###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 25249
_Assigned_chem_shift_list.ID 1
_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 $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 25249 1
5 '3D 1H-15N NOESY' . . . 25249 1
6 '3D 1H-13C NOESY aliphatic' . . . 25249 1
7 '3D 1H-13C NOESY aromatic' . . . 25249 1
8 '3D HCCH-TOCSY' . . . 25249 1
9 'APSY 4D-HACANH' . . . 25249 1
10 'APSY 5D-HACACONH' . . . 25249 1
11 'APSY 5D-CBCACONH' . . . 25249 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_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.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 MET HA H 1 4.449 0.020 . 1 . . . . 1 MET HA . 25249 1
2 . 1 1 1 1 MET HB2 H 1 2.029 0.020 . 2 . . . . 1 MET HB2 . 25249 1
3 . 1 1 1 1 MET HB3 H 1 2.583 0.020 . 2 . . . . 1 MET HB3 . 25249 1
4 . 1 1 1 1 MET CA C 13 55.424 0.3 . 1 . . . . 1 MET CA . 25249 1
5 . 1 1 1 1 MET CB C 13 32.690 0.3 . 1 . . . . 1 MET CB . 25249 1
6 . 1 1 2 2 LYS HA H 1 4.257 0.020 . 1 . . . . 2 LYS HA . 25249 1
7 . 1 1 2 2 LYS HB2 H 1 1.754 0.020 . 2 . . . . 2 LYS HB2 . 25249 1
8 . 1 1 2 2 LYS HB3 H 1 1.702 0.020 . 2 . . . . 2 LYS HB3 . 25249 1
9 . 1 1 2 2 LYS CA C 13 56.180 0.3 . 1 . . . . 2 LYS CA . 25249 1
10 . 1 1 2 2 LYS CB C 13 32.992 0.3 . 1 . . . . 2 LYS CB . 25249 1
11 . 1 1 2 2 LYS N N 15 122.712 0.3 . 1 . . . . 2 LYS N . 25249 1
12 . 1 1 3 3 GLN HA H 1 4.286 0.020 . 1 . . . . 3 GLN HA . 25249 1
13 . 1 1 3 3 GLN HB2 H 1 2.063 0.020 . 1 . . . . 3 GLN HB2 . 25249 1
14 . 1 1 3 3 GLN CA C 13 55.627 0.3 . 1 . . . . 3 GLN CA . 25249 1
15 . 1 1 3 3 GLN CB C 13 29.462 0.3 . 1 . . . . 3 GLN CB . 25249 1
16 . 1 1 3 3 GLN N N 15 121.835 0.3 . 1 . . . . 3 GLN N . 25249 1
17 . 1 1 4 4 ASP HA H 1 4.513 0.020 . 1 . . . . 4 ASP HA . 25249 1
18 . 1 1 4 4 ASP HB2 H 1 2.622 0.020 . 1 . . . . 4 ASP HB2 . 25249 1
19 . 1 1 4 4 ASP CA C 13 54.592 0.3 . 1 . . . . 4 ASP CA . 25249 1
20 . 1 1 4 4 ASP CB C 13 41.021 0.3 . 1 . . . . 4 ASP CB . 25249 1
21 . 1 1 4 4 ASP N N 15 121.160 0.3 . 1 . . . . 4 ASP N . 25249 1
22 . 1 1 5 5 GLY HA2 H 1 3.973 0.020 . 1 . . . . 5 GLY HA2 . 25249 1
23 . 1 1 5 5 GLY CA C 13 45.206 0.3 . 1 . . . . 5 GLY CA . 25249 1
24 . 1 1 5 5 GLY N N 15 109.155 0.3 . 1 . . . . 5 GLY N . 25249 1
25 . 1 1 6 6 GLU HA H 1 4.273 0.020 . 1 . . . . 6 GLU HA . 25249 1
26 . 1 1 6 6 GLU HB2 H 1 1.882 0.020 . 2 . . . . 6 GLU HB2 . 25249 1
27 . 1 1 6 6 GLU HB3 H 1 2.192 0.020 . 2 . . . . 6 GLU HB3 . 25249 1
28 . 1 1 6 6 GLU CA C 13 56.174 0.3 . 1 . . . . 6 GLU CA . 25249 1
29 . 1 1 6 6 GLU CB C 13 30.347 0.3 . 1 . . . . 6 GLU CB . 25249 1
30 . 1 1 6 6 GLU N N 15 120.048 0.3 . 1 . . . . 6 GLU N . 25249 1
31 . 1 1 7 7 GLU HA H 1 4.244 0.020 . 1 . . . . 7 GLU HA . 25249 1
32 . 1 1 7 7 GLU HB2 H 1 2.015 0.020 . 2 . . . . 7 GLU HB2 . 25249 1
33 . 1 1 7 7 GLU HB3 H 1 2.181 0.020 . 2 . . . . 7 GLU HB3 . 25249 1
34 . 1 1 7 7 GLU CA C 13 56.706 0.3 . 1 . . . . 7 GLU CA . 25249 1
35 . 1 1 7 7 GLU CB C 13 30.232 0.3 . 1 . . . . 7 GLU CB . 25249 1
36 . 1 1 7 7 GLU N N 15 121.807 0.3 . 1 . . . . 7 GLU N . 25249 1
37 . 1 1 8 8 GLY CA C 13 45.166 0.3 . 1 . . . . 8 GLY CA . 25249 1
38 . 1 1 8 8 GLY N N 15 109.924 0.3 . 1 . . . . 8 GLY N . 25249 1
39 . 1 1 9 9 THR HA H 1 4.351 0.020 . 1 . . . . 9 THR HA . 25249 1
40 . 1 1 9 9 THR HB H 1 4.204 0.020 . 1 . . . . 9 THR HB . 25249 1
41 . 1 1 9 9 THR CA C 13 61.403 0.3 . 1 . . . . 9 THR CA . 25249 1
42 . 1 1 9 9 THR CB C 13 70.017 0.3 . 1 . . . . 9 THR CB . 25249 1
43 . 1 1 9 9 THR CG2 C 13 21.534 0.3 . 1 . . . . 9 THR CG2 . 25249 1
44 . 1 1 9 9 THR N N 15 112.915 0.3 . 1 . . . . 9 THR N . 25249 1
45 . 1 1 10 10 GLU HA H 1 4.256 0.020 . 1 . . . . 10 GLU HA . 25249 1
46 . 1 1 10 10 GLU CA C 13 56.429 0.3 . 1 . . . . 10 GLU CA . 25249 1
47 . 1 1 10 10 GLU CB C 13 30.215 0.3 . 1 . . . . 10 GLU CB . 25249 1
48 . 1 1 10 10 GLU N N 15 122.925 0.3 . 1 . . . . 10 GLU N . 25249 1
49 . 1 1 11 11 GLU HA H 1 4.229 0.020 . 1 . . . . 11 GLU HA . 25249 1
50 . 1 1 11 11 GLU CA C 13 56.358 0.3 . 1 . . . . 11 GLU CA . 25249 1
51 . 1 1 11 11 GLU N N 15 121.611 0.3 . 1 . . . . 11 GLU N . 25249 1
52 . 1 1 12 12 ASP HA H 1 4.620 0.020 . 1 . . . . 12 ASP HA . 25249 1
53 . 1 1 12 12 ASP HB2 H 1 2.565 0.020 . 2 . . . . 12 ASP HB2 . 25249 1
54 . 1 1 12 12 ASP HB3 H 1 2.687 0.020 . 2 . . . . 12 ASP HB3 . 25249 1
55 . 1 1 12 12 ASP CA C 13 54.165 0.3 . 1 . . . . 12 ASP CA . 25249 1
56 . 1 1 12 12 ASP CB C 13 41.035 0.3 . 1 . . . . 12 ASP CB . 25249 1
57 . 1 1 12 12 ASP N N 15 121.724 0.3 . 1 . . . . 12 ASP N . 25249 1
58 . 1 1 13 13 THR HA H 1 4.263 0.020 . 1 . . . . 13 THR HA . 25249 1
59 . 1 1 13 13 THR HB H 1 4.207 0.020 . 1 . . . . 13 THR HB . 25249 1
60 . 1 1 13 13 THR CA C 13 61.602 0.3 . 1 . . . . 13 THR CA . 25249 1
61 . 1 1 13 13 THR CB C 13 69.692 0.3 . 1 . . . . 13 THR CB . 25249 1
62 . 1 1 13 13 THR N N 15 113.917 0.3 . 1 . . . . 13 THR N . 25249 1
63 . 1 1 14 14 GLU HA H 1 4.250 0.020 . 1 . . . . 14 GLU HA . 25249 1
64 . 1 1 14 14 GLU HB2 H 1 1.849 0.020 . 2 . . . . 14 GLU HB2 . 25249 1
65 . 1 1 14 14 GLU HB3 H 1 1.942 0.020 . 2 . . . . 14 GLU HB3 . 25249 1
66 . 1 1 14 14 GLU CA C 13 56.207 0.3 . 1 . . . . 14 GLU CA . 25249 1
67 . 1 1 14 14 GLU CB C 13 30.475 0.3 . 1 . . . . 14 GLU CB . 25249 1
68 . 1 1 14 14 GLU N N 15 122.686 0.3 . 1 . . . . 14 GLU N . 25249 1
69 . 1 1 15 15 GLU HA H 1 4.248 0.020 . 1 . . . . 15 GLU HA . 25249 1
70 . 1 1 15 15 GLU HG2 H 1 2.207 0.020 . 2 . . . . 15 GLU HG2 . 25249 1
71 . 1 1 15 15 GLU HG3 H 1 2.099 0.020 . 2 . . . . 15 GLU HG3 . 25249 1
72 . 1 1 15 15 GLU CA C 13 56.315 0.3 . 1 . . . . 15 GLU CA . 25249 1
73 . 1 1 15 15 GLU CB C 13 30.841 0.3 . 1 . . . . 15 GLU CB . 25249 1
74 . 1 1 15 15 GLU CG C 13 36.224 0.3 . 1 . . . . 15 GLU CG . 25249 1
75 . 1 1 15 15 GLU N N 15 122.702 0.3 . 1 . . . . 15 GLU N . 25249 1
76 . 1 1 16 16 LYS HA H 1 4.581 0.020 . 1 . . . . 16 LYS HA . 25249 1
77 . 1 1 16 16 LYS HB2 H 1 1.353 0.020 . 2 . . . . 16 LYS HB2 . 25249 1
78 . 1 1 16 16 LYS HB3 H 1 1.281 0.020 . 2 . . . . 16 LYS HB3 . 25249 1
79 . 1 1 16 16 LYS HG2 H 1 1.135 0.020 . 2 . . . . 16 LYS HG2 . 25249 1
80 . 1 1 16 16 LYS HG3 H 1 0.987 0.020 . 2 . . . . 16 LYS HG3 . 25249 1
81 . 1 1 16 16 LYS HD3 H 1 1.438 0.020 . 1 . . . . 16 LYS HD3 . 25249 1
82 . 1 1 16 16 LYS HE3 H 1 2.798 0.020 . 1 . . . . 16 LYS HE3 . 25249 1
83 . 1 1 16 16 LYS CA C 13 54.283 0.3 . 1 . . . . 16 LYS CA . 25249 1
84 . 1 1 16 16 LYS CB C 13 35.552 0.3 . 1 . . . . 16 LYS CB . 25249 1
85 . 1 1 16 16 LYS CG C 13 24.909 0.3 . 1 . . . . 16 LYS CG . 25249 1
86 . 1 1 16 16 LYS CD C 13 29.146 0.3 . 1 . . . . 16 LYS CD . 25249 1
87 . 1 1 16 16 LYS CE C 13 41.830 0.3 . 1 . . . . 16 LYS CE . 25249 1
88 . 1 1 16 16 LYS N N 15 119.862 0.3 . 1 . . . . 16 LYS N . 25249 1
89 . 1 1 17 17 CYS HA H 1 4.275 0.020 . 1 . . . . 17 CYS HA . 25249 1
90 . 1 1 17 17 CYS HB2 H 1 2.282 0.020 . 2 . . . . 17 CYS HB2 . 25249 1
91 . 1 1 17 17 CYS HB3 H 1 3.479 0.020 . 2 . . . . 17 CYS HB3 . 25249 1
92 . 1 1 17 17 CYS CA C 13 58.613 0.3 . 1 . . . . 17 CYS CA . 25249 1
93 . 1 1 17 17 CYS CB C 13 31.390 0.3 . 1 . . . . 17 CYS CB . 25249 1
94 . 1 1 17 17 CYS N N 15 123.455 0.3 . 1 . . . . 17 CYS N . 25249 1
95 . 1 1 18 18 THR HA H 1 3.917 0.020 . 1 . . . . 18 THR HA . 25249 1
96 . 1 1 18 18 THR HB H 1 4.069 0.020 . 1 . . . . 18 THR HB . 25249 1
97 . 1 1 18 18 THR CA C 13 65.089 0.3 . 1 . . . . 18 THR CA . 25249 1
98 . 1 1 18 18 THR CB C 13 68.867 0.3 . 1 . . . . 18 THR CB . 25249 1
99 . 1 1 18 18 THR CG2 C 13 22.469 0.3 . 1 . . . . 18 THR CG2 . 25249 1
100 . 1 1 18 18 THR N N 15 122.246 0.3 . 1 . . . . 18 THR N . 25249 1
101 . 1 1 19 19 ILE HA H 1 4.057 0.020 . 1 . . . . 19 ILE HA . 25249 1
102 . 1 1 19 19 ILE HB H 1 1.874 0.020 . 1 . . . . 19 ILE HB . 25249 1
103 . 1 1 19 19 ILE HG12 H 1 1.105 0.020 . 2 . . . . 19 ILE HG12 . 25249 1
104 . 1 1 19 19 ILE HG13 H 1 1.704 0.020 . 2 . . . . 19 ILE HG13 . 25249 1
105 . 1 1 19 19 ILE CA C 13 63.890 0.3 . 1 . . . . 19 ILE CA . 25249 1
106 . 1 1 19 19 ILE CB C 13 38.839 0.3 . 1 . . . . 19 ILE CB . 25249 1
107 . 1 1 19 19 ILE CG1 C 13 28.084 0.3 . 1 . . . . 19 ILE CG1 . 25249 1
108 . 1 1 19 19 ILE CG2 C 13 16.417 0.3 . 1 . . . . 19 ILE CG2 . 25249 1
109 . 1 1 19 19 ILE CD1 C 13 13.342 0.3 . 1 . . . . 19 ILE CD1 . 25249 1
110 . 1 1 19 19 ILE N N 15 120.833 0.3 . 1 . . . . 19 ILE N . 25249 1
111 . 1 1 20 20 CYS HA H 1 4.821 0.020 . 1 . . . . 20 CYS HA . 25249 1
112 . 1 1 20 20 CYS HB2 H 1 3.274 0.020 . 2 . . . . 20 CYS HB2 . 25249 1
113 . 1 1 20 20 CYS HB3 H 1 3.070 0.020 . 2 . . . . 20 CYS HB3 . 25249 1
114 . 1 1 20 20 CYS CA C 13 58.569 0.3 . 1 . . . . 20 CYS CA . 25249 1
115 . 1 1 20 20 CYS CB C 13 31.291 0.3 . 1 . . . . 20 CYS CB . 25249 1
116 . 1 1 20 20 CYS N N 15 116.325 0.3 . 1 . . . . 20 CYS N . 25249 1
117 . 1 1 21 21 LEU HA H 1 4.039 0.020 . 1 . . . . 21 LEU HA . 25249 1
118 . 1 1 21 21 LEU HB2 H 1 2.116 0.020 . 2 . . . . 21 LEU HB2 . 25249 1
119 . 1 1 21 21 LEU HB3 H 1 1.633 0.020 . 2 . . . . 21 LEU HB3 . 25249 1
120 . 1 1 21 21 LEU HG H 1 1.391 0.020 . 1 . . . . 21 LEU HG . 25249 1
121 . 1 1 21 21 LEU CA C 13 56.691 0.3 . 1 . . . . 21 LEU CA . 25249 1
122 . 1 1 21 21 LEU CB C 13 38.402 0.3 . 1 . . . . 21 LEU CB . 25249 1
123 . 1 1 21 21 LEU CG C 13 27.104 0.3 . 1 . . . . 21 LEU CG . 25249 1
124 . 1 1 21 21 LEU CD1 C 13 25.123 0.3 . 1 . . . . 21 LEU CD1 . 25249 1
125 . 1 1 21 21 LEU CD2 C 13 22.833 0.3 . 1 . . . . 21 LEU CD2 . 25249 1
126 . 1 1 21 21 LEU N N 15 119.292 0.3 . 1 . . . . 21 LEU N . 25249 1
127 . 1 1 22 22 SER HA H 1 4.808 0.020 . 1 . . . . 22 SER HA . 25249 1
128 . 1 1 22 22 SER HB2 H 1 4.007 0.020 . 1 . . . . 22 SER HB2 . 25249 1
129 . 1 1 22 22 SER CA C 13 58.039 0.3 . 1 . . . . 22 SER CA . 25249 1
130 . 1 1 22 22 SER CB C 13 64.671 0.3 . 1 . . . . 22 SER CB . 25249 1
131 . 1 1 22 22 SER N N 15 115.811 0.3 . 1 . . . . 22 SER N . 25249 1
132 . 1 1 23 23 ILE HA H 1 3.988 0.020 . 1 . . . . 23 ILE HA . 25249 1
133 . 1 1 23 23 ILE HB H 1 1.771 0.020 . 1 . . . . 23 ILE HB . 25249 1
134 . 1 1 23 23 ILE HG12 H 1 1.094 0.020 . 2 . . . . 23 ILE HG12 . 25249 1
135 . 1 1 23 23 ILE HG13 H 1 1.489 0.020 . 2 . . . . 23 ILE HG13 . 25249 1
136 . 1 1 23 23 ILE CA C 13 61.853 0.3 . 1 . . . . 23 ILE CA . 25249 1
137 . 1 1 23 23 ILE CB C 13 38.966 0.3 . 1 . . . . 23 ILE CB . 25249 1
138 . 1 1 23 23 ILE CG1 C 13 28.208 0.3 . 1 . . . . 23 ILE CG1 . 25249 1
139 . 1 1 23 23 ILE CG2 C 13 17.555 0.3 . 1 . . . . 23 ILE CG2 . 25249 1
140 . 1 1 23 23 ILE CD1 C 13 13.095 0.3 . 1 . . . . 23 ILE CD1 . 25249 1
141 . 1 1 23 23 ILE N N 15 121.789 0.3 . 1 . . . . 23 ILE N . 25249 1
142 . 1 1 24 24 LEU HA H 1 4.242 0.020 . 1 . . . . 24 LEU HA . 25249 1
143 . 1 1 24 24 LEU HB2 H 1 1.457 0.020 . 2 . . . . 24 LEU HB2 . 25249 1
144 . 1 1 24 24 LEU HB3 H 1 1.055 0.020 . 2 . . . . 24 LEU HB3 . 25249 1
145 . 1 1 24 24 LEU HG H 1 1.143 0.020 . 1 . . . . 24 LEU HG . 25249 1
146 . 1 1 24 24 LEU CA C 13 53.893 0.3 . 1 . . . . 24 LEU CA . 25249 1
147 . 1 1 24 24 LEU CB C 13 41.277 0.3 . 1 . . . . 24 LEU CB . 25249 1
148 . 1 1 24 24 LEU CG C 13 26.388 0.3 . 1 . . . . 24 LEU CG . 25249 1
149 . 1 1 24 24 LEU CD1 C 13 23.440 0.3 . 1 . . . . 24 LEU CD1 . 25249 1
150 . 1 1 24 24 LEU CD2 C 13 26.106 0.3 . 1 . . . . 24 LEU CD2 . 25249 1
151 . 1 1 24 24 LEU N N 15 126.064 0.3 . 1 . . . . 24 LEU N . 25249 1
152 . 1 1 25 25 GLU HA H 1 4.405 0.020 . 1 . . . . 25 GLU HA . 25249 1
153 . 1 1 25 25 GLU HB2 H 1 2.009 0.020 . 2 . . . . 25 GLU HB2 . 25249 1
154 . 1 1 25 25 GLU HB3 H 1 1.722 0.020 . 2 . . . . 25 GLU HB3 . 25249 1
155 . 1 1 25 25 GLU HG2 H 1 2.256 0.020 . 2 . . . . 25 GLU HG2 . 25249 1
156 . 1 1 25 25 GLU HG3 H 1 2.154 0.020 . 2 . . . . 25 GLU HG3 . 25249 1
157 . 1 1 25 25 GLU CA C 13 54.902 0.3 . 1 . . . . 25 GLU CA . 25249 1
158 . 1 1 25 25 GLU CB C 13 31.436 0.3 . 1 . . . . 25 GLU CB . 25249 1
159 . 1 1 25 25 GLU CG C 13 36.093 0.3 . 1 . . . . 25 GLU CG . 25249 1
160 . 1 1 25 25 GLU N N 15 124.998 0.3 . 1 . . . . 25 GLU N . 25249 1
161 . 1 1 26 26 GLU HA H 1 4.012 0.020 . 1 . . . . 26 GLU HA . 25249 1
162 . 1 1 26 26 GLU HB2 H 1 1.974 0.020 . 2 . . . . 26 GLU HB2 . 25249 1
163 . 1 1 26 26 GLU HB3 H 1 1.923 0.020 . 2 . . . . 26 GLU HB3 . 25249 1
164 . 1 1 26 26 GLU CA C 13 58.091 0.3 . 1 . . . . 26 GLU CA . 25249 1
165 . 1 1 26 26 GLU CB C 13 29.368 0.3 . 1 . . . . 26 GLU CB . 25249 1
166 . 1 1 26 26 GLU N N 15 123.130 0.3 . 1 . . . . 26 GLU N . 25249 1
167 . 1 1 27 27 GLY HA2 H 1 4.204 0.020 . 1 . . . . 27 GLY HA2 . 25249 1
168 . 1 1 27 27 GLY CA C 13 44.972 0.3 . 1 . . . . 27 GLY CA . 25249 1
169 . 1 1 27 27 GLY N N 15 112.530 0.3 . 1 . . . . 27 GLY N . 25249 1
170 . 1 1 28 28 GLU HA H 1 4.338 0.020 . 1 . . . . 28 GLU HA . 25249 1
171 . 1 1 28 28 GLU HB2 H 1 2.240 0.020 . 2 . . . . 28 GLU HB2 . 25249 1
172 . 1 1 28 28 GLU HB3 H 1 1.946 0.020 . 2 . . . . 28 GLU HB3 . 25249 1
173 . 1 1 28 28 GLU HG2 H 1 2.199 0.020 . 2 . . . . 28 GLU HG2 . 25249 1
174 . 1 1 28 28 GLU HG3 H 1 2.342 0.020 . 2 . . . . 28 GLU HG3 . 25249 1
175 . 1 1 28 28 GLU CA C 13 56.359 0.3 . 1 . . . . 28 GLU CA . 25249 1
176 . 1 1 28 28 GLU CB C 13 31.015 0.3 . 1 . . . . 28 GLU CB . 25249 1
177 . 1 1 28 28 GLU CG C 13 37.672 0.3 . 1 . . . . 28 GLU CG . 25249 1
178 . 1 1 28 28 GLU N N 15 118.877 0.3 . 1 . . . . 28 GLU N . 25249 1
179 . 1 1 29 29 ASP HA H 1 4.770 0.020 . 1 . . . . 29 ASP HA . 25249 1
180 . 1 1 29 29 ASP HB2 H 1 2.703 0.020 . 2 . . . . 29 ASP HB2 . 25249 1
181 . 1 1 29 29 ASP HB3 H 1 2.747 0.020 . 2 . . . . 29 ASP HB3 . 25249 1
182 . 1 1 29 29 ASP CA C 13 54.603 0.3 . 1 . . . . 29 ASP CA . 25249 1
183 . 1 1 29 29 ASP CB C 13 40.308 0.3 . 1 . . . . 29 ASP CB . 25249 1
184 . 1 1 29 29 ASP N N 15 121.103 0.3 . 1 . . . . 29 ASP N . 25249 1
185 . 1 1 30 30 VAL HA H 1 4.831 0.020 . 1 . . . . 30 VAL HA . 25249 1
186 . 1 1 30 30 VAL HB H 1 1.969 0.020 . 1 . . . . 30 VAL HB . 25249 1
187 . 1 1 30 30 VAL CA C 13 60.353 0.3 . 1 . . . . 30 VAL CA . 25249 1
188 . 1 1 30 30 VAL CB C 13 35.285 0.3 . 1 . . . . 30 VAL CB . 25249 1
189 . 1 1 30 30 VAL CG2 C 13 22.064 0.3 . 1 . . . . 30 VAL CG2 . 25249 1
190 . 1 1 30 30 VAL N N 15 122.204 0.3 . 1 . . . . 30 VAL N . 25249 1
191 . 1 1 31 31 ARG HA H 1 4.556 0.020 . 1 . . . . 31 ARG HA . 25249 1
192 . 1 1 31 31 ARG HB2 H 1 1.559 0.020 . 2 . . . . 31 ARG HB2 . 25249 1
193 . 1 1 31 31 ARG HB3 H 1 1.367 0.020 . 2 . . . . 31 ARG HB3 . 25249 1
194 . 1 1 31 31 ARG HG3 H 1 0.842 0.020 . 1 . . . . 31 ARG HG3 . 25249 1
195 . 1 1 31 31 ARG HD3 H 1 3.115 0.020 . 1 . . . . 31 ARG HD3 . 25249 1
196 . 1 1 31 31 ARG CA C 13 54.417 0.3 . 1 . . . . 31 ARG CA . 25249 1
197 . 1 1 31 31 ARG CB C 13 33.218 0.3 . 1 . . . . 31 ARG CB . 25249 1
198 . 1 1 31 31 ARG CG C 13 20.325 0.3 . 1 . . . . 31 ARG CG . 25249 1
199 . 1 1 31 31 ARG CD C 13 42.707 0.3 . 1 . . . . 31 ARG CD . 25249 1
200 . 1 1 31 31 ARG N N 15 123.197 0.3 . 1 . . . . 31 ARG N . 25249 1
201 . 1 1 32 32 ARG HA H 1 4.996 0.020 . 1 . . . . 32 ARG HA . 25249 1
202 . 1 1 32 32 ARG HB2 H 1 1.734 0.020 . 2 . . . . 32 ARG HB2 . 25249 1
203 . 1 1 32 32 ARG HB3 H 1 1.567 0.020 . 2 . . . . 32 ARG HB3 . 25249 1
204 . 1 1 32 32 ARG HG3 H 1 0.661 0.020 . 1 . . . . 32 ARG HG3 . 25249 1
205 . 1 1 32 32 ARG HD2 H 1 3.145 0.020 . 2 . . . . 32 ARG HD2 . 25249 1
206 . 1 1 32 32 ARG HD3 H 1 3.053 0.020 . 2 . . . . 32 ARG HD3 . 25249 1
207 . 1 1 32 32 ARG CA C 13 54.213 0.3 . 1 . . . . 32 ARG CA . 25249 1
208 . 1 1 32 32 ARG CB C 13 32.005 0.3 . 1 . . . . 32 ARG CB . 25249 1
209 . 1 1 32 32 ARG CG C 13 25.320 0.3 . 1 . . . . 32 ARG CG . 25249 1
210 . 1 1 32 32 ARG CD C 13 43.255 0.3 . 1 . . . . 32 ARG CD . 25249 1
211 . 1 1 32 32 ARG N N 15 127.152 0.3 . 1 . . . . 32 ARG N . 25249 1
212 . 1 1 33 33 LEU HA H 1 4.731 0.020 . 1 . . . . 33 LEU HA . 25249 1
213 . 1 1 33 33 LEU HG H 1 1.302 0.020 . 1 . . . . 33 LEU HG . 25249 1
214 . 1 1 33 33 LEU CA C 13 54.026 0.3 . 1 . . . . 33 LEU CA . 25249 1
215 . 1 1 33 33 LEU CG C 13 27.679 0.3 . 1 . . . . 33 LEU CG . 25249 1
216 . 1 1 33 33 LEU N N 15 126.642 0.3 . 1 . . . . 33 LEU N . 25249 1
217 . 1 1 34 34 PRO HA H 1 4.282 0.020 . 1 . . . . 34 PRO HA . 25249 1
218 . 1 1 34 34 PRO HB2 H 1 1.941 0.020 . 2 . . . . 34 PRO HB2 . 25249 1
219 . 1 1 34 34 PRO HB3 H 1 2.385 0.020 . 2 . . . . 34 PRO HB3 . 25249 1
220 . 1 1 34 34 PRO HG2 H 1 2.034 0.020 . 2 . . . . 34 PRO HG2 . 25249 1
221 . 1 1 34 34 PRO HG3 H 1 2.224 0.020 . 2 . . . . 34 PRO HG3 . 25249 1
222 . 1 1 34 34 PRO HD2 H 1 3.886 0.020 . 2 . . . . 34 PRO HD2 . 25249 1
223 . 1 1 34 34 PRO HD3 H 1 3.865 0.020 . 2 . . . . 34 PRO HD3 . 25249 1
224 . 1 1 34 34 PRO CA C 13 65.649 0.3 . 1 . . . . 34 PRO CA . 25249 1
225 . 1 1 34 34 PRO CB C 13 31.625 0.3 . 1 . . . . 34 PRO CB . 25249 1
226 . 1 1 34 34 PRO CG C 13 28.059 0.3 . 1 . . . . 34 PRO CG . 25249 1
227 . 1 1 34 34 PRO CD C 13 50.795 0.3 . 1 . . . . 34 PRO CD . 25249 1
228 . 1 1 35 35 CYS HA H 1 4.308 0.020 . 1 . . . . 35 CYS HA . 25249 1
229 . 1 1 35 35 CYS HB2 H 1 2.603 0.020 . 2 . . . . 35 CYS HB2 . 25249 1
230 . 1 1 35 35 CYS HB3 H 1 3.055 0.020 . 2 . . . . 35 CYS HB3 . 25249 1
231 . 1 1 35 35 CYS CA C 13 57.780 0.3 . 1 . . . . 35 CYS CA . 25249 1
232 . 1 1 35 35 CYS CB C 13 31.235 0.3 . 1 . . . . 35 CYS CB . 25249 1
233 . 1 1 35 35 CYS N N 15 113.100 0.3 . 1 . . . . 35 CYS N . 25249 1
234 . 1 1 36 36 MET HA H 1 3.937 0.020 . 1 . . . . 36 MET HA . 25249 1
235 . 1 1 36 36 MET HB2 H 1 2.517 0.020 . 2 . . . . 36 MET HB2 . 25249 1
236 . 1 1 36 36 MET HB3 H 1 2.032 0.020 . 2 . . . . 36 MET HB3 . 25249 1
237 . 1 1 36 36 MET HG2 H 1 2.566 0.020 . 2 . . . . 36 MET HG2 . 25249 1
238 . 1 1 36 36 MET HG3 H 1 2.222 0.020 . 2 . . . . 36 MET HG3 . 25249 1
239 . 1 1 36 36 MET CA C 13 57.021 0.3 . 1 . . . . 36 MET CA . 25249 1
240 . 1 1 36 36 MET CB C 13 28.515 0.3 . 1 . . . . 36 MET CB . 25249 1
241 . 1 1 36 36 MET CG C 13 32.530 0.3 . 1 . . . . 36 MET CG . 25249 1
242 . 1 1 36 36 MET N N 15 112.000 0.3 . 1 . . . . 36 MET N . 25249 1
243 . 1 1 37 37 HIS HA H 1 4.445 0.020 . 1 . . . . 37 HIS HA . 25249 1
244 . 1 1 37 37 HIS HB2 H 1 3.339 0.020 . 2 . . . . 37 HIS HB2 . 25249 1
245 . 1 1 37 37 HIS HB3 H 1 2.809 0.020 . 2 . . . . 37 HIS HB3 . 25249 1
246 . 1 1 37 37 HIS CA C 13 60.742 0.3 . 1 . . . . 37 HIS CA . 25249 1
247 . 1 1 37 37 HIS CB C 13 31.079 0.3 . 1 . . . . 37 HIS CB . 25249 1
248 . 1 1 37 37 HIS N N 15 122.481 0.3 . 1 . . . . 37 HIS N . 25249 1
249 . 1 1 38 38 LEU HA H 1 4.900 0.020 . 1 . . . . 38 LEU HA . 25249 1
250 . 1 1 38 38 LEU HB2 H 1 1.237 0.020 . 2 . . . . 38 LEU HB2 . 25249 1
251 . 1 1 38 38 LEU HB3 H 1 1.369 0.020 . 2 . . . . 38 LEU HB3 . 25249 1
252 . 1 1 38 38 LEU CA C 13 53.848 0.3 . 1 . . . . 38 LEU CA . 25249 1
253 . 1 1 38 38 LEU CB C 13 46.222 0.3 . 1 . . . . 38 LEU CB . 25249 1
254 . 1 1 38 38 LEU CD2 C 13 25.388 0.3 . 1 . . . . 38 LEU CD2 . 25249 1
255 . 1 1 38 38 LEU N N 15 123.516 0.3 . 1 . . . . 38 LEU N . 25249 1
256 . 1 1 39 39 PHE HA H 1 5.212 0.020 . 1 . . . . 39 PHE HA . 25249 1
257 . 1 1 39 39 PHE HB2 H 1 3.411 0.020 . 2 . . . . 39 PHE HB2 . 25249 1
258 . 1 1 39 39 PHE HB3 H 1 2.451 0.020 . 2 . . . . 39 PHE HB3 . 25249 1
259 . 1 1 39 39 PHE CA C 13 55.438 0.3 . 1 . . . . 39 PHE CA . 25249 1
260 . 1 1 39 39 PHE CB C 13 45.472 0.3 . 1 . . . . 39 PHE CB . 25249 1
261 . 1 1 39 39 PHE N N 15 117.036 0.3 . 1 . . . . 39 PHE N . 25249 1
262 . 1 1 40 40 HIS HA H 1 4.685 0.020 . 1 . . . . 40 HIS HA . 25249 1
263 . 1 1 40 40 HIS HB2 H 1 3.696 0.020 . 2 . . . . 40 HIS HB2 . 25249 1
264 . 1 1 40 40 HIS HB3 H 1 3.974 0.020 . 2 . . . . 40 HIS HB3 . 25249 1
265 . 1 1 40 40 HIS CA C 13 59.873 0.3 . 1 . . . . 40 HIS CA . 25249 1
266 . 1 1 40 40 HIS CB C 13 31.142 0.3 . 1 . . . . 40 HIS CB . 25249 1
267 . 1 1 40 40 HIS N N 15 118.984 0.3 . 1 . . . . 40 HIS N . 25249 1
268 . 1 1 41 41 GLN HA H 1 3.787 0.020 . 1 . . . . 41 GLN HA . 25249 1
269 . 1 1 41 41 GLN HB2 H 1 2.026 0.020 . 2 . . . . 41 GLN HB2 . 25249 1
270 . 1 1 41 41 GLN HB3 H 1 1.799 0.020 . 2 . . . . 41 GLN HB3 . 25249 1
271 . 1 1 41 41 GLN HG2 H 1 2.298 0.020 . 2 . . . . 41 GLN HG2 . 25249 1
272 . 1 1 41 41 GLN HG3 H 1 2.193 0.020 . 2 . . . . 41 GLN HG3 . 25249 1
273 . 1 1 41 41 GLN HE21 H 1 6.678 0.020 . 1 . . . . 41 GLN HE21 . 25249 1
274 . 1 1 41 41 GLN HE22 H 1 7.725 0.020 . 1 . . . . 41 GLN HE22 . 25249 1
275 . 1 1 41 41 GLN CA C 13 59.799 0.3 . 1 . . . . 41 GLN CA . 25249 1
276 . 1 1 41 41 GLN CB C 13 28.237 0.3 . 1 . . . . 41 GLN CB . 25249 1
277 . 1 1 41 41 GLN CG C 13 33.103 0.3 . 1 . . . . 41 GLN CG . 25249 1
278 . 1 1 41 41 GLN N N 15 125.672 0.3 . 1 . . . . 41 GLN N . 25249 1
279 . 1 1 41 41 GLN NE2 N 15 112.256 0.3 . 1 . . . . 41 GLN NE2 . 25249 1
280 . 1 1 42 42 VAL HA H 1 3.944 0.020 . 1 . . . . 42 VAL HA . 25249 1
281 . 1 1 42 42 VAL HB H 1 2.052 0.020 . 1 . . . . 42 VAL HB . 25249 1
282 . 1 1 42 42 VAL CA C 13 65.059 0.3 . 1 . . . . 42 VAL CA . 25249 1
283 . 1 1 42 42 VAL CB C 13 31.774 0.3 . 1 . . . . 42 VAL CB . 25249 1
284 . 1 1 42 42 VAL N N 15 113.844 0.3 . 1 . . . . 42 VAL N . 25249 1
285 . 1 1 43 43 CYS HA H 1 4.033 0.020 . 1 . . . . 43 CYS HA . 25249 1
286 . 1 1 43 43 CYS HB2 H 1 3.001 0.020 . 2 . . . . 43 CYS HB2 . 25249 1
287 . 1 1 43 43 CYS HB3 H 1 3.046 0.020 . 2 . . . . 43 CYS HB3 . 25249 1
288 . 1 1 43 43 CYS CA C 13 62.926 0.3 . 1 . . . . 43 CYS CA . 25249 1
289 . 1 1 43 43 CYS CB C 13 29.336 0.3 . 1 . . . . 43 CYS CB . 25249 1
290 . 1 1 43 43 CYS N N 15 117.674 0.3 . 1 . . . . 43 CYS N . 25249 1
291 . 1 1 44 44 VAL HA H 1 3.771 0.020 . 1 . . . . 44 VAL HA . 25249 1
292 . 1 1 44 44 VAL HB H 1 1.644 0.020 . 1 . . . . 44 VAL HB . 25249 1
293 . 1 1 44 44 VAL CA C 13 63.411 0.3 . 1 . . . . 44 VAL CA . 25249 1
294 . 1 1 44 44 VAL CB C 13 32.700 0.3 . 1 . . . . 44 VAL CB . 25249 1
295 . 1 1 44 44 VAL CG1 C 13 20.317 0.3 . 1 . . . . 44 VAL CG1 . 25249 1
296 . 1 1 44 44 VAL CG2 C 13 22.807 0.3 . 1 . . . . 44 VAL CG2 . 25249 1
297 . 1 1 44 44 VAL N N 15 117.878 0.3 . 1 . . . . 44 VAL N . 25249 1
298 . 1 1 45 45 ASP HA H 1 4.280 0.020 . 1 . . . . 45 ASP HA . 25249 1
299 . 1 1 45 45 ASP HB2 H 1 2.728 0.020 . 2 . . . . 45 ASP HB2 . 25249 1
300 . 1 1 45 45 ASP HB3 H 1 2.488 0.020 . 2 . . . . 45 ASP HB3 . 25249 1
301 . 1 1 45 45 ASP CA C 13 57.476 0.3 . 1 . . . . 45 ASP CA . 25249 1
302 . 1 1 45 45 ASP CB C 13 39.898 0.3 . 1 . . . . 45 ASP CB . 25249 1
303 . 1 1 45 45 ASP N N 15 122.872 0.3 . 1 . . . . 45 ASP N . 25249 1
304 . 1 1 46 46 GLN HA H 1 4.049 0.020 . 1 . . . . 46 GLN HA . 25249 1
305 . 1 1 46 46 GLN HB2 H 1 2.079 0.020 . 2 . . . . 46 GLN HB2 . 25249 1
306 . 1 1 46 46 GLN HB3 H 1 1.637 0.020 . 2 . . . . 46 GLN HB3 . 25249 1
307 . 1 1 46 46 GLN HG2 H 1 2.456 0.020 . 2 . . . . 46 GLN HG2 . 25249 1
308 . 1 1 46 46 GLN HG3 H 1 2.353 0.020 . 2 . . . . 46 GLN HG3 . 25249 1
309 . 1 1 46 46 GLN HE22 H 1 7.969 0.020 . 1 . . . . 46 GLN HE22 . 25249 1
310 . 1 1 46 46 GLN CA C 13 57.842 0.3 . 1 . . . . 46 GLN CA . 25249 1
311 . 1 1 46 46 GLN CB C 13 28.351 0.3 . 1 . . . . 46 GLN CB . 25249 1
312 . 1 1 46 46 GLN CG C 13 33.881 0.3 . 1 . . . . 46 GLN CG . 25249 1
313 . 1 1 46 46 GLN N N 15 116.199 0.3 . 1 . . . . 46 GLN N . 25249 1
314 . 1 1 46 46 GLN NE2 N 15 116.769 0.3 . 1 . . . . 46 GLN NE2 . 25249 1
315 . 1 1 47 47 ALA HA H 1 4.148 0.020 . 1 . . . . 47 ALA HA . 25249 1
316 . 1 1 47 47 ALA CA C 13 54.359 0.3 . 1 . . . . 47 ALA CA . 25249 1
317 . 1 1 47 47 ALA CB C 13 18.332 0.3 . 1 . . . . 47 ALA CB . 25249 1
318 . 1 1 47 47 ALA N N 15 122.521 0.3 . 1 . . . . 47 ALA N . 25249 1
319 . 1 1 48 48 LEU HA H 1 3.907 0.020 . 1 . . . . 48 LEU HA . 25249 1
320 . 1 1 48 48 LEU HB2 H 1 1.763 0.020 . 2 . . . . 48 LEU HB2 . 25249 1
321 . 1 1 48 48 LEU HB3 H 1 1.456 0.020 . 2 . . . . 48 LEU HB3 . 25249 1
322 . 1 1 48 48 LEU CA C 13 55.820 0.3 . 1 . . . . 48 LEU CA . 25249 1
323 . 1 1 48 48 LEU CB C 13 41.371 0.3 . 1 . . . . 48 LEU CB . 25249 1
324 . 1 1 48 48 LEU N N 15 116.770 0.3 . 1 . . . . 48 LEU N . 25249 1
325 . 1 1 49 49 ILE HA H 1 3.791 0.020 . 1 . . . . 49 ILE HA . 25249 1
326 . 1 1 49 49 ILE HB H 1 1.869 0.020 . 1 . . . . 49 ILE HB . 25249 1
327 . 1 1 49 49 ILE HG12 H 1 1.639 0.020 . 2 . . . . 49 ILE HG12 . 25249 1
328 . 1 1 49 49 ILE HG13 H 1 1.146 0.020 . 2 . . . . 49 ILE HG13 . 25249 1
329 . 1 1 49 49 ILE CA C 13 63.691 0.3 . 1 . . . . 49 ILE CA . 25249 1
330 . 1 1 49 49 ILE CB C 13 37.938 0.3 . 1 . . . . 49 ILE CB . 25249 1
331 . 1 1 49 49 ILE CG1 C 13 28.160 0.3 . 1 . . . . 49 ILE CG1 . 25249 1
332 . 1 1 49 49 ILE CG2 C 13 17.212 0.3 . 1 . . . . 49 ILE CG2 . 25249 1
333 . 1 1 49 49 ILE CD1 C 13 12.968 0.3 . 1 . . . . 49 ILE CD1 . 25249 1
334 . 1 1 49 49 ILE N N 15 117.633 0.3 . 1 . . . . 49 ILE N . 25249 1
335 . 1 1 50 50 THR HA H 1 4.213 0.020 . 1 . . . . 50 THR HA . 25249 1
336 . 1 1 50 50 THR HB H 1 4.714 0.020 . 1 . . . . 50 THR HB . 25249 1
337 . 1 1 50 50 THR CA C 13 63.015 0.3 . 1 . . . . 50 THR CA . 25249 1
338 . 1 1 50 50 THR CB C 13 69.665 0.3 . 1 . . . . 50 THR CB . 25249 1
339 . 1 1 50 50 THR N N 15 110.839 0.3 . 1 . . . . 50 THR N . 25249 1
340 . 1 1 51 51 ASN HA H 1 4.681 0.020 . 1 . . . . 51 ASN HA . 25249 1
341 . 1 1 51 51 ASN HB3 H 1 2.712 0.020 . 1 . . . . 51 ASN HB3 . 25249 1
342 . 1 1 51 51 ASN CA C 13 53.219 0.3 . 1 . . . . 51 ASN CA . 25249 1
343 . 1 1 51 51 ASN CB C 13 39.857 0.3 . 1 . . . . 51 ASN CB . 25249 1
344 . 1 1 51 51 ASN N N 15 118.705 0.3 . 1 . . . . 51 ASN N . 25249 1
345 . 1 1 52 52 LYS HA H 1 4.161 0.020 . 1 . . . . 52 LYS HA . 25249 1
346 . 1 1 52 52 LYS HB2 H 1 1.792 0.020 . 2 . . . . 52 LYS HB2 . 25249 1
347 . 1 1 52 52 LYS HB3 H 1 1.952 0.020 . 2 . . . . 52 LYS HB3 . 25249 1
348 . 1 1 52 52 LYS HG3 H 1 1.359 0.020 . 1 . . . . 52 LYS HG3 . 25249 1
349 . 1 1 52 52 LYS HD2 H 1 1.659 0.020 . 2 . . . . 52 LYS HD2 . 25249 1
350 . 1 1 52 52 LYS HD3 H 1 1.554 0.020 . 2 . . . . 52 LYS HD3 . 25249 1
351 . 1 1 52 52 LYS CA C 13 56.119 0.3 . 1 . . . . 52 LYS CA . 25249 1
352 . 1 1 52 52 LYS CB C 13 30.693 0.3 . 1 . . . . 52 LYS CB . 25249 1
353 . 1 1 52 52 LYS CG C 13 24.941 0.3 . 1 . . . . 52 LYS CG . 25249 1
354 . 1 1 52 52 LYS CD C 13 29.126 0.3 . 1 . . . . 52 LYS CD . 25249 1
355 . 1 1 53 53 LYS HA H 1 4.757 0.020 . 1 . . . . 53 LYS HA . 25249 1
356 . 1 1 53 53 LYS HB2 H 1 1.280 0.020 . 1 . . . . 53 LYS HB2 . 25249 1
357 . 1 1 53 53 LYS CA C 13 54.068 0.3 . 1 . . . . 53 LYS CA . 25249 1
358 . 1 1 53 53 LYS CB C 13 36.679 0.3 . 1 . . . . 53 LYS CB . 25249 1
359 . 1 1 53 53 LYS N N 15 118.006 0.3 . 1 . . . . 53 LYS N . 25249 1
360 . 1 1 54 54 CYS HA H 1 4.119 0.020 . 1 . . . . 54 CYS HA . 25249 1
361 . 1 1 54 54 CYS HB2 H 1 2.831 0.020 . 2 . . . . 54 CYS HB2 . 25249 1
362 . 1 1 54 54 CYS HB3 H 1 3.068 0.020 . 2 . . . . 54 CYS HB3 . 25249 1
363 . 1 1 54 54 CYS CA C 13 56.870 0.3 . 1 . . . . 54 CYS CA . 25249 1
364 . 1 1 54 54 CYS CB C 13 31.429 0.3 . 1 . . . . 54 CYS CB . 25249 1
365 . 1 1 54 54 CYS N N 15 123.251 0.3 . 1 . . . . 54 CYS N . 25249 1
366 . 1 1 58 58 ARG HA H 1 3.968 0.020 . 1 . . . . 58 ARG HA . 25249 1
367 . 1 1 58 58 ARG HB2 H 1 1.940 0.020 . 2 . . . . 58 ARG HB2 . 25249 1
368 . 1 1 58 58 ARG HB3 H 1 1.423 0.020 . 2 . . . . 58 ARG HB3 . 25249 1
369 . 1 1 58 58 ARG HG3 H 1 3.064 0.020 . 1 . . . . 58 ARG HG3 . 25249 1
370 . 1 1 58 58 ARG CA C 13 57.469 0.3 . 1 . . . . 58 ARG CA . 25249 1
371 . 1 1 58 58 ARG CB C 13 26.688 0.3 . 1 . . . . 58 ARG CB . 25249 1
372 . 1 1 58 58 ARG CG C 13 31.399 0.3 . 1 . . . . 58 ARG CG . 25249 1
373 . 1 1 58 58 ARG N N 15 115.933 0.3 . 1 . . . . 58 ARG N . 25249 1
374 . 1 1 59 59 VAL HA H 1 4.057 0.020 . 1 . . . . 59 VAL HA . 25249 1
375 . 1 1 59 59 VAL HB H 1 2.046 0.020 . 1 . . . . 59 VAL HB . 25249 1
376 . 1 1 59 59 VAL CA C 13 62.783 0.3 . 1 . . . . 59 VAL CA . 25249 1
377 . 1 1 59 59 VAL CB C 13 32.653 0.3 . 1 . . . . 59 VAL CB . 25249 1
378 . 1 1 59 59 VAL CG2 C 13 21.091 0.3 . 1 . . . . 59 VAL CG2 . 25249 1
379 . 1 1 59 59 VAL N N 15 118.898 0.3 . 1 . . . . 59 VAL N . 25249 1
380 . 1 1 60 60 ASP HA H 1 4.596 0.020 . 1 . . . . 60 ASP HA . 25249 1
381 . 1 1 60 60 ASP HB2 H 1 2.467 0.020 . 2 . . . . 60 ASP HB2 . 25249 1
382 . 1 1 60 60 ASP HB3 H 1 2.696 0.020 . 2 . . . . 60 ASP HB3 . 25249 1
383 . 1 1 60 60 ASP CA C 13 55.269 0.3 . 1 . . . . 60 ASP CA . 25249 1
384 . 1 1 60 60 ASP CB C 13 41.612 0.3 . 1 . . . . 60 ASP CB . 25249 1
385 . 1 1 60 60 ASP N N 15 125.485 0.3 . 1 . . . . 60 ASP N . 25249 1
386 . 1 1 61 61 ILE HA H 1 4.110 0.020 . 1 . . . . 61 ILE HA . 25249 1
387 . 1 1 61 61 ILE HB H 1 1.808 0.020 . 1 . . . . 61 ILE HB . 25249 1
388 . 1 1 61 61 ILE HG12 H 1 1.311 0.020 . 2 . . . . 61 ILE HG12 . 25249 1
389 . 1 1 61 61 ILE HG13 H 1 1.129 0.020 . 2 . . . . 61 ILE HG13 . 25249 1
390 . 1 1 61 61 ILE CA C 13 61.567 0.3 . 1 . . . . 61 ILE CA . 25249 1
391 . 1 1 61 61 ILE CB C 13 38.191 0.3 . 1 . . . . 61 ILE CB . 25249 1
392 . 1 1 61 61 ILE CG1 C 13 26.770 0.3 . 1 . . . . 61 ILE CG1 . 25249 1
393 . 1 1 61 61 ILE CG2 C 13 18.157 0.3 . 1 . . . . 61 ILE CG2 . 25249 1
394 . 1 1 61 61 ILE CD1 C 13 13.940 0.3 . 1 . . . . 61 ILE CD1 . 25249 1
395 . 1 1 61 61 ILE N N 15 119.985 0.3 . 1 . . . . 61 ILE N . 25249 1
396 . 1 1 62 62 GLU HA H 1 4.266 0.020 . 1 . . . . 62 GLU HA . 25249 1
397 . 1 1 62 62 GLU HB2 H 1 2.013 0.020 . 2 . . . . 62 GLU HB2 . 25249 1
398 . 1 1 62 62 GLU HB3 H 1 1.873 0.020 . 2 . . . . 62 GLU HB3 . 25249 1
399 . 1 1 62 62 GLU CA C 13 55.943 0.3 . 1 . . . . 62 GLU CA . 25249 1
400 . 1 1 62 62 GLU CB C 13 30.355 0.3 . 1 . . . . 62 GLU CB . 25249 1
401 . 1 1 62 62 GLU N N 15 122.512 0.3 . 1 . . . . 62 GLU N . 25249 1
402 . 1 1 63 63 ALA HA H 1 4.208 0.020 . 1 . . . . 63 ALA HA . 25249 1
403 . 1 1 63 63 ALA CA C 13 52.355 0.3 . 1 . . . . 63 ALA CA . 25249 1
404 . 1 1 63 63 ALA CB C 13 19.209 0.3 . 1 . . . . 63 ALA CB . 25249 1
405 . 1 1 63 63 ALA N N 15 124.328 0.3 . 1 . . . . 63 ALA N . 25249 1
406 . 1 1 64 64 GLN HA H 1 4.266 0.020 . 1 . . . . 64 GLN HA . 25249 1
407 . 1 1 64 64 GLN HB2 H 1 1.893 0.020 . 2 . . . . 64 GLN HB2 . 25249 1
408 . 1 1 64 64 GLN HB3 H 1 2.295 0.020 . 2 . . . . 64 GLN HB3 . 25249 1
409 . 1 1 64 64 GLN CA C 13 55.186 0.3 . 1 . . . . 64 GLN CA . 25249 1
410 . 1 1 64 64 GLN CB C 13 29.491 0.3 . 1 . . . . 64 GLN CB . 25249 1
411 . 1 1 64 64 GLN N N 15 119.250 0.3 . 1 . . . . 64 GLN N . 25249 1
412 . 1 1 65 65 LEU HA H 1 4.547 0.020 . 1 . . . . 65 LEU HA . 25249 1
413 . 1 1 65 65 LEU CA C 13 52.920 0.3 . 1 . . . . 65 LEU CA . 25249 1
414 . 1 1 65 65 LEU N N 15 124.973 0.3 . 1 . . . . 65 LEU N . 25249 1
415 . 1 1 67 67 SER HA H 1 4.443 0.020 . 1 . . . . 67 SER HA . 25249 1
416 . 1 1 67 67 SER CA C 13 58.228 0.3 . 1 . . . . 67 SER CA . 25249 1
417 . 1 1 67 67 SER CB C 13 63.859 0.3 . 1 . . . . 67 SER CB . 25249 1
418 . 1 1 67 67 SER N N 15 115.998 0.3 . 1 . . . . 67 SER N . 25249 1
419 . 1 1 68 68 GLU HA H 1 4.450 0.020 . 1 . . . . 68 GLU HA . 25249 1
420 . 1 1 68 68 GLU CA C 13 55.433 0.3 . 1 . . . . 68 GLU CA . 25249 1
421 . 1 1 68 68 GLU N N 15 122.021 0.3 . 1 . . . . 68 GLU N . 25249 1
stop_
save_