###################################
# 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 18531
_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 '3D [13C,15N]-resolved NOESY' . . . 18531 1
2 '3D [15N]-resolved NOESY' . . . 18531 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 4.13 0.04 . 1 . . . A 1 MET HA . 18531 1
2 . 1 1 1 1 MET HB2 H 1 2.03 0.04 . 2 . . . A 1 MET HB2 . 18531 1
3 . 1 1 1 1 MET HB3 H 1 2.06 0.04 . 2 . . . A 1 MET HB3 . 18531 1
4 . 1 1 1 1 MET HG2 H 1 2.09 0.04 . 2 . . . A 1 MET HG2 . 18531 1
5 . 1 1 1 1 MET HG3 H 1 2.09 0.04 . 2 . . . A 1 MET HG3 . 18531 1
6 . 1 1 1 1 MET H H 1 8.26 0.04 . 1 . . . A 1 MET H1 . 18531 1
7 . 1 1 1 1 MET CA C 13 54.5 0.10 . 1 . . . A 1 MET CA . 18531 1
8 . 1 1 1 1 MET CB C 13 29.1 0.10 . 1 . . . A 1 MET CB . 18531 1
9 . 1 1 1 1 MET CG C 13 32.2 0.10 . 1 . . . A 1 MET CG . 18531 1
10 . 1 1 2 2 GLN H H 1 8.41 0.04 . 1 . . . A 2 GLN H . 18531 1
11 . 1 1 2 2 GLN HA H 1 5.05 0.04 . 1 . . . A 2 GLN HA . 18531 1
12 . 1 1 2 2 GLN HB2 H 1 1.89 0.04 . 2 . . . A 2 GLN HB2 . 18531 1
13 . 1 1 2 2 GLN HB3 H 1 2.01 0.04 . 2 . . . A 2 GLN HB3 . 18531 1
14 . 1 1 2 2 GLN HG2 H 1 2.23 0.04 . 2 . . . A 2 GLN HG2 . 18531 1
15 . 1 1 2 2 GLN HG3 H 1 2.23 0.04 . 2 . . . A 2 GLN HG3 . 18531 1
16 . 1 1 2 2 GLN HE21 H 1 7.62 0.04 . 2 . . . A 2 GLN HE21 . 18531 1
17 . 1 1 2 2 GLN HE22 H 1 6.98 0.04 . 2 . . . A 2 GLN HE22 . 18531 1
18 . 1 1 2 2 GLN CA C 13 55.6 0.10 . 1 . . . A 2 GLN CA . 18531 1
19 . 1 1 2 2 GLN CB C 13 30.7 0.10 . 1 . . . A 2 GLN CB . 18531 1
20 . 1 1 2 2 GLN CG C 13 34.8 0.10 . 1 . . . A 2 GLN CG . 18531 1
21 . 1 1 3 3 TYR H H 1 9.07 0.04 . 1 . . . A 3 TYR H . 18531 1
22 . 1 1 3 3 TYR HA H 1 5.36 0.04 . 1 . . . A 3 TYR HA . 18531 1
23 . 1 1 3 3 TYR HB2 H 1 3.42 0.04 . 2 . . . A 3 TYR HB2 . 18531 1
24 . 1 1 3 3 TYR HB3 H 1 2.73 0.04 . 2 . . . A 3 TYR HB3 . 18531 1
25 . 1 1 3 3 TYR HD1 H 1 7.10 0.04 . 1 . . . A 3 TYR HD1 . 18531 1
26 . 1 1 3 3 TYR HD2 H 1 7.10 0.04 . 1 . . . A 3 TYR HD2 . 18531 1
27 . 1 1 3 3 TYR HE1 H 1 7.09 0.04 . 1 . . . A 3 TYR HE1 . 18531 1
28 . 1 1 3 3 TYR HE2 H 1 7.10 0.04 . 1 . . . A 3 TYR HE2 . 18531 1
29 . 1 1 3 3 TYR CA C 13 57.1 0.10 . 1 . . . A 3 TYR CA . 18531 1
30 . 1 1 3 3 TYR CB C 13 43.6 0.10 . 1 . . . A 3 TYR CB . 18531 1
31 . 1 1 3 3 TYR CD1 C 13 132.3 0.10 . 1 . . . A 3 TYR CD1 . 18531 1
32 . 1 1 3 3 TYR CD2 C 13 132.5 0.10 . 1 . . . A 3 TYR CD2 . 18531 1
33 . 1 1 3 3 TYR CE1 C 13 117.9 0.10 . 1 . . . A 3 TYR CE1 . 18531 1
34 . 1 1 3 3 TYR CE2 C 13 117.8 0.10 . 1 . . . A 3 TYR CE2 . 18531 1
35 . 1 1 3 3 TYR N N 15 124.0 0.10 . 1 . . . A 3 TYR N . 18531 1
36 . 1 1 4 4 LYS H H 1 9.10 0.04 . 1 . . . A 4 LYS H . 18531 1
37 . 1 1 4 4 LYS HA H 1 5.22 0.04 . 1 . . . A 4 LYS HA . 18531 1
38 . 1 1 4 4 LYS HB2 H 1 2.02 0.04 . 2 . . . A 4 LYS HB2 . 18531 1
39 . 1 1 4 4 LYS HB3 H 1 1.87 0.04 . 2 . . . A 4 LYS HB3 . 18531 1
40 . 1 1 4 4 LYS HG2 H 1 1.46 0.04 . 2 . . . A 4 LYS HG2 . 18531 1
41 . 1 1 4 4 LYS HG3 H 1 1.23 0.04 . 2 . . . A 4 LYS HG3 . 18531 1
42 . 1 1 4 4 LYS HD2 H 1 1.40 0.04 . 2 . . . A 4 LYS HD2 . 18531 1
43 . 1 1 4 4 LYS HD3 H 1 1.40 0.04 . 2 . . . A 4 LYS HD3 . 18531 1
44 . 1 1 4 4 LYS HE2 H 1 2.97 0.04 . 2 . . . A 4 LYS HE2 . 18531 1
45 . 1 1 4 4 LYS HE3 H 1 2.96 0.04 . 2 . . . A 4 LYS HE3 . 18531 1
46 . 1 1 4 4 LYS CA C 13 55.0 0.10 . 1 . . . A 4 LYS CA . 18531 1
47 . 1 1 4 4 LYS CB C 13 36.0 0.10 . 1 . . . A 4 LYS CB . 18531 1
48 . 1 1 4 4 LYS CG C 13 25.5 0.10 . 1 . . . A 4 LYS CG . 18531 1
49 . 1 1 4 4 LYS CD C 13 28.2 0.10 . 1 . . . A 4 LYS CD . 18531 1
50 . 1 1 4 4 LYS N N 15 122.5 0.10 . 1 . . . A 4 LYS N . 18531 1
51 . 1 1 5 5 LEU H H 1 8.62 0.04 . 1 . . . A 5 LEU H . 18531 1
52 . 1 1 5 5 LEU HA H 1 4.97 0.04 . 1 . . . A 5 LEU HA . 18531 1
53 . 1 1 5 5 LEU HB2 H 1 0.76 0.04 . 2 . . . A 5 LEU HB2 . 18531 1
54 . 1 1 5 5 LEU HB3 H 1 -1.20 0.04 . 2 . . . A 5 LEU HB3 . 18531 1
55 . 1 1 5 5 LEU HG H 1 0.85 0.04 . 1 . . . A 5 LEU HG . 18531 1
56 . 1 1 5 5 LEU HD11 H 1 0.46 0.04 . 2 . . . A 5 LEU HD11 . 18531 1
57 . 1 1 5 5 LEU HD12 H 1 0.46 0.04 . 2 . . . A 5 LEU HD12 . 18531 1
58 . 1 1 5 5 LEU HD13 H 1 0.46 0.04 . 2 . . . A 5 LEU HD13 . 18531 1
59 . 1 1 5 5 LEU HD21 H 1 0.50 0.04 . 2 . . . A 5 LEU HD21 . 18531 1
60 . 1 1 5 5 LEU HD22 H 1 0.50 0.04 . 2 . . . A 5 LEU HD22 . 18531 1
61 . 1 1 5 5 LEU HD23 H 1 0.50 0.04 . 2 . . . A 5 LEU HD23 . 18531 1
62 . 1 1 5 5 LEU CA C 13 52.8 0.10 . 1 . . . A 5 LEU CA . 18531 1
63 . 1 1 5 5 LEU CB C 13 42.6 0.10 . 1 . . . A 5 LEU CB . 18531 1
64 . 1 1 5 5 LEU CG C 13 27.1 0.10 . 1 . . . A 5 LEU CG . 18531 1
65 . 1 1 5 5 LEU CD1 C 13 24.5 0.10 . 1 . . . A 5 LEU CD1 . 18531 1
66 . 1 1 5 5 LEU CD2 C 13 25.5 0.10 . 1 . . . A 5 LEU CD2 . 18531 1
67 . 1 1 5 5 LEU N N 15 126.4 0.10 . 1 . . . A 5 LEU N . 18531 1
68 . 1 1 6 6 VAL H H 1 9.19 0.04 . 1 . . . A 6 VAL H . 18531 1
69 . 1 1 6 6 VAL HA H 1 4.16 0.04 . 1 . . . A 6 VAL HA . 18531 1
70 . 1 1 6 6 VAL HB H 1 2.06 0.04 . 1 . . . A 6 VAL HB . 18531 1
71 . 1 1 6 6 VAL HG11 H 1 0.83 0.04 . 2 . . . A 6 VAL HG11 . 18531 1
72 . 1 1 6 6 VAL HG12 H 1 0.83 0.04 . 2 . . . A 6 VAL HG12 . 18531 1
73 . 1 1 6 6 VAL HG13 H 1 0.83 0.04 . 2 . . . A 6 VAL HG13 . 18531 1
74 . 1 1 6 6 VAL HG21 H 1 0.82 0.04 . 2 . . . A 6 VAL HG21 . 18531 1
75 . 1 1 6 6 VAL HG22 H 1 0.82 0.04 . 2 . . . A 6 VAL HG22 . 18531 1
76 . 1 1 6 6 VAL HG23 H 1 0.82 0.04 . 2 . . . A 6 VAL HG23 . 18531 1
77 . 1 1 6 6 VAL CA C 13 62.3 0.10 . 1 . . . A 6 VAL CA . 18531 1
78 . 1 1 6 6 VAL CB C 13 32.7 0.10 . 1 . . . A 6 VAL CB . 18531 1
79 . 1 1 6 6 VAL CG1 C 13 21.3 0.10 . 1 . . . A 6 VAL CG1 . 18531 1
80 . 1 1 6 6 VAL CG2 C 13 21.3 0.10 . 1 . . . A 6 VAL CG2 . 18531 1
81 . 1 1 6 6 VAL N N 15 127.0 0.10 . 1 . . . A 6 VAL N . 18531 1
82 . 1 1 7 7 ILE H H 1 8.80 0.04 . 1 . . . A 7 ILE H . 18531 1
83 . 1 1 7 7 ILE HA H 1 4.09 0.04 . 1 . . . A 7 ILE HA . 18531 1
84 . 1 1 7 7 ILE HB H 1 1.53 0.04 . 1 . . . A 7 ILE HB . 18531 1
85 . 1 1 7 7 ILE HG12 H 1 1.31 0.04 . 2 . . . A 7 ILE HG12 . 18531 1
86 . 1 1 7 7 ILE HG13 H 1 0.57 0.04 . 2 . . . A 7 ILE HG13 . 18531 1
87 . 1 1 7 7 ILE HG21 H 1 0.70 0.04 . 1 . . . A 7 ILE HG21 . 18531 1
88 . 1 1 7 7 ILE HG22 H 1 0.70 0.04 . 1 . . . A 7 ILE HG22 . 18531 1
89 . 1 1 7 7 ILE HG23 H 1 0.70 0.04 . 1 . . . A 7 ILE HG23 . 18531 1
90 . 1 1 7 7 ILE HD11 H 1 0.75 0.04 . 1 . . . A 7 ILE HD11 . 18531 1
91 . 1 1 7 7 ILE HD12 H 1 0.75 0.04 . 1 . . . A 7 ILE HD12 . 18531 1
92 . 1 1 7 7 ILE HD13 H 1 0.75 0.04 . 1 . . . A 7 ILE HD13 . 18531 1
93 . 1 1 7 7 ILE CA C 13 60.7 0.10 . 1 . . . A 7 ILE CA . 18531 1
94 . 1 1 7 7 ILE CB C 13 39.0 0.10 . 1 . . . A 7 ILE CB . 18531 1
95 . 1 1 7 7 ILE CG1 C 13 27.7 0.10 . 1 . . . A 7 ILE CG1 . 18531 1
96 . 1 1 7 7 ILE CG2 C 13 18.3 0.10 . 1 . . . A 7 ILE CG2 . 18531 1
97 . 1 1 7 7 ILE CD1 C 13 14.6 0.10 . 1 . . . A 7 ILE CD1 . 18531 1
98 . 1 1 7 7 ILE N N 15 125.4 0.10 . 1 . . . A 7 ILE N . 18531 1
99 . 1 1 8 8 ASN H H 1 8.99 0.04 . 1 . . . A 8 ASN H . 18531 1
100 . 1 1 8 8 ASN HA H 1 5.28 0.04 . 1 . . . A 8 ASN HA . 18531 1
101 . 1 1 8 8 ASN HB2 H 1 2.95 0.04 . 2 . . . A 8 ASN HB2 . 18531 1
102 . 1 1 8 8 ASN HB3 H 1 2.51 0.04 . 2 . . . A 8 ASN HB3 . 18531 1
103 . 1 1 8 8 ASN HD21 H 1 7.20 0.04 . 2 . . . A 8 ASN HD21 . 18531 1
104 . 1 1 8 8 ASN HD22 H 1 6.80 0.04 . 2 . . . A 8 ASN HD22 . 18531 1
105 . 1 1 8 8 ASN CA C 13 50.8 0.10 . 1 . . . A 8 ASN CA . 18531 1
106 . 1 1 8 8 ASN CB C 13 38.1 0.10 . 1 . . . A 8 ASN CB . 18531 1
107 . 1 1 8 8 ASN N N 15 128.9 0.10 . 1 . . . A 8 ASN N . 18531 1
108 . 1 1 9 9 GLY H H 1 7.92 0.04 . 1 . . . A 9 GLY H . 18531 1
109 . 1 1 9 9 GLY HA2 H 1 4.43 0.04 . 2 . . . A 9 GLY HA2 . 18531 1
110 . 1 1 9 9 GLY HA3 H 1 4.06 0.04 . 2 . . . A 9 GLY HA3 . 18531 1
111 . 1 1 9 9 GLY CA C 13 44.7 0.10 . 1 . . . A 9 GLY CA . 18531 1
112 . 1 1 9 9 GLY N N 15 110.2 0.10 . 1 . . . A 9 GLY N . 18531 1
113 . 1 1 10 10 LYS H H 1 9.52 0.04 . 1 . . . A 10 LYS H . 18531 1
114 . 1 1 10 10 LYS HA H 1 4.06 0.04 . 1 . . . A 10 LYS HA . 18531 1
115 . 1 1 10 10 LYS HB2 H 1 1.81 0.04 . 2 . . . A 10 LYS HB2 . 18531 1
116 . 1 1 10 10 LYS HB3 H 1 1.81 0.04 . 2 . . . A 10 LYS HB3 . 18531 1
117 . 1 1 10 10 LYS HG2 H 1 1.46 0.04 . 2 . . . A 10 LYS HG2 . 18531 1
118 . 1 1 10 10 LYS HG3 H 1 1.46 0.04 . 2 . . . A 10 LYS HG3 . 18531 1
119 . 1 1 10 10 LYS HD2 H 1 1.76 0.04 . 2 . . . A 10 LYS HD2 . 18531 1
120 . 1 1 10 10 LYS HD3 H 1 1.46 0.04 . 2 . . . A 10 LYS HD3 . 18531 1
121 . 1 1 10 10 LYS HE2 H 1 2.93 0.04 . 2 . . . A 10 LYS HE2 . 18531 1
122 . 1 1 10 10 LYS HE3 H 1 2.93 0.04 . 2 . . . A 10 LYS HE3 . 18531 1
123 . 1 1 10 10 LYS CA C 13 59.2 0.10 . 1 . . . A 10 LYS CA . 18531 1
124 . 1 1 10 10 LYS CB C 13 32.9 0.10 . 1 . . . A 10 LYS CB . 18531 1
125 . 1 1 10 10 LYS CG C 13 25.6 0.10 . 1 . . . A 10 LYS CG . 18531 1
126 . 1 1 10 10 LYS CD C 13 29.1 0.10 . 1 . . . A 10 LYS CD . 18531 1
127 . 1 1 10 10 LYS N N 15 120.7 0.10 . 1 . . . A 10 LYS N . 18531 1
128 . 1 1 11 11 THR H H 1 8.79 0.04 . 1 . . . A 11 THR H . 18531 1
129 . 1 1 11 11 THR HA H 1 4.36 0.04 . 1 . . . A 11 THR HA . 18531 1
130 . 1 1 11 11 THR HB H 1 4.19 0.04 . 1 . . . A 11 THR HB . 18531 1
131 . 1 1 11 11 THR HG21 H 1 1.12 0.04 . 1 . . . A 11 THR HG21 . 18531 1
132 . 1 1 11 11 THR HG22 H 1 1.12 0.04 . 1 . . . A 11 THR HG22 . 18531 1
133 . 1 1 11 11 THR HG23 H 1 1.12 0.04 . 1 . . . A 11 THR HG23 . 18531 1
134 . 1 1 11 11 THR CA C 13 62.0 0.10 . 1 . . . A 11 THR CA . 18531 1
135 . 1 1 11 11 THR CB C 13 69.8 0.10 . 1 . . . A 11 THR CB . 18531 1
136 . 1 1 11 11 THR CG2 C 13 21.9 0.10 . 1 . . . A 11 THR CG2 . 18531 1
137 . 1 1 11 11 THR N N 15 108.9 0.10 . 1 . . . A 11 THR N . 18531 1
138 . 1 1 12 12 LEU H H 1 7.58 0.04 . 1 . . . A 12 LEU H . 18531 1
139 . 1 1 12 12 LEU HA H 1 4.44 0.04 . 1 . . . A 12 LEU HA . 18531 1
140 . 1 1 12 12 LEU HB2 H 1 1.57 0.04 . 2 . . . A 12 LEU HB2 . 18531 1
141 . 1 1 12 12 LEU HB3 H 1 1.37 0.04 . 2 . . . A 12 LEU HB3 . 18531 1
142 . 1 1 12 12 LEU HG H 1 1.32 0.04 . 1 . . . A 12 LEU HG . 18531 1
143 . 1 1 12 12 LEU HD11 H 1 0.87 0.04 . 2 . . . A 12 LEU HD11 . 18531 1
144 . 1 1 12 12 LEU HD12 H 1 0.87 0.04 . 2 . . . A 12 LEU HD12 . 18531 1
145 . 1 1 12 12 LEU HD13 H 1 0.87 0.04 . 2 . . . A 12 LEU HD13 . 18531 1
146 . 1 1 12 12 LEU HD21 H 1 0.78 0.04 . 2 . . . A 12 LEU HD21 . 18531 1
147 . 1 1 12 12 LEU HD22 H 1 0.78 0.04 . 2 . . . A 12 LEU HD22 . 18531 1
148 . 1 1 12 12 LEU HD23 H 1 0.78 0.04 . 2 . . . A 12 LEU HD23 . 18531 1
149 . 1 1 12 12 LEU CA C 13 55.0 0.10 . 1 . . . A 12 LEU CA . 18531 1
150 . 1 1 12 12 LEU CB C 13 43.3 0.10 . 1 . . . A 12 LEU CB . 18531 1
151 . 1 1 12 12 LEU CG C 13 27.5 0.10 . 1 . . . A 12 LEU CG . 18531 1
152 . 1 1 12 12 LEU CD1 C 13 25.0 0.10 . 1 . . . A 12 LEU CD1 . 18531 1
153 . 1 1 12 12 LEU CD2 C 13 23.7 0.10 . 1 . . . A 12 LEU CD2 . 18531 1
154 . 1 1 12 12 LEU N N 15 125.7 0.10 . 1 . . . A 12 LEU N . 18531 1
155 . 1 1 13 13 LYS H H 1 8.14 0.04 . 1 . . . A 13 LYS H . 18531 1
156 . 1 1 13 13 LYS HA H 1 5.12 0.04 . 1 . . . A 13 LYS HA . 18531 1
157 . 1 1 13 13 LYS HB2 H 1 1.87 0.04 . 2 . . . A 13 LYS HB2 . 18531 1
158 . 1 1 13 13 LYS HB3 H 1 1.72 0.04 . 2 . . . A 13 LYS HB3 . 18531 1
159 . 1 1 13 13 LYS HG2 H 1 1.42 0.04 . 2 . . . A 13 LYS HG2 . 18531 1
160 . 1 1 13 13 LYS HG3 H 1 1.43 0.04 . 2 . . . A 13 LYS HG3 . 18531 1
161 . 1 1 13 13 LYS HD2 H 1 1.75 0.04 . 2 . . . A 13 LYS HD2 . 18531 1
162 . 1 1 13 13 LYS HD3 H 1 1.75 0.04 . 2 . . . A 13 LYS HD3 . 18531 1
163 . 1 1 13 13 LYS HE2 H 1 2.93 0.04 . 2 . . . A 13 LYS HE2 . 18531 1
164 . 1 1 13 13 LYS HE3 H 1 2.93 0.04 . 2 . . . A 13 LYS HE3 . 18531 1
165 . 1 1 13 13 LYS CA C 13 53.9 0.10 . 1 . . . A 13 LYS CA . 18531 1
166 . 1 1 13 13 LYS CB C 13 34.8 0.10 . 1 . . . A 13 LYS CB . 18531 1
167 . 1 1 13 13 LYS CG C 13 25.2 0.10 . 1 . . . A 13 LYS CG . 18531 1
168 . 1 1 13 13 LYS CD C 13 29.2 0.10 . 1 . . . A 13 LYS CD . 18531 1
169 . 1 1 13 13 LYS N N 15 123.5 0.10 . 1 . . . A 13 LYS N . 18531 1
170 . 1 1 14 14 GLY H H 1 8.34 0.04 . 1 . . . A 14 GLY H . 18531 1
171 . 1 1 14 14 GLY HA2 H 1 4.23 0.04 . 2 . . . A 14 GLY HA2 . 18531 1
172 . 1 1 14 14 GLY HA3 H 1 4.14 0.04 . 2 . . . A 14 GLY HA3 . 18531 1
173 . 1 1 14 14 GLY CA C 13 45.2 0.10 . 1 . . . A 14 GLY CA . 18531 1
174 . 1 1 14 14 GLY N N 15 109.1 0.10 . 1 . . . A 14 GLY N . 18531 1
175 . 1 1 15 15 GLU H H 1 8.39 0.04 . 1 . . . A 15 GLU H . 18531 1
176 . 1 1 15 15 GLU HA H 1 5.60 0.04 . 1 . . . A 15 GLU HA . 18531 1
177 . 1 1 15 15 GLU HB2 H 1 2.03 0.04 . 2 . . . A 15 GLU HB2 . 18531 1
178 . 1 1 15 15 GLU HB3 H 1 1.91 0.04 . 2 . . . A 15 GLU HB3 . 18531 1
179 . 1 1 15 15 GLU HG2 H 1 2.15 0.04 . 2 . . . A 15 GLU HG2 . 18531 1
180 . 1 1 15 15 GLU HG3 H 1 2.15 0.04 . 2 . . . A 15 GLU HG3 . 18531 1
181 . 1 1 15 15 GLU CA C 13 54.5 0.10 . 1 . . . A 15 GLU CA . 18531 1
182 . 1 1 15 15 GLU CB C 13 33.8 0.10 . 1 . . . A 15 GLU CB . 18531 1
183 . 1 1 15 15 GLU CG C 13 36.0 0.10 . 1 . . . A 15 GLU CG . 18531 1
184 . 1 1 15 15 GLU N N 15 118.2 0.10 . 1 . . . A 15 GLU N . 18531 1
185 . 1 1 16 16 THR H H 1 8.82 0.04 . 1 . . . A 16 THR H . 18531 1
186 . 1 1 16 16 THR HA H 1 4.73 0.04 . 1 . . . A 16 THR HA . 18531 1
187 . 1 1 16 16 THR HB H 1 3.93 0.04 . 1 . . . A 16 THR HB . 18531 1
188 . 1 1 16 16 THR HG21 H 1 0.46 0.04 . 1 . . . A 16 THR HG21 . 18531 1
189 . 1 1 16 16 THR HG22 H 1 0.46 0.04 . 1 . . . A 16 THR HG22 . 18531 1
190 . 1 1 16 16 THR HG23 H 1 0.46 0.04 . 1 . . . A 16 THR HG23 . 18531 1
191 . 1 1 16 16 THR CA C 13 60.6 0.10 . 1 . . . A 16 THR CA . 18531 1
192 . 1 1 16 16 THR CB C 13 69.5 0.10 . 1 . . . A 16 THR CB . 18531 1
193 . 1 1 16 16 THR CG2 C 13 19.3 0.10 . 1 . . . A 16 THR CG2 . 18531 1
194 . 1 1 16 16 THR N N 15 115.6 0.10 . 1 . . . A 16 THR N . 18531 1
195 . 1 1 17 17 THR H H 1 8.14 0.04 . 1 . . . A 17 THR H . 18531 1
196 . 1 1 17 17 THR HA H 1 5.79 0.04 . 1 . . . A 17 THR HA . 18531 1
197 . 1 1 17 17 THR HB H 1 4.28 0.04 . 1 . . . A 17 THR HB . 18531 1
198 . 1 1 17 17 THR HG21 H 1 1.20 0.04 . 1 . . . A 17 THR HG21 . 18531 1
199 . 1 1 17 17 THR HG22 H 1 1.20 0.04 . 1 . . . A 17 THR HG22 . 18531 1
200 . 1 1 17 17 THR HG23 H 1 1.20 0.04 . 1 . . . A 17 THR HG23 . 18531 1
201 . 1 1 17 17 THR CA C 13 59.8 0.10 . 1 . . . A 17 THR CA . 18531 1
202 . 1 1 17 17 THR CB C 13 73.1 0.10 . 1 . . . A 17 THR CB . 18531 1
203 . 1 1 17 17 THR CG2 C 13 21.4 0.10 . 1 . . . A 17 THR CG2 . 18531 1
204 . 1 1 17 17 THR N N 15 111.8 0.10 . 1 . . . A 17 THR N . 18531 1
205 . 1 1 18 18 THR H H 1 8.93 0.04 . 1 . . . A 18 THR H . 18531 1
206 . 1 1 18 18 THR HA H 1 4.64 0.04 . 1 . . . A 18 THR HA . 18531 1
207 . 1 1 18 18 THR HB H 1 3.78 0.04 . 1 . . . A 18 THR HB . 18531 1
208 . 1 1 18 18 THR HG21 H 1 0.43 0.04 . 1 . . . A 18 THR HG21 . 18531 1
209 . 1 1 18 18 THR HG22 H 1 0.43 0.04 . 1 . . . A 18 THR HG22 . 18531 1
210 . 1 1 18 18 THR HG23 H 1 0.43 0.04 . 1 . . . A 18 THR HG23 . 18531 1
211 . 1 1 18 18 THR CA C 13 61.9 0.10 . 1 . . . A 18 THR CA . 18531 1
212 . 1 1 18 18 THR CB C 13 70.0 0.10 . 1 . . . A 18 THR CB . 18531 1
213 . 1 1 18 18 THR CG2 C 13 19.3 0.10 . 1 . . . A 18 THR CG2 . 18531 1
214 . 1 1 18 18 THR N N 15 115.1 0.10 . 1 . . . A 18 THR N . 18531 1
215 . 1 1 19 19 LYS H H 1 7.95 0.04 . 1 . . . A 19 LYS H . 18531 1
216 . 1 1 19 19 LYS HA H 1 5.33 0.04 . 1 . . . A 19 LYS HA . 18531 1
217 . 1 1 19 19 LYS HB2 H 1 1.72 0.04 . 2 . . . A 19 LYS HB2 . 18531 1
218 . 1 1 19 19 LYS HB3 H 1 1.72 0.04 . 2 . . . A 19 LYS HB3 . 18531 1
219 . 1 1 19 19 LYS HG2 H 1 1.24 0.04 . 2 . . . A 19 LYS HG2 . 18531 1
220 . 1 1 19 19 LYS HG3 H 1 1.47 0.04 . 2 . . . A 19 LYS HG3 . 18531 1
221 . 1 1 19 19 LYS HD2 H 1 1.65 0.04 . 2 . . . A 19 LYS HD2 . 18531 1
222 . 1 1 19 19 LYS HD3 H 1 1.65 0.04 . 2 . . . A 19 LYS HD3 . 18531 1
223 . 1 1 19 19 LYS HE2 H 1 2.93 0.04 . 2 . . . A 19 LYS HE2 . 18531 1
224 . 1 1 19 19 LYS HE3 H 1 2.93 0.04 . 2 . . . A 19 LYS HE3 . 18531 1
225 . 1 1 19 19 LYS CA C 13 55.0 0.10 . 1 . . . A 19 LYS CA . 18531 1
226 . 1 1 19 19 LYS CB C 13 33.8 0.10 . 1 . . . A 19 LYS CB . 18531 1
227 . 1 1 19 19 LYS CG C 13 25.1 0.10 . 1 . . . A 19 LYS CG . 18531 1
228 . 1 1 19 19 LYS CD C 13 29.3 0.10 . 1 . . . A 19 LYS CD . 18531 1
229 . 1 1 19 19 LYS N N 15 124.3 0.10 . 1 . . . A 19 LYS N . 18531 1
230 . 1 1 20 20 ALA H H 1 9.11 0.04 . 1 . . . A 20 ALA H . 18531 1
231 . 1 1 20 20 ALA HA H 1 4.78 0.04 . 1 . . . A 20 ALA HA . 18531 1
232 . 1 1 20 20 ALA HB1 H 1 1.33 0.04 . 1 . . . A 20 ALA HB1 . 18531 1
233 . 1 1 20 20 ALA HB2 H 1 1.33 0.04 . 1 . . . A 20 ALA HB2 . 18531 1
234 . 1 1 20 20 ALA HB3 H 1 1.33 0.04 . 1 . . . A 20 ALA HB3 . 18531 1
235 . 1 1 20 20 ALA CA C 13 50.9 0.10 . 1 . . . A 20 ALA CA . 18531 1
236 . 1 1 20 20 ALA CB C 13 23.8 0.10 . 1 . . . A 20 ALA CB . 18531 1
237 . 1 1 20 20 ALA N N 15 124.6 0.10 . 1 . . . A 20 ALA N . 18531 1
238 . 1 1 21 21 VAL H H 1 8.48 0.04 . 1 . . . A 21 VAL H . 18531 1
239 . 1 1 21 21 VAL HA H 1 4.11 0.04 . 1 . . . A 21 VAL HA . 18531 1
240 . 1 1 21 21 VAL HB H 1 2.18 0.04 . 1 . . . A 21 VAL HB . 18531 1
241 . 1 1 21 21 VAL HG11 H 1 0.97 0.04 . 2 . . . A 21 VAL HG11 . 18531 1
242 . 1 1 21 21 VAL HG12 H 1 0.97 0.04 . 2 . . . A 21 VAL HG12 . 18531 1
243 . 1 1 21 21 VAL HG13 H 1 0.97 0.04 . 2 . . . A 21 VAL HG13 . 18531 1
244 . 1 1 21 21 VAL HG21 H 1 0.97 0.04 . 2 . . . A 21 VAL HG21 . 18531 1
245 . 1 1 21 21 VAL HG22 H 1 0.97 0.04 . 2 . . . A 21 VAL HG22 . 18531 1
246 . 1 1 21 21 VAL HG23 H 1 0.97 0.04 . 2 . . . A 21 VAL HG23 . 18531 1
247 . 1 1 21 21 VAL CA C 13 63.3 0.10 . 1 . . . A 21 VAL CA . 18531 1
248 . 1 1 21 21 VAL CB C 13 32.2 0.10 . 1 . . . A 21 VAL CB . 18531 1
249 . 1 1 21 21 VAL CG1 C 13 20.0 0.10 . 1 . . . A 21 VAL CG1 . 18531 1
250 . 1 1 21 21 VAL CG2 C 13 20.0 0.10 . 1 . . . A 21 VAL CG2 . 18531 1
251 . 1 1 21 21 VAL N N 15 115.3 0.10 . 1 . . . A 21 VAL N . 18531 1
252 . 1 1 22 22 ASP H H 1 7.31 0.04 . 1 . . . A 22 ASP H . 18531 1
253 . 1 1 22 22 ASP HA H 1 4.71 0.04 . 1 . . . A 22 ASP HA . 18531 1
254 . 1 1 22 22 ASP HB2 H 1 2.94 0.04 . 2 . . . A 22 ASP HB2 . 18531 1
255 . 1 1 22 22 ASP HB3 H 1 3.09 0.04 . 2 . . . A 22 ASP HB3 . 18531 1
256 . 1 1 22 22 ASP CA C 13 52.4 0.10 . 1 . . . A 22 ASP CA . 18531 1
257 . 1 1 22 22 ASP CB C 13 42.2 0.10 . 1 . . . A 22 ASP CB . 18531 1
258 . 1 1 22 22 ASP N N 15 115.2 0.10 . 1 . . . A 22 ASP N . 18531 1
259 . 1 1 23 23 ALA H H 1 8.37 0.04 . 1 . . . A 23 ALA H . 18531 1
260 . 1 1 23 23 ALA HA H 1 3.34 0.04 . 1 . . . A 23 ALA HA . 18531 1
261 . 1 1 23 23 ALA HB1 H 1 1.17 0.04 . 1 . . . A 23 ALA HB1 . 18531 1
262 . 1 1 23 23 ALA HB2 H 1 1.17 0.04 . 1 . . . A 23 ALA HB2 . 18531 1
263 . 1 1 23 23 ALA HB3 H 1 1.17 0.04 . 1 . . . A 23 ALA HB3 . 18531 1
264 . 1 1 23 23 ALA CA C 13 54.9 0.10 . 1 . . . A 23 ALA CA . 18531 1
265 . 1 1 23 23 ALA CB C 13 17.5 0.10 . 1 . . . A 23 ALA CB . 18531 1
266 . 1 1 23 23 ALA N N 15 121.0 0.10 . 1 . . . A 23 ALA N . 18531 1
267 . 1 1 24 24 GLU H H 1 8.41 0.04 . 1 . . . A 24 GLU H . 18531 1
268 . 1 1 24 24 GLU HA H 1 3.86 0.04 . 1 . . . A 24 GLU HA . 18531 1
269 . 1 1 24 24 GLU HB2 H 1 1.96 0.04 . 2 . . . A 24 GLU HB2 . 18531 1
270 . 1 1 24 24 GLU HB3 H 1 1.80 0.04 . 2 . . . A 24 GLU HB3 . 18531 1
271 . 1 1 24 24 GLU HG2 H 1 2.18 0.04 . 2 . . . A 24 GLU HG2 . 18531 1
272 . 1 1 24 24 GLU HG3 H 1 2.18 0.04 . 2 . . . A 24 GLU HG3 . 18531 1
273 . 1 1 24 24 GLU CA C 13 59.7 0.10 . 1 . . . A 24 GLU CA . 18531 1
274 . 1 1 24 24 GLU CB C 13 29.1 0.10 . 1 . . . A 24 GLU CB . 18531 1
275 . 1 1 24 24 GLU CG C 13 36.8 0.10 . 1 . . . A 24 GLU CG . 18531 1
276 . 1 1 24 24 GLU N N 15 118.9 0.10 . 1 . . . A 24 GLU N . 18531 1
277 . 1 1 25 25 THR H H 1 8.38 0.04 . 1 . . . A 25 THR H . 18531 1
278 . 1 1 25 25 THR HA H 1 3.67 0.04 . 1 . . . A 25 THR HA . 18531 1
279 . 1 1 25 25 THR HB H 1 4.00 0.04 . 1 . . . A 25 THR HB . 18531 1
280 . 1 1 25 25 THR HG21 H 1 1.23 0.04 . 1 . . . A 25 THR HG21 . 18531 1
281 . 1 1 25 25 THR HG22 H 1 1.23 0.04 . 1 . . . A 25 THR HG22 . 18531 1
282 . 1 1 25 25 THR HG23 H 1 1.23 0.04 . 1 . . . A 25 THR HG23 . 18531 1
283 . 1 1 25 25 THR CA C 13 66.8 0.10 . 1 . . . A 25 THR CA . 18531 1
284 . 1 1 25 25 THR CB C 13 68.0 0.10 . 1 . . . A 25 THR CB . 18531 1
285 . 1 1 25 25 THR CG2 C 13 21.4 0.10 . 1 . . . A 25 THR CG2 . 18531 1
286 . 1 1 25 25 THR N N 15 117.4 0.10 . 1 . . . A 25 THR N . 18531 1
287 . 1 1 26 26 ALA H H 1 7.22 0.04 . 1 . . . A 26 ALA H . 18531 1
288 . 1 1 26 26 ALA HA H 1 3.19 0.04 . 1 . . . A 26 ALA HA . 18531 1
289 . 1 1 26 26 ALA HB1 H 1 0.47 0.04 . 1 . . . A 26 ALA HB1 . 18531 1
290 . 1 1 26 26 ALA HB2 H 1 0.47 0.04 . 1 . . . A 26 ALA HB2 . 18531 1
291 . 1 1 26 26 ALA HB3 H 1 0.47 0.04 . 1 . . . A 26 ALA HB3 . 18531 1
292 . 1 1 26 26 ALA CA C 13 55.0 0.10 . 1 . . . A 26 ALA CA . 18531 1
293 . 1 1 26 26 ALA CB C 13 17.3 0.10 . 1 . . . A 26 ALA CB . 18531 1
294 . 1 1 26 26 ALA N N 15 125.1 0.10 . 1 . . . A 26 ALA N . 18531 1
295 . 1 1 27 27 GLU H H 1 8.37 0.04 . 1 . . . A 27 GLU H . 18531 1
296 . 1 1 27 27 GLU HA H 1 2.59 0.04 . 1 . . . A 27 GLU HA . 18531 1
297 . 1 1 27 27 GLU HB2 H 1 1.84 0.04 . 2 . . . A 27 GLU HB2 . 18531 1
298 . 1 1 27 27 GLU HB3 H 1 1.92 0.04 . 2 . . . A 27 GLU HB3 . 18531 1
299 . 1 1 27 27 GLU HG2 H 1 1.57 0.04 . 2 . . . A 27 GLU HG2 . 18531 1
300 . 1 1 27 27 GLU HG3 H 1 1.57 0.04 . 2 . . . A 27 GLU HG3 . 18531 1
301 . 1 1 27 27 GLU CA C 13 59.7 0.10 . 1 . . . A 27 GLU CA . 18531 1
302 . 1 1 27 27 GLU CB C 13 29.2 0.10 . 1 . . . A 27 GLU CB . 18531 1
303 . 1 1 27 27 GLU CG C 13 35.9 0.10 . 1 . . . A 27 GLU CG . 18531 1
304 . 1 1 27 27 GLU N N 15 117.4 0.10 . 1 . . . A 27 GLU N . 18531 1
305 . 1 1 28 28 LYS H H 1 7.17 0.04 . 1 . . . A 28 LYS H . 18531 1
306 . 1 1 28 28 LYS HA H 1 3.67 0.04 . 1 . . . A 28 LYS HA . 18531 1
307 . 1 1 28 28 LYS HB2 H 1 1.75 0.04 . 2 . . . A 28 LYS HB2 . 18531 1
308 . 1 1 28 28 LYS HB3 H 1 1.75 0.04 . 2 . . . A 28 LYS HB3 . 18531 1
309 . 1 1 28 28 LYS HG2 H 1 1.29 0.04 . 2 . . . A 28 LYS HG2 . 18531 1
310 . 1 1 28 28 LYS HG3 H 1 1.51 0.04 . 2 . . . A 28 LYS HG3 . 18531 1
311 . 1 1 28 28 LYS HD2 H 1 1.57 0.04 . 2 . . . A 28 LYS HD2 . 18531 1
312 . 1 1 28 28 LYS HD3 H 1 1.57 0.04 . 2 . . . A 28 LYS HD3 . 18531 1
313 . 1 1 28 28 LYS HE2 H 1 2.85 0.04 . 2 . . . A 28 LYS HE2 . 18531 1
314 . 1 1 28 28 LYS HE3 H 1 2.85 0.04 . 2 . . . A 28 LYS HE3 . 18531 1
315 . 1 1 28 28 LYS CA C 13 59.6 0.10 . 1 . . . A 28 LYS CA . 18531 1
316 . 1 1 28 28 LYS CB C 13 32.2 0.10 . 1 . . . A 28 LYS CB . 18531 1
317 . 1 1 28 28 LYS CG C 13 25.3 0.10 . 1 . . . A 28 LYS CG . 18531 1
318 . 1 1 28 28 LYS CD C 13 29.1 0.10 . 1 . . . A 28 LYS CD . 18531 1
319 . 1 1 28 28 LYS N N 15 116.3 0.10 . 1 . . . A 28 LYS N . 18531 1
320 . 1 1 29 29 ALA H H 1 7.20 0.04 . 1 . . . A 29 ALA H . 18531 1
321 . 1 1 29 29 ALA HA H 1 4.09 0.04 . 1 . . . A 29 ALA HA . 18531 1
322 . 1 1 29 29 ALA HB1 H 1 1.20 0.04 . 1 . . . A 29 ALA HB1 . 18531 1
323 . 1 1 29 29 ALA HB2 H 1 1.20 0.04 . 1 . . . A 29 ALA HB2 . 18531 1
324 . 1 1 29 29 ALA HB3 H 1 1.20 0.04 . 1 . . . A 29 ALA HB3 . 18531 1
325 . 1 1 29 29 ALA CA C 13 54.7 0.10 . 1 . . . A 29 ALA CA . 18531 1
326 . 1 1 29 29 ALA CB C 13 17.5 0.10 . 1 . . . A 29 ALA CB . 18531 1
327 . 1 1 29 29 ALA N N 15 122.0 0.10 . 1 . . . A 29 ALA N . 18531 1
328 . 1 1 30 30 PHE H H 1 8.61 0.04 . 1 . . . A 30 PHE H . 18531 1
329 . 1 1 30 30 PHE HA H 1 4.78 0.04 . 1 . . . A 30 PHE HA . 18531 1
330 . 1 1 30 30 PHE HB2 H 1 3.34 0.04 . 2 . . . A 30 PHE HB2 . 18531 1
331 . 1 1 30 30 PHE HB3 H 1 2.83 0.04 . 2 . . . A 30 PHE HB3 . 18531 1
332 . 1 1 30 30 PHE HD1 H 1 6.61 0.04 . 1 . . . A 30 PHE HD1 . 18531 1
333 . 1 1 30 30 PHE HD2 H 1 6.64 0.04 . 1 . . . A 30 PHE HD2 . 18531 1
334 . 1 1 30 30 PHE HE1 H 1 7.19 0.04 . 1 . . . A 30 PHE HE1 . 18531 1
335 . 1 1 30 30 PHE HE2 H 1 7.19 0.04 . 1 . . . A 30 PHE HE2 . 18531 1
336 . 1 1 30 30 PHE HZ H 1 7.53 0.04 . 1 . . . A 30 PHE HZ . 18531 1
337 . 1 1 30 30 PHE CA C 13 56.6 0.10 . 1 . . . A 30 PHE CA . 18531 1
338 . 1 1 30 30 PHE CB C 13 37.4 0.10 . 1 . . . A 30 PHE CB . 18531 1
339 . 1 1 30 30 PHE CD1 C 13 131.3 0.10 . 1 . . . A 30 PHE CD1 . 18531 1
340 . 1 1 30 30 PHE CD2 C 13 131.4 0.10 . 1 . . . A 30 PHE CD2 . 18531 1
341 . 1 1 30 30 PHE CE1 C 13 130.6 0.10 . 1 . . . A 30 PHE CE1 . 18531 1
342 . 1 1 30 30 PHE CE2 C 13 130.5 0.10 . 1 . . . A 30 PHE CE2 . 18531 1
343 . 1 1 30 30 PHE CZ C 13 129.1 0.10 . 1 . . . A 30 PHE CZ . 18531 1
344 . 1 1 30 30 PHE N N 15 119.6 0.10 . 1 . . . A 30 PHE N . 18531 1
345 . 1 1 31 31 LYS H H 1 9.03 0.04 . 1 . . . A 31 LYS H . 18531 1
346 . 1 1 31 31 LYS HA H 1 4.09 0.04 . 1 . . . A 31 LYS HA . 18531 1
347 . 1 1 31 31 LYS HB2 H 1 1.53 0.04 . 2 . . . A 31 LYS HB2 . 18531 1
348 . 1 1 31 31 LYS HB3 H 1 1.62 0.04 . 2 . . . A 31 LYS HB3 . 18531 1
349 . 1 1 31 31 LYS HG2 H 1 0.40 0.04 . 2 . . . A 31 LYS HG2 . 18531 1
350 . 1 1 31 31 LYS HG3 H 1 0.73 0.04 . 2 . . . A 31 LYS HG3 . 18531 1
351 . 1 1 31 31 LYS HD2 H 1 1.05 0.04 . 2 . . . A 31 LYS HD2 . 18531 1
352 . 1 1 31 31 LYS HD3 H 1 0.99 0.04 . 2 . . . A 31 LYS HD3 . 18531 1
353 . 1 1 31 31 LYS HE2 H 1 3.69 0.04 . 2 . . . A 31 LYS HE2 . 18531 1
354 . 1 1 31 31 LYS HE3 H 1 3.67 0.04 . 2 . . . A 31 LYS HE3 . 18531 1
355 . 1 1 31 31 LYS CA C 13 59.7 0.10 . 1 . . . A 31 LYS CA . 18531 1
356 . 1 1 31 31 LYS CB C 13 31.6 0.10 . 1 . . . A 31 LYS CB . 18531 1
357 . 1 1 31 31 LYS CG C 13 25.6 0.10 . 1 . . . A 31 LYS CG . 18531 1
358 . 1 1 31 31 LYS CD C 13 28.6 0.10 . 1 . . . A 31 LYS CD . 18531 1
359 . 1 1 31 31 LYS N N 15 122.8 0.10 . 1 . . . A 31 LYS N . 18531 1
360 . 1 1 32 32 GLN H H 1 7.51 0.04 . 1 . . . A 32 GLN H . 18531 1
361 . 1 1 32 32 GLN HA H 1 4.03 0.04 . 1 . . . A 32 GLN HA . 18531 1
362 . 1 1 32 32 GLN HB2 H 1 2.20 0.04 . 2 . . . A 32 GLN HB2 . 18531 1
363 . 1 1 32 32 GLN HB3 H 1 2.20 0.04 . 2 . . . A 32 GLN HB3 . 18531 1
364 . 1 1 32 32 GLN HG2 H 1 2.19 0.04 . 2 . . . A 32 GLN HG2 . 18531 1
365 . 1 1 32 32 GLN HG3 H 1 2.39 0.04 . 2 . . . A 32 GLN HG3 . 18531 1
366 . 1 1 32 32 GLN HE21 H 1 7.96 0.04 . 2 . . . A 32 GLN HE21 . 18531 1
367 . 1 1 32 32 GLN HE22 H 1 6.91 0.04 . 2 . . . A 32 GLN HE22 . 18531 1
368 . 1 1 32 32 GLN CA C 13 58.7 0.10 . 1 . . . A 32 GLN CA . 18531 1
369 . 1 1 32 32 GLN CB C 13 28.1 0.10 . 1 . . . A 32 GLN CB . 18531 1
370 . 1 1 32 32 GLN CG C 13 33.3 0.10 . 1 . . . A 32 GLN CG . 18531 1
371 . 1 1 32 32 GLN N N 15 119.6 0.10 . 1 . . . A 32 GLN N . 18531 1
372 . 1 1 33 33 TYR H H 1 8.08 0.04 . 1 . . . A 33 TYR H . 18531 1
373 . 1 1 33 33 TYR HA H 1 4.25 0.04 . 1 . . . A 33 TYR HA . 18531 1
374 . 1 1 33 33 TYR HB2 H 1 3.29 0.04 . 2 . . . A 33 TYR HB2 . 18531 1
375 . 1 1 33 33 TYR HB3 H 1 3.29 0.04 . 2 . . . A 33 TYR HB3 . 18531 1
376 . 1 1 33 33 TYR HD1 H 1 6.95 0.04 . 1 . . . A 33 TYR HD1 . 18531 1
377 . 1 1 33 33 TYR HD2 H 1 6.94 0.04 . 1 . . . A 33 TYR HD2 . 18531 1
378 . 1 1 33 33 TYR HE1 H 1 6.67 0.04 . 1 . . . A 33 TYR HE1 . 18531 1
379 . 1 1 33 33 TYR HE2 H 1 6.66 0.04 . 1 . . . A 33 TYR HE2 . 18531 1
380 . 1 1 33 33 TYR CA C 13 61.8 0.10 . 1 . . . A 33 TYR CA . 18531 1
381 . 1 1 33 33 TYR CB C 13 38.7 0.10 . 1 . . . A 33 TYR CB . 18531 1
382 . 1 1 33 33 TYR CD1 C 13 132.5 0.10 . 1 . . . A 33 TYR CD1 . 18531 1
383 . 1 1 33 33 TYR CD2 C 13 132.3 0.10 . 1 . . . A 33 TYR CD2 . 18531 1
384 . 1 1 33 33 TYR CE1 C 13 117.8 0.10 . 1 . . . A 33 TYR CE1 . 18531 1
385 . 1 1 33 33 TYR CE2 C 13 117.9 0.10 . 1 . . . A 33 TYR CE2 . 18531 1
386 . 1 1 33 33 TYR N N 15 120.4 0.10 . 1 . . . A 33 TYR N . 18531 1
387 . 1 1 34 34 ALA H H 1 9.21 0.04 . 1 . . . A 34 ALA H . 18531 1
388 . 1 1 34 34 ALA HA H 1 3.78 0.04 . 1 . . . A 34 ALA HA . 18531 1
389 . 1 1 34 34 ALA HB1 H 1 1.82 0.04 . 1 . . . A 34 ALA HB1 . 18531 1
390 . 1 1 34 34 ALA HB2 H 1 1.82 0.04 . 1 . . . A 34 ALA HB2 . 18531 1
391 . 1 1 34 34 ALA HB3 H 1 1.82 0.04 . 1 . . . A 34 ALA HB3 . 18531 1
392 . 1 1 34 34 ALA CA C 13 56.1 0.10 . 1 . . . A 34 ALA CA . 18531 1
393 . 1 1 34 34 ALA CB C 13 17.7 0.10 . 1 . . . A 34 ALA CB . 18531 1
394 . 1 1 34 34 ALA N N 15 122.3 0.10 . 1 . . . A 34 ALA N . 18531 1
395 . 1 1 35 35 ASN H H 1 8.39 0.04 . 1 . . . A 35 ASN H . 18531 1
396 . 1 1 35 35 ASN HA H 1 4.46 0.04 . 1 . . . A 35 ASN HA . 18531 1
397 . 1 1 35 35 ASN HB2 H 1 2.92 0.04 . 2 . . . A 35 ASN HB2 . 18531 1
398 . 1 1 35 35 ASN HB3 H 1 2.92 0.04 . 2 . . . A 35 ASN HB3 . 18531 1
399 . 1 1 35 35 ASN HD21 H 1 7.61 0.04 . 2 . . . A 35 ASN HD21 . 18531 1
400 . 1 1 35 35 ASN HD22 H 1 6.93 0.04 . 2 . . . A 35 ASN HD22 . 18531 1
401 . 1 1 35 35 ASN CA C 13 57.0 0.10 . 1 . . . A 35 ASN CA . 18531 1
402 . 1 1 35 35 ASN CB C 13 39.0 0.10 . 1 . . . A 35 ASN CB . 18531 1
403 . 1 1 35 35 ASN N N 15 117.7 0.10 . 1 . . . A 35 ASN N . 18531 1
404 . 1 1 36 36 ASP H H 1 8.83 0.04 . 1 . . . A 36 ASP H . 18531 1
405 . 1 1 36 36 ASP HA H 1 4.36 0.04 . 1 . . . A 36 ASP HA . 18531 1
406 . 1 1 36 36 ASP HB2 H 1 2.55 0.04 . 2 . . . A 36 ASP HB2 . 18531 1
407 . 1 1 36 36 ASP HB3 H 1 2.71 0.04 . 2 . . . A 36 ASP HB3 . 18531 1
408 . 1 1 36 36 ASP CA C 13 56.7 0.10 . 1 . . . A 36 ASP CA . 18531 1
409 . 1 1 36 36 ASP CB C 13 40.0 0.10 . 1 . . . A 36 ASP CB . 18531 1
410 . 1 1 36 36 ASP N N 15 121.1 0.10 . 1 . . . A 36 ASP N . 18531 1
411 . 1 1 37 37 ASN H H 1 7.39 0.04 . 1 . . . A 37 ASN H . 18531 1
412 . 1 1 37 37 ASN HA H 1 4.61 0.04 . 1 . . . A 37 ASN HA . 18531 1
413 . 1 1 37 37 ASN HB2 H 1 2.68 0.04 . 2 . . . A 37 ASN HB2 . 18531 1
414 . 1 1 37 37 ASN HB3 H 1 2.07 0.04 . 2 . . . A 37 ASN HB3 . 18531 1
415 . 1 1 37 37 ASN HD21 H 1 6.65 0.04 . 2 . . . A 37 ASN HD21 . 18531 1
416 . 1 1 37 37 ASN HD22 H 1 6.39 0.04 . 2 . . . A 37 ASN HD22 . 18531 1
417 . 1 1 37 37 ASN CA C 13 53.7 0.10 . 1 . . . A 37 ASN CA . 18531 1
418 . 1 1 37 37 ASN CB C 13 40.0 0.10 . 1 . . . A 37 ASN CB . 18531 1
419 . 1 1 37 37 ASN N N 15 115.2 0.10 . 1 . . . A 37 ASN N . 18531 1
420 . 1 1 38 38 GLY H H 1 7.80 0.04 . 1 . . . A 38 GLY H . 18531 1
421 . 1 1 38 38 GLY HA2 H 1 3.92 0.04 . 2 . . . A 38 GLY HA2 . 18531 1
422 . 1 1 38 38 GLY HA3 H 1 3.92 0.04 . 2 . . . A 38 GLY HA3 . 18531 1
423 . 1 1 38 38 GLY CA C 13 46.4 0.10 . 1 . . . A 38 GLY CA . 18531 1
424 . 1 1 38 38 GLY N N 15 108.2 0.10 . 1 . . . A 38 GLY N . 18531 1
425 . 1 1 39 39 VAL H H 1 8.12 0.04 . 1 . . . A 39 VAL H . 18531 1
426 . 1 1 39 39 VAL HA H 1 4.14 0.04 . 1 . . . A 39 VAL HA . 18531 1
427 . 1 1 39 39 VAL HB H 1 1.76 0.04 . 1 . . . A 39 VAL HB . 18531 1
428 . 1 1 39 39 VAL HG11 H 1 0.66 0.04 . 2 . . . A 39 VAL HG11 . 18531 1
429 . 1 1 39 39 VAL HG12 H 1 0.66 0.04 . 2 . . . A 39 VAL HG12 . 18531 1
430 . 1 1 39 39 VAL HG13 H 1 0.66 0.04 . 2 . . . A 39 VAL HG13 . 18531 1
431 . 1 1 39 39 VAL HG21 H 1 0.79 0.04 . 2 . . . A 39 VAL HG21 . 18531 1
432 . 1 1 39 39 VAL HG22 H 1 0.79 0.04 . 2 . . . A 39 VAL HG22 . 18531 1
433 . 1 1 39 39 VAL HG23 H 1 0.79 0.04 . 2 . . . A 39 VAL HG23 . 18531 1
434 . 1 1 39 39 VAL CA C 13 61.7 0.10 . 1 . . . A 39 VAL CA . 18531 1
435 . 1 1 39 39 VAL CB C 13 33.3 0.10 . 1 . . . A 39 VAL CB . 18531 1
436 . 1 1 39 39 VAL CG1 C 13 21.4 0.10 . 1 . . . A 39 VAL CG1 . 18531 1
437 . 1 1 39 39 VAL CG2 C 13 21.4 0.10 . 1 . . . A 39 VAL CG2 . 18531 1
438 . 1 1 39 39 VAL N N 15 120.8 0.10 . 1 . . . A 39 VAL N . 18531 1
439 . 1 1 40 40 ASP H H 1 8.77 0.04 . 1 . . . A 40 ASP H . 18531 1
440 . 1 1 40 40 ASP HA H 1 4.89 0.04 . 1 . . . A 40 ASP HA . 18531 1
441 . 1 1 40 40 ASP HB2 H 1 2.75 0.04 . 2 . . . A 40 ASP HB2 . 18531 1
442 . 1 1 40 40 ASP HB3 H 1 2.56 0.04 . 2 . . . A 40 ASP HB3 . 18531 1
443 . 1 1 40 40 ASP CA C 13 52.8 0.10 . 1 . . . A 40 ASP CA . 18531 1
444 . 1 1 40 40 ASP CB C 13 43.1 0.10 . 1 . . . A 40 ASP CB . 18531 1
445 . 1 1 40 40 ASP N N 15 128.0 0.10 . 1 . . . A 40 ASP N . 18531 1
446 . 1 1 41 41 GLY H H 1 7.91 0.04 . 1 . . . A 41 GLY H . 18531 1
447 . 1 1 41 41 GLY HA2 H 1 4.34 0.04 . 2 . . . A 41 GLY HA2 . 18531 1
448 . 1 1 41 41 GLY HA3 H 1 3.54 0.04 . 2 . . . A 41 GLY HA3 . 18531 1
449 . 1 1 41 41 GLY CA C 13 45.4 0.10 . 1 . . . A 41 GLY CA . 18531 1
450 . 1 1 41 41 GLY N N 15 107.1 0.10 . 1 . . . A 41 GLY N . 18531 1
451 . 1 1 42 42 VAL H H 1 8.25 0.04 . 1 . . . A 42 VAL H . 18531 1
452 . 1 1 42 42 VAL HA H 1 4.38 0.04 . 1 . . . A 42 VAL HA . 18531 1
453 . 1 1 42 42 VAL HB H 1 1.95 0.04 . 1 . . . A 42 VAL HB . 18531 1
454 . 1 1 42 42 VAL HG11 H 1 0.98 0.04 . 2 . . . A 42 VAL HG11 . 18531 1
455 . 1 1 42 42 VAL HG12 H 1 0.98 0.04 . 2 . . . A 42 VAL HG12 . 18531 1
456 . 1 1 42 42 VAL HG13 H 1 0.98 0.04 . 2 . . . A 42 VAL HG13 . 18531 1
457 . 1 1 42 42 VAL HG21 H 1 1.04 0.04 . 2 . . . A 42 VAL HG21 . 18531 1
458 . 1 1 42 42 VAL HG22 H 1 1.04 0.04 . 2 . . . A 42 VAL HG22 . 18531 1
459 . 1 1 42 42 VAL HG23 H 1 1.04 0.04 . 2 . . . A 42 VAL HG23 . 18531 1
460 . 1 1 42 42 VAL CA C 13 62.1 0.10 . 1 . . . A 42 VAL CA . 18531 1
461 . 1 1 42 42 VAL CB C 13 33.4 0.10 . 1 . . . A 42 VAL CB . 18531 1
462 . 1 1 42 42 VAL CG1 C 13 21.4 0.10 . 1 . . . A 42 VAL CG1 . 18531 1
463 . 1 1 42 42 VAL CG2 C 13 21.4 0.10 . 1 . . . A 42 VAL CG2 . 18531 1
464 . 1 1 42 42 VAL N N 15 120.3 0.10 . 1 . . . A 42 VAL N . 18531 1
465 . 1 1 43 43 TRP H H 1 9.36 0.04 . 1 . . . A 43 TRP H . 18531 1
466 . 1 1 43 43 TRP HA H 1 5.36 0.04 . 1 . . . A 43 TRP HA . 18531 1
467 . 1 1 43 43 TRP HB2 H 1 3.34 0.04 . 2 . . . A 43 TRP HB2 . 18531 1
468 . 1 1 43 43 TRP HB3 H 1 3.14 0.04 . 2 . . . A 43 TRP HB3 . 18531 1
469 . 1 1 43 43 TRP HD1 H 1 7.16 0.04 . 1 . . . A 43 TRP HD1 . 18531 1
470 . 1 1 43 43 TRP HE1 H 1 10.13 0.04 . 1 . . . A 43 TRP HE1 . 18531 1
471 . 1 1 43 43 TRP HE3 H 1 7.17 0.04 . 1 . . . A 43 TRP HE3 . 18531 1
472 . 1 1 43 43 TRP HZ2 H 1 7.14 0.04 . 1 . . . A 43 TRP HZ2 . 18531 1
473 . 1 1 43 43 TRP HZ3 H 1 6.68 0.04 . 1 . . . A 43 TRP HZ3 . 18531 1
474 . 1 1 43 43 TRP HH2 H 1 6.82 0.04 . 1 . . . A 43 TRP HH2 . 18531 1
475 . 1 1 43 43 TRP CA C 13 57.6 0.10 . 1 . . . A 43 TRP CA . 18531 1
476 . 1 1 43 43 TRP CB C 13 30.2 0.10 . 1 . . . A 43 TRP CB . 18531 1
477 . 1 1 43 43 TRP CD1 C 13 126.2 0.10 . 1 . . . A 43 TRP CD1 . 18531 1
478 . 1 1 43 43 TRP CE3 C 13 120.4 0.10 . 1 . . . A 43 TRP CE3 . 18531 1
479 . 1 1 43 43 TRP CZ2 C 13 114.2 0.10 . 1 . . . A 43 TRP CZ2 . 18531 1
480 . 1 1 43 43 TRP CZ3 C 13 121.6 0.10 . 1 . . . A 43 TRP CZ3 . 18531 1
481 . 1 1 43 43 TRP CH2 C 13 123.8 0.10 . 1 . . . A 43 TRP CH2 . 18531 1
482 . 1 1 43 43 TRP N N 15 130.7 0.10 . 1 . . . A 43 TRP N . 18531 1
483 . 1 1 44 44 THR H H 1 9.40 0.04 . 1 . . . A 44 THR H . 18531 1
484 . 1 1 44 44 THR HA H 1 4.83 0.04 . 1 . . . A 44 THR HA . 18531 1
485 . 1 1 44 44 THR HB H 1 4.26 0.04 . 1 . . . A 44 THR HB . 18531 1
486 . 1 1 44 44 THR HG21 H 1 1.16 0.04 . 1 . . . A 44 THR HG21 . 18531 1
487 . 1 1 44 44 THR HG22 H 1 1.16 0.04 . 1 . . . A 44 THR HG22 . 18531 1
488 . 1 1 44 44 THR HG23 H 1 1.16 0.04 . 1 . . . A 44 THR HG23 . 18531 1
489 . 1 1 44 44 THR CA C 13 60.3 0.10 . 1 . . . A 44 THR CA . 18531 1
490 . 1 1 44 44 THR CB C 13 72.1 0.10 . 1 . . . A 44 THR CB . 18531 1
491 . 1 1 44 44 THR CG2 C 13 22.4 0.10 . 1 . . . A 44 THR CG2 . 18531 1
492 . 1 1 44 44 THR N N 15 114.5 0.10 . 1 . . . A 44 THR N . 18531 1
493 . 1 1 45 45 TYR H H 1 8.58 0.04 . 1 . . . A 45 TYR H . 18531 1
494 . 1 1 45 45 TYR HA H 1 4.97 0.04 . 1 . . . A 45 TYR HA . 18531 1
495 . 1 1 45 45 TYR HB2 H 1 2.49 0.04 . 2 . . . A 45 TYR HB2 . 18531 1
496 . 1 1 45 45 TYR HB3 H 1 2.88 0.04 . 2 . . . A 45 TYR HB3 . 18531 1
497 . 1 1 45 45 TYR HD1 H 1 5.89 0.04 . 1 . . . A 45 TYR HD1 . 18531 1
498 . 1 1 45 45 TYR HD2 H 1 5.89 0.04 . 1 . . . A 45 TYR HD2 . 18531 1
499 . 1 1 45 45 TYR HE1 H 1 6.31 0.04 . 1 . . . A 45 TYR HE1 . 18531 1
500 . 1 1 45 45 TYR HE2 H 1 6.31 0.04 . 1 . . . A 45 TYR HE2 . 18531 1
501 . 1 1 45 45 TYR CA C 13 57.0 0.10 . 1 . . . A 45 TYR CA . 18531 1
502 . 1 1 45 45 TYR CB C 13 41.6 0.10 . 1 . . . A 45 TYR CB . 18531 1
503 . 1 1 45 45 TYR CD1 C 13 132.3 0.10 . 1 . . . A 45 TYR CD1 . 18531 1
504 . 1 1 45 45 TYR CD2 C 13 132.5 0.10 . 1 . . . A 45 TYR CD2 . 18531 1
505 . 1 1 45 45 TYR CE1 C 13 117.9 0.10 . 1 . . . A 45 TYR CE1 . 18531 1
506 . 1 1 45 45 TYR CE2 C 13 117.8 0.10 . 1 . . . A 45 TYR CE2 . 18531 1
507 . 1 1 45 45 TYR N N 15 120.1 0.10 . 1 . . . A 45 TYR N . 18531 1
508 . 1 1 46 46 ASP H H 1 7.58 0.04 . 1 . . . A 46 ASP H . 18531 1
509 . 1 1 46 46 ASP HA H 1 4.58 0.04 . 1 . . . A 46 ASP HA . 18531 1
510 . 1 1 46 46 ASP HB2 H 1 2.58 0.04 . 2 . . . A 46 ASP HB2 . 18531 1
511 . 1 1 46 46 ASP HB3 H 1 2.25 0.04 . 2 . . . A 46 ASP HB3 . 18531 1
512 . 1 1 46 46 ASP CA C 13 51.9 0.10 . 1 . . . A 46 ASP CA . 18531 1
513 . 1 1 46 46 ASP CB C 13 43.1 0.10 . 1 . . . A 46 ASP CB . 18531 1
514 . 1 1 46 46 ASP N N 15 128.3 0.10 . 1 . . . A 46 ASP N . 18531 1
515 . 1 1 47 47 ASP H H 1 8.59 0.04 . 1 . . . A 47 ASP H . 18531 1
516 . 1 1 47 47 ASP HA H 1 4.11 0.04 . 1 . . . A 47 ASP HA . 18531 1
517 . 1 1 47 47 ASP HB2 H 1 2.50 0.04 . 2 . . . A 47 ASP HB2 . 18531 1
518 . 1 1 47 47 ASP HB3 H 1 2.82 0.04 . 2 . . . A 47 ASP HB3 . 18531 1
519 . 1 1 47 47 ASP CA C 13 56.5 0.10 . 1 . . . A 47 ASP CA . 18531 1
520 . 1 1 47 47 ASP CB C 13 42.1 0.10 . 1 . . . A 47 ASP CB . 18531 1
521 . 1 1 47 47 ASP N N 15 124.8 0.10 . 1 . . . A 47 ASP N . 18531 1
522 . 1 1 48 48 ALA H H 1 8.34 0.04 . 1 . . . A 48 ALA H . 18531 1
523 . 1 1 48 48 ALA HA H 1 4.09 0.04 . 1 . . . A 48 ALA HA . 18531 1
524 . 1 1 48 48 ALA HB1 H 1 1.49 0.04 . 1 . . . A 48 ALA HB1 . 18531 1
525 . 1 1 48 48 ALA HB2 H 1 1.49 0.04 . 1 . . . A 48 ALA HB2 . 18531 1
526 . 1 1 48 48 ALA HB3 H 1 1.49 0.04 . 1 . . . A 48 ALA HB3 . 18531 1
527 . 1 1 48 48 ALA CA C 13 55.0 0.10 . 1 . . . A 48 ALA CA . 18531 1
528 . 1 1 48 48 ALA CB C 13 18.3 0.10 . 1 . . . A 48 ALA CB . 18531 1
529 . 1 1 48 48 ALA N N 15 119.7 0.10 . 1 . . . A 48 ALA N . 18531 1
530 . 1 1 49 49 THR H H 1 7.00 0.04 . 1 . . . A 49 THR H . 18531 1
531 . 1 1 49 49 THR HA H 1 4.39 0.04 . 1 . . . A 49 THR HA . 18531 1
532 . 1 1 49 49 THR HB H 1 4.39 0.04 . 1 . . . A 49 THR HB . 18531 1
533 . 1 1 49 49 THR HG21 H 1 1.06 0.04 . 1 . . . A 49 THR HG21 . 18531 1
534 . 1 1 49 49 THR HG22 H 1 1.06 0.04 . 1 . . . A 49 THR HG22 . 18531 1
535 . 1 1 49 49 THR HG23 H 1 1.06 0.04 . 1 . . . A 49 THR HG23 . 18531 1
536 . 1 1 49 49 THR CA C 13 60.2 0.10 . 1 . . . A 49 THR CA . 18531 1
537 . 1 1 49 49 THR CB C 13 70.0 0.10 . 1 . . . A 49 THR CB . 18531 1
538 . 1 1 49 49 THR CG2 C 13 21.4 0.10 . 1 . . . A 49 THR CG2 . 18531 1
539 . 1 1 49 49 THR N N 15 103.2 0.10 . 1 . . . A 49 THR N . 18531 1
540 . 1 1 50 50 LYS H H 1 7.86 0.04 . 1 . . . A 50 LYS H . 18531 1
541 . 1 1 50 50 LYS HA H 1 4.19 0.04 . 1 . . . A 50 LYS HA . 18531 1
542 . 1 1 50 50 LYS HB2 H 1 2.01 0.04 . 2 . . . A 50 LYS HB2 . 18531 1
543 . 1 1 50 50 LYS HB3 H 1 2.01 0.04 . 2 . . . A 50 LYS HB3 . 18531 1
544 . 1 1 50 50 LYS HG2 H 1 1.24 0.04 . 2 . . . A 50 LYS HG2 . 18531 1
545 . 1 1 50 50 LYS HG3 H 1 1.40 0.04 . 2 . . . A 50 LYS HG3 . 18531 1
546 . 1 1 50 50 LYS HD2 H 1 1.74 0.04 . 2 . . . A 50 LYS HD2 . 18531 1
547 . 1 1 50 50 LYS HD3 H 1 1.41 0.04 . 2 . . . A 50 LYS HD3 . 18531 1
548 . 1 1 50 50 LYS HE2 H 1 2.93 0.04 . 2 . . . A 50 LYS HE2 . 18531 1
549 . 1 1 50 50 LYS HE3 H 1 2.93 0.04 . 2 . . . A 50 LYS HE3 . 18531 1
550 . 1 1 50 50 LYS CA C 13 56.6 0.10 . 1 . . . A 50 LYS CA . 18531 1
551 . 1 1 50 50 LYS CB C 13 28.6 0.10 . 1 . . . A 50 LYS CB . 18531 1
552 . 1 1 50 50 LYS CG C 13 24.9 0.10 . 1 . . . A 50 LYS CG . 18531 1
553 . 1 1 50 50 LYS CD C 13 28.8 0.10 . 1 . . . A 50 LYS CD . 18531 1
554 . 1 1 50 50 LYS N N 15 123.1 0.10 . 1 . . . A 50 LYS N . 18531 1
555 . 1 1 51 51 THR H H 1 7.39 0.04 . 1 . . . A 51 THR H . 18531 1
556 . 1 1 51 51 THR HA H 1 5.49 0.04 . 1 . . . A 51 THR HA . 18531 1
557 . 1 1 51 51 THR HB H 1 3.75 0.04 . 1 . . . A 51 THR HB . 18531 1
558 . 1 1 51 51 THR HG21 H 1 0.96 0.04 . 1 . . . A 51 THR HG21 . 18531 1
559 . 1 1 51 51 THR HG22 H 1 0.96 0.04 . 1 . . . A 51 THR HG22 . 18531 1
560 . 1 1 51 51 THR HG23 H 1 0.96 0.04 . 1 . . . A 51 THR HG23 . 18531 1
561 . 1 1 51 51 THR CA C 13 62.3 0.10 . 1 . . . A 51 THR CA . 18531 1
562 . 1 1 51 51 THR CB C 13 72.1 0.10 . 1 . . . A 51 THR CB . 18531 1
563 . 1 1 51 51 THR CG2 C 13 20.9 0.10 . 1 . . . A 51 THR CG2 . 18531 1
564 . 1 1 51 51 THR N N 15 111.2 0.10 . 1 . . . A 51 THR N . 18531 1
565 . 1 1 52 52 PHE H H 1 10.39 0.04 . 1 . . . A 52 PHE H . 18531 1
566 . 1 1 52 52 PHE HA H 1 5.63 0.04 . 1 . . . A 52 PHE HA . 18531 1
567 . 1 1 52 52 PHE HB2 H 1 3.21 0.04 . 2 . . . A 52 PHE HB2 . 18531 1
568 . 1 1 52 52 PHE HB3 H 1 3.21 0.04 . 2 . . . A 52 PHE HB3 . 18531 1
569 . 1 1 52 52 PHE HD1 H 1 6.61 0.04 . 1 . . . A 52 PHE HD1 . 18531 1
570 . 1 1 52 52 PHE HD2 H 1 6.62 0.04 . 1 . . . A 52 PHE HD2 . 18531 1
571 . 1 1 52 52 PHE HE1 H 1 7.07 0.04 . 1 . . . A 52 PHE HE1 . 18531 1
572 . 1 1 52 52 PHE HE2 H 1 7.07 0.04 . 1 . . . A 52 PHE HE2 . 18531 1
573 . 1 1 52 52 PHE HZ H 1 7.09 0.04 . 1 . . . A 52 PHE HZ . 18531 1
574 . 1 1 52 52 PHE CA C 13 57.3 0.10 . 1 . . . A 52 PHE CA . 18531 1
575 . 1 1 52 52 PHE CB C 13 42.6 0.10 . 1 . . . A 52 PHE CB . 18531 1
576 . 1 1 52 52 PHE CD1 C 13 131.3 0.10 . 1 . . . A 52 PHE CD1 . 18531 1
577 . 1 1 52 52 PHE CD2 C 13 131.4 0.10 . 1 . . . A 52 PHE CD2 . 18531 1
578 . 1 1 52 52 PHE CE1 C 13 130.6 0.10 . 1 . . . A 52 PHE CE1 . 18531 1
579 . 1 1 52 52 PHE CE2 C 13 130.5 0.10 . 1 . . . A 52 PHE CE2 . 18531 1
580 . 1 1 52 52 PHE CZ C 13 129.1 0.10 . 1 . . . A 52 PHE CZ . 18531 1
581 . 1 1 52 52 PHE N N 15 131.0 0.10 . 1 . . . A 52 PHE N . 18531 1
582 . 1 1 53 53 THR H H 1 9.18 0.04 . 1 . . . A 53 THR H . 18531 1
583 . 1 1 53 53 THR HA H 1 5.27 0.04 . 1 . . . A 53 THR HA . 18531 1
584 . 1 1 53 53 THR HB H 1 3.80 0.04 . 1 . . . A 53 THR HB . 18531 1
585 . 1 1 53 53 THR HG21 H 1 0.93 0.04 . 1 . . . A 53 THR HG21 . 18531 1
586 . 1 1 53 53 THR HG22 H 1 0.93 0.04 . 1 . . . A 53 THR HG22 . 18531 1
587 . 1 1 53 53 THR HG23 H 1 0.93 0.04 . 1 . . . A 53 THR HG23 . 18531 1
588 . 1 1 53 53 THR CA C 13 61.2 0.10 . 1 . . . A 53 THR CA . 18531 1
589 . 1 1 53 53 THR CB C 13 71.0 0.10 . 1 . . . A 53 THR CB . 18531 1
590 . 1 1 53 53 THR CG2 C 13 20.4 0.10 . 1 . . . A 53 THR CG2 . 18531 1
591 . 1 1 53 53 THR N N 15 117.4 0.10 . 1 . . . A 53 THR N . 18531 1
592 . 1 1 54 54 VAL H H 1 8.28 0.04 . 1 . . . A 54 VAL H . 18531 1
593 . 1 1 54 54 VAL HA H 1 4.46 0.04 . 1 . . . A 54 VAL HA . 18531 1
594 . 1 1 54 54 VAL HB H 1 -0.37 0.04 . 1 . . . A 54 VAL HB . 18531 1
595 . 1 1 54 54 VAL HG11 H 1 0.35 0.04 . 2 . . . A 54 VAL HG11 . 18531 1
596 . 1 1 54 54 VAL HG12 H 1 0.35 0.04 . 2 . . . A 54 VAL HG12 . 18531 1
597 . 1 1 54 54 VAL HG13 H 1 0.35 0.04 . 2 . . . A 54 VAL HG13 . 18531 1
598 . 1 1 54 54 VAL HG21 H 1 -0.35 0.04 . 2 . . . A 54 VAL HG21 . 18531 1
599 . 1 1 54 54 VAL HG22 H 1 -0.35 0.04 . 2 . . . A 54 VAL HG22 . 18531 1
600 . 1 1 54 54 VAL HG23 H 1 -0.35 0.04 . 2 . . . A 54 VAL HG23 . 18531 1
601 . 1 1 54 54 VAL CA C 13 58.1 0.10 . 1 . . . A 54 VAL CA . 18531 1
602 . 1 1 54 54 VAL CB C 13 32.3 0.10 . 1 . . . A 54 VAL CB . 18531 1
603 . 1 1 54 54 VAL CG1 C 13 20.3 0.10 . 1 . . . A 54 VAL CG1 . 18531 1
604 . 1 1 54 54 VAL CG2 C 13 21.0 0.10 . 1 . . . A 54 VAL CG2 . 18531 1
605 . 1 1 54 54 VAL N N 15 123.0 0.10 . 1 . . . A 54 VAL N . 18531 1
606 . 1 1 55 55 THR H H 1 8.32 0.04 . 1 . . . A 55 THR H . 18531 1
607 . 1 1 55 55 THR HA H 1 4.70 0.04 . 1 . . . A 55 THR HA . 18531 1
608 . 1 1 55 55 THR HB H 1 3.79 0.04 . 1 . . . A 55 THR HB . 18531 1
609 . 1 1 55 55 THR HG21 H 1 1.23 0.04 . 1 . . . A 55 THR HG21 . 18531 1
610 . 1 1 55 55 THR HG22 H 1 1.23 0.04 . 1 . . . A 55 THR HG22 . 18531 1
611 . 1 1 55 55 THR HG23 H 1 1.23 0.04 . 1 . . . A 55 THR HG23 . 18531 1
612 . 1 1 55 55 THR CA C 13 61.2 0.10 . 1 . . . A 55 THR CA . 18531 1
613 . 1 1 55 55 THR CB C 13 70.7 0.10 . 1 . . . A 55 THR CB . 18531 1
614 . 1 1 55 55 THR CG2 C 13 21.4 0.10 . 1 . . . A 55 THR CG2 . 18531 1
615 . 1 1 55 55 THR N N 15 123.9 0.10 . 1 . . . A 55 THR N . 18531 1
616 . 1 1 56 56 GLU H H 1 7.90 0.04 . 1 . . . A 56 GLU H . 18531 1
617 . 1 1 56 56 GLU HA H 1 4.29 0.04 . 1 . . . A 56 GLU HA . 18531 1
618 . 1 1 56 56 GLU HB2 H 1 2.15 0.04 . 2 . . . A 56 GLU HB2 . 18531 1
619 . 1 1 56 56 GLU HB3 H 1 1.95 0.04 . 2 . . . A 56 GLU HB3 . 18531 1
620 . 1 1 56 56 GLU HG2 H 1 2.29 0.04 . 2 . . . A 56 GLU HG2 . 18531 1
621 . 1 1 56 56 GLU HG3 H 1 2.29 0.04 . 2 . . . A 56 GLU HG3 . 18531 1
622 . 1 1 56 56 GLU CA C 13 58.2 0.10 . 1 . . . A 56 GLU CA . 18531 1
623 . 1 1 56 56 GLU CB C 13 32.8 0.10 . 1 . . . A 56 GLU CB . 18531 1
624 . 1 1 56 56 GLU CG C 13 37.4 0.10 . 1 . . . A 56 GLU CG . 18531 1
625 . 1 1 56 56 GLU N N 15 133.4 0.10 . 1 . . . A 56 GLU N . 18531 1
stop_
save_