###################################
# 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 16739
_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' . . . 16739 1
2 '2D 1H-13C HSQC' . . . 16739 1
3 '3D CBCA(CO)NH' . . . 16739 1
4 '3D HNCACB' . . . 16739 1
5 '3D HNCO' . . . 16739 1
6 '3D HCCH-TOCSY' . . . 16739 1
7 '3D HCCH-COSY' . . . 16739 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $TOPSPIN . . 16739 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 GLY HA2 H 1 3.60 0.02 . 2 . . . . 1 GLY HA2 . 16739 1
2 . 1 1 1 1 GLY HA3 H 1 3.70 0.02 . 2 . . . . 1 GLY HA3 . 16739 1
3 . 1 1 1 1 GLY C C 13 170.5 0.3 . 1 . . . . 1 GLY C . 16739 1
4 . 1 1 1 1 GLY CA C 13 43.1 0.3 . 1 . . . . 1 GLY CA . 16739 1
5 . 1 1 2 2 PHE H H 1 8.61 0.02 . 1 . . . . 2 PHE H . 16739 1
6 . 1 1 2 2 PHE HA H 1 4.00 0.02 . 1 . . . . 2 PHE HA . 16739 1
7 . 1 1 2 2 PHE HB2 H 1 2.73 0.02 . 2 . . . . 2 PHE HB2 . 16739 1
8 . 1 1 2 2 PHE HB3 H 1 2.87 0.02 . 2 . . . . 2 PHE HB3 . 16739 1
9 . 1 1 2 2 PHE HD2 H 1 6.82 0.02 . 1 . . . . 2 PHE HD2 . 16739 1
10 . 1 1 2 2 PHE HE2 H 1 7.20 0.02 . 1 . . . . 2 PHE HE2 . 16739 1
11 . 1 1 2 2 PHE C C 13 172.4 0.3 . 1 . . . . 2 PHE C . 16739 1
12 . 1 1 2 2 PHE CA C 13 59.0 0.3 . 1 . . . . 2 PHE CA . 16739 1
13 . 1 1 2 2 PHE CB C 13 37.1 0.3 . 1 . . . . 2 PHE CB . 16739 1
14 . 1 1 2 2 PHE CD2 C 13 131.0 0.3 . 1 . . . . 2 PHE CD2 . 16739 1
15 . 1 1 2 2 PHE N N 15 119.5 0.3 . 1 . . . . 2 PHE N . 16739 1
16 . 1 1 3 3 GLY H H 1 8.09 0.02 . 1 . . . . 3 GLY H . 16739 1
17 . 1 1 3 3 GLY HA2 H 1 3.41 0.02 . 2 . . . . 3 GLY HA2 . 16739 1
18 . 1 1 3 3 GLY HA3 H 1 4.59 0.02 . 2 . . . . 3 GLY HA3 . 16739 1
19 . 1 1 3 3 GLY C C 13 174.7 0.3 . 1 . . . . 3 GLY C . 16739 1
20 . 1 1 3 3 GLY CA C 13 44.5 0.3 . 1 . . . . 3 GLY CA . 16739 1
21 . 1 1 3 3 GLY N N 15 101.2 0.3 . 1 . . . . 3 GLY N . 16739 1
22 . 1 1 4 4 CYS H H 1 7.59 0.02 . 1 . . . . 4 CYS H . 16739 1
23 . 1 1 4 4 CYS HA H 1 4.70 0.02 . 1 . . . . 4 CYS HA . 16739 1
24 . 1 1 4 4 CYS HB2 H 1 2.62 0.02 . 2 . . . . 4 CYS HB2 . 16739 1
25 . 1 1 4 4 CYS HB3 H 1 2.76 0.02 . 2 . . . . 4 CYS HB3 . 16739 1
26 . 1 1 4 4 CYS C C 13 173.6 0.3 . 1 . . . . 4 CYS C . 16739 1
27 . 1 1 4 4 CYS CA C 13 52.5 0.3 . 1 . . . . 4 CYS CA . 16739 1
28 . 1 1 4 4 CYS CB C 13 34.5 0.3 . 1 . . . . 4 CYS CB . 16739 1
29 . 1 1 4 4 CYS N N 15 123.2 0.3 . 1 . . . . 4 CYS N . 16739 1
30 . 1 1 5 5 ASN H H 1 8.11 0.02 . 1 . . . . 5 ASN H . 16739 1
31 . 1 1 5 5 ASN HA H 1 5.15 0.02 . 1 . . . . 5 ASN HA . 16739 1
32 . 1 1 5 5 ASN HB2 H 1 2.83 0.02 . 2 . . . . 5 ASN HB2 . 16739 1
33 . 1 1 5 5 ASN HB3 H 1 3.03 0.02 . 2 . . . . 5 ASN HB3 . 16739 1
34 . 1 1 5 5 ASN HD21 H 1 7.47 0.02 . 1 . . . . 5 ASN HD21 . 16739 1
35 . 1 1 5 5 ASN HD22 H 1 6.91 0.02 . 1 . . . . 5 ASN HD22 . 16739 1
36 . 1 1 5 5 ASN C C 13 173.9 0.3 . 1 . . . . 5 ASN C . 16739 1
37 . 1 1 5 5 ASN CA C 13 52.0 0.3 . 1 . . . . 5 ASN CA . 16739 1
38 . 1 1 5 5 ASN CB C 13 39.6 0.3 . 1 . . . . 5 ASN CB . 16739 1
39 . 1 1 5 5 ASN CG C 13 178.3 0.3 . 1 . . . . 5 ASN CG . 16739 1
40 . 1 1 5 5 ASN N N 15 122.5 0.3 . 1 . . . . 5 ASN N . 16739 1
41 . 1 1 5 5 ASN ND2 N 15 115.6 0.3 . 1 . . . . 5 ASN ND2 . 16739 1
42 . 1 1 6 6 GLY H H 1 7.16 0.02 . 1 . . . . 6 GLY H . 16739 1
43 . 1 1 6 6 GLY HA2 H 1 1.54 0.02 . 2 . . . . 6 GLY HA2 . 16739 1
44 . 1 1 6 6 GLY HA3 H 1 3.37 0.02 . 2 . . . . 6 GLY HA3 . 16739 1
45 . 1 1 6 6 GLY CA C 13 43.0 0.3 . 1 . . . . 6 GLY CA . 16739 1
46 . 1 1 6 6 GLY N N 15 109.8 0.3 . 1 . . . . 6 GLY N . 16739 1
47 . 1 1 7 7 PRO HA H 1 3.98 0.02 . 1 . . . . 7 PRO HA . 16739 1
48 . 1 1 7 7 PRO HB2 H 1 1.20 0.02 . 2 . . . . 7 PRO HB2 . 16739 1
49 . 1 1 7 7 PRO HB3 H 1 1.87 0.02 . 2 . . . . 7 PRO HB3 . 16739 1
50 . 1 1 7 7 PRO HD2 H 1 2.93 0.02 . 2 . . . . 7 PRO HD2 . 16739 1
51 . 1 1 7 7 PRO HD3 H 1 3.09 0.02 . 2 . . . . 7 PRO HD3 . 16739 1
52 . 1 1 7 7 PRO HG2 H 1 1.50 0.02 . 2 . . . . 7 PRO HG2 . 16739 1
53 . 1 1 7 7 PRO HG3 H 1 1.78 0.02 . 2 . . . . 7 PRO HG3 . 16739 1
54 . 1 1 7 7 PRO C C 13 177.2 0.3 . 1 . . . . 7 PRO C . 16739 1
55 . 1 1 7 7 PRO CA C 13 64.3 0.3 . 1 . . . . 7 PRO CA . 16739 1
56 . 1 1 7 7 PRO CB C 13 30.9 0.3 . 1 . . . . 7 PRO CB . 16739 1
57 . 1 1 7 7 PRO CD C 13 49.1 0.3 . 1 . . . . 7 PRO CD . 16739 1
58 . 1 1 7 7 PRO CG C 13 27.0 0.3 . 1 . . . . 7 PRO CG . 16739 1
59 . 1 1 8 8 TRP H H 1 7.33 0.02 . 1 . . . . 8 TRP H . 16739 1
60 . 1 1 8 8 TRP HA H 1 4.76 0.02 . 1 . . . . 8 TRP HA . 16739 1
61 . 1 1 8 8 TRP HB2 H 1 3.15 0.02 . 2 . . . . 8 TRP HB2 . 16739 1
62 . 1 1 8 8 TRP HB3 H 1 3.45 0.02 . 2 . . . . 8 TRP HB3 . 16739 1
63 . 1 1 8 8 TRP HD1 H 1 7.16 0.02 . 1 . . . . 8 TRP HD1 . 16739 1
64 . 1 1 8 8 TRP HE1 H 1 10.20 0.02 . 1 . . . . 8 TRP HE1 . 16739 1
65 . 1 1 8 8 TRP HE3 H 1 7.70 0.02 . 1 . . . . 8 TRP HE3 . 16739 1
66 . 1 1 8 8 TRP HH2 H 1 7.36 0.02 . 1 . . . . 8 TRP HH2 . 16739 1
67 . 1 1 8 8 TRP HZ2 H 1 7.60 0.02 . 1 . . . . 8 TRP HZ2 . 16739 1
68 . 1 1 8 8 TRP HZ3 H 1 7.24 0.02 . 1 . . . . 8 TRP HZ3 . 16739 1
69 . 1 1 8 8 TRP C C 13 175.5 0.3 . 1 . . . . 8 TRP C . 16739 1
70 . 1 1 8 8 TRP CA C 13 56.1 0.3 . 1 . . . . 8 TRP CA . 16739 1
71 . 1 1 8 8 TRP CB C 13 28.4 0.3 . 1 . . . . 8 TRP CB . 16739 1
72 . 1 1 8 8 TRP CD1 C 13 127.0 0.3 . 1 . . . . 8 TRP CD1 . 16739 1
73 . 1 1 8 8 TRP CE3 C 13 120.5 0.3 . 1 . . . . 8 TRP CE3 . 16739 1
74 . 1 1 8 8 TRP CH2 C 13 124.6 0.3 . 1 . . . . 8 TRP CH2 . 16739 1
75 . 1 1 8 8 TRP CZ2 C 13 114.8 0.3 . 1 . . . . 8 TRP CZ2 . 16739 1
76 . 1 1 8 8 TRP CZ3 C 13 122.1 0.3 . 1 . . . . 8 TRP CZ3 . 16739 1
77 . 1 1 8 8 TRP N N 15 116.2 0.3 . 1 . . . . 8 TRP N . 16739 1
78 . 1 1 8 8 TRP NE1 N 15 130.6 0.3 . 1 . . . . 8 TRP NE1 . 16739 1
79 . 1 1 9 9 ASP H H 1 7.53 0.02 . 1 . . . . 9 ASP H . 16739 1
80 . 1 1 9 9 ASP HA H 1 4.64 0.02 . 1 . . . . 9 ASP HA . 16739 1
81 . 1 1 9 9 ASP HB2 H 1 2.40 0.02 . 2 . . . . 9 ASP HB2 . 16739 1
82 . 1 1 9 9 ASP HB3 H 1 2.50 0.02 . 2 . . . . 9 ASP HB3 . 16739 1
83 . 1 1 9 9 ASP C C 13 172.2 0.3 . 1 . . . . 9 ASP C . 16739 1
84 . 1 1 9 9 ASP CA C 13 53.4 0.3 . 1 . . . . 9 ASP CA . 16739 1
85 . 1 1 9 9 ASP CB C 13 40.0 0.3 . 1 . . . . 9 ASP CB . 16739 1
86 . 1 1 9 9 ASP N N 15 123.2 0.3 . 1 . . . . 9 ASP N . 16739 1
87 . 1 1 10 10 GLU H H 1 8.37 0.02 . 1 . . . . 10 GLU H . 16739 1
88 . 1 1 10 10 GLU HA H 1 4.87 0.02 . 1 . . . . 10 GLU HA . 16739 1
89 . 1 1 10 10 GLU HB2 H 1 1.96 0.02 . 2 . . . . 10 GLU HB2 . 16739 1
90 . 1 1 10 10 GLU HB3 H 1 2.09 0.02 . 2 . . . . 10 GLU HB3 . 16739 1
91 . 1 1 10 10 GLU HG2 H 1 2.25 0.02 . 2 . . . . 10 GLU HG2 . 16739 1
92 . 1 1 10 10 GLU HG3 H 1 2.44 0.02 . 2 . . . . 10 GLU HG3 . 16739 1
93 . 1 1 10 10 GLU C C 13 174.6 0.3 . 1 . . . . 10 GLU C . 16739 1
94 . 1 1 10 10 GLU CA C 13 54.6 0.3 . 1 . . . . 10 GLU CA . 16739 1
95 . 1 1 10 10 GLU CB C 13 29.6 0.3 . 1 . . . . 10 GLU CB . 16739 1
96 . 1 1 10 10 GLU CG C 13 33.4 0.3 . 1 . . . . 10 GLU CG . 16739 1
97 . 1 1 10 10 GLU N N 15 121.8 0.3 . 1 . . . . 10 GLU N . 16739 1
98 . 1 1 11 11 ASP H H 1 8.46 0.02 . 1 . . . . 11 ASP H . 16739 1
99 . 1 1 11 11 ASP HA H 1 4.88 0.02 . 1 . . . . 11 ASP HA . 16739 1
100 . 1 1 11 11 ASP HB2 H 1 2.59 0.02 . 2 . . . . 11 ASP HB2 . 16739 1
101 . 1 1 11 11 ASP HB3 H 1 3.04 0.02 . 2 . . . . 11 ASP HB3 . 16739 1
102 . 1 1 11 11 ASP C C 13 175.2 0.3 . 1 . . . . 11 ASP C . 16739 1
103 . 1 1 11 11 ASP CA C 13 51.8 0.3 . 1 . . . . 11 ASP CA . 16739 1
104 . 1 1 11 11 ASP CB C 13 40.5 0.3 . 1 . . . . 11 ASP CB . 16739 1
105 . 1 1 11 11 ASP N N 15 126.4 0.3 . 1 . . . . 11 ASP N . 16739 1
106 . 1 1 12 12 ASP H H 1 8.42 0.02 . 1 . . . . 12 ASP H . 16739 1
107 . 1 1 12 12 ASP HA H 1 4.38 0.02 . 1 . . . . 12 ASP HA . 16739 1
108 . 1 1 12 12 ASP HB2 H 1 2.95 0.02 . 2 . . . . 12 ASP HB2 . 16739 1
109 . 1 1 12 12 ASP HB3 H 1 2.68 0.02 . 2 . . . . 12 ASP HB3 . 16739 1
110 . 1 1 12 12 ASP C C 13 178.0 0.3 . 1 . . . . 12 ASP C . 16739 1
111 . 1 1 12 12 ASP CA C 13 57.7 0.3 . 1 . . . . 12 ASP CA . 16739 1
112 . 1 1 12 12 ASP CB C 13 41.2 0.3 . 1 . . . . 12 ASP CB . 16739 1
113 . 1 1 12 12 ASP N N 15 123.8 0.3 . 1 . . . . 12 ASP N . 16739 1
114 . 1 1 13 13 MET H H 1 8.41 0.02 . 1 . . . . 13 MET H . 16739 1
115 . 1 1 13 13 MET HA H 1 4.44 0.02 . 1 . . . . 13 MET HA . 16739 1
116 . 1 1 13 13 MET HB2 H 1 2.20 0.02 . 1 . . . . 13 MET HB2 . 16739 1
117 . 1 1 13 13 MET HE1 H 1 2.04 0.02 . 1 . . . . 13 MET HE . 16739 1
118 . 1 1 13 13 MET HE2 H 1 2.04 0.02 . 1 . . . . 13 MET HE . 16739 1
119 . 1 1 13 13 MET HE3 H 1 2.04 0.02 . 1 . . . . 13 MET HE . 16739 1
120 . 1 1 13 13 MET HG3 H 1 2.63 0.02 . 1 . . . . 13 MET HG3 . 16739 1
121 . 1 1 13 13 MET C C 13 178.4 0.3 . 1 . . . . 13 MET C . 16739 1
122 . 1 1 13 13 MET CA C 13 57.6 0.3 . 1 . . . . 13 MET CA . 16739 1
123 . 1 1 13 13 MET CB C 13 31.0 0.3 . 1 . . . . 13 MET CB . 16739 1
124 . 1 1 13 13 MET CE C 13 16.7 0.3 . 1 . . . . 13 MET CE . 16739 1
125 . 1 1 13 13 MET CG C 13 32.0 0.3 . 1 . . . . 13 MET CG . 16739 1
126 . 1 1 13 13 MET N N 15 119.3 0.3 . 1 . . . . 13 MET N . 16739 1
127 . 1 1 14 14 GLN H H 1 7.64 0.02 . 1 . . . . 14 GLN H . 16739 1
128 . 1 1 14 14 GLN HA H 1 4.10 0.02 . 1 . . . . 14 GLN HA . 16739 1
129 . 1 1 14 14 GLN HB2 H 1 2.05 0.02 . 2 . . . . 14 GLN HB2 . 16739 1
130 . 1 1 14 14 GLN HB3 H 1 2.12 0.02 . 2 . . . . 14 GLN HB3 . 16739 1
131 . 1 1 14 14 GLN HE21 H 1 7.72 0.02 . 1 . . . . 14 GLN HE21 . 16739 1
132 . 1 1 14 14 GLN HE22 H 1 6.99 0.02 . 1 . . . . 14 GLN HE22 . 16739 1
133 . 1 1 14 14 GLN HG2 H 1 2.49 0.02 . 2 . . . . 14 GLN HG2 . 16739 1
134 . 1 1 14 14 GLN HG3 H 1 2.18 0.02 . 2 . . . . 14 GLN HG3 . 16739 1
135 . 1 1 14 14 GLN C C 13 179.0 0.3 . 1 . . . . 14 GLN C . 16739 1
136 . 1 1 14 14 GLN CA C 13 58.9 0.3 . 1 . . . . 14 GLN CA . 16739 1
137 . 1 1 14 14 GLN CB C 13 28.7 0.3 . 1 . . . . 14 GLN CB . 16739 1
138 . 1 1 14 14 GLN CD C 13 179.8 0.3 . 1 . . . . 14 GLN CD . 16739 1
139 . 1 1 14 14 GLN CG C 13 34.1 0.3 . 1 . . . . 14 GLN CG . 16739 1
140 . 1 1 14 14 GLN N N 15 121.6 0.3 . 1 . . . . 14 GLN N . 16739 1
141 . 1 1 14 14 GLN NE2 N 15 112.4 0.3 . 1 . . . . 14 GLN NE2 . 16739 1
142 . 1 1 15 15 CYS H H 1 7.37 0.02 . 1 . . . . 15 CYS H . 16739 1
143 . 1 1 15 15 CYS HA H 1 4.83 0.02 . 1 . . . . 15 CYS HA . 16739 1
144 . 1 1 15 15 CYS HB2 H 1 2.63 0.02 . 2 . . . . 15 CYS HB2 . 16739 1
145 . 1 1 15 15 CYS HB3 H 1 3.74 0.02 . 2 . . . . 15 CYS HB3 . 16739 1
146 . 1 1 15 15 CYS C C 13 175.7 0.3 . 1 . . . . 15 CYS C . 16739 1
147 . 1 1 15 15 CYS CA C 13 58.5 0.3 . 1 . . . . 15 CYS CA . 16739 1
148 . 1 1 15 15 CYS CB C 13 35.9 0.3 . 1 . . . . 15 CYS CB . 16739 1
149 . 1 1 15 15 CYS N N 15 122.4 0.3 . 1 . . . . 15 CYS N . 16739 1
150 . 1 1 16 16 HIS H H 1 9.06 0.02 . 1 . . . . 16 HIS H . 16739 1
151 . 1 1 16 16 HIS HA H 1 3.85 0.02 . 1 . . . . 16 HIS HA . 16739 1
152 . 1 1 16 16 HIS HB2 H 1 3.52 0.02 . 2 . . . . 16 HIS HB2 . 16739 1
153 . 1 1 16 16 HIS HB3 H 1 3.52 0.02 . 2 . . . . 16 HIS HB3 . 16739 1
154 . 1 1 16 16 HIS HD2 H 1 7.21 0.02 . 1 . . . . 16 HIS HD2 . 16739 1
155 . 1 1 16 16 HIS HE1 H 1 8.22 0.02 . 1 . . . . 16 HIS HE1 . 16739 1
156 . 1 1 16 16 HIS C C 13 177.0 0.3 . 1 . . . . 16 HIS C . 16739 1
157 . 1 1 16 16 HIS CA C 13 60.5 0.3 . 1 . . . . 16 HIS CA . 16739 1
158 . 1 1 16 16 HIS CB C 13 30.2 0.3 . 1 . . . . 16 HIS CB . 16739 1
159 . 1 1 16 16 HIS CD2 C 13 118.7 0.3 . 1 . . . . 16 HIS CD2 . 16739 1
160 . 1 1 16 16 HIS CE1 C 13 138.5 0.3 . 1 . . . . 16 HIS CE1 . 16739 1
161 . 1 1 16 16 HIS N N 15 122.7 0.3 . 1 . . . . 16 HIS N . 16739 1
162 . 1 1 17 17 ASN H H 1 8.64 0.02 . 1 . . . . 17 ASN H . 16739 1
163 . 1 1 17 17 ASN HA H 1 4.31 0.02 . 1 . . . . 17 ASN HA . 16739 1
164 . 1 1 17 17 ASN HB2 H 1 2.80 0.02 . 2 . . . . 17 ASN HB2 . 16739 1
165 . 1 1 17 17 ASN HB3 H 1 2.90 0.02 . 2 . . . . 17 ASN HB3 . 16739 1
166 . 1 1 17 17 ASN HD21 H 1 7.59 0.02 . 1 . . . . 17 ASN HD21 . 16739 1
167 . 1 1 17 17 ASN HD22 H 1 6.94 0.02 . 1 . . . . 17 ASN HD22 . 16739 1
168 . 1 1 17 17 ASN C C 13 178.3 0.3 . 1 . . . . 17 ASN C . 16739 1
169 . 1 1 17 17 ASN CA C 13 55.7 0.3 . 1 . . . . 17 ASN CA . 16739 1
170 . 1 1 17 17 ASN CB C 13 37.5 0.3 . 1 . . . . 17 ASN CB . 16739 1
171 . 1 1 17 17 ASN CG C 13 175.7 0.3 . 1 . . . . 17 ASN CG . 16739 1
172 . 1 1 17 17 ASN N N 15 117.3 0.3 . 1 . . . . 17 ASN N . 16739 1
173 . 1 1 17 17 ASN ND2 N 15 112.4 0.3 . 1 . . . . 17 ASN ND2 . 16739 1
174 . 1 1 18 18 HIS H H 1 8.17 0.02 . 1 . . . . 18 HIS H . 16739 1
175 . 1 1 18 18 HIS HA H 1 4.29 0.02 . 1 . . . . 18 HIS HA . 16739 1
176 . 1 1 18 18 HIS HB2 H 1 3.26 0.02 . 2 . . . . 18 HIS HB2 . 16739 1
177 . 1 1 18 18 HIS HB3 H 1 3.63 0.02 . 2 . . . . 18 HIS HB3 . 16739 1
178 . 1 1 18 18 HIS HD2 H 1 6.67 0.02 . 1 . . . . 18 HIS HD2 . 16739 1
179 . 1 1 18 18 HIS HE1 H 1 8.04 0.02 . 1 . . . . 18 HIS HE1 . 16739 1
180 . 1 1 18 18 HIS C C 13 177.4 0.3 . 1 . . . . 18 HIS C . 16739 1
181 . 1 1 18 18 HIS CA C 13 58.7 0.3 . 1 . . . . 18 HIS CA . 16739 1
182 . 1 1 18 18 HIS CB C 13 27.1 0.3 . 1 . . . . 18 HIS CB . 16739 1
183 . 1 1 18 18 HIS CD2 C 13 120.0 0.3 . 1 . . . . 18 HIS CD2 . 16739 1
184 . 1 1 18 18 HIS CE1 C 13 136.8 0.3 . 1 . . . . 18 HIS CE1 . 16739 1
185 . 1 1 18 18 HIS N N 15 121.4 0.3 . 1 . . . . 18 HIS N . 16739 1
186 . 1 1 19 19 CYS H H 1 8.64 0.02 . 1 . . . . 19 CYS H . 16739 1
187 . 1 1 19 19 CYS HA H 1 3.68 0.02 . 1 . . . . 19 CYS HA . 16739 1
188 . 1 1 19 19 CYS HB3 H 1 2.23 0.02 . 1 . . . . 19 CYS HB3 . 16739 1
189 . 1 1 19 19 CYS CA C 13 58.3 0.3 . 1 . . . . 19 CYS CA . 16739 1
190 . 1 1 19 19 CYS CB C 13 37.2 0.3 . 1 . . . . 19 CYS CB . 16739 1
191 . 1 1 19 19 CYS N N 15 121.3 0.3 . 1 . . . . 19 CYS N . 16739 1
192 . 1 1 20 20 LYS H H 1 7.80 0.02 . 1 . . . . 20 LYS H . 16739 1
193 . 1 1 20 20 LYS HA H 1 3.72 0.02 . 1 . . . . 20 LYS HA . 16739 1
194 . 1 1 20 20 LYS HB2 H 1 1.55 0.02 . 1 . . . . 20 LYS HB2 . 16739 1
195 . 1 1 20 20 LYS HE3 H 1 2.96 0.02 . 1 . . . . 20 LYS HE3 . 16739 1
196 . 1 1 20 20 LYS HG2 H 1 1.18 0.02 . 1 . . . . 20 LYS HG2 . 16739 1
197 . 1 1 20 20 LYS C C 13 176.5 0.3 . 1 . . . . 20 LYS C . 16739 1
198 . 1 1 20 20 LYS CA C 13 57.8 0.3 . 1 . . . . 20 LYS CA . 16739 1
199 . 1 1 20 20 LYS CB C 13 31.2 0.3 . 1 . . . . 20 LYS CB . 16739 1
200 . 1 1 20 20 LYS CD C 13 28.8 0.3 . 1 . . . . 20 LYS CD . 16739 1
201 . 1 1 20 20 LYS CE C 13 41.6 0.3 . 1 . . . . 20 LYS CE . 16739 1
202 . 1 1 20 20 LYS CG C 13 24.6 0.3 . 1 . . . . 20 LYS CG . 16739 1
203 . 1 1 20 20 LYS N N 15 115.4 0.3 . 1 . . . . 20 LYS N . 16739 1
204 . 1 1 21 21 SER H H 1 7.21 0.02 . 1 . . . . 21 SER H . 16739 1
205 . 1 1 21 21 SER HA H 1 4.34 0.02 . 1 . . . . 21 SER HA . 16739 1
206 . 1 1 21 21 SER HB2 H 1 3.87 0.02 . 2 . . . . 21 SER HB2 . 16739 1
207 . 1 1 21 21 SER HB3 H 1 4.01 0.02 . 2 . . . . 21 SER HB3 . 16739 1
208 . 1 1 21 21 SER C C 13 173.0 0.3 . 1 . . . . 21 SER C . 16739 1
209 . 1 1 21 21 SER CA C 13 59.3 0.3 . 1 . . . . 21 SER CA . 16739 1
210 . 1 1 21 21 SER CB C 13 64.0 0.3 . 1 . . . . 21 SER CB . 16739 1
211 . 1 1 21 21 SER N N 15 114.6 0.3 . 1 . . . . 21 SER N . 16739 1
212 . 1 1 22 22 ILE H H 1 7.58 0.02 . 1 . . . . 22 ILE H . 16739 1
213 . 1 1 22 22 ILE HA H 1 4.01 0.02 . 1 . . . . 22 ILE HA . 16739 1
214 . 1 1 22 22 ILE HB H 1 2.02 0.02 . 1 . . . . 22 ILE HB . 16739 1
215 . 1 1 22 22 ILE HD11 H 1 0.50 0.02 . 1 . . . . 22 ILE HD1 . 16739 1
216 . 1 1 22 22 ILE HD12 H 1 0.50 0.02 . 1 . . . . 22 ILE HD1 . 16739 1
217 . 1 1 22 22 ILE HD13 H 1 0.50 0.02 . 1 . . . . 22 ILE HD1 . 16739 1
218 . 1 1 22 22 ILE HG12 H 1 0.73 0.02 . 2 . . . . 22 ILE HG12 . 16739 1
219 . 1 1 22 22 ILE HG13 H 1 1.34 0.02 . 2 . . . . 22 ILE HG13 . 16739 1
220 . 1 1 22 22 ILE HG21 H 1 0.82 0.02 . 1 . . . . 22 ILE HG2 . 16739 1
221 . 1 1 22 22 ILE HG22 H 1 0.82 0.02 . 1 . . . . 22 ILE HG2 . 16739 1
222 . 1 1 22 22 ILE HG23 H 1 0.82 0.02 . 1 . . . . 22 ILE HG2 . 16739 1
223 . 1 1 22 22 ILE C C 13 175.0 0.3 . 1 . . . . 22 ILE C . 16739 1
224 . 1 1 22 22 ILE CA C 13 60.7 0.3 . 1 . . . . 22 ILE CA . 16739 1
225 . 1 1 22 22 ILE CB C 13 38.4 0.3 . 1 . . . . 22 ILE CB . 16739 1
226 . 1 1 22 22 ILE CD1 C 13 13.1 0.3 . 1 . . . . 22 ILE CD1 . 16739 1
227 . 1 1 22 22 ILE CG1 C 13 26.6 0.3 . 1 . . . . 22 ILE CG1 . 16739 1
228 . 1 1 22 22 ILE CG2 C 13 17.4 0.3 . 1 . . . . 22 ILE CG2 . 16739 1
229 . 1 1 22 22 ILE N N 15 126.9 0.3 . 1 . . . . 22 ILE N . 16739 1
230 . 1 1 23 23 LYS H H 1 8.22 0.02 . 1 . . . . 23 LYS H . 16739 1
231 . 1 1 23 23 LYS HA H 1 3.91 0.02 . 1 . . . . 23 LYS HA . 16739 1
232 . 1 1 23 23 LYS HB2 H 1 1.66 0.02 . 2 . . . . 23 LYS HB2 . 16739 1
233 . 1 1 23 23 LYS HB3 H 1 1.75 0.02 . 2 . . . . 23 LYS HB3 . 16739 1
234 . 1 1 23 23 LYS HD3 H 1 1.65 0.02 . 1 . . . . 23 LYS HD3 . 16739 1
235 . 1 1 23 23 LYS HE3 H 1 2.96 0.02 . 1 . . . . 23 LYS HE3 . 16739 1
236 . 1 1 23 23 LYS HG2 H 1 1.32 0.02 . 2 . . . . 23 LYS HG2 . 16739 1
237 . 1 1 23 23 LYS HG3 H 1 1.44 0.02 . 2 . . . . 23 LYS HG3 . 16739 1
238 . 1 1 23 23 LYS C C 13 177.1 0.3 . 1 . . . . 23 LYS C . 16739 1
239 . 1 1 23 23 LYS CA C 13 58.4 0.3 . 1 . . . . 23 LYS CA . 16739 1
240 . 1 1 23 23 LYS CB C 13 32.0 0.3 . 1 . . . . 23 LYS CB . 16739 1
241 . 1 1 23 23 LYS CD C 13 29.1 0.3 . 1 . . . . 23 LYS CD . 16739 1
242 . 1 1 23 23 LYS CE C 13 42.0 0.3 . 1 . . . . 23 LYS CE . 16739 1
243 . 1 1 23 23 LYS CG C 13 24.4 0.3 . 1 . . . . 23 LYS CG . 16739 1
244 . 1 1 23 23 LYS N N 15 127.7 0.3 . 1 . . . . 23 LYS N . 16739 1
245 . 1 1 24 24 GLY H H 1 8.60 0.02 . 1 . . . . 24 GLY H . 16739 1
246 . 1 1 24 24 GLY HA2 H 1 3.47 0.02 . 2 . . . . 24 GLY HA2 . 16739 1
247 . 1 1 24 24 GLY HA3 H 1 4.09 0.02 . 2 . . . . 24 GLY HA3 . 16739 1
248 . 1 1 24 24 GLY C C 13 174.6 0.3 . 1 . . . . 24 GLY C . 16739 1
249 . 1 1 24 24 GLY CA C 13 44.6 0.3 . 1 . . . . 24 GLY CA . 16739 1
250 . 1 1 24 24 GLY N N 15 113.9 0.3 . 1 . . . . 24 GLY N . 16739 1
251 . 1 1 25 25 TYR H H 1 7.69 0.02 . 1 . . . . 25 TYR H . 16739 1
252 . 1 1 25 25 TYR HA H 1 4.92 0.02 . 1 . . . . 25 TYR HA . 16739 1
253 . 1 1 25 25 TYR HB2 H 1 2.81 0.02 . 2 . . . . 25 TYR HB2 . 16739 1
254 . 1 1 25 25 TYR HB3 H 1 3.15 0.02 . 2 . . . . 25 TYR HB3 . 16739 1
255 . 1 1 25 25 TYR C C 13 175.5 0.3 . 1 . . . . 25 TYR C . 16739 1
256 . 1 1 25 25 TYR CA C 13 56.5 0.3 . 1 . . . . 25 TYR CA . 16739 1
257 . 1 1 25 25 TYR CB C 13 38.7 0.3 . 1 . . . . 25 TYR CB . 16739 1
258 . 1 1 25 25 TYR N N 15 120.5 0.3 . 1 . . . . 25 TYR N . 16739 1
259 . 1 1 26 26 LYS H H 1 10.74 0.02 . 1 . . . . 26 LYS H . 16739 1
260 . 1 1 26 26 LYS HA H 1 4.43 0.02 . 1 . . . . 26 LYS HA . 16739 1
261 . 1 1 26 26 LYS HB2 H 1 1.77 0.02 . 2 . . . . 26 LYS HB2 . 16739 1
262 . 1 1 26 26 LYS HB3 H 1 1.86 0.02 . 2 . . . . 26 LYS HB3 . 16739 1
263 . 1 1 26 26 LYS HD2 H 1 1.79 0.02 . 1 . . . . 26 LYS HD2 . 16739 1
264 . 1 1 26 26 LYS HE2 H 1 3.09 0.02 . 1 . . . . 26 LYS HE2 . 16739 1
265 . 1 1 26 26 LYS HG2 H 1 1.49 0.02 . 2 . . . . 26 LYS HG2 . 16739 1
266 . 1 1 26 26 LYS HG3 H 1 1.54 0.02 . 2 . . . . 26 LYS HG3 . 16739 1
267 . 1 1 26 26 LYS C C 13 176.3 0.3 . 1 . . . . 26 LYS C . 16739 1
268 . 1 1 26 26 LYS CA C 13 55.8 0.3 . 1 . . . . 26 LYS CA . 16739 1
269 . 1 1 26 26 LYS CB C 13 35.0 0.3 . 1 . . . . 26 LYS CB . 16739 1
270 . 1 1 26 26 LYS CD C 13 29.2 0.3 . 1 . . . . 26 LYS CD . 16739 1
271 . 1 1 26 26 LYS CE C 13 42.1 0.3 . 1 . . . . 26 LYS CE . 16739 1
272 . 1 1 26 26 LYS CG C 13 24.6 0.3 . 1 . . . . 26 LYS CG . 16739 1
273 . 1 1 26 26 LYS N N 15 121.7 0.3 . 1 . . . . 26 LYS N . 16739 1
274 . 1 1 27 27 GLY H H 1 7.40 0.02 . 1 . . . . 27 GLY H . 16739 1
275 . 1 1 27 27 GLY HA2 H 1 3.26 0.02 . 2 . . . . 27 GLY HA2 . 16739 1
276 . 1 1 27 27 GLY HA3 H 1 3.58 0.02 . 2 . . . . 27 GLY HA3 . 16739 1
277 . 1 1 27 27 GLY C C 13 169.8 0.3 . 1 . . . . 27 GLY C . 16739 1
278 . 1 1 27 27 GLY CA C 13 45.3 0.3 . 1 . . . . 27 GLY CA . 16739 1
279 . 1 1 27 27 GLY N N 15 107.4 0.3 . 1 . . . . 27 GLY N . 16739 1
280 . 1 1 28 28 GLY H H 1 8.34 0.02 . 1 . . . . 28 GLY H . 16739 1
281 . 1 1 28 28 GLY HA2 H 1 4.26 0.02 . 2 . . . . 28 GLY HA2 . 16739 1
282 . 1 1 28 28 GLY HA3 H 1 4.88 0.02 . 2 . . . . 28 GLY HA3 . 16739 1
283 . 1 1 28 28 GLY C C 13 170.6 0.3 . 1 . . . . 28 GLY C . 16739 1
284 . 1 1 28 28 GLY CA C 13 47.2 0.3 . 1 . . . . 28 GLY CA . 16739 1
285 . 1 1 28 28 GLY N N 15 107.7 0.3 . 1 . . . . 28 GLY N . 16739 1
286 . 1 1 29 29 TYR H H 1 8.49 0.02 . 1 . . . . 29 TYR H . 16739 1
287 . 1 1 29 29 TYR HA H 1 4.80 0.02 . 1 . . . . 29 TYR HA . 16739 1
288 . 1 1 29 29 TYR HB2 H 1 3.09 0.02 . 2 . . . . 29 TYR HB2 . 16739 1
289 . 1 1 29 29 TYR HB3 H 1 3.25 0.02 . 2 . . . . 29 TYR HB3 . 16739 1
290 . 1 1 29 29 TYR C C 13 173.2 0.3 . 1 . . . . 29 TYR C . 16739 1
291 . 1 1 29 29 TYR CA C 13 55.8 0.3 . 1 . . . . 29 TYR CA . 16739 1
292 . 1 1 29 29 TYR CB C 13 40.5 0.3 . 1 . . . . 29 TYR CB . 16739 1
293 . 1 1 29 29 TYR N N 15 116.9 0.3 . 1 . . . . 29 TYR N . 16739 1
294 . 1 1 30 30 CYS H H 1 8.99 0.02 . 1 . . . . 30 CYS H . 16739 1
295 . 1 1 30 30 CYS HA H 1 5.49 0.02 . 1 . . . . 30 CYS HA . 16739 1
296 . 1 1 30 30 CYS HB2 H 1 2.58 0.02 . 2 . . . . 30 CYS HB2 . 16739 1
297 . 1 1 30 30 CYS HB3 H 1 2.89 0.02 . 2 . . . . 30 CYS HB3 . 16739 1
298 . 1 1 30 30 CYS C C 13 174.7 0.3 . 1 . . . . 30 CYS C . 16739 1
299 . 1 1 30 30 CYS CA C 13 52.9 0.3 . 1 . . . . 30 CYS CA . 16739 1
300 . 1 1 30 30 CYS CB C 13 36.3 0.3 . 1 . . . . 30 CYS CB . 16739 1
301 . 1 1 30 30 CYS N N 15 118.2 0.3 . 1 . . . . 30 CYS N . 16739 1
302 . 1 1 31 31 ALA H H 1 9.46 0.02 . 1 . . . . 31 ALA H . 16739 1
303 . 1 1 31 31 ALA HA H 1 4.71 0.02 . 1 . . . . 31 ALA HA . 16739 1
304 . 1 1 31 31 ALA HB1 H 1 1.46 0.02 . 1 . . . . 31 ALA HB . 16739 1
305 . 1 1 31 31 ALA HB2 H 1 1.46 0.02 . 1 . . . . 31 ALA HB . 16739 1
306 . 1 1 31 31 ALA HB3 H 1 1.46 0.02 . 1 . . . . 31 ALA HB . 16739 1
307 . 1 1 31 31 ALA C C 13 176.7 0.3 . 1 . . . . 31 ALA C . 16739 1
308 . 1 1 31 31 ALA CA C 13 50.9 0.3 . 1 . . . . 31 ALA CA . 16739 1
309 . 1 1 31 31 ALA CB C 13 22.0 0.3 . 1 . . . . 31 ALA CB . 16739 1
310 . 1 1 31 31 ALA N N 15 130.3 0.3 . 1 . . . . 31 ALA N . 16739 1
311 . 1 1 32 32 LYS H H 1 8.88 0.02 . 1 . . . . 32 LYS H . 16739 1
312 . 1 1 32 32 LYS HA H 1 4.00 0.02 . 1 . . . . 32 LYS HA . 16739 1
313 . 1 1 32 32 LYS HB2 H 1 1.87 0.02 . 2 . . . . 32 LYS HB2 . 16739 1
314 . 1 1 32 32 LYS HB3 H 1 1.95 0.02 . 2 . . . . 32 LYS HB3 . 16739 1
315 . 1 1 32 32 LYS HD2 H 1 1.71 0.02 . 1 . . . . 32 LYS HD2 . 16739 1
316 . 1 1 32 32 LYS HG2 H 1 1.42 0.02 . 2 . . . . 32 LYS HG2 . 16739 1
317 . 1 1 32 32 LYS HG3 H 1 1.50 0.02 . 2 . . . . 32 LYS HG3 . 16739 1
318 . 1 1 32 32 LYS C C 13 177.9 0.3 . 1 . . . . 32 LYS C . 16739 1
319 . 1 1 32 32 LYS CA C 13 57.0 0.3 . 1 . . . . 32 LYS CA . 16739 1
320 . 1 1 32 32 LYS CB C 13 30.6 0.3 . 1 . . . . 32 LYS CB . 16739 1
321 . 1 1 32 32 LYS CD C 13 29.0 0.3 . 1 . . . . 32 LYS CD . 16739 1
322 . 1 1 32 32 LYS CE C 13 42.1 0.3 . 1 . . . . 32 LYS CE . 16739 1
323 . 1 1 32 32 LYS CG C 13 24.8 0.3 . 1 . . . . 32 LYS CG . 16739 1
324 . 1 1 32 32 LYS N N 15 120.7 0.3 . 1 . . . . 32 LYS N . 16739 1
325 . 1 1 33 33 GLY H H 1 8.81 0.02 . 1 . . . . 33 GLY H . 16739 1
326 . 1 1 33 33 GLY HA2 H 1 3.65 0.02 . 2 . . . . 33 GLY HA2 . 16739 1
327 . 1 1 33 33 GLY HA3 H 1 4.27 0.02 . 2 . . . . 33 GLY HA3 . 16739 1
328 . 1 1 33 33 GLY C C 13 174.1 0.3 . 1 . . . . 33 GLY C . 16739 1
329 . 1 1 33 33 GLY CA C 13 45.7 0.3 . 1 . . . . 33 GLY CA . 16739 1
330 . 1 1 33 33 GLY N N 15 112.5 0.3 . 1 . . . . 33 GLY N . 16739 1
331 . 1 1 34 34 GLY H H 1 7.59 0.02 . 1 . . . . 34 GLY H . 16739 1
332 . 1 1 34 34 GLY HA2 H 1 3.18 0.02 . 2 . . . . 34 GLY HA2 . 16739 1
333 . 1 1 34 34 GLY HA3 H 1 3.58 0.02 . 2 . . . . 34 GLY HA3 . 16739 1
334 . 1 1 34 34 GLY C C 13 174.1 0.3 . 1 . . . . 34 GLY C . 16739 1
335 . 1 1 34 34 GLY CA C 13 44.8 0.3 . 1 . . . . 34 GLY CA . 16739 1
336 . 1 1 34 34 GLY N N 15 104.1 0.3 . 1 . . . . 34 GLY N . 16739 1
337 . 1 1 35 35 PHE H H 1 7.54 0.02 . 1 . . . . 35 PHE H . 16739 1
338 . 1 1 35 35 PHE HA H 1 4.30 0.02 . 1 . . . . 35 PHE HA . 16739 1
339 . 1 1 35 35 PHE HB2 H 1 2.71 0.02 . 2 . . . . 35 PHE HB2 . 16739 1
340 . 1 1 35 35 PHE HB3 H 1 3.31 0.02 . 2 . . . . 35 PHE HB3 . 16739 1
341 . 1 1 35 35 PHE C C 13 175.3 0.3 . 1 . . . . 35 PHE C . 16739 1
342 . 1 1 35 35 PHE CA C 13 60.0 0.3 . 1 . . . . 35 PHE CA . 16739 1
343 . 1 1 35 35 PHE CB C 13 41.3 0.3 . 1 . . . . 35 PHE CB . 16739 1
344 . 1 1 35 35 PHE N N 15 117.8 0.3 . 1 . . . . 35 PHE N . 16739 1
345 . 1 1 36 36 VAL H H 1 7.63 0.02 . 1 . . . . 36 VAL H . 16739 1
346 . 1 1 36 36 VAL HA H 1 4.36 0.02 . 1 . . . . 36 VAL HA . 16739 1
347 . 1 1 36 36 VAL HB H 1 1.74 0.02 . 1 . . . . 36 VAL HB . 16739 1
348 . 1 1 36 36 VAL HG11 H 1 0.82 0.02 . 1 . . . . 36 VAL HG1 . 16739 1
349 . 1 1 36 36 VAL HG12 H 1 0.82 0.02 . 1 . . . . 36 VAL HG1 . 16739 1
350 . 1 1 36 36 VAL HG13 H 1 0.82 0.02 . 1 . . . . 36 VAL HG1 . 16739 1
351 . 1 1 36 36 VAL HG21 H 1 0.94 0.02 . 1 . . . . 36 VAL HG2 . 16739 1
352 . 1 1 36 36 VAL HG22 H 1 0.94 0.02 . 1 . . . . 36 VAL HG2 . 16739 1
353 . 1 1 36 36 VAL HG23 H 1 0.94 0.02 . 1 . . . . 36 VAL HG2 . 16739 1
354 . 1 1 36 36 VAL C C 13 174.4 0.3 . 1 . . . . 36 VAL C . 16739 1
355 . 1 1 36 36 VAL CA C 13 60.9 0.3 . 1 . . . . 36 VAL CA . 16739 1
356 . 1 1 36 36 VAL CB C 13 35.4 0.3 . 1 . . . . 36 VAL CB . 16739 1
357 . 1 1 36 36 VAL CG1 C 13 20.4 0.3 . 1 . . . . 36 VAL CG1 . 16739 1
358 . 1 1 36 36 VAL CG2 C 13 21.5 0.3 . 1 . . . . 36 VAL CG2 . 16739 1
359 . 1 1 36 36 VAL N N 15 118.9 0.3 . 1 . . . . 36 VAL N . 16739 1
360 . 1 1 37 37 CYS H H 1 8.80 0.02 . 1 . . . . 37 CYS H . 16739 1
361 . 1 1 37 37 CYS HA H 1 5.13 0.02 . 1 . . . . 37 CYS HA . 16739 1
362 . 1 1 37 37 CYS HB2 H 1 2.59 0.02 . 2 . . . . 37 CYS HB2 . 16739 1
363 . 1 1 37 37 CYS HB3 H 1 3.27 0.02 . 2 . . . . 37 CYS HB3 . 16739 1
364 . 1 1 37 37 CYS C C 13 172.3 0.3 . 1 . . . . 37 CYS C . 16739 1
365 . 1 1 37 37 CYS CA C 13 55.5 0.3 . 1 . . . . 37 CYS CA . 16739 1
366 . 1 1 37 37 CYS CB C 13 35.3 0.3 . 1 . . . . 37 CYS CB . 16739 1
367 . 1 1 37 37 CYS N N 15 127.4 0.3 . 1 . . . . 37 CYS N . 16739 1
368 . 1 1 38 38 LYS H H 1 9.06 0.02 . 1 . . . . 38 LYS H . 16739 1
369 . 1 1 38 38 LYS HA H 1 4.33 0.02 . 1 . . . . 38 LYS HA . 16739 1
370 . 1 1 38 38 LYS HB2 H 1 1.57 0.02 . 2 . . . . 38 LYS HB2 . 16739 1
371 . 1 1 38 38 LYS HB3 H 1 1.16 0.02 . 2 . . . . 38 LYS HB3 . 16739 1
372 . 1 1 38 38 LYS HD2 H 1 1.24 0.02 . 1 . . . . 38 LYS HD2 . 16739 1
373 . 1 1 38 38 LYS HE2 H 1 3.01 0.02 . 1 . . . . 38 LYS HE2 . 16739 1
374 . 1 1 38 38 LYS HG2 H 1 1.16 0.02 . 2 . . . . 38 LYS HG2 . 16739 1
375 . 1 1 38 38 LYS HG3 H 1 1.23 0.02 . 2 . . . . 38 LYS HG3 . 16739 1
376 . 1 1 38 38 LYS C C 13 173.6 0.3 . 1 . . . . 38 LYS C . 16739 1
377 . 1 1 38 38 LYS CA C 13 54.6 0.3 . 1 . . . . 38 LYS CA . 16739 1
378 . 1 1 38 38 LYS CB C 13 34.1 0.3 . 1 . . . . 38 LYS CB . 16739 1
379 . 1 1 38 38 LYS CD C 13 28.8 0.3 . 1 . . . . 38 LYS CD . 16739 1
380 . 1 1 38 38 LYS CE C 13 42.3 0.3 . 1 . . . . 38 LYS CE . 16739 1
381 . 1 1 38 38 LYS CG C 13 24.8 0.3 . 1 . . . . 38 LYS CG . 16739 1
382 . 1 1 38 38 LYS N N 15 137.0 0.3 . 1 . . . . 38 LYS N . 16739 1
383 . 1 1 39 39 CYS H H 1 7.96 0.02 . 1 . . . . 39 CYS H . 16739 1
384 . 1 1 39 39 CYS HA H 1 5.32 0.02 . 1 . . . . 39 CYS HA . 16739 1
385 . 1 1 39 39 CYS HB2 H 1 1.32 0.02 . 2 . . . . 39 CYS HB2 . 16739 1
386 . 1 1 39 39 CYS HB3 H 1 1.98 0.02 . 2 . . . . 39 CYS HB3 . 16739 1
387 . 1 1 39 39 CYS C C 13 174.2 0.3 . 1 . . . . 39 CYS C . 16739 1
388 . 1 1 39 39 CYS CA C 13 51.2 0.3 . 1 . . . . 39 CYS CA . 16739 1
389 . 1 1 39 39 CYS CB C 13 34.6 0.3 . 1 . . . . 39 CYS CB . 16739 1
390 . 1 1 39 39 CYS N N 15 122.2 0.3 . 1 . . . . 39 CYS N . 16739 1
391 . 1 1 40 40 TYR H H 1 8.28 0.02 . 1 . . . . 40 TYR H . 16739 1
392 . 1 1 40 40 TYR HA H 1 4.63 0.02 . 1 . . . . 40 TYR HA . 16739 1
393 . 1 1 40 40 TYR HB2 H 1 2.75 0.02 . 2 . . . . 40 TYR HB2 . 16739 1
394 . 1 1 40 40 TYR HB3 H 1 3.24 0.02 . 2 . . . . 40 TYR HB3 . 16739 1
395 . 1 1 40 40 TYR CA C 13 58.3 0.3 . 1 . . . . 40 TYR CA . 16739 1
396 . 1 1 40 40 TYR CB C 13 40.2 0.3 . 1 . . . . 40 TYR CB . 16739 1
397 . 1 1 40 40 TYR N N 15 126.9 0.3 . 1 . . . . 40 TYR N . 16739 1
stop_
save_