###################################
# 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 36068
_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 36068 1
2 '2D 1H-1H NOESY' 1 $sample_1 isotropic 36068 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.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 PHE HA H 1 3.505 0.001 . 1 . . . . A 1 PHE HA . 36068 1
2 . 1 1 1 1 PHE HB2 H 1 2.644 0.002 . 2 . . . . A 1 PHE HB2 . 36068 1
3 . 1 1 1 1 PHE HB3 H 1 3.198 0.006 . 2 . . . . A 1 PHE HB3 . 36068 1
4 . 1 1 1 1 PHE HD1 H 1 7.224 0.005 . 3 . . . . A 1 PHE HD1 . 36068 1
5 . 1 1 1 1 PHE HD2 H 1 7.224 0.005 . 3 . . . . A 1 PHE HD2 . 36068 1
6 . 1 1 2 2 GLN H H 1 8.535 0.001 . 1 . . . . A 2 GLN H . 36068 1
7 . 1 1 2 2 GLN HA H 1 4.495 0.003 . 1 . . . . A 2 GLN HA . 36068 1
8 . 1 1 2 2 GLN HB2 H 1 2.129 0.004 . 2 . . . . A 2 GLN HB2 . 36068 1
9 . 1 1 2 2 GLN HB3 H 1 2.019 0.002 . 2 . . . . A 2 GLN HB3 . 36068 1
10 . 1 1 2 2 GLN HG2 H 1 2.452 0.002 . 2 . . . . A 2 GLN HG2 . 36068 1
11 . 1 1 2 2 GLN HG3 H 1 2.452 0.002 . 2 . . . . A 2 GLN HG3 . 36068 1
12 . 1 1 3 3 CYS H H 1 7.838 0.003 . 1 . . . . A 3 CYS H . 36068 1
13 . 1 1 3 3 CYS HA H 1 4.823 0.002 . 1 . . . . A 3 CYS HA . 36068 1
14 . 1 1 3 3 CYS HB2 H 1 2.997 0.010 . 2 . . . . A 3 CYS HB2 . 36068 1
15 . 1 1 3 3 CYS HB3 H 1 2.615 0.012 . 2 . . . . A 3 CYS HB3 . 36068 1
16 . 1 1 4 4 GLY H H 1 8.255 0.003 . 1 . . . . A 4 GLY H . 36068 1
17 . 1 1 4 4 GLY HA2 H 1 3.797 0.001 . 2 . . . . A 4 GLY HA2 . 36068 1
18 . 1 1 4 4 GLY HA3 H 1 3.659 0.005 . 2 . . . . A 4 GLY HA3 . 36068 1
19 . 1 1 5 5 ARG H H 1 9.105 0.001 . 1 . . . . A 5 ARG H . 36068 1
20 . 1 1 5 5 ARG HA H 1 3.973 0.001 . 1 . . . . A 5 ARG HA . 36068 1
21 . 1 1 5 5 ARG HB2 H 1 1.776 0.003 . 2 . . . . A 5 ARG HB2 . 36068 1
22 . 1 1 5 5 ARG HB3 H 1 1.696 0.003 . 2 . . . . A 5 ARG HB3 . 36068 1
23 . 1 1 5 5 ARG HG2 H 1 1.599 0.002 . 2 . . . . A 5 ARG HG2 . 36068 1
24 . 1 1 5 5 ARG HG3 H 1 1.429 0.004 . 2 . . . . A 5 ARG HG3 . 36068 1
25 . 1 1 5 5 ARG HD2 H 1 3.136 0.002 . 2 . . . . A 5 ARG HD2 . 36068 1
26 . 1 1 5 5 ARG HD3 H 1 3.136 0.002 . 2 . . . . A 5 ARG HD3 . 36068 1
27 . 1 1 5 5 ARG HE H 1 7.254 0.000 . 1 . . . . A 5 ARG HE . 36068 1
28 . 1 1 6 6 GLN H H 1 9.074 0.003 . 1 . . . . A 6 GLN H . 36068 1
29 . 1 1 6 6 GLN HA H 1 3.771 0.009 . 1 . . . . A 6 GLN HA . 36068 1
30 . 1 1 6 6 GLN HB2 H 1 1.414 0.004 . 2 . . . . A 6 GLN HB2 . 36068 1
31 . 1 1 6 6 GLN HB3 H 1 0.904 0.004 . 2 . . . . A 6 GLN HB3 . 36068 1
32 . 1 1 6 6 GLN HG2 H 1 1.936 0.002 . 2 . . . . A 6 GLN HG2 . 36068 1
33 . 1 1 6 6 GLN HG3 H 1 1.936 0.002 . 2 . . . . A 6 GLN HG3 . 36068 1
34 . 1 1 6 6 GLN HE21 H 1 7.627 0.000 . 2 . . . . A 6 GLN HE21 . 36068 1
35 . 1 1 6 6 GLN HE22 H 1 7.254 0.003 . 2 . . . . A 6 GLN HE22 . 36068 1
36 . 1 1 7 7 ALA H H 1 7.412 0.005 . 1 . . . . A 7 ALA H . 36068 1
37 . 1 1 7 7 ALA HA H 1 4.669 0.004 . 1 . . . . A 7 ALA HA . 36068 1
38 . 1 1 7 7 ALA HB1 H 1 0.897 0.002 . 1 . . . . A 7 ALA HB1 . 36068 1
39 . 1 1 7 7 ALA HB2 H 1 0.897 0.002 . 1 . . . . A 7 ALA HB2 . 36068 1
40 . 1 1 7 7 ALA HB3 H 1 0.897 0.002 . 1 . . . . A 7 ALA HB3 . 36068 1
41 . 1 1 8 8 GLY H H 1 7.985 0.001 . 1 . . . . A 8 GLY H . 36068 1
42 . 1 1 8 8 GLY HA2 H 1 3.836 0.001 . 2 . . . . A 8 GLY HA2 . 36068 1
43 . 1 1 8 8 GLY HA3 H 1 3.836 0.001 . 2 . . . . A 8 GLY HA3 . 36068 1
44 . 1 1 9 9 GLY H H 1 8.293 0.001 . 1 . . . . A 9 GLY H . 36068 1
45 . 1 1 9 9 GLY HA2 H 1 4.111 0.004 . 2 . . . . A 9 GLY HA2 . 36068 1
46 . 1 1 9 9 GLY HA3 H 1 3.300 0.010 . 2 . . . . A 9 GLY HA3 . 36068 1
47 . 1 1 10 10 ALA H H 1 6.930 0.001 . 1 . . . . A 10 ALA H . 36068 1
48 . 1 1 10 10 ALA HA H 1 4.155 0.002 . 1 . . . . A 10 ALA HA . 36068 1
49 . 1 1 10 10 ALA HB1 H 1 1.445 0.001 . 1 . . . . A 10 ALA HB1 . 36068 1
50 . 1 1 10 10 ALA HB2 H 1 1.445 0.001 . 1 . . . . A 10 ALA HB2 . 36068 1
51 . 1 1 10 10 ALA HB3 H 1 1.445 0.001 . 1 . . . . A 10 ALA HB3 . 36068 1
52 . 1 1 11 11 ARG H H 1 8.548 0.005 . 1 . . . . A 11 ARG H . 36068 1
53 . 1 1 11 11 ARG HA H 1 4.488 0.001 . 1 . . . . A 11 ARG HA . 36068 1
54 . 1 1 11 11 ARG HB2 H 1 1.906 0.003 . 2 . . . . A 11 ARG HB2 . 36068 1
55 . 1 1 11 11 ARG HB3 H 1 1.715 0.001 . 2 . . . . A 11 ARG HB3 . 36068 1
56 . 1 1 11 11 ARG HG2 H 1 1.444 0.000 . 2 . . . . A 11 ARG HG2 . 36068 1
57 . 1 1 11 11 ARG HG3 H 1 1.638 0.002 . 2 . . . . A 11 ARG HG3 . 36068 1
58 . 1 1 11 11 ARG HD2 H 1 3.253 0.001 . 2 . . . . A 11 ARG HD2 . 36068 1
59 . 1 1 11 11 ARG HD3 H 1 3.253 0.001 . 2 . . . . A 11 ARG HD3 . 36068 1
60 . 1 1 12 12 CYS H H 1 9.565 0.002 . 1 . . . . A 12 CYS H . 36068 1
61 . 1 1 12 12 CYS HA H 1 4.648 0.000 . 1 . . . . A 12 CYS HA . 36068 1
62 . 1 1 12 12 CYS HB2 H 1 3.049 0.009 . 2 . . . . A 12 CYS HB2 . 36068 1
63 . 1 1 12 12 CYS HB3 H 1 2.595 0.003 . 2 . . . . A 12 CYS HB3 . 36068 1
64 . 1 1 13 13 SER H H 1 8.860 0.001 . 1 . . . . A 13 SER H . 36068 1
65 . 1 1 13 13 SER HA H 1 4.386 0.000 . 1 . . . . A 13 SER HA . 36068 1
66 . 1 1 13 13 SER HB2 H 1 3.902 0.001 . 2 . . . . A 13 SER HB2 . 36068 1
67 . 1 1 13 13 SER HB3 H 1 3.819 0.003 . 2 . . . . A 13 SER HB3 . 36068 1
68 . 1 1 14 14 ASN H H 1 8.582 0.001 . 1 . . . . A 14 ASN H . 36068 1
69 . 1 1 14 14 ASN HA H 1 4.318 0.003 . 1 . . . . A 14 ASN HA . 36068 1
70 . 1 1 14 14 ASN HB2 H 1 2.839 0.002 . 2 . . . . A 14 ASN HB2 . 36068 1
71 . 1 1 14 14 ASN HB3 H 1 2.724 0.003 . 2 . . . . A 14 ASN HB3 . 36068 1
72 . 1 1 15 15 GLY H H 1 8.699 0.001 . 1 . . . . A 15 GLY H . 36068 1
73 . 1 1 15 15 GLY HA2 H 1 4.137 0.001 . 2 . . . . A 15 GLY HA2 . 36068 1
74 . 1 1 15 15 GLY HA3 H 1 3.621 0.009 . 2 . . . . A 15 GLY HA3 . 36068 1
75 . 1 1 16 16 LEU H H 1 7.566 0.002 . 1 . . . . A 16 LEU H . 36068 1
76 . 1 1 16 16 LEU HA H 1 4.381 0.003 . 1 . . . . A 16 LEU HA . 36068 1
77 . 1 1 16 16 LEU HB2 H 1 1.838 0.002 . 2 . . . . A 16 LEU HB2 . 36068 1
78 . 1 1 16 16 LEU HB3 H 1 1.315 0.015 . 2 . . . . A 16 LEU HB3 . 36068 1
79 . 1 1 16 16 LEU HG H 1 1.286 0.003 . 1 . . . . A 16 LEU HG . 36068 1
80 . 1 1 16 16 LEU HD11 H 1 0.760 0.002 . 2 . . . . A 16 LEU HD11 . 36068 1
81 . 1 1 16 16 LEU HD12 H 1 0.760 0.002 . 2 . . . . A 16 LEU HD12 . 36068 1
82 . 1 1 16 16 LEU HD13 H 1 0.760 0.002 . 2 . . . . A 16 LEU HD13 . 36068 1
83 . 1 1 16 16 LEU HD21 H 1 0.645 0.001 . 2 . . . . A 16 LEU HD21 . 36068 1
84 . 1 1 16 16 LEU HD22 H 1 0.645 0.001 . 2 . . . . A 16 LEU HD22 . 36068 1
85 . 1 1 16 16 LEU HD23 H 1 0.645 0.001 . 2 . . . . A 16 LEU HD23 . 36068 1
86 . 1 1 17 17 CYS H H 1 8.717 0.006 . 1 . . . . A 17 CYS H . 36068 1
87 . 1 1 17 17 CYS HA H 1 4.937 0.001 . 1 . . . . A 17 CYS HA . 36068 1
88 . 1 1 17 17 CYS HB2 H 1 4.165 0.009 . 2 . . . . A 17 CYS HB2 . 36068 1
89 . 1 1 17 17 CYS HB3 H 1 2.505 0.005 . 2 . . . . A 17 CYS HB3 . 36068 1
90 . 1 1 18 18 CYS H H 1 8.238 0.007 . 1 . . . . A 18 CYS H . 36068 1
91 . 1 1 18 18 CYS HA H 1 5.266 0.002 . 1 . . . . A 18 CYS HA . 36068 1
92 . 1 1 18 18 CYS HB2 H 1 3.244 0.005 . 2 . . . . A 18 CYS HB2 . 36068 1
93 . 1 1 18 18 CYS HB3 H 1 2.828 0.008 . 2 . . . . A 18 CYS HB3 . 36068 1
94 . 1 1 19 19 SER H H 1 10.129 0.002 . 1 . . . . A 19 SER H . 36068 1
95 . 1 1 19 19 SER HA H 1 5.302 0.001 . 1 . . . . A 19 SER HA . 36068 1
96 . 1 1 19 19 SER HB2 H 1 4.580 0.001 . 2 . . . . A 19 SER HB2 . 36068 1
97 . 1 1 19 19 SER HB3 H 1 4.404 0.001 . 2 . . . . A 19 SER HB3 . 36068 1
98 . 1 1 20 20 GLN H H 1 8.962 0.001 . 1 . . . . A 20 GLN H . 36068 1
99 . 1 1 20 20 GLN HA H 1 4.094 0.001 . 1 . . . . A 20 GLN HA . 36068 1
100 . 1 1 20 20 GLN HB2 H 1 1.739 0.003 . 2 . . . . A 20 GLN HB2 . 36068 1
101 . 1 1 20 20 GLN HB3 H 1 1.739 0.003 . 2 . . . . A 20 GLN HB3 . 36068 1
102 . 1 1 20 20 GLN HG2 H 1 1.900 0.002 . 2 . . . . A 20 GLN HG2 . 36068 1
103 . 1 1 20 20 GLN HG3 H 1 1.505 0.000 . 2 . . . . A 20 GLN HG3 . 36068 1
104 . 1 1 20 20 GLN HE21 H 1 6.981 0.000 . 2 . . . . A 20 GLN HE21 . 36068 1
105 . 1 1 20 20 GLN HE22 H 1 6.834 0.001 . 2 . . . . A 20 GLN HE22 . 36068 1
106 . 1 1 21 21 PHE H H 1 7.492 0.003 . 1 . . . . A 21 PHE H . 36068 1
107 . 1 1 21 21 PHE HA H 1 4.699 0.001 . 1 . . . . A 21 PHE HA . 36068 1
108 . 1 1 21 21 PHE HB2 H 1 3.044 0.002 . 2 . . . . A 21 PHE HB2 . 36068 1
109 . 1 1 21 21 PHE HB3 H 1 3.044 0.002 . 2 . . . . A 21 PHE HB3 . 36068 1
110 . 1 1 21 21 PHE HD1 H 1 6.493 0.000 . 3 . . . . A 21 PHE HD1 . 36068 1
111 . 1 1 21 21 PHE HD2 H 1 6.179 0.000 . 3 . . . . A 21 PHE HD2 . 36068 1
112 . 1 1 22 22 GLY H H 1 7.871 0.002 . 1 . . . . A 22 GLY H . 36068 1
113 . 1 1 22 22 GLY HA2 H 1 3.963 0.006 . 2 . . . . A 22 GLY HA2 . 36068 1
114 . 1 1 22 22 GLY HA3 H 1 3.725 0.004 . 2 . . . . A 22 GLY HA3 . 36068 1
115 . 1 1 23 23 TYR H H 1 7.507 0.007 . 1 . . . . A 23 TYR H . 36068 1
116 . 1 1 23 23 TYR HA H 1 5.071 0.002 . 1 . . . . A 23 TYR HA . 36068 1
117 . 1 1 23 23 TYR HB2 H 1 2.950 0.002 . 2 . . . . A 23 TYR HB2 . 36068 1
118 . 1 1 23 23 TYR HB3 H 1 3.562 0.006 . 2 . . . . A 23 TYR HB3 . 36068 1
119 . 1 1 23 23 TYR HD1 H 1 7.161 0.002 . 3 . . . . A 23 TYR HD1 . 36068 1
120 . 1 1 23 23 TYR HD2 H 1 6.696 0.007 . 3 . . . . A 23 TYR HD2 . 36068 1
121 . 1 1 24 24 CYS H H 1 8.681 0.001 . 1 . . . . A 24 CYS H . 36068 1
122 . 1 1 24 24 CYS HA H 1 5.933 0.001 . 1 . . . . A 24 CYS HA . 36068 1
123 . 1 1 24 24 CYS HB2 H 1 2.840 0.001 . 2 . . . . A 24 CYS HB2 . 36068 1
124 . 1 1 24 24 CYS HB3 H 1 2.840 0.001 . 2 . . . . A 24 CYS HB3 . 36068 1
125 . 1 1 25 25 GLY H H 1 9.085 0.002 . 1 . . . . A 25 GLY H . 36068 1
126 . 1 1 25 25 GLY HA2 H 1 3.675 0.001 . 2 . . . . A 25 GLY HA2 . 36068 1
127 . 1 1 25 25 GLY HA3 H 1 2.115 0.002 . 2 . . . . A 25 GLY HA3 . 36068 1
128 . 1 1 26 26 SER H H 1 8.823 0.006 . 1 . . . . A 26 SER H . 36068 1
129 . 1 1 26 26 SER HA H 1 5.202 0.004 . 1 . . . . A 26 SER HA . 36068 1
130 . 1 1 26 26 SER HB2 H 1 4.119 0.004 . 2 . . . . A 26 SER HB2 . 36068 1
131 . 1 1 26 26 SER HB3 H 1 3.671 0.005 . 2 . . . . A 26 SER HB3 . 36068 1
132 . 1 1 27 27 THR H H 1 7.332 0.002 . 1 . . . . A 27 THR H . 36068 1
133 . 1 1 27 27 THR HA H 1 4.805 0.005 . 1 . . . . A 27 THR HA . 36068 1
134 . 1 1 27 27 THR HG21 H 1 1.356 0.001 . 1 . . . . A 27 THR HG21 . 36068 1
135 . 1 1 27 27 THR HG22 H 1 1.356 0.001 . 1 . . . . A 27 THR HG22 . 36068 1
136 . 1 1 27 27 THR HG23 H 1 1.356 0.001 . 1 . . . . A 27 THR HG23 . 36068 1
137 . 1 1 28 28 PRO HA H 1 4.351 0.001 . 1 . . . . A 28 PRO HA . 36068 1
138 . 1 1 28 28 PRO HB2 H 1 2.233 0.000 . 2 . . . . A 28 PRO HB2 . 36068 1
139 . 1 1 28 28 PRO HB3 H 1 2.013 0.001 . 2 . . . . A 28 PRO HB3 . 36068 1
140 . 1 1 28 28 PRO HG2 H 1 1.902 0.001 . 2 . . . . A 28 PRO HG2 . 36068 1
141 . 1 1 28 28 PRO HG3 H 1 1.902 0.001 . 2 . . . . A 28 PRO HG3 . 36068 1
142 . 1 1 28 28 PRO HD2 H 1 3.767 0.001 . 2 . . . . A 28 PRO HD2 . 36068 1
143 . 1 1 28 28 PRO HD3 H 1 3.695 0.003 . 2 . . . . A 28 PRO HD3 . 36068 1
144 . 1 1 29 29 PRO HA H 1 4.416 0.005 . 1 . . . . A 29 PRO HA . 36068 1
145 . 1 1 29 29 PRO HB2 H 1 2.444 0.001 . 2 . . . . A 29 PRO HB2 . 36068 1
146 . 1 1 29 29 PRO HB3 H 1 2.266 0.000 . 2 . . . . A 29 PRO HB3 . 36068 1
147 . 1 1 29 29 PRO HG2 H 1 2.074 0.000 . 2 . . . . A 29 PRO HG2 . 36068 1
148 . 1 1 29 29 PRO HG3 H 1 2.006 0.000 . 2 . . . . A 29 PRO HG3 . 36068 1
149 . 1 1 29 29 PRO HD2 H 1 3.999 0.004 . 2 . . . . A 29 PRO HD2 . 36068 1
150 . 1 1 29 29 PRO HD3 H 1 3.999 0.004 . 2 . . . . A 29 PRO HD3 . 36068 1
151 . 1 1 30 30 TYR H H 1 8.135 0.008 . 1 . . . . A 30 TYR H . 36068 1
152 . 1 1 30 30 TYR HA H 1 4.178 0.003 . 1 . . . . A 30 TYR HA . 36068 1
153 . 1 1 30 30 TYR HB2 H 1 2.957 0.003 . 2 . . . . A 30 TYR HB2 . 36068 1
154 . 1 1 30 30 TYR HB3 H 1 2.906 0.005 . 2 . . . . A 30 TYR HB3 . 36068 1
155 . 1 1 30 30 TYR HD1 H 1 7.380 0.001 . 3 . . . . A 30 TYR HD1 . 36068 1
156 . 1 1 30 30 TYR HD2 H 1 7.380 0.001 . 3 . . . . A 30 TYR HD2 . 36068 1
157 . 1 1 31 31 CYS H H 1 7.404 0.003 . 1 . . . . A 31 CYS H . 36068 1
158 . 1 1 31 31 CYS HA H 1 4.721 0.006 . 1 . . . . A 31 CYS HA . 36068 1
159 . 1 1 31 31 CYS HB2 H 1 3.304 0.008 . 2 . . . . A 31 CYS HB2 . 36068 1
160 . 1 1 31 31 CYS HB3 H 1 2.514 0.004 . 2 . . . . A 31 CYS HB3 . 36068 1
161 . 1 1 32 32 GLY H H 1 9.097 0.001 . 1 . . . . A 32 GLY H . 36068 1
162 . 1 1 32 32 GLY HA2 H 1 3.980 0.003 . 2 . . . . A 32 GLY HA2 . 36068 1
163 . 1 1 32 32 GLY HA3 H 1 3.829 0.004 . 2 . . . . A 32 GLY HA3 . 36068 1
164 . 1 1 33 33 ALA H H 1 8.504 0.001 . 1 . . . . A 33 ALA H . 36068 1
165 . 1 1 33 33 ALA HA H 1 4.217 0.003 . 1 . . . . A 33 ALA HA . 36068 1
166 . 1 1 33 33 ALA HB1 H 1 1.409 0.002 . 1 . . . . A 33 ALA HB1 . 36068 1
167 . 1 1 33 33 ALA HB2 H 1 1.409 0.002 . 1 . . . . A 33 ALA HB2 . 36068 1
168 . 1 1 33 33 ALA HB3 H 1 1.409 0.002 . 1 . . . . A 33 ALA HB3 . 36068 1
169 . 1 1 34 34 GLY H H 1 8.870 0.004 . 1 . . . . A 34 GLY H . 36068 1
170 . 1 1 34 34 GLY HA2 H 1 4.226 0.002 . 2 . . . . A 34 GLY HA2 . 36068 1
171 . 1 1 34 34 GLY HA3 H 1 3.744 0.003 . 2 . . . . A 34 GLY HA3 . 36068 1
172 . 1 1 35 35 GLN H H 1 7.973 0.006 . 1 . . . . A 35 GLN H . 36068 1
173 . 1 1 35 35 GLN HA H 1 4.365 0.002 . 1 . . . . A 35 GLN HA . 36068 1
174 . 1 1 35 35 GLN HB2 H 1 2.060 0.000 . 2 . . . . A 35 GLN HB2 . 36068 1
175 . 1 1 35 35 GLN HB3 H 1 1.646 0.002 . 2 . . . . A 35 GLN HB3 . 36068 1
176 . 1 1 35 35 GLN HG2 H 1 2.377 0.005 . 2 . . . . A 35 GLN HG2 . 36068 1
177 . 1 1 35 35 GLN HG3 H 1 2.253 0.004 . 2 . . . . A 35 GLN HG3 . 36068 1
178 . 1 1 36 36 CYS H H 1 7.472 0.001 . 1 . . . . A 36 CYS H . 36068 1
179 . 1 1 36 36 CYS HB2 H 1 3.432 0.008 . 2 . . . . A 36 CYS HB2 . 36068 1
180 . 1 1 36 36 CYS HB3 H 1 2.722 0.002 . 2 . . . . A 36 CYS HB3 . 36068 1
181 . 1 1 37 37 GLN H H 1 9.853 0.006 . 1 . . . . A 37 GLN H . 36068 1
182 . 1 1 37 37 GLN HA H 1 4.686 0.002 . 1 . . . . A 37 GLN HA . 36068 1
183 . 1 1 37 37 GLN HB2 H 1 2.175 0.001 . 2 . . . . A 37 GLN HB2 . 36068 1
184 . 1 1 37 37 GLN HB3 H 1 2.080 0.000 . 2 . . . . A 37 GLN HB3 . 36068 1
185 . 1 1 37 37 GLN HG2 H 1 2.172 0.001 . 2 . . . . A 37 GLN HG2 . 36068 1
186 . 1 1 37 37 GLN HG3 H 1 2.088 0.002 . 2 . . . . A 37 GLN HG3 . 36068 1
187 . 1 1 37 37 GLN HE21 H 1 8.046 0.001 . 2 . . . . A 37 GLN HE21 . 36068 1
188 . 1 1 37 37 GLN HE22 H 1 8.372 0.001 . 2 . . . . A 37 GLN HE22 . 36068 1
189 . 1 1 38 38 SER H H 1 7.980 0.001 . 1 . . . . A 38 SER H . 36068 1
190 . 1 1 38 38 SER HA H 1 4.484 0.000 . 1 . . . . A 38 SER HA . 36068 1
191 . 1 1 38 38 SER HB2 H 1 4.160 0.004 . 2 . . . . A 38 SER HB2 . 36068 1
192 . 1 1 38 38 SER HB3 H 1 3.908 0.007 . 2 . . . . A 38 SER HB3 . 36068 1
193 . 1 1 39 39 GLN H H 1 8.909 0.001 . 1 . . . . A 39 GLN H . 36068 1
194 . 1 1 39 39 GLN HA H 1 3.823 0.001 . 1 . . . . A 39 GLN HA . 36068 1
195 . 1 1 39 39 GLN HB2 H 1 2.260 0.004 . 2 . . . . A 39 GLN HB2 . 36068 1
196 . 1 1 39 39 GLN HB3 H 1 2.168 0.001 . 2 . . . . A 39 GLN HB3 . 36068 1
197 . 1 1 39 39 GLN HG2 H 1 2.468 0.009 . 2 . . . . A 39 GLN HG2 . 36068 1
198 . 1 1 39 39 GLN HG3 H 1 2.403 0.001 . 2 . . . . A 39 GLN HG3 . 36068 1
199 . 1 1 39 39 GLN HE21 H 1 7.393 0.001 . 2 . . . . A 39 GLN HE21 . 36068 1
200 . 1 1 39 39 GLN HE22 H 1 7.826 0.000 . 2 . . . . A 39 GLN HE22 . 36068 1
201 . 1 1 40 40 CYS H H 1 7.845 0.001 . 1 . . . . A 40 CYS H . 36068 1
202 . 1 1 40 40 CYS HA H 1 4.837 0.003 . 1 . . . . A 40 CYS HA . 36068 1
203 . 1 1 40 40 CYS HB2 H 1 3.576 0.011 . 2 . . . . A 40 CYS HB2 . 36068 1
204 . 1 1 40 40 CYS HB3 H 1 2.719 0.001 . 2 . . . . A 40 CYS HB3 . 36068 1
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