020 . 2 . . . . A 11 ASN HD21 . 31063 1
94 . 1 . 1 11 11 ASN HD22 H 1 6.748 0.020 . 2 . . . . A 11 ASN HD22 . 31063 1
95 . 1 . 1 11 11 ASN N N 15 116.009 0.400 . 1 . . . . A 11 ASN N . 31063 1
96 . 1 . 1 11 11 ASN ND2 N 15 113.794 0.400 . 1 . . . . A 11 ASN ND2 . 31063 1
97 . 1 . 1 12 12 ASP H H 1 9.024 0.020 . 1 . . . . A 12 ASP H . 31063 1
98 . 1 . 1 12 12 ASP HA H 1 4.117 0.020 . 1 . . . . A 12 ASP HA . 31063 1
99 . 1 . 1 12 12 ASP HB2 H 1 2.951 0.020 . 2 . . . . A 12 ASP HB2 . 31063 1
100 . 1 . 1 12 12 ASP HB3 H 1 2.662 0.020 . 2 . . . . A 12 ASP HB3 . 31063 1
101 . 1 . 1 12 12 ASP CA C 13 55.756 0.400 . 1 . . . . A 12 ASP CA . 31063 1
102 . 1 . 1 12 12 ASP N N 15 120.641 0.400 . 1 . . . . A 12 ASP N . 31063 1
103 . 1 . 1 13 13 ALA H H 1 8.184 0.020 . 1 . . . . A 13 ALA H . 31063 1
104 . 1 . 1 13 13 ALA HA H 1 4.212 0.020 . 1 . . . . A 13 ALA HA . 31063 1
105 . 1 . 1 13 13 ALA HB1 H 1 1.403 0.020 . 1 . . . . A 13 ALA HB1 . 31063 1
106 . 1 . 1 13 13 ALA HB2 H 1 1.403 0.020 . 1 . . . . A 13 ALA HB2 . 31063 1
107 . 1 . 1 13 13 ALA HB3 H 1 1.403 0.020 . 1 . . . . A 13 ALA HB3 . 31063 1
108 . 1 . 1 13 13 ALA CA C 13 51.176 0.400 . 1 . . . . A 13 ALA CA . 31063 1
109 . 1 . 1 13 13 ALA N N 15 120.384 0.400 . 1 . . . . A 13 ALA N . 31063 1
110 . 1 . 1 14 14 ASP H H 1 7.640 0.020 . 1 . . . . A 14 ASP H . 31063 1
111 . 1 . 1 14 14 ASP HA H 1 4.530 0.020 . 1 . . . . A 14 ASP HA . 31063 1
112 . 1 . 1 14 14 ASP HB2 H 1 2.918 0.020 . 2 . . . . A 14 ASP HB2 . 31063 1
113 . 1 . 1 14 14 ASP HB3 H 1 2.869 0.020 . 2 . . . . A 14 ASP HB3 . 31063 1
114 . 1 . 1 14 14 ASP N N 15 115.589 0.400 . 1 . . . . A 14 ASP N . 31063 1
115 . 1 . 1 15 15 CYS H H 1 7.853 0.020 . 1 . . . . A 15 CYS H . 31063 1
116 . 1 . 1 15 15 CYS HA H 1 5.093 0.020 . 1 . . . . A 15 CYS HA . 31063 1
117 . 1 . 1 15 15 CYS HB2 H 1 3.040 0.020 . 2 . . . . A 15 CYS HB2 . 31063 1
118 . 1 . 1 15 15 CYS HB3 H 1 2.652 0.020 . 2 . . . . A 15 CYS HB3 . 31063 1
119 . 1 . 1 15 15 CYS CA C 13 50.925 0.400 . 1 . . . . A 15 CYS CA . 31063 1
120 . 1 . 1 16 16 CYS H H 1 8.969 0.020 . 1 . . . . A 16 CYS H . 31063 1
121 . 1 . 1 16 16 CYS HA H 1 4.531 0.020 . 1 . . . . A 16 CYS HA . 31063 1
122 . 1 . 1 16 16 CYS HB2 H 1 2.089 0.020 . 2 . . . . A 16 CYS HB2 . 31063 1
123 . 1 . 1 16 16 CYS HB3 H 1 3.259 0.020 . 2 . . . . A 16 CYS HB3 . 31063 1
124 . 1 . 1 16 16 CYS CA C 13 50.835 0.400 . 1 . . . . A 16 CYS CA . 31063 1
125 . 1 . 1 16 16 CYS N N 15 120.070 0.400 . 1 . . . . A 16 CYS N . 31063 1
126 . 1 . 1 17 17 LYS H H 1 7.896 0.020 . 1 . . . . A 17 LYS H . 31063 1
127 . 1 . 1 17 17 LYS HA H 1 3.947 0.020 . 1 . . . . A 17 LYS HA . 31063 1
128 . 1 . 1 17 17 LYS HB2 H 1 1.694 0.020 . 2 . . . . A 17 LYS HB2 . 31063 1
129 . 1 . 1 17 17 LYS HB3 H 1 1.511 0.020 . 2 . . . . A 17 LYS HB3 . 31063 1
130 . 1 . 1 17 17 LYS HG2 H 1 1.270 0.020 . 2 . . . . A 17 LYS HG2 . 31063 1
131 . 1 . 1 17 17 LYS HG3 H 1 1.016 0.020 . 2 . . . . A 17 LYS HG3 . 31063 1
132 . 1 . 1 17 17 LYS HD2 H 1 1.626 0.020 . 2 . . . . A 17 LYS HD2 . 31063 1
133 . 1 . 1 17 17 LYS HD3 H 1 1.626 0.020 . 2 . . . . A 17 LYS HD3 . 31063 1
134 . 1 . 1 17 17 LYS HE2 H 1 2.929 0.020 . 2 . . . . A 17 LYS HE2 . 31063 1
135 . 1 . 1 17 17 LYS HE3 H 1 2.929 0.020 . 2 . . . . A 17 LYS HE3 . 31063 1
136 . 1 . 1 17 17 LYS CA C 13 55.752 0.400 . 1 . . . . A 17 LYS CA . 31063 1
137 . 1 . 1 17 17 LYS N N 15 117.818 0.400 . 1 . . . . A 17 LYS N . 31063 1
138 . 1 . 1 18 18 HIS H H 1 8.597 0.020 . 1 . . . . A 18 HIS H . 31063 1
139 . 1 . 1 18 18 HIS HA H 1 4.230 0.020 . 1 . . . . A 18 HIS HA . 31063 1
140 . 1 . 1 18 18 HIS HB2 H 1 3.950 0.020 . 2 . . . . A 18 HIS HB2 . 31063 1
141 . 1 . 1 18 18 HIS HB3 H 1 3.582 0.020 . 2 . . . . A 18 HIS HB3 . 31063 1
142 . 1 . 1 18 18 HIS HD2 H 1 7.272 0.020 . 1 . . . . A 18 HIS HD2 . 31063 1
143 . 1 . 1 18 18 HIS HE1 H 1 8.639 0.020 . 1 . . . . A 18 HIS HE1 . 31063 1
144 . 1 . 1 18 18 HIS CA C 13 55.229 0.400 . 1 . . . . A 18 HIS CA . 31063 1
145 . 1 . 1 18 18 HIS N N 15 112.507 0.400 . 1 . . . . A 18 HIS N . 31063 1
146 . 1 . 1 19 19 LEU H H 1 8.009 0.020 . 1 . . . . A 19 LEU H . 31063 1
147 . 1 . 1 19 19 LEU HA H 1 5.056 0.020 . 1 . . . . A 19 LEU HA . 31063 1
148 . 1 . 1 19 19 LEU HB2 H 1 1.034 0.020 . 2 . . . . A 19 LEU HB2 . 31063 1
149 . 1 . 1 19 19 LEU HB3 H 1 2.003 0.020 . 2 . . . . A 19 LEU HB3 . 31063 1
150 . 1 . 1 19 19 LEU HG H 1 1.010 0.020 . 1 . . . . A 19 LEU HG . 31063 1
151 . 1 . 1 19 19 LEU HD11 H 1 0.335 0.020 . 2 . . . . A 19 LEU HD11 . 31063 1
152 . 1 . 1 19 19 LEU HD12 H 1 0.335 0.020 . 2 . . . . A 19 LEU HD12 . 31063 1
153 . 1 . 1 19 19 LEU HD13 H 1 0.335 0.020 . 2 . . . . A 19 LEU HD13 . 31063 1
154 . 1 . 1 19 19 LEU HD21 H 1 -0.424 0.020 . 2 . . . . A 19 LEU HD21 . 31063 1
155 . 1 . 1 19 19 LEU HD22 H 1 -0.424 0.020 . 2 . . . . A 19 LEU HD22 . 31063 1
156 . 1 . 1 19 19 LEU HD23 H 1 -0.424 0.020 . 2 . . . . A 19 LEU HD23 . 31063 1
157 . 1 . 1 19 19 LEU CB C 13 42.086 0.400 . 1 . . . . A 19 LEU CB . 31063 1
158 . 1 . 1 19 19 LEU CG C 13 21.781 0.400 . 1 . . . . A 19 LEU CG . 31063 1
159 . 1 . 1 19 19 LEU CD1 C 13 24.594 0.400 . 2 . . . . A 19 LEU CD1 . 31063 1
160 . 1 . 1 19 19 LEU CD2 C 13 22.659 0.400 . 2 . . . . A 19 LEU CD2 . 31063 1
161 . 1 . 1 19 19 LEU N N 15 119.580 0.400 . 1 . . . . A 19 LEU N . 31063 1
162 . 1 . 1 20 20 GLU H H 1 9.311 0.020 . 1 . . . . A 20 GLU H . 31063 1
163 . 1 . 1 20 20 GLU HA H 1 4.482 0.020 . 1 . . . . A 20 GLU HA . 31063 1
164 . 1 . 1 20 20 GLU HB2 H 1 1.993 0.020 . 2 . . . . A 20 GLU HB2 . 31063 1
165 . 1 . 1 20 20 GLU HB3 H 1 1.993 0.020 . 2 . . . . A 20 GLU HB3 . 31063 1
166 . 1 . 1 20 20 GLU HG2 H 1 2.285 0.020 . 2 . . . . A 20 GLU HG2 . 31063 1
167 . 1 . 1 20 20 GLU HG3 H 1 2.285 0.020 . 2 . . . . A 20 GLU HG3 . 31063 1
168 . 1 . 1 20 20 GLU N N 15 117.167 0.400 . 1 . . . . A 20 GLU N . 31063 1
169 . 1 . 1 21 21 CYS H H 1 9.195 0.020 . 1 . . . . A 21 CYS H . 31063 1
170 . 1 . 1 21 21 CYS HA H 1 4.563 0.020 . 1 . . . . A 21 CYS HA . 31063 1
171 . 1 . 1 21 21 CYS HB2 H 1 2.569 0.020 . 2 . . . . A 21 CYS HB2 . 31063 1
172 . 1 . 1 21 21 CYS HB3 H 1 2.668 0.020 . 2 . . . . A 21 CYS HB3 . 31063 1
173 . 1 . 1 21 21 CYS N N 15 122.289 0.400 . 1 . . . . A 21 CYS N . 31063 1
174 . 1 . 1 22 22 LYS H H 1 8.776 0.020 . 1 . . . . A 22 LYS H . 31063 1
175 . 1 . 1 22 22 LYS HA H 1 4.047 0.020 . 1 . . . . A 22 LYS HA . 31063 1
176 . 1 . 1 22 22 LYS HB2 H 1 2.185 0.020 . 2 . . . . A 22 LYS HB2 . 31063 1
177 . 1 . 1 22 22 LYS HB3 H 1 1.857 0.020 . 2 . . . . A 22 LYS HB3 . 31063 1
178 . 1 . 1 22 22 LYS HG2 H 1 1.698 0.020 . 2 . . . . A 22 LYS HG2 . 31063 1
179 . 1 . 1 22 22 LYS HG3 H 1 1.490 0.020 . 2 . . . . A 22 LYS HG3 . 31063 1
180 . 1 . 1 22 22 LYS HD2 H 1 1.611 0.020 . 2 . . . . A 22 LYS HD2 . 31063 1
181 . 1 . 1 22 22 LYS HD3 H 1 1.794 0.020 . 2 . . . . A 22 LYS HD3 . 31063 1
182 . 1 . 1 22 22 LYS HE2 H 1 2.807 0.020 . 2 . . . . A 22 LYS HE2 . 31063 1
183 . 1 . 1 22 22 LYS HE3 H 1 2.878 0.020 . 2 . . . . A 22 LYS HE3 . 31063 1
184 . 1 . 1 22 22 LYS HZ1 H 1 7.412 0.020 . 1 . . . . A 22 LYS HZ1 . 31063 1
185 . 1 . 1 22 22 LYS HZ2 H 1 7.412 0.020 . 1 . . . . A 22 LYS HZ2 . 31063 1
186 . 1 . 1 22 22 LYS HZ3 H 1 7.412 0.020 . 1 . . . . A 22 LYS HZ3 . 31063 1
187 . 1 . 1 22 22 LYS N N 15 133.231 0.400 . 1 . . . . A 22 LYS N . 31063 1
188 . 1 . 1 23 23 ARG H H 1 8.639 0.020 . 1 . . . . A 23 ARG H . 31063 1
189 . 1 . 1 23 23 ARG HA H 1 4.131 0.020 . 1 . . . . A 23 ARG HA . 31063 1
190 . 1 . 1 23 23 ARG HB2 H 1 1.968 0.020 . 2 . . . . A 23 ARG HB2 . 31063 1
191 . 1 . 1 23 23 ARG HB3 H 1 1.884 0.020 . 2 . . . . A 23 ARG HB3 . 31063 1
192 . 1 . 1 23 23 ARG HG2 H 1 1.794 0.020 . 2 . . . . A 23 ARG HG2 . 31063 1
193 . 1 . 1 23 23 ARG HG3 H 1 1.794 0.020 . 2 . . . . A 23 ARG HG3 . 31063 1
194 . 1 . 1 23 23 ARG HD2 H 1 3.224 0.020 . 2 . . . . A 23 ARG HD2 . 31063 1
195 . 1 . 1 23 23 ARG HD3 H 1 3.224 0.020 . 2 . . . . A 23 ARG HD3 . 31063 1
196 . 1 . 1 23 23 ARG HE H 1 7.221 0.020 . 1 . . . . A 23 ARG HE . 31063 1
197 . 1 . 1 24 24 LYS H H 1 7.543 0.020 . 1 . . . . A 24 LYS H . 31063 1
198 . 1 . 1 24 24 LYS HA H 1 4.508 0.020 . 1 . . . . A 24 LYS HA . 31063 1
199 . 1 . 1 24 24 LYS HB2 H 1 1.595 0.020 . 2 . . . . A 24 LYS HB2 . 31063 1
200 . 1 . 1 24 24 LYS HB3 H 1 1.881 0.020 . 2 . . . . A 24 LYS HB3 . 31063 1
201 . 1 . 1 24 24 LYS HG2 H 1 1.725 0.020 . 2 . . . . A 24 LYS HG2 . 31063 1
202 . 1 . 1 24 24 LYS HG3 H 1 1.502 0.020 . 2 . . . . A 24 LYS HG3 . 31063 1
203 . 1 . 1 24 24 LYS HE2 H 1 3.036 0.020 . 2 . . . . A 24 LYS HE2 . 31063 1
204 . 1 . 1 24 24 LYS HE3 H 1 3.036 0.020 . 2 . . . . A 24 LYS HE3 . 31063 1
205 . 1 . 1 25 25 TRP H H 1 8.344 0.020 . 1 . . . . A 25 TRP H . 31063 1
206 . 1 . 1 25 25 TRP HA H 1 3.372 0.020 . 1 . . . . A 25 TRP HA . 31063 1
207 . 1 . 1 25 25 TRP HB2 H 1 3.059 0.020 . 2 . . . . A 25 TRP HB2 . 31063 1
208 . 1 . 1 25 25 TRP HB3 H 1 3.059 0.020 . 2 . . . . A 25 TRP HB3 . 31063 1
209 . 1 . 1 25 25 TRP HD1 H 1 7.190 0.020 . 1 . . . . A 25 TRP HD1 . 31063 1
210 . 1 . 1 25 25 TRP HE1 H 1 10.296 0.020 . 1 . . . . A 25 TRP HE1 . 31063 1
211 . 1 . 1 25 25 TRP HE3 H 1 7.330 0.020 . 1 . . . . A 25 TRP HE3 . 31063 1
212 . 1 . 1 25 25 TRP HZ2 H 1 7.518 0.020 . 1 . . . . A 25 TRP HZ2 . 31063 1
213 . 1 . 1 25 25 TRP HZ3 H 1 7.173 0.020 . 1 . . . . A 25 TRP HZ3 . 31063 1
214 . 1 . 1 25 25 TRP HH2 H 1 7.268 0.020 . 1 . . . . A 25 TRP HH2 . 31063 1
215 . 1 . 1 25 25 TRP CA C 13 53.717 0.400 . 1 . . . . A 25 TRP CA . 31063 1
216 . 1 . 1 25 25 TRP CZ2 C 13 112.252 0.400 . 1 . . . . A 25 TRP CZ2 . 31063 1
217 . 1 . 1 25 25 TRP N N 15 121.480 0.400 . 1 . . . . A 25 TRP N . 31063 1
218 . 1 . 1 25 25 TRP NE1 N 15 130.454 0.400 . 1 . . . . A 25 TRP NE1 . 31063 1
219 . 1 . 1 26 26 PRO HA H 1 2.928 0.020 . 1 . . . . A 26 PRO HA . 31063 1
220 . 1 . 1 26 26 PRO HB2 H 1 1.258 0.020 . 2 . . . . A 26 PRO HB2 . 31063 1
221 . 1 . 1 26 26 PRO HB3 H 1 0.970 0.020 . 2 . . . . A 26 PRO HB3 . 31063 1
222 . 1 . 1 26 26 PRO HG2 H 1 1.419 0.020 . 2 . . . . A 26 PRO HG2 . 31063 1
223 . 1 . 1 26 26 PRO HG3 H 1 1.105 0.020 . 2 . . . . A 26 PRO HG3 . 31063 1
224 . 1 . 1 26 26 PRO HD2 H 1 3.180 0.020 . 2 . . . . A 26 PRO HD2 . 31063 1
225 . 1 . 1 26 26 PRO HD3 H 1 3.128 0.020 . 2 . . . . A 26 PRO HD3 . 31063 1
226 . 1 . 1 26 26 PRO CA C 13 59.153 0.400 . 1 . . . . A 26 PRO CA . 31063 1
227 . 1 . 1 26 26 PRO CD C 13 47.966 0.400 . 1 . . . . A 26 PRO CD . 31063 1
228 . 1 . 1 27 27 HIS H H 1 7.998 0.020 . 1 . . . . A 27 HIS H . 31063 1
229 . 1 . 1 27 27 HIS HA H 1 4.595 0.020 . 1 . . . . A 27 HIS HA . 31063 1
230 . 1 . 1 27 27 HIS HB2 H 1 3.519 0.020 . 2 . . . . A 27 HIS HB2 . 31063 1
231 . 1 . 1 27 27 HIS HB3 H 1 3.141 0.020 . 2 . . . . A 27 HIS HB3 . 31063 1
232 . 1 . 1 27 27 HIS HD2 H 1 7.476 0.020 . 1 . . . . A 27 HIS HD2 . 31063 1
233 . 1 . 1 27 27 HIS HE1 H 1 8.618 0.020 . 1 . . . . A 27 HIS HE1 . 31063 1
234 . 1 . 1 27 27 HIS CA C 13 51.718 0.400 . 1 . . . . A 27 HIS CA . 31063 1
235 . 1 . 1 27 27 HIS N N 15 119.177 0.400 . 1 . . . . A 27 HIS N . 31063 1
236 . 1 . 1 28 28 ILE H H 1 6.703 0.020 . 1 . . . . A 28 ILE H . 31063 1
237 . 1 . 1 28 28 ILE HA H 1 5.092 0.020 . 1 . . . . A 28 ILE HA . 31063 1
238 . 1 . 1 28 28 ILE HB H 1 1.032 0.020 . 1 . . . . A 28 ILE HB . 31063 1
239 . 1 . 1 28 28 ILE HG12 H 1 0.601 0.020 . 2 . . . . A 28 ILE HG12 . 31063 1
240 . 1 . 1 28 28 ILE HG13 H 1 0.498 0.020 . 2 . . . . A 28 ILE HG13 . 31063 1
241 . 1 . 1 28 28 ILE HG21 H 1 0.268 0.020 . 1 . . . . A 28 ILE HG21 . 31063 1
242 . 1 . 1 28 28 ILE HG22 H 1 0.268 0.020 . 1 . . . . A 28 ILE HG22 . 31063 1
243 . 1 . 1 28 28 ILE HG23 H 1 0.268 0.020 . 1 . . . . A 28 ILE HG23 . 31063 1
244 . 1 . 1 28 28 ILE HD11 H 1 -0.175 0.020 . 1 . . . . A 28 ILE HD11 . 31063 1
245 . 1 . 1 28 28 ILE HD12 H 1 -0.175 0.020 . 1 . . . . A 28 ILE HD12 . 31063 1
246 . 1 . 1 28 28 ILE HD13 H 1 -0.175 0.020 . 1 . . . . A 28 ILE HD13 . 31063 1
247 . 1 . 1 28 28 ILE CA C 13 55.738 0.400 . 1 . . . . A 28 ILE CA . 31063 1
248 . 1 . 1 28 28 ILE CB C 13 40.292 0.400 . 1 . . . . A 28 ILE CB . 31063 1
249 . 1 . 1 28 28 ILE CG1 C 13 21.711 0.400 . 1 . . . . A 28 ILE CG1 . 31063 1
250 . 1 . 1 28 28 ILE CG2 C 13 15.626 0.400 . 1 . . . . A 28 ILE CG2 . 31063 1
251 . 1 . 1 28 28 ILE CD1 C 13 10.007 0.400 . 1 . . . . A 28 ILE CD1 . 31063 1
252 . 1 . 1 29 29 CYS H H 1 8.665 0.020 . 1 . . . . A 29 CYS H . 31063 1
253 . 1 . 1 29 29 CYS HA H 1 4.852 0.020 . 1 . . . . A 29 CYS HA . 31063 1
254 . 1 . 1 29 29 CYS HB2 H 1 2.887 0.020 . 2 . . . . A 29 CYS HB2 . 31063 1
255 . 1 . 1 29 29 CYS HB3 H 1 2.444 0.020 . 2 . . . . A 29 CYS HB3 . 31063 1
256 . 1 . 1 29 29 CYS N N 15 120.549 0.400 . 1 . . . . A 29 CYS N . 31063 1
257 . 1 . 1 30 30 LEU H H 1 9.288 0.020 . 1 . . . . A 30 LEU H . 31063 1
258 . 1 . 1 30 30 LEU HA H 1 4.717 0.020 . 1 . . . . A 30 LEU HA . 31063 1
259 . 1 . 1 30 30 LEU HB2 H 1 1.683 0.020 . 2 . . . . A 30 LEU HB2 . 31063 1
260 . 1 . 1 30 30 LEU HB3 H 1 1.683 0.020 . 2 . . . . A 30 LEU HB3 . 31063 1
261 . 1 . 1 30 30 LEU HG H 1 1.527 0.020 . 1 . . . . A 30 LEU HG . 31063 1
262 . 1 . 1 30 30 LEU HD11 H 1 0.794 0.020 . 2 . . . . A 30 LEU HD11 . 31063 1
263 . 1 . 1 30 30 LEU HD12 H 1 0.794 0.020 . 2 . . . . A 30 LEU HD12 . 31063 1
264 . 1 . 1 30 30 LEU HD13 H 1 0.794 0.020 . 2 . . . . A 30 LEU HD13 . 31063 1
265 . 1 . 1 30 30 LEU HD21 H 1 0.846 0.020 . 2 . . . . A 30 LEU HD21 . 31063 1
266 . 1 . 1 30 30 LEU HD22 H 1 0.846 0.020 . 2 . . . . A 30 LEU HD22 . 31063 1
267 . 1 . 1 30 30 LEU HD23 H 1 0.846 0.020 . 2 . . . . A 30 LEU HD23 . 31063 1
268 . 1 . 1 30 30 LEU CB C 13 43.180 0.400 . 1 . . . . A 30 LEU CB . 31063 1
269 . 1 . 1 30 30 LEU CD1 C 13 21.230 0.400 . 2 . . . . A 30 LEU CD1 . 31063 1
270 . 1 . 1 30 30 LEU CD2 C 13 23.632 0.400 . 2 . . . . A 30 LEU CD2 . 31063 1
271 . 1 . 1 30 30 LEU N N 15 124.665 0.400 . 1 . . . . A 30 LEU N . 31063 1
272 . 1 . 1 31 31 TRP H H 1 7.627 0.020 . 1 . . . . A 31 TRP H . 31063 1
273 . 1 . 1 31 31 TRP HA H 1 4.814 0.020 . 1 . . . . A 31 TRP HA . 31063 1
274 . 1 . 1 31 31 TRP HB2 H 1 3.139 0.020 . 2 . . . . A 31 TRP HB2 . 31063 1
275 . 1 . 1 31 31 TRP HB3 H 1 3.496 0.020 . 2 . . . . A 31 TRP HB3 . 31063 1
276 . 1 . 1 31 31 TRP HD1 H 1 7.119 0.020 . 1 . . . . A 31 TRP HD1 . 31063 1
277 . 1 . 1 31 31 TRP HE1 H 1 9.326 0.020 . 1 . . . . A 31 TRP HE1 . 31063 1
278 . 1 . 1 31 31 TRP HE3 H 1 7.687 0.020 . 1 . . . . A 31 TRP HE3 . 31063 1
279 . 1 . 1 31 31 TRP HZ3 H 1 7.012 0.020 . 1 . . . . A 31 TRP HZ3 . 31063 1
280 . 1 . 1 31 31 TRP NE1 N 15 129.228 0.400 . 1 . . . . A 31 TRP NE1 . 31063 1
281 . 1 . 1 32 32 ASP H H 1 8.864 0.020 . 1 . . . . A 32 ASP H . 31063 1
282 . 1 . 1 32 32 ASP HA H 1 4.584 0.020 . 1 . . . . A 32 ASP HA . 31063 1
283 . 1 . 1 32 32 ASP HB2 H 1 2.721 0.020 . 2 . . . . A 32 ASP HB2 . 31063 1
284 . 1 . 1 32 32 ASP HB3 H 1 2.721 0.020 . 2 . . . . A 32 ASP HB3 . 31063 1
285 . 1 . 1 32 32 ASP N N 15 122.901 0.400 . 1 . . . . A 32 ASP N . 31063 1
286 . 1 . 1 33 33 GLY H H 1 8.166 0.020 . 1 . . . . A 33 GLY H . 31063 1
287 . 1 . 1 33 33 GLY HA2 H 1 4.035 0.020 . 2 . . . . A 33 GLY HA2 . 31063 1
288 . 1 . 1 33 33 GLY HA3 H 1 3.789 0.020 . 2 . . . . A 33 GLY HA3 . 31063 1
289 . 1 . 1 33 33 GLY CA C 13 43.110 0.400 . 1 . . . . A 33 GLY CA . 31063 1
290 . 1 . 1 33 33 GLY N N 15 109.302 0.400 . 1 . . . . A 33 GLY N . 31063 1
291 . 1 . 1 34 34 THR H H 1 8.023 0.020 . 1 . . . . A 34 THR H . 31063 1
292 . 1 . 1 34 34 THR HA H 1 4.324 0.020 . 1 . . . . A 34 THR HA . 31063 1
293 . 1 . 1 34 34 THR HB H 1 4.240 0.020 . 1 . . . . A 34 THR HB . 31063 1
294 . 1 . 1 34 34 THR HG21 H 1 1.168 0.020 . 1 . . . . A 34 THR HG21 . 31063 1
295 . 1 . 1 34 34 THR HG22 H 1 1.168 0.020 . 1 . . . . A 34 THR HG22 . 31063 1
296 . 1 . 1 34 34 THR HG23 H 1 1.168 0.020 . 1 . . . . A 34 THR HG23 . 31063 1
297 . 1 . 1 34 34 THR CA C 13 59.644 0.400 . 1 . . . . A 34 THR CA . 31063 1
298 . 1 . 1 34 34 THR CB C 13 67.482 0.400 . 1 . . . . A 34 THR CB . 31063 1
299 . 1 . 1 34 34 THR N N 15 112.989 0.400 . 1 . . . . A 34 THR N . 31063 1
300 . 1 . 1 35 35 PHE H H 1 8.199 0.020 . 1 . . . . A 35 PHE H . 31063 1
301 . 1 . 1 35 35 PHE HA H 1 4.660 0.020 . 1 . . . . A 35 PHE HA . 31063 1
302 . 1 . 1 35 35 PHE HB2 H 1 3.080 0.020 . 2 . . . . A 35 PHE HB2 . 31063 1
303 . 1 . 1 35 35 PHE HB3 H 1 2.964 0.020 . 2 . . . . A 35 PHE HB3 . 31063 1
304 . 1 . 1 35 35 PHE HD1 H 1 7.148 0.020 . 1 . . . . A 35 PHE HD1 . 31063 1
305 . 1 . 1 35 35 PHE HD2 H 1 7.148 0.020 . 1 . . . . A 35 PHE HD2 . 31063 1
306 . 1 . 1 35 35 PHE CD2 C 13 129.623 0.400 . 3 . . . . A 35 PHE CD2 . 31063 1
307 . 1 . 1 35 35 PHE N N 15 122.284 0.400 . 1 . . . . A 35 PHE N . 31063 1
308 . 1 . 1 36 36 THR H H 1 7.855 0.020 . 1 . . . . A 36 THR H . 31063 1
309 . 1 . 1 36 36 THR HA H 1 4.127 0.020 . 1 . . . . A 36 THR HA . 31063 1
310 . 1 . 1 36 36 THR HB H 1 4.208 0.020 . 1 . . . . A 36 THR HB . 31063 1
311 . 1 . 1 36 36 THR HG21 H 1 1.097 0.020 . 1 . . . . A 36 THR HG21 . 31063 1
312 . 1 . 1 36 36 THR HG22 H 1 1.097 0.020 . 1 . . . . A 36 THR HG22 . 31063 1
313 . 1 . 1 36 36 THR HG23 H 1 1.097 0.020 . 1 . . . . A 36 THR HG23 . 31063 1
314 . 1 . 1 36 36 THR CA C 13 59.609 0.400 . 1 . . . . A 36 THR CA . 31063 1
315 . 1 . 1 36 36 THR CB C 13 68.301 0.400 . 1 . . . . A 36 THR CB . 31063 1
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