###################################
# 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 18528
_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 0.01
_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 COSY' . . . 18528 1
2 '2D 1H-1H TOCSY' . . . 18528 1
3 '2D 1H-1H NOESY' . . . 18528 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 PHE HA H 1 4.24 0.01 . 1 . . . . 404 PHE HA . 18528 1
2 . 1 1 1 1 PHE HB2 H 1 3.07 0.01 . 2 . . . . 404 PHE HB2 . 18528 1
3 . 1 1 1 1 PHE HB3 H 1 3.14 0.01 . 2 . . . . 404 PHE HB3 . 18528 1
4 . 1 1 1 1 PHE HD1 H 1 7.18 0.01 . 3 . . . . 404 PHE HD1 . 18528 1
5 . 1 1 1 1 PHE HD2 H 1 7.18 0.01 . 3 . . . . 404 PHE HD2 . 18528 1
6 . 1 1 1 1 PHE HE1 H 1 7.30 0.01 . 3 . . . . 404 PHE HE1 . 18528 1
7 . 1 1 1 1 PHE HE2 H 1 7.30 0.01 . 3 . . . . 404 PHE HE2 . 18528 1
8 . 1 1 1 1 PHE HZ H 1 7.14 0.01 . 1 . . . . 404 PHE HZ . 18528 1
9 . 1 1 2 2 VAL HA H 1 4.04 0.01 . 1 . . . . 405 VAL HA . 18528 1
10 . 1 1 2 2 VAL HB H 1 1.83 0.01 . 1 . . . . 405 VAL HB . 18528 1
11 . 1 1 2 2 VAL HG11 H 1 0.68 0.01 . 2 . . . . 405 VAL HG1 . 18528 1
12 . 1 1 2 2 VAL HG12 H 1 0.68 0.01 . 2 . . . . 405 VAL HG1 . 18528 1
13 . 1 1 2 2 VAL HG13 H 1 0.68 0.01 . 2 . . . . 405 VAL HG1 . 18528 1
14 . 1 1 2 2 VAL HG21 H 1 0.80 0.01 . 2 . . . . 405 VAL HG2 . 18528 1
15 . 1 1 2 2 VAL HG22 H 1 0.80 0.01 . 2 . . . . 405 VAL HG2 . 18528 1
16 . 1 1 2 2 VAL HG23 H 1 0.80 0.01 . 2 . . . . 405 VAL HG2 . 18528 1
17 . 1 1 3 3 HIS H H 1 7.84 0.01 . 1 . . . . 406 HIS H . 18528 1
18 . 1 1 3 3 HIS HA H 1 4.59 0.01 . 1 . . . . 406 HIS HA . 18528 1
19 . 1 1 3 3 HIS HB2 H 1 3.00 0.01 . 1 . . . . 406 HIS HB2 . 18528 1
20 . 1 1 3 3 HIS HB3 H 1 3.00 0.01 . 1 . . . . 406 HIS HB3 . 18528 1
21 . 1 1 3 3 HIS HD2 H 1 7.05 0.01 . 1 . . . . 406 HIS HD2 . 18528 1
22 . 1 1 3 3 HIS HE1 H 1 8.08 0.01 . 1 . . . . 406 HIS HE1 . 18528 1
23 . 1 1 4 4 TRP H H 1 7.84 0.01 . 1 . . . . 407 TRP H . 18528 1
24 . 1 1 4 4 TRP HA H 1 4.64 0.01 . 1 . . . . 407 TRP HA . 18528 1
25 . 1 1 4 4 TRP HB2 H 1 3.17 0.01 . 1 . . . . 407 TRP HB2 . 18528 1
26 . 1 1 4 4 TRP HB3 H 1 3.17 0.01 . 1 . . . . 407 TRP HB3 . 18528 1
27 . 1 1 4 4 TRP HD1 H 1 7.14 0.01 . 1 . . . . 407 TRP HD1 . 18528 1
28 . 1 1 4 4 TRP HE1 H 1 10.06 0.01 . 1 . . . . 407 TRP HE1 . 18528 1
29 . 1 1 4 4 TRP HE3 H 1 7.50 0.01 . 1 . . . . 407 TRP HE3 . 18528 1
30 . 1 1 4 4 TRP HZ2 H 1 7.47 0.01 . 1 . . . . 407 TRP HZ2 . 18528 1
31 . 1 1 4 4 TRP HZ3 H 1 7.12 0.01 . 1 . . . . 407 TRP HZ3 . 18528 1
32 . 1 1 4 4 TRP HH2 H 1 7.21 0.01 . 1 . . . . 407 TRP HH2 . 18528 1
33 . 1 1 5 5 TYR H H 1 7.79 0.01 . 1 . . . . 408 TYR H . 18528 1
34 . 1 1 5 5 TYR HA H 1 4.49 0.01 . 1 . . . . 408 TYR HA . 18528 1
35 . 1 1 5 5 TYR HB2 H 1 2.78 0.01 . 1 . . . . 408 TYR HB2 . 18528 1
36 . 1 1 5 5 TYR HB3 H 1 2.78 0.01 . 1 . . . . 408 TYR HB3 . 18528 1
37 . 1 1 5 5 TYR HD1 H 1 6.95 0.01 . 3 . . . . 408 TYR HD1 . 18528 1
38 . 1 1 5 5 TYR HD2 H 1 6.95 0.01 . 3 . . . . 408 TYR HD2 . 18528 1
39 . 1 1 5 5 TYR HE1 H 1 6.76 0.01 . 3 . . . . 408 TYR HE1 . 18528 1
40 . 1 1 5 5 TYR HE2 H 1 6.76 0.01 . 3 . . . . 408 TYR HE2 . 18528 1
41 . 1 1 6 6 VAL H H 1 7.76 0.01 . 1 . . . . 409 VAL H . 18528 1
42 . 1 1 6 6 VAL HA H 1 4.04 0.01 . 1 . . . . 409 VAL HA . 18528 1
43 . 1 1 6 6 VAL HB H 1 2.03 0.01 . 1 . . . . 409 VAL HB . 18528 1
44 . 1 1 6 6 VAL HG11 H 1 0.88 0.01 . 1 . . . . 409 VAL HG1 . 18528 1
45 . 1 1 6 6 VAL HG12 H 1 0.88 0.01 . 1 . . . . 409 VAL HG1 . 18528 1
46 . 1 1 6 6 VAL HG13 H 1 0.88 0.01 . 1 . . . . 409 VAL HG1 . 18528 1
47 . 1 1 6 6 VAL HG21 H 1 0.88 0.01 . 1 . . . . 409 VAL HG2 . 18528 1
48 . 1 1 6 6 VAL HG22 H 1 0.88 0.01 . 1 . . . . 409 VAL HG2 . 18528 1
49 . 1 1 6 6 VAL HG23 H 1 0.88 0.01 . 1 . . . . 409 VAL HG2 . 18528 1
50 . 1 1 8 8 GLU H H 1 8.25 0.01 . 1 . . . . 411 GLU H . 18528 1
51 . 1 1 8 8 GLU HA H 1 4.31 0.01 . 1 . . . . 411 GLU HA . 18528 1
52 . 1 1 8 8 GLU HB2 H 1 1.97 0.01 . 2 . . . . 411 GLU HB2 . 18528 1
53 . 1 1 8 8 GLU HB3 H 1 2.09 0.01 . 2 . . . . 411 GLU HB3 . 18528 1
54 . 1 1 8 8 GLU HG2 H 1 2.29 0.01 . 1 . . . . 411 GLU HG2 . 18528 1
55 . 1 1 8 8 GLU HG3 H 1 2.29 0.01 . 1 . . . . 411 GLU HG3 . 18528 1
56 . 1 1 9 9 GLY H H 1 8.56 0.01 . 1 . . . . 412 GLY H . 18528 1
57 . 1 1 9 9 GLY HA2 H 1 3.91 0.01 . 2 . . . . 412 GLY HA2 . 18528 1
58 . 1 1 9 9 GLY HA3 H 1 4.01 0.01 . 2 . . . . 412 GLY HA3 . 18528 1
59 . 1 1 10 10 MET H H 1 8.06 0.01 . 1 . . . . 413 MET H . 18528 1
60 . 1 1 10 10 MET HA H 1 4.50 0.01 . 1 . . . . 413 MET HA . 18528 1
61 . 1 1 10 10 MET HB2 H 1 2.02 0.01 . 2 . . . . 413 MET HB2 . 18528 1
62 . 1 1 10 10 MET HB3 H 1 2.11 0.01 . 2 . . . . 413 MET HB3 . 18528 1
63 . 1 1 10 10 MET HG2 H 1 2.47 0.01 . 2 . . . . 413 MET HG2 . 18528 1
64 . 1 1 10 10 MET HG3 H 1 2.54 0.01 . 2 . . . . 413 MET HG3 . 18528 1
65 . 1 1 11 11 GLU H H 1 8.59 0.01 . 1 . . . . 414 GLU H . 18528 1
66 . 1 1 11 11 GLU HA H 1 4.32 0.01 . 1 . . . . 414 GLU HA . 18528 1
67 . 1 1 11 11 GLU HB2 H 1 1.98 0.01 . 2 . . . . 414 GLU HB2 . 18528 1
68 . 1 1 11 11 GLU HB3 H 1 2.11 0.01 . 2 . . . . 414 GLU HB3 . 18528 1
69 . 1 1 11 11 GLU HG2 H 1 2.31 0.01 . 1 . . . . 414 GLU HG2 . 18528 1
70 . 1 1 11 11 GLU HG3 H 1 2.31 0.01 . 1 . . . . 414 GLU HG3 . 18528 1
71 . 1 1 12 12 GLU H H 1 8.49 0.01 . 1 . . . . 415 GLU H . 18528 1
72 . 1 1 12 12 GLU HA H 1 4.26 0.01 . 1 . . . . 415 GLU HA . 18528 1
73 . 1 1 12 12 GLU HB2 H 1 2.01 0.01 . 2 . . . . 415 GLU HB2 . 18528 1
74 . 1 1 12 12 GLU HB3 H 1 2.12 0.01 . 2 . . . . 415 GLU HB3 . 18528 1
75 . 1 1 12 12 GLU HG2 H 1 2.31 0.01 . 1 . . . . 415 GLU HG2 . 18528 1
76 . 1 1 12 12 GLU HG3 H 1 2.31 0.01 . 1 . . . . 415 GLU HG3 . 18528 1
77 . 1 1 13 13 GLY H H 1 8.36 0.01 . 1 . . . . 416 GLY H . 18528 1
78 . 1 1 13 13 GLY HA2 H 1 3.94 0.01 . 1 . . . . 416 GLY HA2 . 18528 1
79 . 1 1 13 13 GLY HA3 H 1 3.94 0.01 . 1 . . . . 416 GLY HA3 . 18528 1
80 . 1 1 14 14 GLU H H 1 8.17 0.01 . 1 . . . . 417 GLU H . 18528 1
81 . 1 1 14 14 GLU HA H 1 4.24 0.01 . 1 . . . . 417 GLU HA . 18528 1
82 . 1 1 14 14 GLU HB2 H 1 1.91 0.01 . 2 . . . . 417 GLU HB2 . 18528 1
83 . 1 1 14 14 GLU HB3 H 1 1.94 0.01 . 2 . . . . 417 GLU HB3 . 18528 1
84 . 1 1 14 14 GLU HG2 H 1 2.13 0.01 . 2 . . . . 417 GLU HG2 . 18528 1
85 . 1 1 14 14 GLU HG3 H 1 2.19 0.01 . 2 . . . . 417 GLU HG3 . 18528 1
86 . 1 1 15 15 PHE H H 1 8.23 0.01 . 1 . . . . 418 PHE H . 18528 1
87 . 1 1 15 15 PHE HA H 1 4.66 0.01 . 1 . . . . 418 PHE HA . 18528 1
88 . 1 1 15 15 PHE HB2 H 1 3.03 0.01 . 2 . . . . 418 PHE HB2 . 18528 1
89 . 1 1 15 15 PHE HB3 H 1 3.19 0.01 . 2 . . . . 418 PHE HB3 . 18528 1
90 . 1 1 15 15 PHE HD1 H 1 7.24 0.01 . 3 . . . . 418 PHE HD1 . 18528 1
91 . 1 1 15 15 PHE HD2 H 1 7.24 0.01 . 3 . . . . 418 PHE HD2 . 18528 1
92 . 1 1 15 15 PHE HE1 H 1 7.32 0.01 . 3 . . . . 418 PHE HE1 . 18528 1
93 . 1 1 15 15 PHE HE2 H 1 7.32 0.01 . 3 . . . . 418 PHE HE2 . 18528 1
94 . 1 1 16 16 SER H H 1 8.09 0.01 . 1 . . . . 419 SER H . 18528 1
95 . 1 1 16 16 SER HA H 1 4.36 0.01 . 1 . . . . 419 SER HA . 18528 1
96 . 1 1 16 16 SER HB2 H 1 3.84 0.01 . 2 . . . . 419 SER HB2 . 18528 1
97 . 1 1 16 16 SER HB3 H 1 3.92 0.01 . 2 . . . . 419 SER HB3 . 18528 1
98 . 1 1 17 17 GLU H H 1 8.37 0.01 . 1 . . . . 420 GLU H . 18528 1
99 . 1 1 17 17 GLU HA H 1 4.26 0.01 . 1 . . . . 420 GLU HA . 18528 1
100 . 1 1 17 17 GLU HB2 H 1 1.99 0.01 . 2 . . . . 420 GLU HB2 . 18528 1
101 . 1 1 17 17 GLU HB3 H 1 2.11 0.01 . 2 . . . . 420 GLU HB3 . 18528 1
102 . 1 1 17 17 GLU HG2 H 1 2.31 0.01 . 1 . . . . 420 GLU HG2 . 18528 1
103 . 1 1 17 17 GLU HG3 H 1 2.31 0.01 . 1 . . . . 420 GLU HG3 . 18528 1
104 . 1 1 18 18 ALA H H 1 8.15 0.01 . 1 . . . . 421 ALA H . 18528 1
105 . 1 1 18 18 ALA HA H 1 4.32 0.01 . 1 . . . . 421 ALA HA . 18528 1
106 . 1 1 18 18 ALA HB1 H 1 1.41 0.01 . 1 . . . . 421 ALA HB . 18528 1
107 . 1 1 18 18 ALA HB2 H 1 1.41 0.01 . 1 . . . . 421 ALA HB . 18528 1
108 . 1 1 18 18 ALA HB3 H 1 1.41 0.01 . 1 . . . . 421 ALA HB . 18528 1
109 . 1 1 19 19 ARG H H 1 8.10 0.01 . 1 . . . . 422 ARG H . 18528 1
110 . 1 1 19 19 ARG HA H 1 4.25 0.01 . 1 . . . . 422 ARG HA . 18528 1
111 . 1 1 19 19 ARG HB2 H 1 1.80 0.01 . 2 . . . . 422 ARG HB2 . 18528 1
112 . 1 1 19 19 ARG HB3 H 1 1.91 0.01 . 2 . . . . 422 ARG HB3 . 18528 1
113 . 1 1 19 19 ARG HG2 H 1 1.62 0.01 . 2 . . . . 422 ARG HG2 . 18528 1
114 . 1 1 19 19 ARG HG3 H 1 1.67 0.01 . 2 . . . . 422 ARG HG3 . 18528 1
115 . 1 1 19 19 ARG HD2 H 1 3.18 0.01 . 1 . . . . 422 ARG HD2 . 18528 1
116 . 1 1 19 19 ARG HD3 H 1 3.18 0.01 . 1 . . . . 422 ARG HD3 . 18528 1
117 . 1 1 19 19 ARG HE H 1 7.47 0.01 . 1 . . . . 422 ARG HE . 18528 1
118 . 1 1 20 20 GLU H H 1 8.44 0.01 . 1 . . . . 423 GLU H . 18528 1
119 . 1 1 20 20 GLU HA H 1 4.20 0.01 . 1 . . . . 423 GLU HA . 18528 1
120 . 1 1 20 20 GLU HB2 H 1 2.02 0.01 . 2 . . . . 423 GLU HB2 . 18528 1
121 . 1 1 20 20 GLU HB3 H 1 2.09 0.01 . 2 . . . . 423 GLU HB3 . 18528 1
122 . 1 1 20 20 GLU HG2 H 1 2.33 0.01 . 1 . . . . 423 GLU HG2 . 18528 1
123 . 1 1 20 20 GLU HG3 H 1 2.33 0.01 . 1 . . . . 423 GLU HG3 . 18528 1
124 . 1 1 21 21 ASP H H 1 8.28 0.01 . 1 . . . . 424 ASP H . 18528 1
125 . 1 1 21 21 ASP HA H 1 4.58 0.01 . 1 . . . . 424 ASP HA . 18528 1
126 . 1 1 21 21 ASP HB2 H 1 2.73 0.01 . 1 . . . . 424 ASP HB2 . 18528 1
127 . 1 1 21 21 ASP HB3 H 1 2.73 0.01 . 1 . . . . 424 ASP HB3 . 18528 1
128 . 1 1 22 22 MET H H 1 8.13 0.01 . 1 . . . . 425 MET H . 18528 1
129 . 1 1 22 22 MET HA H 1 4.36 0.01 . 1 . . . . 425 MET HA . 18528 1
130 . 1 1 22 22 MET HB2 H 1 2.08 0.01 . 2 . . . . 425 MET HB2 . 18528 1
131 . 1 1 22 22 MET HB3 H 1 2.15 0.01 . 2 . . . . 425 MET HB3 . 18528 1
132 . 1 1 22 22 MET HG2 H 1 2.55 0.01 . 2 . . . . 425 MET HG2 . 18528 1
133 . 1 1 22 22 MET HG3 H 1 2.65 0.01 . 2 . . . . 425 MET HG3 . 18528 1
134 . 1 1 23 23 ALA H H 1 8.14 0.01 . 1 . . . . 426 ALA H . 18528 1
135 . 1 1 23 23 ALA HA H 1 4.24 0.01 . 1 . . . . 426 ALA HA . 18528 1
136 . 1 1 23 23 ALA HB1 H 1 1.46 0.01 . 1 . . . . 426 ALA HB . 18528 1
137 . 1 1 23 23 ALA HB2 H 1 1.46 0.01 . 1 . . . . 426 ALA HB . 18528 1
138 . 1 1 23 23 ALA HB3 H 1 1.46 0.01 . 1 . . . . 426 ALA HB . 18528 1
139 . 1 1 24 24 ALA H H 1 7.90 0.01 . 1 . . . . 427 ALA H . 18528 1
140 . 1 1 24 24 ALA HA H 1 4.24 0.01 . 1 . . . . 427 ALA HA . 18528 1
141 . 1 1 24 24 ALA HB1 H 1 1.46 0.01 . 1 . . . . 427 ALA HB . 18528 1
142 . 1 1 24 24 ALA HB2 H 1 1.46 0.01 . 1 . . . . 427 ALA HB . 18528 1
143 . 1 1 24 24 ALA HB3 H 1 1.46 0.01 . 1 . . . . 427 ALA HB . 18528 1
144 . 1 1 25 25 LEU H H 1 7.81 0.01 . 1 . . . . 428 LEU H . 18528 1
145 . 1 1 25 25 LEU HA H 1 4.28 0.01 . 1 . . . . 428 LEU HA . 18528 1
146 . 1 1 25 25 LEU HB2 H 1 1.66 0.01 . 2 . . . . 428 LEU HB2 . 18528 1
147 . 1 1 25 25 LEU HB3 H 1 1.76 0.01 . 2 . . . . 428 LEU HB3 . 18528 1
148 . 1 1 25 25 LEU HG H 1 1.72 0.01 . 1 . . . . 428 LEU HG . 18528 1
149 . 1 1 25 25 LEU HD11 H 1 0.90 0.01 . 2 . . . . 428 LEU HD1 . 18528 1
150 . 1 1 25 25 LEU HD12 H 1 0.90 0.01 . 2 . . . . 428 LEU HD1 . 18528 1
151 . 1 1 25 25 LEU HD13 H 1 0.90 0.01 . 2 . . . . 428 LEU HD1 . 18528 1
152 . 1 1 25 25 LEU HD21 H 1 0.95 0.01 . 2 . . . . 428 LEU HD2 . 18528 1
153 . 1 1 25 25 LEU HD22 H 1 0.95 0.01 . 2 . . . . 428 LEU HD2 . 18528 1
154 . 1 1 25 25 LEU HD23 H 1 0.95 0.01 . 2 . . . . 428 LEU HD2 . 18528 1
155 . 1 1 26 26 GLU H H 1 8.07 0.01 . 1 . . . . 429 GLU H . 18528 1
156 . 1 1 26 26 GLU HA H 1 4.21 0.01 . 1 . . . . 429 GLU HA . 18528 1
157 . 1 1 26 26 GLU HB2 H 1 2.02 0.01 . 2 . . . . 429 GLU HB2 . 18528 1
158 . 1 1 26 26 GLU HB3 H 1 2.12 0.01 . 2 . . . . 429 GLU HB3 . 18528 1
159 . 1 1 26 26 GLU HG2 H 1 2.28 0.01 . 2 . . . . 429 GLU HG2 . 18528 1
160 . 1 1 26 26 GLU HG3 H 1 2.35 0.01 . 2 . . . . 429 GLU HG3 . 18528 1
161 . 1 1 27 27 LYS H H 1 7.99 0.01 . 1 . . . . 430 LYS H . 18528 1
162 . 1 1 27 27 LYS HA H 1 4.26 0.01 . 1 . . . . 430 LYS HA . 18528 1
163 . 1 1 27 27 LYS HB2 H 1 1.77 0.01 . 1 . . . . 430 LYS HB2 . 18528 1
164 . 1 1 27 27 LYS HB3 H 1 1.77 0.01 . 1 . . . . 430 LYS HB3 . 18528 1
165 . 1 1 27 27 LYS HG2 H 1 1.44 0.01 . 2 . . . . 430 LYS HG2 . 18528 1
166 . 1 1 27 27 LYS HG3 H 1 1.46 0.01 . 2 . . . . 430 LYS HG3 . 18528 1
167 . 1 1 27 27 LYS HD2 H 1 1.68 0.01 . 1 . . . . 430 LYS HD2 . 18528 1
168 . 1 1 27 27 LYS HD3 H 1 1.68 0.01 . 1 . . . . 430 LYS HD3 . 18528 1
169 . 1 1 27 27 LYS HE2 H 1 3.00 0.01 . 1 . . . . 430 LYS HE2 . 18528 1
170 . 1 1 27 27 LYS HE3 H 1 3.00 0.01 . 1 . . . . 430 LYS HE3 . 18528 1
171 . 1 1 28 28 ASP H H 1 8.20 0.01 . 1 . . . . 431 ASP H . 18528 1
172 . 1 1 28 28 ASP HA H 1 4.61 0.01 . 1 . . . . 431 ASP HA . 18528 1
173 . 1 1 28 28 ASP HB2 H 1 2.63 0.01 . 2 . . . . 431 ASP HB2 . 18528 1
174 . 1 1 28 28 ASP HB3 H 1 2.68 0.01 . 2 . . . . 431 ASP HB3 . 18528 1
175 . 1 1 29 29 TYR H H 1 7.98 0.01 . 1 . . . . 432 TYR H . 18528 1
176 . 1 1 29 29 TYR HA H 1 4.49 0.01 . 1 . . . . 432 TYR HA . 18528 1
177 . 1 1 29 29 TYR HB2 H 1 3.02 0.01 . 2 . . . . 432 TYR HB2 . 18528 1
178 . 1 1 29 29 TYR HB3 H 1 3.09 0.01 . 2 . . . . 432 TYR HB3 . 18528 1
179 . 1 1 29 29 TYR HD1 H 1 7.13 0.01 . 3 . . . . 432 TYR HD1 . 18528 1
180 . 1 1 29 29 TYR HD2 H 1 7.13 0.01 . 3 . . . . 432 TYR HD2 . 18528 1
181 . 1 1 29 29 TYR HE1 H 1 6.84 0.01 . 3 . . . . 432 TYR HE1 . 18528 1
182 . 1 1 29 29 TYR HE2 H 1 6.84 0.01 . 3 . . . . 432 TYR HE2 . 18528 1
183 . 1 1 30 30 GLU H H 1 8.16 0.01 . 1 . . . . 433 GLU H . 18528 1
184 . 1 1 30 30 GLU HA H 1 4.24 0.01 . 1 . . . . 433 GLU HA . 18528 1
185 . 1 1 30 30 GLU HB2 H 1 1.98 0.01 . 2 . . . . 433 GLU HB2 . 18528 1
186 . 1 1 30 30 GLU HB3 H 1 2.06 0.01 . 2 . . . . 433 GLU HB3 . 18528 1
187 . 1 1 30 30 GLU HG2 H 1 2.26 0.01 . 2 . . . . 433 GLU HG2 . 18528 1
188 . 1 1 30 30 GLU HG3 H 1 2.29 0.01 . 2 . . . . 433 GLU HG3 . 18528 1
189 . 1 1 31 31 GLU H H 1 8.25 0.01 . 1 . . . . 434 GLU H . 18528 1
190 . 1 1 31 31 GLU HA H 1 4.31 0.01 . 1 . . . . 434 GLU HA . 18528 1
191 . 1 1 31 31 GLU HB2 H 1 1.97 0.01 . 2 . . . . 434 GLU HB2 . 18528 1
192 . 1 1 31 31 GLU HB3 H 1 2.09 0.01 . 2 . . . . 434 GLU HB3 . 18528 1
193 . 1 1 31 31 GLU HG2 H 1 2.29 0.01 . 1 . . . . 434 GLU HG2 . 18528 1
194 . 1 1 31 31 GLU HG3 H 1 2.29 0.01 . 1 . . . . 434 GLU HG3 . 18528 1
195 . 1 1 32 32 VAL H H 1 8.07 0.01 . 1 . . . . 435 VAL H . 18528 1
196 . 1 1 32 32 VAL HA H 1 4.15 0.01 . 1 . . . . 435 VAL HA . 18528 1
197 . 1 1 32 32 VAL HB H 1 2.13 0.01 . 1 . . . . 435 VAL HB . 18528 1
198 . 1 1 32 32 VAL HG11 H 1 0.98 0.01 . 1 . . . . 435 VAL HG1 . 18528 1
199 . 1 1 32 32 VAL HG12 H 1 0.98 0.01 . 1 . . . . 435 VAL HG1 . 18528 1
200 . 1 1 32 32 VAL HG13 H 1 0.98 0.01 . 1 . . . . 435 VAL HG1 . 18528 1
201 . 1 1 32 32 VAL HG21 H 1 0.98 0.01 . 1 . . . . 435 VAL HG2 . 18528 1
202 . 1 1 32 32 VAL HG22 H 1 0.98 0.01 . 1 . . . . 435 VAL HG2 . 18528 1
203 . 1 1 32 32 VAL HG23 H 1 0.98 0.01 . 1 . . . . 435 VAL HG2 . 18528 1
204 . 1 1 33 33 GLY H H 1 8.42 0.01 . 1 . . . . 436 GLY H . 18528 1
205 . 1 1 33 33 GLY HA2 H 1 3.95 0.01 . 2 . . . . 436 GLY HA2 . 18528 1
206 . 1 1 33 33 GLY HA3 H 1 4.04 0.01 . 2 . . . . 436 GLY HA3 . 18528 1
207 . 1 1 34 34 VAL H H 1 7.93 0.01 . 1 . . . . 437 VAL H . 18528 1
208 . 1 1 34 34 VAL HA H 1 4.16 0.01 . 1 . . . . 437 VAL HA . 18528 1
209 . 1 1 34 34 VAL HB H 1 2.13 0.01 . 1 . . . . 437 VAL HB . 18528 1
210 . 1 1 34 34 VAL HG11 H 1 0.95 0.01 . 1 . . . . 437 VAL HG1 . 18528 1
211 . 1 1 34 34 VAL HG12 H 1 0.95 0.01 . 1 . . . . 437 VAL HG1 . 18528 1
212 . 1 1 34 34 VAL HG13 H 1 0.95 0.01 . 1 . . . . 437 VAL HG1 . 18528 1
213 . 1 1 34 34 VAL HG21 H 1 0.95 0.01 . 1 . . . . 437 VAL HG2 . 18528 1
214 . 1 1 34 34 VAL HG22 H 1 0.95 0.01 . 1 . . . . 437 VAL HG2 . 18528 1
215 . 1 1 34 34 VAL HG23 H 1 0.95 0.01 . 1 . . . . 437 VAL HG2 . 18528 1
216 . 1 1 35 35 ASP H H 1 8.42 0.01 . 1 . . . . 438 ASP H . 18528 1
217 . 1 1 35 35 ASP HA H 1 4.69 0.01 . 1 . . . . 438 ASP HA . 18528 1
218 . 1 1 35 35 ASP HB2 H 1 2.66 0.01 . 2 . . . . 438 ASP HB2 . 18528 1
219 . 1 1 35 35 ASP HB3 H 1 2.73 0.01 . 2 . . . . 438 ASP HB3 . 18528 1
220 . 1 1 36 36 SER H H 1 8.14 0.01 . 1 . . . . 439 SER H . 18528 1
221 . 1 1 36 36 SER HA H 1 4.51 0.01 . 1 . . . . 439 SER HA . 18528 1
222 . 1 1 36 36 SER HB2 H 1 3.88 0.01 . 2 . . . . 439 SER HB2 . 18528 1
223 . 1 1 36 36 SER HB3 H 1 3.91 0.01 . 2 . . . . 439 SER HB3 . 18528 1
224 . 1 1 37 37 VAL H H 1 8.15 0.01 . 1 . . . . 440 VAL H . 18528 1
225 . 1 1 37 37 VAL HA H 1 4.19 0.01 . 1 . . . . 440 VAL HA . 18528 1
226 . 1 1 37 37 VAL HB H 1 2.15 0.01 . 1 . . . . 440 VAL HB . 18528 1
227 . 1 1 37 37 VAL HG11 H 1 0.96 0.01 . 1 . . . . 440 VAL HG1 . 18528 1
228 . 1 1 37 37 VAL HG12 H 1 0.96 0.01 . 1 . . . . 440 VAL HG1 . 18528 1
229 . 1 1 37 37 VAL HG13 H 1 0.96 0.01 . 1 . . . . 440 VAL HG1 . 18528 1
230 . 1 1 37 37 VAL HG21 H 1 0.96 0.01 . 1 . . . . 440 VAL HG2 . 18528 1
231 . 1 1 37 37 VAL HG22 H 1 0.96 0.01 . 1 . . . . 440 VAL HG2 . 18528 1
232 . 1 1 37 37 VAL HG23 H 1 0.96 0.01 . 1 . . . . 440 VAL HG2 . 18528 1
233 . 1 1 38 38 GLU H H 1 8.46 0.01 . 1 . . . . 441 GLU H . 18528 1
234 . 1 1 38 38 GLU HA H 1 4.31 0.01 . 1 . . . . 441 GLU HA . 18528 1
235 . 1 1 38 38 GLU HB2 H 1 2.00 0.01 . 2 . . . . 441 GLU HB2 . 18528 1
236 . 1 1 38 38 GLU HB3 H 1 2.09 0.01 . 2 . . . . 441 GLU HB3 . 18528 1
237 . 1 1 38 38 GLU HG2 H 1 2.32 0.01 . 1 . . . . 441 GLU HG2 . 18528 1
238 . 1 1 38 38 GLU HG3 H 1 2.32 0.01 . 1 . . . . 441 GLU HG3 . 18528 1
239 . 1 1 39 39 GLY H H 1 8.44 0.01 . 1 . . . . 442 GLY H . 18528 1
240 . 1 1 39 39 GLY HA2 H 1 4.01 0.01 . 1 . . . . 442 GLY HA2 . 18528 1
241 . 1 1 39 39 GLY HA3 H 1 4.01 0.01 . 1 . . . . 442 GLY HA3 . 18528 1
242 . 1 1 40 40 GLU H H 1 8.30 0.01 . 1 . . . . 443 GLU H . 18528 1
243 . 1 1 40 40 GLU HA H 1 4.36 0.01 . 1 . . . . 443 GLU HA . 18528 1
244 . 1 1 40 40 GLU HB2 H 1 1.97 0.01 . 2 . . . . 443 GLU HB2 . 18528 1
245 . 1 1 40 40 GLU HB3 H 1 2.11 0.01 . 2 . . . . 443 GLU HB3 . 18528 1
246 . 1 1 40 40 GLU HG2 H 1 2.32 0.01 . 1 . . . . 443 GLU HG2 . 18528 1
247 . 1 1 40 40 GLU HG3 H 1 2.32 0.01 . 1 . . . . 443 GLU HG3 . 18528 1
248 . 1 1 41 41 GLY H H 1 8.53 0.01 . 1 . . . . 444 GLY H . 18528 1
249 . 1 1 41 41 GLY HA2 H 1 4.01 0.01 . 1 . . . . 444 GLY HA2 . 18528 1
250 . 1 1 41 41 GLY HA3 H 1 4.01 0.01 . 1 . . . . 444 GLY HA3 . 18528 1
251 . 1 1 42 42 GLU H H 1 8.22 0.01 . 1 . . . . 445 GLU H . 18528 1
252 . 1 1 42 42 GLU HA H 1 4.34 0.01 . 1 . . . . 445 GLU HA . 18528 1
253 . 1 1 42 42 GLU HB2 H 1 1.92 0.01 . 2 . . . . 445 GLU HB2 . 18528 1
254 . 1 1 42 42 GLU HB3 H 1 2.04 0.01 . 2 . . . . 445 GLU HB3 . 18528 1
255 . 1 1 42 42 GLU HG2 H 1 2.27 0.01 . 1 . . . . 445 GLU HG2 . 18528 1
256 . 1 1 42 42 GLU HG3 H 1 2.27 0.01 . 1 . . . . 445 GLU HG3 . 18528 1
257 . 1 1 43 43 GLU H H 1 8.30 0.01 . 1 . . . . 446 GLU H . 18528 1
258 . 1 1 43 43 GLU HA H 1 4.36 0.01 . 1 . . . . 446 GLU HA . 18528 1
259 . 1 1 43 43 GLU HB2 H 1 1.97 0.01 . 1 . . . . 446 GLU HB2 . 18528 1
260 . 1 1 43 43 GLU HB3 H 1 2.11 0.01 . 1 . . . . 446 GLU HB3 . 18528 1
261 . 1 1 43 43 GLU HG2 H 1 2.29 0.01 . 1 . . . . 446 GLU HG2 . 18528 1
262 . 1 1 43 43 GLU HG3 H 1 2.29 0.01 . 1 . . . . 446 GLU HG3 . 18528 1
263 . 1 1 44 44 GLU H H 1 8.56 0.01 . 1 . . . . 447 GLU H . 18528 1
264 . 1 1 44 44 GLU HA H 1 4.32 0.01 . 1 . . . . 447 GLU HA . 18528 1
265 . 1 1 44 44 GLU HB2 H 1 1.99 0.01 . 1 . . . . 447 GLU HB2 . 18528 1
266 . 1 1 44 44 GLU HB3 H 1 2.10 0.01 . 1 . . . . 447 GLU HB3 . 18528 1
267 . 1 1 44 44 GLU HG2 H 1 2.29 0.01 . 1 . . . . 447 GLU HG2 . 18528 1
268 . 1 1 44 44 GLU HG3 H 1 2.29 0.01 . 1 . . . . 447 GLU HG3 . 18528 1
269 . 1 1 45 45 GLY H H 1 8.42 0.01 . 1 . . . . 448 GLY H . 18528 1
270 . 1 1 45 45 GLY HA2 H 1 4.01 0.01 . 1 . . . . 448 GLY HA2 . 18528 1
271 . 1 1 45 45 GLY HA3 H 1 4.01 0.01 . 1 . . . . 448 GLY HA3 . 18528 1
272 . 1 1 46 46 GLU H H 1 8.49 0.01 . 1 . . . . 449 GLU H . 18528 1
273 . 1 1 46 46 GLU HA H 1 4.33 0.01 . 1 . . . . 449 GLU HA . 18528 1
274 . 1 1 46 46 GLU HB2 H 1 2.01 0.01 . 2 . . . . 449 GLU HB2 . 18528 1
275 . 1 1 46 46 GLU HB3 H 1 2.12 0.01 . 2 . . . . 449 GLU HB3 . 18528 1
276 . 1 1 46 46 GLU HG2 H 1 2.31 0.01 . 1 . . . . 449 GLU HG2 . 18528 1
277 . 1 1 46 46 GLU HG3 H 1 2.31 0.01 . 1 . . . . 449 GLU HG3 . 18528 1
278 . 1 1 47 47 GLU H H 1 8.41 0.01 . 1 . . . . 450 GLU H . 18528 1
279 . 1 1 47 47 GLU HA H 1 4.27 0.01 . 1 . . . . 450 GLU HA . 18528 1
280 . 1 1 47 47 GLU HB2 H 1 1.89 0.01 . 2 . . . . 450 GLU HB2 . 18528 1
281 . 1 1 47 47 GLU HB3 H 1 2.02 0.01 . 2 . . . . 450 GLU HB3 . 18528 1
282 . 1 1 47 47 GLU HG2 H 1 2.19 0.01 . 2 . . . . 450 GLU HG2 . 18528 1
283 . 1 1 47 47 GLU HG3 H 1 2.26 0.01 . 2 . . . . 450 GLU HG3 . 18528 1
284 . 1 1 48 48 TYR H H 1 7.68 0.01 . 1 . . . . 451 TYR H . 18528 1
285 . 1 1 48 48 TYR HA H 1 4.40 0.01 . 1 . . . . 451 TYR HA . 18528 1
286 . 1 1 48 48 TYR HB2 H 1 2.91 0.01 . 2 . . . . 451 TYR HB2 . 18528 1
287 . 1 1 48 48 TYR HB3 H 1 3.10 0.01 . 2 . . . . 451 TYR HB3 . 18528 1
288 . 1 1 48 48 TYR HD1 H 1 7.13 0.01 . 3 . . . . 451 TYR HD1 . 18528 1
289 . 1 1 48 48 TYR HD2 H 1 7.13 0.01 . 3 . . . . 451 TYR HD2 . 18528 1
290 . 1 1 48 48 TYR HE1 H 1 6.84 0.01 . 3 . . . . 451 TYR HE1 . 18528 1
291 . 1 1 48 48 TYR HE2 H 1 6.84 0.01 . 3 . . . . 451 TYR HE2 . 18528 1
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