###################################
# 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_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 36054
_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 $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-1H TOCSY' 1 $sample_1 isotropic 36054 1
2 '2D DQF-COSY' 1 $sample_1 isotropic 36054 1
3 '2D 1H-1H NOESY' 1 $sample_1 isotropic 36054 1
4 '2D 1H-13C HSQC' 1 $sample_1 isotropic 36054 1
5 '2D 1H-13C HSQC-TOCSY' 1 $sample_1 isotropic 36054 1
6 '2D 1H-15N HSQC' 1 $sample_1 isotropic 36054 1
7 '2D 1H-1H TOCSY' 2 $sample_2 isotropic 36054 1
8 '2D DQF-COSY' 2 $sample_2 isotropic 36054 1
9 '2D 1H-1H NOESY' 2 $sample_2 isotropic 36054 1
10 '2D 1H-13C HSQC' 2 $sample_2 isotropic 36054 1
11 '2D 1H-13C HSQC-TOCSY' 2 $sample_2 isotropic 36054 1
12 '2D 1H-13C H2BC' 2 $sample_2 isotropic 36054 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 THR HA H 1 3.9280 0.02 . 1 . . . A 1 THR HA . 36054 1
2 . 1 1 1 1 THR HB H 1 4.1100 0.02 . 1 . . . A 1 THR HB . 36054 1
3 . 1 1 1 1 THR HG21 H 1 1.2140 0.02 . 1 . . . A 1 THR HG21 . 36054 1
4 . 1 1 1 1 THR HG22 H 1 1.2140 0.02 . 1 . . . A 1 THR HG22 . 36054 1
5 . 1 1 1 1 THR HG23 H 1 1.2140 0.02 . 1 . . . A 1 THR HG23 . 36054 1
6 . 1 1 1 1 THR CA C 13 61.0500 0.3 . 1 . . . A 1 THR CA . 36054 1
7 . 1 1 1 1 THR CB C 13 69.4800 0.3 . 1 . . . A 1 THR CB . 36054 1
8 . 1 1 1 1 THR CG2 C 13 21.8000 0.3 . 1 . . . A 1 THR CG2 . 36054 1
9 . 1 1 2 2 GLN H H 1 9.2400 0.02 . 1 . . . A 2 GLN H . 36054 1
10 . 1 1 2 2 GLN HA H 1 4.8040 0.02 . 1 . . . A 2 GLN HA . 36054 1
11 . 1 1 2 2 GLN HB2 H 1 1.7530 0.02 . 1 . . . A 2 GLN HB2 . 36054 1
12 . 1 1 2 2 GLN HB3 H 1 1.8780 0.02 . 1 . . . A 2 GLN HB3 . 36054 1
13 . 1 1 2 2 GLN HG2 H 1 2.2630 0.02 . 2 . . . A 2 GLN HG2 . 36054 1
14 . 1 1 2 2 GLN HG3 H 1 2.6690 0.02 . 2 . . . A 2 GLN HG3 . 36054 1
15 . 1 1 2 2 GLN HE21 H 1 8.8830 0.02 . 1 . . . A 2 GLN HE21 . 36054 1
16 . 1 1 2 2 GLN HE22 H 1 7.2500 0.02 . 1 . . . A 2 GLN HE22 . 36054 1
17 . 1 1 2 2 GLN CA C 13 54.5000 0.3 . 1 . . . A 2 GLN CA . 36054 1
18 . 1 1 2 2 GLN CB C 13 30.9900 0.3 . 1 . . . A 2 GLN CB . 36054 1
19 . 1 1 2 2 GLN CG C 13 32.8600 0.3 . 1 . . . A 2 GLN CG . 36054 1
20 . 1 1 2 2 GLN N N 15 122.8200 0.2 . 1 . . . A 2 GLN N . 36054 1
21 . 1 1 2 2 GLN NE2 N 15 116.5000 0.2 . 1 . . . A 2 GLN NE2 . 36054 1
22 . 1 1 3 3 SER H H 1 9.0530 0.02 . 1 . . . A 3 SER H . 36054 1
23 . 1 1 3 3 SER HA H 1 4.4960 0.02 . 1 . . . A 3 SER HA . 36054 1
24 . 1 1 3 3 SER HB2 H 1 4.2170 0.02 . 2 . . . A 3 SER HB2 . 36054 1
25 . 1 1 3 3 SER HB3 H 1 3.9900 0.02 . 2 . . . A 3 SER HB3 . 36054 1
26 . 1 1 3 3 SER CA C 13 56.0620 0.3 . 1 . . . A 3 SER CA . 36054 1
27 . 1 1 3 3 SER CB C 13 71.9700 0.3 . 1 . . . A 3 SER CB . 36054 1
28 . 1 1 3 3 SER N N 15 120.5300 0.2 . 1 . . . A 3 SER N . 36054 1
29 . 1 1 4 4 HIS H H 1 8.7790 0.02 . 1 . . . A 4 HIS H . 36054 1
30 . 1 1 4 4 HIS HA H 1 4.0470 0.02 . 1 . . . A 4 HIS HA . 36054 1
31 . 1 1 4 4 HIS HB2 H 1 2.9230 0.02 . 1 . . . A 4 HIS HB2 . 36054 1
32 . 1 1 4 4 HIS HB3 H 1 3.0790 0.02 . 1 . . . A 4 HIS HB3 . 36054 1
33 . 1 1 4 4 HIS HD2 H 1 6.7550 0.02 . 1 . . . A 4 HIS HD2 . 36054 1
34 . 1 1 4 4 HIS HE1 H 1 8.4940 0.02 . 1 . . . A 4 HIS HE1 . 36054 1
35 . 1 1 4 4 HIS CA C 13 55.8800 0.3 . 1 . . . A 4 HIS CA . 36054 1
36 . 1 1 4 4 HIS CB C 13 28.9000 0.3 . 1 . . . A 4 HIS CB . 36054 1
37 . 1 1 4 4 HIS CD2 C 13 118.2000 0.3 . 1 . . . A 4 HIS CD2 . 36054 1
38 . 1 1 4 4 HIS CE1 C 13 136.2300 0.3 . 1 . . . A 4 HIS CE1 . 36054 1
39 . 1 1 4 4 HIS N N 15 120.6100 0.2 . 1 . . . A 4 HIS N . 36054 1
40 . 1 1 5 5 TYR H H 1 9.3400 0.02 . 1 . . . A 5 TYR H . 36054 1
41 . 1 1 5 5 TYR HA H 1 4.0520 0.02 . 1 . . . A 5 TYR HA . 36054 1
42 . 1 1 5 5 TYR HB2 H 1 3.2770 0.02 . 2 . . . A 5 TYR HB2 . 36054 1
43 . 1 1 5 5 TYR HB3 H 1 3.0300 0.02 . 2 . . . A 5 TYR HB3 . 36054 1
44 . 1 1 5 5 TYR HD1 H 1 6.7690 0.02 . 3 . . . A 5 TYR HD1 . 36054 1
45 . 1 1 5 5 TYR HD2 H 1 6.7690 0.02 . 3 . . . A 5 TYR HD2 . 36054 1
46 . 1 1 5 5 TYR HE1 H 1 6.4400 0.02 . 3 . . . A 5 TYR HE1 . 36054 1
47 . 1 1 5 5 TYR HE2 H 1 6.4400 0.02 . 3 . . . A 5 TYR HE2 . 36054 1
48 . 1 1 5 5 TYR CA C 13 61.6680 0.3 . 1 . . . A 5 TYR CA . 36054 1
49 . 1 1 5 5 TYR CB C 13 36.0000 0.3 . 1 . . . A 5 TYR CB . 36054 1
50 . 1 1 5 5 TYR CD1 C 13 132.5800 0.3 . 3 . . . A 5 TYR CD1 . 36054 1
51 . 1 1 5 5 TYR CD2 C 13 132.5800 0.3 . 3 . . . A 5 TYR CD2 . 36054 1
52 . 1 1 5 5 TYR CE1 C 13 117.5400 0.3 . 3 . . . A 5 TYR CE1 . 36054 1
53 . 1 1 5 5 TYR CE2 C 13 117.5400 0.3 . 3 . . . A 5 TYR CE2 . 36054 1
54 . 1 1 5 5 TYR N N 15 120.6000 0.2 . 1 . . . A 5 TYR N . 36054 1
55 . 1 1 6 6 GLY H H 1 8.7530 0.02 . 1 . . . A 6 GLY H . 36054 1
56 . 1 1 6 6 GLY HA2 H 1 4.2280 0.02 . 1 . . . A 6 GLY HA2 . 36054 1
57 . 1 1 6 6 GLY HA3 H 1 3.4460 0.02 . 1 . . . A 6 GLY HA3 . 36054 1
58 . 1 1 6 6 GLY CA C 13 44.6000 0.3 . 1 . . . A 6 GLY CA . 36054 1
59 . 1 1 6 6 GLY N N 15 110.1800 0.2 . 1 . . . A 6 GLY N . 36054 1
60 . 1 1 7 7 GLN H H 1 8.6760 0.02 . 1 . . . A 7 GLN H . 36054 1
61 . 1 1 7 7 GLN HA H 1 4.2720 0.02 . 1 . . . A 7 GLN HA . 36054 1
62 . 1 1 7 7 GLN HB2 H 1 2.0630 0.02 . 1 . . . A 7 GLN HB2 . 36054 1
63 . 1 1 7 7 GLN HB3 H 1 1.6780 0.02 . 1 . . . A 7 GLN HB3 . 36054 1
64 . 1 1 7 7 GLN HG2 H 1 1.0390 0.02 . 2 . . . A 7 GLN HG2 . 36054 1
65 . 1 1 7 7 GLN HG3 H 1 2.2760 0.02 . 2 . . . A 7 GLN HG3 . 36054 1
66 . 1 1 7 7 GLN HE21 H 1 7.1900 0.02 . 1 . . . A 7 GLN HE21 . 36054 1
67 . 1 1 7 7 GLN HE22 H 1 6.9900 0.02 . 1 . . . A 7 GLN HE22 . 36054 1
68 . 1 1 7 7 GLN CA C 13 56.0900 0.3 . 1 . . . A 7 GLN CA . 36054 1
69 . 1 1 7 7 GLN CB C 13 27.5300 0.3 . 1 . . . A 7 GLN CB . 36054 1
70 . 1 1 7 7 GLN CG C 13 33.3600 0.3 . 1 . . . A 7 GLN CG . 36054 1
71 . 1 1 7 7 GLN N N 15 123.2000 0.2 . 1 . . . A 7 GLN N . 36054 1
72 . 1 1 7 7 GLN NE2 N 15 109.3000 0.2 . 1 . . . A 7 GLN NE2 . 36054 1
73 . 1 1 8 8 CYS H H 1 7.9500 0.02 . 1 . . . A 8 CYS H . 36054 1
74 . 1 1 8 8 CYS HA H 1 5.1970 0.02 . 1 . . . A 8 CYS HA . 36054 1
75 . 1 1 8 8 CYS HB2 H 1 3.4700 0.02 . 1 . . . A 8 CYS HB2 . 36054 1
76 . 1 1 8 8 CYS HB3 H 1 2.8050 0.02 . 1 . . . A 8 CYS HB3 . 36054 1
77 . 1 1 8 8 CYS CA C 13 55.5000 0.3 . 1 . . . A 8 CYS CA . 36054 1
78 . 1 1 8 8 CYS CB C 13 46.8800 0.3 . 1 . . . A 8 CYS CB . 36054 1
79 . 1 1 8 8 CYS N N 15 115.7900 0.2 . 1 . . . A 8 CYS N . 36054 1
80 . 1 1 9 9 GLY H H 1 6.6540 0.02 . 1 . . . A 9 GLY H . 36054 1
81 . 1 1 9 9 GLY HA2 H 1 4.2260 0.02 . 2 . . . A 9 GLY HA2 . 36054 1
82 . 1 1 9 9 GLY HA3 H 1 3.8170 0.02 . 2 . . . A 9 GLY HA3 . 36054 1
83 . 1 1 9 9 GLY CA C 13 45.4000 0.3 . 1 . . . A 9 GLY CA . 36054 1
84 . 1 1 9 9 GLY N N 15 108.1610 0.2 . 1 . . . A 9 GLY N . 36054 1
85 . 1 1 10 10 GLY H H 1 8.6060 0.02 . 1 . . . A 10 GLY H . 36054 1
86 . 1 1 10 10 GLY HA2 H 1 3.8160 0.02 . 1 . . . A 10 GLY HA2 . 36054 1
87 . 1 1 10 10 GLY HA3 H 1 4.3120 0.02 . 1 . . . A 10 GLY HA3 . 36054 1
88 . 1 1 10 10 GLY CA C 13 43.4700 0.3 . 1 . . . A 10 GLY CA . 36054 1
89 . 1 1 10 10 GLY N N 15 112.0090 0.2 . 1 . . . A 10 GLY N . 36054 1
90 . 1 1 11 11 ILE H H 1 8.3670 0.02 . 1 . . . A 11 ILE H . 36054 1
91 . 1 1 11 11 ILE HA H 1 3.7890 0.02 . 1 . . . A 11 ILE HA . 36054 1
92 . 1 1 11 11 ILE HB H 1 1.2600 0.02 . 1 . . . A 11 ILE HB . 36054 1
93 . 1 1 11 11 ILE HG12 H 1 0.9630 0.02 . 1 . . . A 11 ILE HG12 . 36054 1
94 . 1 1 11 11 ILE HG13 H 1 1.4950 0.02 . 1 . . . A 11 ILE HG13 . 36054 1
95 . 1 1 11 11 ILE HG21 H 1 0.8950 0.02 . 1 . . . A 11 ILE HG21 . 36054 1
96 . 1 1 11 11 ILE HG22 H 1 0.8950 0.02 . 1 . . . A 11 ILE HG22 . 36054 1
97 . 1 1 11 11 ILE HG23 H 1 0.8950 0.02 . 1 . . . A 11 ILE HG23 . 36054 1
98 . 1 1 11 11 ILE HD11 H 1 0.4700 0.02 . 1 . . . A 11 ILE HD11 . 36054 1
99 . 1 1 11 11 ILE HD12 H 1 0.4700 0.02 . 1 . . . A 11 ILE HD12 . 36054 1
100 . 1 1 11 11 ILE HD13 H 1 0.4700 0.02 . 1 . . . A 11 ILE HD13 . 36054 1
101 . 1 1 11 11 ILE CA C 13 64.4200 0.3 . 1 . . . A 11 ILE CA . 36054 1
102 . 1 1 11 11 ILE CB C 13 38.3100 0.3 . 1 . . . A 11 ILE CB . 36054 1
103 . 1 1 11 11 ILE CG1 C 13 28.8000 0.3 . 1 . . . A 11 ILE CG1 . 36054 1
104 . 1 1 11 11 ILE CG2 C 13 17.1300 0.3 . 1 . . . A 11 ILE CG2 . 36054 1
105 . 1 1 11 11 ILE CD1 C 13 13.3900 0.3 . 1 . . . A 11 ILE CD1 . 36054 1
106 . 1 1 11 11 ILE N N 15 124.8000 0.2 . 1 . . . A 11 ILE N . 36054 1
107 . 1 1 12 12 GLY H H 1 9.0700 0.02 . 1 . . . A 12 GLY H . 36054 1
108 . 1 1 12 12 GLY HA2 H 1 3.7350 0.02 . 1 . . . A 12 GLY HA2 . 36054 1
109 . 1 1 12 12 GLY HA3 H 1 4.3120 0.02 . 1 . . . A 12 GLY HA3 . 36054 1
110 . 1 1 12 12 GLY CA C 13 45.3400 0.3 . 1 . . . A 12 GLY CA . 36054 1
111 . 1 1 12 12 GLY N N 15 117.0920 0.2 . 1 . . . A 12 GLY N . 36054 1
112 . 1 1 13 13 TYR H H 1 7.9430 0.02 . 1 . . . A 13 TYR H . 36054 1
113 . 1 1 13 13 TYR HA H 1 4.6170 0.02 . 1 . . . A 13 TYR HA . 36054 1
114 . 1 1 13 13 TYR HB2 H 1 2.8110 0.02 . 1 . . . A 13 TYR HB2 . 36054 1
115 . 1 1 13 13 TYR HB3 H 1 2.8760 0.02 . 1 . . . A 13 TYR HB3 . 36054 1
116 . 1 1 13 13 TYR HD1 H 1 6.8930 0.02 . 3 . . . A 13 TYR HD1 . 36054 1
117 . 1 1 13 13 TYR HD2 H 1 6.8930 0.02 . 3 . . . A 13 TYR HD2 . 36054 1
118 . 1 1 13 13 TYR HE1 H 1 6.4600 0.02 . 3 . . . A 13 TYR HE1 . 36054 1
119 . 1 1 13 13 TYR HE2 H 1 6.4600 0.02 . 3 . . . A 13 TYR HE2 . 36054 1
120 . 1 1 13 13 TYR CA C 13 58.2880 0.3 . 1 . . . A 13 TYR CA . 36054 1
121 . 1 1 13 13 TYR CB C 13 38.9200 0.3 . 1 . . . A 13 TYR CB . 36054 1
122 . 1 1 13 13 TYR CD1 C 13 133.0400 0.3 . 3 . . . A 13 TYR CD1 . 36054 1
123 . 1 1 13 13 TYR CD2 C 13 133.0400 0.3 . 3 . . . A 13 TYR CD2 . 36054 1
124 . 1 1 13 13 TYR CE1 C 13 117.8600 0.3 . 3 . . . A 13 TYR CE1 . 36054 1
125 . 1 1 13 13 TYR CE2 C 13 117.8600 0.3 . 3 . . . A 13 TYR CE2 . 36054 1
126 . 1 1 13 13 TYR N N 15 121.8800 0.2 . 1 . . . A 13 TYR N . 36054 1
127 . 1 1 14 14 SER H H 1 8.4060 0.02 . 1 . . . A 14 SER H . 36054 1
128 . 1 1 14 14 SER HA H 1 4.5100 0.02 . 1 . . . A 14 SER HA . 36054 1
129 . 1 1 14 14 SER HB2 H 1 3.7800 0.02 . 2 . . . A 14 SER HB2 . 36054 1
130 . 1 1 14 14 SER HB3 H 1 3.6230 0.02 . 2 . . . A 14 SER HB3 . 36054 1
131 . 1 1 14 14 SER CA C 13 57.1500 0.3 . 1 . . . A 14 SER CA . 36054 1
132 . 1 1 14 14 SER CB C 13 64.0500 0.3 . 1 . . . A 14 SER CB . 36054 1
133 . 1 1 14 14 SER N N 15 123.7500 0.2 . 1 . . . A 14 SER N . 36054 1
134 . 1 1 15 15 GLY H H 1 5.1870 0.02 . 1 . . . A 15 GLY H . 36054 1
135 . 1 1 15 15 GLY HA2 H 1 4.0380 0.02 . 2 . . . A 15 GLY HA2 . 36054 1
136 . 1 1 15 15 GLY HA3 H 1 3.6480 0.02 . 2 . . . A 15 GLY HA3 . 36054 1
137 . 1 1 15 15 GLY CA C 13 44.9400 0.3 . 1 . . . A 15 GLY CA . 36054 1
138 . 1 1 15 15 GLY N N 15 108.4900 0.2 . 1 . . . A 15 GLY N . 36054 1
139 . 1 1 16 16 PRO HA H 1 4.4900 0.02 . 1 . . . A 16 PRO HA . 36054 1
140 . 1 1 16 16 PRO HB2 H 1 1.7690 0.02 . 1 . . . A 16 PRO HB2 . 36054 1
141 . 1 1 16 16 PRO HB3 H 1 2.3540 0.02 . 1 . . . A 16 PRO HB3 . 36054 1
142 . 1 1 16 16 PRO HG2 H 1 2.0100 0.02 . 1 . . . A 16 PRO HG2 . 36054 1
143 . 1 1 16 16 PRO HG3 H 1 2.0410 0.02 . 1 . . . A 16 PRO HG3 . 36054 1
144 . 1 1 16 16 PRO HD2 H 1 3.5040 0.02 . 1 . . . A 16 PRO HD2 . 36054 1
145 . 1 1 16 16 PRO HD3 H 1 3.6720 0.02 . 1 . . . A 16 PRO HD3 . 36054 1
146 . 1 1 16 16 PRO CA C 13 63.3300 0.3 . 1 . . . A 16 PRO CA . 36054 1
147 . 1 1 16 16 PRO CB C 13 32.5800 0.3 . 1 . . . A 16 PRO CB . 36054 1
148 . 1 1 16 16 PRO CG C 13 27.6200 0.3 . 1 . . . A 16 PRO CG . 36054 1
149 . 1 1 16 16 PRO CD C 13 49.8300 0.3 . 1 . . . A 16 PRO CD . 36054 1
150 . 1 1 17 17 THR H H 1 8.3870 0.02 . 1 . . . A 17 THR H . 36054 1
151 . 1 1 17 17 THR HA H 1 4.7170 0.02 . 1 . . . A 17 THR HA . 36054 1
152 . 1 1 17 17 THR HB H 1 4.5980 0.02 . 1 . . . A 17 THR HB . 36054 1
153 . 1 1 17 17 THR HG21 H 1 1.3160 0.02 . 1 . . . A 17 THR HG21 . 36054 1
154 . 1 1 17 17 THR HG22 H 1 1.3160 0.02 . 1 . . . A 17 THR HG22 . 36054 1
155 . 1 1 17 17 THR HG23 H 1 1.3160 0.02 . 1 . . . A 17 THR HG23 . 36054 1
156 . 1 1 17 17 THR CA C 13 61.4360 0.3 . 1 . . . A 17 THR CA . 36054 1
157 . 1 1 17 17 THR CB C 13 70.5340 0.3 . 1 . . . A 17 THR CB . 36054 1
158 . 1 1 17 17 THR CG2 C 13 21.6980 0.3 . 1 . . . A 17 THR CG2 . 36054 1
159 . 1 1 17 17 THR N N 15 110.8100 0.2 . 1 . . . A 17 THR N . 36054 1
160 . 1 1 18 18 VAL H H 1 7.2380 0.02 . 1 . . . A 18 VAL H . 36054 1
161 . 1 1 18 18 VAL HA H 1 4.0950 0.02 . 1 . . . A 18 VAL HA . 36054 1
162 . 1 1 18 18 VAL HB H 1 1.9950 0.02 . 1 . . . A 18 VAL HB . 36054 1
163 . 1 1 18 18 VAL HG11 H 1 0.9620 0.02 . 1 . . . A 18 VAL HG11 . 36054 1
164 . 1 1 18 18 VAL HG12 H 1 0.9620 0.02 . 1 . . . A 18 VAL HG12 . 36054 1
165 . 1 1 18 18 VAL HG13 H 1 0.9620 0.02 . 1 . . . A 18 VAL HG13 . 36054 1
166 . 1 1 18 18 VAL HG21 H 1 0.9620 0.02 . 1 . . . A 18 VAL HG21 . 36054 1
167 . 1 1 18 18 VAL HG22 H 1 0.9620 0.02 . 1 . . . A 18 VAL HG22 . 36054 1
168 . 1 1 18 18 VAL HG23 H 1 0.9620 0.02 . 1 . . . A 18 VAL HG23 . 36054 1
169 . 1 1 18 18 VAL CA C 13 61.9600 0.3 . 1 . . . A 18 VAL CA . 36054 1
170 . 1 1 18 18 VAL CB C 13 32.4400 0.3 . 1 . . . A 18 VAL CB . 36054 1
171 . 1 1 18 18 VAL CG1 C 13 21.1600 0.3 . 1 . . . A 18 VAL CG1 . 36054 1
172 . 1 1 18 18 VAL CG2 C 13 21.1600 0.3 . 1 . . . A 18 VAL CG2 . 36054 1
173 . 1 1 18 18 VAL N N 15 121.2700 0.2 . 1 . . . A 18 VAL N . 36054 1
174 . 1 1 19 19 CYS H H 1 8.6980 0.02 . 1 . . . A 19 CYS H . 36054 1
175 . 1 1 19 19 CYS HA H 1 4.5690 0.02 . 1 . . . A 19 CYS HA . 36054 1
176 . 1 1 19 19 CYS HB2 H 1 2.2470 0.02 . 1 . . . A 19 CYS HB2 . 36054 1
177 . 1 1 19 19 CYS HB3 H 1 3.6380 0.02 . 1 . . . A 19 CYS HB3 . 36054 1
178 . 1 1 19 19 CYS CA C 13 55.4000 0.3 . 1 . . . A 19 CYS CA . 36054 1
179 . 1 1 19 19 CYS CB C 13 39.6200 0.3 . 1 . . . A 19 CYS CB . 36054 1
180 . 1 1 19 19 CYS N N 15 126.7100 0.2 . 1 . . . A 19 CYS N . 36054 1
181 . 1 1 20 20 ALA H H 1 8.0480 0.02 . 1 . . . A 20 ALA H . 36054 1
182 . 1 1 20 20 ALA HA H 1 4.0480 0.02 . 1 . . . A 20 ALA HA . 36054 1
183 . 1 1 20 20 ALA HB1 H 1 1.3220 0.02 . 1 . . . A 20 ALA HB1 . 36054 1
184 . 1 1 20 20 ALA HB2 H 1 1.3220 0.02 . 1 . . . A 20 ALA HB2 . 36054 1
185 . 1 1 20 20 ALA HB3 H 1 1.3220 0.02 . 1 . . . A 20 ALA HB3 . 36054 1
186 . 1 1 20 20 ALA CA C 13 52.1900 0.3 . 1 . . . A 20 ALA CA . 36054 1
187 . 1 1 20 20 ALA CB C 13 19.4400 0.3 . 1 . . . A 20 ALA CB . 36054 1
188 . 1 1 20 20 ALA N N 15 124.0300 0.2 . 1 . . . A 20 ALA N . 36054 1
189 . 1 1 21 21 SER H H 1 8.4350 0.02 . 1 . . . A 21 SER H . 36054 1
190 . 1 1 21 21 SER HA H 1 4.1770 0.02 . 1 . . . A 21 SER HA . 36054 1
191 . 1 1 21 21 SER HB2 H 1 3.8420 0.02 . 1 . . . A 21 SER HB2 . 36054 1
192 . 1 1 21 21 SER HB3 H 1 3.8420 0.02 . 1 . . . A 21 SER HB3 . 36054 1
193 . 1 1 21 21 SER CA C 13 60.2000 0.3 . 1 . . . A 21 SER CA . 36054 1
194 . 1 1 21 21 SER CB C 13 62.9500 0.3 . 1 . . . A 21 SER CB . 36054 1
195 . 1 1 21 21 SER N N 15 115.4700 0.2 . 1 . . . A 21 SER N . 36054 1
196 . 1 1 22 22 GLY H H 1 8.8800 0.02 . 1 . . . A 22 GLY H . 36054 1
197 . 1 1 22 22 GLY HA2 H 1 3.6000 0.02 . 1 . . . A 22 GLY HA2 . 36054 1
198 . 1 1 22 22 GLY HA3 H 1 4.2970 0.02 . 1 . . . A 22 GLY HA3 . 36054 1
199 . 1 1 22 22 GLY CA C 13 44.9000 0.3 . 1 . . . A 22 GLY CA . 36054 1
200 . 1 1 22 22 GLY N N 15 114.1800 0.2 . 1 . . . A 22 GLY N . 36054 1
201 . 1 1 23 23 THR H H 1 8.1100 0.02 . 1 . . . A 23 THR H . 36054 1
202 . 1 1 23 23 THR HA H 1 4.6890 0.02 . 1 . . . A 23 THR HA . 36054 1
203 . 1 1 23 23 THR HB H 1 3.7440 0.02 . 1 . . . A 23 THR HB . 36054 1
204 . 1 1 23 23 THR HG21 H 1 0.4120 0.02 . 1 . . . A 23 THR HG21 . 36054 1
205 . 1 1 23 23 THR HG22 H 1 0.4120 0.02 . 1 . . . A 23 THR HG22 . 36054 1
206 . 1 1 23 23 THR HG23 H 1 0.4120 0.02 . 1 . . . A 23 THR HG23 . 36054 1
207 . 1 1 23 23 THR CA C 13 59.5500 0.3 . 1 . . . A 23 THR CA . 36054 1
208 . 1 1 23 23 THR CB C 13 72.5700 0.3 . 1 . . . A 23 THR CB . 36054 1
209 . 1 1 23 23 THR CG2 C 13 22.1800 0.3 . 1 . . . A 23 THR CG2 . 36054 1
210 . 1 1 23 23 THR N N 15 110.7400 0.2 . 1 . . . A 23 THR N . 36054 1
211 . 1 1 24 24 THR H H 1 9.3610 0.02 . 1 . . . A 24 THR H . 36054 1
212 . 1 1 24 24 THR HA H 1 4.4800 0.02 . 1 . . . A 24 THR HA . 36054 1
213 . 1 1 24 24 THR HB H 1 4.0060 0.02 . 1 . . . A 24 THR HB . 36054 1
214 . 1 1 24 24 THR HG21 H 1 1.1160 0.02 . 1 . . . A 24 THR HG21 . 36054 1
215 . 1 1 24 24 THR HG22 H 1 1.1160 0.02 . 1 . . . A 24 THR HG22 . 36054 1
216 . 1 1 24 24 THR HG23 H 1 1.1160 0.02 . 1 . . . A 24 THR HG23 . 36054 1
217 . 1 1 24 24 THR CA C 13 60.4700 0.3 . 1 . . . A 24 THR CA . 36054 1
218 . 1 1 24 24 THR CB C 13 72.4470 0.3 . 1 . . . A 24 THR CB . 36054 1
219 . 1 1 24 24 THR CG2 C 13 21.9800 0.3 . 1 . . . A 24 THR CG2 . 36054 1
220 . 1 1 24 24 THR N N 15 112.2400 0.2 . 1 . . . A 24 THR N . 36054 1
221 . 1 1 25 25 CYS H H 1 8.8220 0.02 . 1 . . . A 25 CYS H . 36054 1
222 . 1 1 25 25 CYS HA H 1 4.5840 0.02 . 1 . . . A 25 CYS HA . 36054 1
223 . 1 1 25 25 CYS HB2 H 1 3.1550 0.02 . 1 . . . A 25 CYS HB2 . 36054 1
224 . 1 1 25 25 CYS HB3 H 1 2.9200 0.02 . 1 . . . A 25 CYS HB3 . 36054 1
225 . 1 1 25 25 CYS CA C 13 56.1800 0.3 . 1 . . . A 25 CYS CA . 36054 1
226 . 1 1 25 25 CYS CB C 13 38.8600 0.3 . 1 . . . A 25 CYS CB . 36054 1
227 . 1 1 25 25 CYS N N 15 122.0600 0.2 . 1 . . . A 25 CYS N . 36054 1
228 . 1 1 26 26 GLN H H 1 9.0290 0.02 . 1 . . . A 26 GLN H . 36054 1
229 . 1 1 26 26 GLN HA H 1 4.5910 0.02 . 1 . . . A 26 GLN HA . 36054 1
230 . 1 1 26 26 GLN HB2 H 1 1.9290 0.02 . 1 . . . A 26 GLN HB2 . 36054 1
231 . 1 1 26 26 GLN HB3 H 1 2.0550 0.02 . 1 . . . A 26 GLN HB3 . 36054 1
232 . 1 1 26 26 GLN HG2 H 1 2.2460 0.02 . 2 . . . A 26 GLN HG2 . 36054 1
233 . 1 1 26 26 GLN HG3 H 1 2.4250 0.02 . 2 . . . A 26 GLN HG3 . 36054 1
234 . 1 1 26 26 GLN HE21 H 1 7.0240 0.02 . 1 . . . A 26 GLN HE21 . 36054 1
235 . 1 1 26 26 GLN HE22 H 1 6.7280 0.02 . 1 . . . A 26 GLN HE22 . 36054 1
236 . 1 1 26 26 GLN CA C 13 55.0300 0.3 . 1 . . . A 26 GLN CA . 36054 1
237 . 1 1 26 26 GLN CB C 13 30.3300 0.3 . 1 . . . A 26 GLN CB . 36054 1
238 . 1 1 26 26 GLN CG C 13 33.6300 0.3 . 1 . . . A 26 GLN CG . 36054 1
239 . 1 1 26 26 GLN N N 15 133.5950 0.2 . 1 . . . A 26 GLN N . 36054 1
240 . 1 1 26 26 GLN NE2 N 15 112.2600 0.2 . 1 . . . A 26 GLN NE2 . 36054 1
241 . 1 1 27 27 VAL H H 1 8.6370 0.02 . 1 . . . A 27 VAL H . 36054 1
242 . 1 1 27 27 VAL HA H 1 4.0570 0.02 . 1 . . . A 27 VAL HA . 36054 1
243 . 1 1 27 27 VAL HB H 1 1.9200 0.02 . 1 . . . A 27 VAL HB . 36054 1
244 . 1 1 27 27 VAL HG11 H 1 0.6740 0.02 . 1 . . . A 27 VAL HG11 . 36054 1
245 . 1 1 27 27 VAL HG12 H 1 0.6740 0.02 . 1 . . . A 27 VAL HG12 . 36054 1
246 . 1 1 27 27 VAL HG13 H 1 0.6740 0.02 . 1 . . . A 27 VAL HG13 . 36054 1
247 . 1 1 27 27 VAL HG21 H 1 0.9030 0.02 . 1 . . . A 27 VAL HG21 . 36054 1
248 . 1 1 27 27 VAL HG22 H 1 0.9030 0.02 . 1 . . . A 27 VAL HG22 . 36054 1
249 . 1 1 27 27 VAL HG23 H 1 0.9030 0.02 . 1 . . . A 27 VAL HG23 . 36054 1
250 . 1 1 27 27 VAL CA C 13 63.4500 0.3 . 1 . . . A 27 VAL CA . 36054 1
251 . 1 1 27 27 VAL CB C 13 32.7100 0.3 . 1 . . . A 27 VAL CB . 36054 1
252 . 1 1 27 27 VAL CG1 C 13 20.9000 0.3 . 1 . . . A 27 VAL CG1 . 36054 1
253 . 1 1 27 27 VAL CG2 C 13 21.0000 0.3 . 1 . . . A 27 VAL CG2 . 36054 1
254 . 1 1 27 27 VAL N N 15 125.7370 0.2 . 1 . . . A 27 VAL N . 36054 1
255 . 1 1 28 28 LEU H H 1 8.6260 0.02 . 1 . . . A 28 LEU H . 36054 1
256 . 1 1 28 28 LEU HA H 1 4.7050 0.02 . 1 . . . A 28 LEU HA . 36054 1
257 . 1 1 28 28 LEU HB2 H 1 1.9060 0.02 . 1 . . . A 28 LEU HB2 . 36054 1
258 . 1 1 28 28 LEU HB3 H 1 1.7880 0.02 . 1 . . . A 28 LEU HB3 . 36054 1
259 . 1 1 28 28 LEU HG H 1 1.7900 0.02 . 1 . . . A 28 LEU HG . 36054 1
260 . 1 1 28 28 LEU HD11 H 1 1.0120 0.02 . 2 . . . A 28 LEU HD11 . 36054 1
261 . 1 1 28 28 LEU HD12 H 1 1.0120 0.02 . 2 . . . A 28 LEU HD12 . 36054 1
262 . 1 1 28 28 LEU HD13 H 1 1.0120 0.02 . 2 . . . A 28 LEU HD13 . 36054 1
263 . 1 1 28 28 LEU HD21 H 1 0.9170 0.02 . 2 . . . A 28 LEU HD21 . 36054 1
264 . 1 1 28 28 LEU HD22 H 1 0.9170 0.02 . 2 . . . A 28 LEU HD22 . 36054 1
265 . 1 1 28 28 LEU HD23 H 1 0.9170 0.02 . 2 . . . A 28 LEU HD23 . 36054 1
266 . 1 1 28 28 LEU CA C 13 56.7000 0.3 . 1 . . . A 28 LEU CA . 36054 1
267 . 1 1 28 28 LEU CB C 13 42.4600 0.3 . 1 . . . A 28 LEU CB . 36054 1
268 . 1 1 28 28 LEU CG C 13 28.4800 0.3 . 1 . . . A 28 LEU CG . 36054 1
269 . 1 1 28 28 LEU CD1 C 13 25.1800 0.3 . 2 . . . A 28 LEU CD1 . 36054 1
270 . 1 1 28 28 LEU CD2 C 13 23.8800 0.3 . 2 . . . A 28 LEU CD2 . 36054 1
271 . 1 1 28 28 LEU N N 15 130.4300 0.2 . 1 . . . A 28 LEU N . 36054 1
272 . 1 1 29 29 ASN H H 1 8.6020 0.02 . 1 . . . A 29 ASN H . 36054 1
273 . 1 1 29 29 ASN HA H 1 4.8920 0.02 . 1 . . . A 29 ASN HA . 36054 1
274 . 1 1 29 29 ASN HB2 H 1 3.2110 0.02 . 1 . . . A 29 ASN HB2 . 36054 1
275 . 1 1 29 29 ASN HB3 H 1 3.2110 0.02 . 1 . . . A 29 ASN HB3 . 36054 1
276 . 1 1 29 29 ASN HD21 H 1 7.8510 0.02 . 1 . . . A 29 ASN HD21 . 36054 1
277 . 1 1 29 29 ASN HD22 H 1 7.0420 0.02 . 1 . . . A 29 ASN HD22 . 36054 1
278 . 1 1 29 29 ASN CA C 13 53.0000 0.3 . 1 . . . A 29 ASN CA . 36054 1
279 . 1 1 29 29 ASN CB C 13 37.6000 0.3 . 1 . . . A 29 ASN CB . 36054 1
280 . 1 1 29 29 ASN N N 15 115.5900 0.2 . 1 . . . A 29 ASN N . 36054 1
281 . 1 1 29 29 ASN ND2 N 15 115.3200 0.2 . 1 . . . A 29 ASN ND2 . 36054 1
282 . 1 1 30 30 PRO HA H 1 4.1920 0.02 . 1 . . . A 30 PRO HA . 36054 1
283 . 1 1 30 30 PRO HB2 H 1 1.2110 0.02 . 1 . . . A 30 PRO HB2 . 36054 1
284 . 1 1 30 30 PRO HB3 H 1 2.2340 0.02 . 1 . . . A 30 PRO HB3 . 36054 1
285 . 1 1 30 30 PRO HG2 H 1 2.0850 0.02 . 1 . . . A 30 PRO HG2 . 36054 1
286 . 1 1 30 30 PRO HG3 H 1 1.8940 0.02 . 1 . . . A 30 PRO HG3 . 36054 1
287 . 1 1 30 30 PRO HD2 H 1 3.6860 0.02 . 1 . . . A 30 PRO HD2 . 36054 1
288 . 1 1 30 30 PRO HD3 H 1 3.9100 0.02 . 1 . . . A 30 PRO HD3 . 36054 1
289 . 1 1 30 30 PRO CA C 13 65.9000 0.3 . 1 . . . A 30 PRO CA . 36054 1
290 . 1 1 30 30 PRO CB C 13 31.9900 0.3 . 1 . . . A 30 PRO CB . 36054 1
291 . 1 1 30 30 PRO CG C 13 28.2500 0.3 . 1 . . . A 30 PRO CG . 36054 1
292 . 1 1 30 30 PRO CD C 13 51.1780 0.3 . 1 . . . A 30 PRO CD . 36054 1
293 . 1 1 31 31 TYR H H 1 8.6520 0.02 . 1 . . . A 31 TYR H . 36054 1
294 . 1 1 31 31 TYR HA H 1 4.3800 0.02 . 1 . . . A 31 TYR HA . 36054 1
295 . 1 1 31 31 TYR HB2 H 1 2.8730 0.02 . 1 . . . A 31 TYR HB2 . 36054 1
296 . 1 1 31 31 TYR HB3 H 1 3.3700 0.02 . 1 . . . A 31 TYR HB3 . 36054 1
297 . 1 1 31 31 TYR HD1 H 1 7.0300 0.02 . 3 . . . A 31 TYR HD1 . 36054 1
298 . 1 1 31 31 TYR HD2 H 1 7.0300 0.02 . 3 . . . A 31 TYR HD2 . 36054 1
299 . 1 1 31 31 TYR HE1 H 1 6.6930 0.02 . 3 . . . A 31 TYR HE1 . 36054 1
300 . 1 1 31 31 TYR HE2 H 1 6.6930 0.02 . 3 . . . A 31 TYR HE2 . 36054 1
301 . 1 1 31 31 TYR CA C 13 58.5900 0.3 . 1 . . . A 31 TYR CA . 36054 1
302 . 1 1 31 31 TYR CB C 13 39.2500 0.3 . 1 . . . A 31 TYR CB . 36054 1
303 . 1 1 31 31 TYR CD1 C 13 133.5300 0.3 . 3 . . . A 31 TYR CD1 . 36054 1
304 . 1 1 31 31 TYR CD2 C 13 133.5300 0.3 . 3 . . . A 31 TYR CD2 . 36054 1
305 . 1 1 31 31 TYR CE1 C 13 118.1800 0.3 . 3 . . . A 31 TYR CE1 . 36054 1
306 . 1 1 31 31 TYR CE2 C 13 118.1800 0.3 . 3 . . . A 31 TYR CE2 . 36054 1
307 . 1 1 31 31 TYR N N 15 112.8900 0.2 . 1 . . . A 31 TYR N . 36054 1
308 . 1 1 32 32 TYR H H 1 7.8990 0.02 . 1 . . . A 32 TYR H . 36054 1
309 . 1 1 32 32 TYR HA H 1 4.5730 0.02 . 1 . . . A 32 TYR HA . 36054 1
310 . 1 1 32 32 TYR HB2 H 1 2.8180 0.02 . 1 . . . A 32 TYR HB2 . 36054 1
311 . 1 1 32 32 TYR HB3 H 1 2.6580 0.02 . 1 . . . A 32 TYR HB3 . 36054 1
312 . 1 1 32 32 TYR HD1 H 1 6.8210 0.02 . 3 . . . A 32 TYR HD1 . 36054 1
313 . 1 1 32 32 TYR HD2 H 1 6.8210 0.02 . 3 . . . A 32 TYR HD2 . 36054 1
314 . 1 1 32 32 TYR HE1 H 1 6.4600 0.02 . 3 . . . A 32 TYR HE1 . 36054 1
315 . 1 1 32 32 TYR HE2 H 1 6.4600 0.02 . 3 . . . A 32 TYR HE2 . 36054 1
316 . 1 1 32 32 TYR CA C 13 61.3300 0.3 . 1 . . . A 32 TYR CA . 36054 1
317 . 1 1 32 32 TYR CB C 13 42.7100 0.3 . 1 . . . A 32 TYR CB . 36054 1
318 . 1 1 32 32 TYR CD1 C 13 132.6800 0.3 . 3 . . . A 32 TYR CD1 . 36054 1
319 . 1 1 32 32 TYR CD2 C 13 132.6800 0.3 . 3 . . . A 32 TYR CD2 . 36054 1
320 . 1 1 32 32 TYR CE1 C 13 117.9100 0.3 . 3 . . . A 32 TYR CE1 . 36054 1
321 . 1 1 32 32 TYR CE2 C 13 117.9100 0.3 . 3 . . . A 32 TYR CE2 . 36054 1
322 . 1 1 32 32 TYR N N 15 124.6600 0.2 . 1 . . . A 32 TYR N . 36054 1
323 . 1 1 33 33 SER H H 1 6.6640 0.02 . 1 . . . A 33 SER H . 36054 1
324 . 1 1 33 33 SER HA H 1 5.1680 0.02 . 1 . . . A 33 SER HA . 36054 1
325 . 1 1 33 33 SER HB2 H 1 2.8340 0.02 . 1 . . . A 33 SER HB2 . 36054 1
326 . 1 1 33 33 SER HB3 H 1 3.5260 0.02 . 1 . . . A 33 SER HB3 . 36054 1
327 . 1 1 33 33 SER CA C 13 56.1760 0.3 . 1 . . . A 33 SER CA . 36054 1
328 . 1 1 33 33 SER CB C 13 65.8800 0.3 . 1 . . . A 33 SER CB . 36054 1
329 . 1 1 33 33 SER N N 15 124.5000 0.2 . 1 . . . A 33 SER N . 36054 1
330 . 1 1 34 34 GLN H H 1 9.0540 0.02 . 1 . . . A 34 GLN H . 36054 1
331 . 1 1 34 34 GLN HA H 1 4.7960 0.02 . 1 . . . A 34 GLN HA . 36054 1
332 . 1 1 34 34 GLN HB2 H 1 1.5870 0.02 . 2 . . . A 34 GLN HB2 . 36054 1
333 . 1 1 34 34 GLN HB3 H 1 1.8730 0.02 . 2 . . . A 34 GLN HB3 . 36054 1
334 . 1 1 34 34 GLN HG2 H 1 2.0320 0.02 . 2 . . . A 34 GLN HG2 . 36054 1
335 . 1 1 34 34 GLN HG3 H 1 2.1060 0.02 . 2 . . . A 34 GLN HG3 . 36054 1
336 . 1 1 34 34 GLN HE21 H 1 7.7440 0.02 . 1 . . . A 34 GLN HE21 . 36054 1
337 . 1 1 34 34 GLN HE22 H 1 6.6290 0.02 . 1 . . . A 34 GLN HE22 . 36054 1
338 . 1 1 34 34 GLN CA C 13 54.3200 0.3 . 1 . . . A 34 GLN CA . 36054 1
339 . 1 1 34 34 GLN CB C 13 34.5200 0.3 . 1 . . . A 34 GLN CB . 36054 1
340 . 1 1 34 34 GLN CG C 13 33.9700 0.3 . 1 . . . A 34 GLN CG . 36054 1
341 . 1 1 34 34 GLN N N 15 127.3800 0.2 . 1 . . . A 34 GLN N . 36054 1
342 . 1 1 34 34 GLN NE2 N 15 108.6500 0.2 . 1 . . . A 34 GLN NE2 . 36054 1
343 . 1 1 35 35 CYS H H 1 8.4820 0.02 . 1 . . . A 35 CYS H . 36054 1
344 . 1 1 35 35 CYS HA H 1 5.0500 0.02 . 1 . . . A 35 CYS HA . 36054 1
345 . 1 1 35 35 CYS HB2 H 1 3.0160 0.02 . 2 . . . A 35 CYS HB2 . 36054 1
346 . 1 1 35 35 CYS HB3 H 1 2.9410 0.02 . 2 . . . A 35 CYS HB3 . 36054 1
347 . 1 1 35 35 CYS CA C 13 53.7300 0.3 . 1 . . . A 35 CYS CA . 36054 1
348 . 1 1 35 35 CYS CB C 13 37.7400 0.3 . 1 . . . A 35 CYS CB . 36054 1
349 . 1 1 35 35 CYS N N 15 123.6200 0.2 . 1 . . . A 35 CYS N . 36054 1
350 . 1 1 36 36 LEU H H 1 9.0480 0.02 . 1 . . . A 36 LEU H . 36054 1
351 . 1 1 36 36 LEU HA H 1 4.4890 0.02 . 1 . . . A 36 LEU HA . 36054 1
352 . 1 1 36 36 LEU HB2 H 1 1.5680 0.02 . 1 . . . A 36 LEU HB2 . 36054 1
353 . 1 1 36 36 LEU HB3 H 1 1.5680 0.02 . 1 . . . A 36 LEU HB3 . 36054 1
354 . 1 1 36 36 LEU HG H 1 1.3360 0.02 . 1 . . . A 36 LEU HG . 36054 1
355 . 1 1 36 36 LEU HD11 H 1 0.9290 0.02 . 2 . . . A 36 LEU HD11 . 36054 1
356 . 1 1 36 36 LEU HD12 H 1 0.9290 0.02 . 2 . . . A 36 LEU HD12 . 36054 1
357 . 1 1 36 36 LEU HD13 H 1 0.9290 0.02 . 2 . . . A 36 LEU HD13 . 36054 1
358 . 1 1 36 36 LEU HD21 H 1 0.9880 0.02 . 2 . . . A 36 LEU HD21 . 36054 1
359 . 1 1 36 36 LEU HD22 H 1 0.9880 0.02 . 2 . . . A 36 LEU HD22 . 36054 1
360 . 1 1 36 36 LEU HD23 H 1 0.9880 0.02 . 2 . . . A 36 LEU HD23 . 36054 1
361 . 1 1 36 36 LEU CA C 13 55.8740 0.3 . 1 . . . A 36 LEU CA . 36054 1
362 . 1 1 36 36 LEU CB C 13 47.7000 0.3 . 1 . . . A 36 LEU CB . 36054 1
363 . 1 1 36 36 LEU CG C 13 27.1900 0.3 . 1 . . . A 36 LEU CG . 36054 1
364 . 1 1 36 36 LEU CD1 C 13 25.7300 0.3 . 2 . . . A 36 LEU CD1 . 36054 1
365 . 1 1 36 36 LEU CD2 C 13 23.4200 0.3 . 2 . . . A 36 LEU CD2 . 36054 1
366 . 1 1 36 36 LEU N N 15 135.3400 0.2 . 1 . . . A 36 LEU N . 36054 1
367 . 2 2 1 1 BGC H1 H 1 4.5250 0.02 . 1 . . . A 101 BGC H1 . 36054 1
368 . 2 2 1 1 BGC H2 H 1 3.3100 0.02 . 1 . . . A 101 BGC H2 . 36054 1
369 . 2 2 1 1 BGC H3 H 1 3.5740 0.02 . 1 . . . A 101 BGC H3 . 36054 1
370 . 2 2 1 1 BGC H4 H 1 3.4370 0.02 . 1 . . . A 101 BGC H4 . 36054 1
371 . 2 2 1 1 BGC H5 H 1 3.5110 0.02 . 1 . . . A 101 BGC H5 . 36054 1
372 . 2 2 1 1 BGC H6C1 H 1 3.7550 0.02 . 2 . . . A 101 BGC H6C1 . 36054 1
373 . 2 2 1 1 BGC H6C2 H 1 3.9960 0.02 . 2 . . . A 101 BGC H6C2 . 36054 1
374 . 2 2 1 1 BGC C1 C 13 104.8000 0.3 . 1 . . . A 101 BGC C1 . 36054 1
375 . 2 2 1 1 BGC C2 C 13 76.1400 0.3 . 1 . . . A 101 BGC C2 . 36054 1
376 . 2 2 1 1 BGC C3 C 13 78.2000 0.3 . 1 . . . A 101 BGC C3 . 36054 1
377 . 2 2 1 1 BGC C4 C 13 72.6300 0.3 . 1 . . . A 101 BGC C4 . 36054 1
378 . 2 2 1 1 BGC C5 C 13 78.5400 0.3 . 1 . . . A 101 BGC C5 . 36054 1
379 . 2 2 1 1 BGC C6 C 13 63.7700 0.3 . 1 . . . A 101 BGC C6 . 36054 1
stop_
save_