###################################
# 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 31083
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 '3D HNCA' . . . 31083 1
2 '3D HNCO' . . . 31083 1
3 '3D CBCA(CO)NH' . . . 31083 1
4 '3D HBHA(CO)NH' . . . 31083 1
5 '3D 1H-15N NOESY' . . . 31083 1
6 '3D HCCH-TOCSY' . . . 31083 1
7 '3D 1H-13C NOESY aromatic' . . . 31083 1
8 '3D 1H-13C NOESY aliphatic' . . . 31083 1
9 '2D 1H-15N HSQC' . . . 31083 1
10 '2D 1H-13C HSQC aliphatic' . . . 31083 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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 12 12 SER HA H 1 4.328 0.04 . 1 . . . . A 12 SER HA . 31083 1
2 . 1 . 1 12 12 SER HB2 H 1 3.762 0.04 . 2 . . . . A 12 SER HB2 . 31083 1
3 . 1 . 1 12 12 SER HB3 H 1 3.762 0.04 . 2 . . . . A 12 SER HB3 . 31083 1
4 . 1 . 1 12 12 SER C C 13 174.786 0.40 . 1 . . . . A 12 SER C . 31083 1
5 . 1 . 1 12 12 SER CA C 13 58.215 0.40 . 1 . . . . A 12 SER CA . 31083 1
6 . 1 . 1 12 12 SER CB C 13 63.704 0.40 . 1 . . . . A 12 SER CB . 31083 1
7 . 1 . 1 13 13 GLY H H 1 8.296 0.04 . 1 . . . . A 13 GLY H . 31083 1
8 . 1 . 1 13 13 GLY HA2 H 1 3.818 0.04 . 2 . . . . A 13 GLY HA2 . 31083 1
9 . 1 . 1 13 13 GLY HA3 H 1 3.818 0.04 . 2 . . . . A 13 GLY HA3 . 31083 1
10 . 1 . 1 13 13 GLY C C 13 173.641 0.40 . 1 . . . . A 13 GLY C . 31083 1
11 . 1 . 1 13 13 GLY CA C 13 45.064 0.40 . 1 . . . . A 13 GLY CA . 31083 1
12 . 1 . 1 13 13 GLY N N 15 110.630 0.40 . 1 . . . . A 13 GLY N . 31083 1
13 . 1 . 1 14 14 LEU H H 1 7.975 0.04 . 1 . . . . A 14 LEU H . 31083 1
14 . 1 . 1 14 14 LEU N N 15 121.701 0.40 . 1 . . . . A 14 LEU N . 31083 1
15 . 1 . 1 16 16 PRO HA H 1 4.241 0.04 . 1 . . . . A 16 PRO HA . 31083 1
16 . 1 . 1 16 16 PRO HB2 H 1 2.140 0.04 . 2 . . . . A 16 PRO HB2 . 31083 1
17 . 1 . 1 16 16 PRO HB3 H 1 1.731 0.04 . 2 . . . . A 16 PRO HB3 . 31083 1
18 . 1 . 1 16 16 PRO HG2 H 1 1.893 0.04 . 2 . . . . A 16 PRO HG2 . 31083 1
19 . 1 . 1 16 16 PRO HG3 H 1 1.812 0.04 . 2 . . . . A 16 PRO HG3 . 31083 1
20 . 1 . 1 16 16 PRO HD2 H 1 3.741 0.04 . 2 . . . . A 16 PRO HD2 . 31083 1
21 . 1 . 1 16 16 PRO HD3 H 1 3.516 0.04 . 2 . . . . A 16 PRO HD3 . 31083 1
22 . 1 . 1 16 16 PRO C C 13 176.725 0.40 . 1 . . . . A 16 PRO C . 31083 1
23 . 1 . 1 16 16 PRO CA C 13 62.819 0.40 . 1 . . . . A 16 PRO CA . 31083 1
24 . 1 . 1 16 16 PRO CB C 13 31.968 0.40 . 1 . . . . A 16 PRO CB . 31083 1
25 . 1 . 1 16 16 PRO CG C 13 27.230 0.40 . 1 . . . . A 16 PRO CG . 31083 1
26 . 1 . 1 16 16 PRO CD C 13 50.903 0.40 . 1 . . . . A 16 PRO CD . 31083 1
27 . 1 . 1 17 17 ARG H H 1 8.392 0.04 . 1 . . . . A 17 ARG H . 31083 1
28 . 1 . 1 17 17 ARG HA H 1 4.145 0.04 . 1 . . . . A 17 ARG HA . 31083 1
29 . 1 . 1 17 17 ARG HB2 H 1 1.698 0.04 . 2 . . . . A 17 ARG HB2 . 31083 1
30 . 1 . 1 17 17 ARG HB3 H 1 1.676 0.04 . 2 . . . . A 17 ARG HB3 . 31083 1
31 . 1 . 1 17 17 ARG HD2 H 1 3.061 0.04 . 2 . . . . A 17 ARG HD2 . 31083 1
32 . 1 . 1 17 17 ARG HD3 H 1 3.061 0.04 . 2 . . . . A 17 ARG HD3 . 31083 1
33 . 1 . 1 17 17 ARG C C 13 176.986 0.40 . 1 . . . . A 17 ARG C . 31083 1
34 . 1 . 1 17 17 ARG CA C 13 56.340 0.40 . 1 . . . . A 17 ARG CA . 31083 1
35 . 1 . 1 17 17 ARG CB C 13 30.583 0.40 . 1 . . . . A 17 ARG CB . 31083 1
36 . 1 . 1 17 17 ARG CD C 13 43.185 0.40 . 1 . . . . A 17 ARG CD . 31083 1
37 . 1 . 1 17 17 ARG N N 15 122.135 0.40 . 1 . . . . A 17 ARG N . 31083 1
38 . 1 . 1 18 18 GLY H H 1 8.411 0.04 . 1 . . . . A 18 GLY H . 31083 1
39 . 1 . 1 18 18 GLY HA2 H 1 3.843 0.04 . 2 . . . . A 18 GLY HA2 . 31083 1
40 . 1 . 1 18 18 GLY HA3 H 1 3.843 0.04 . 2 . . . . A 18 GLY HA3 . 31083 1
41 . 1 . 1 18 18 GLY C C 13 174.070 0.40 . 1 . . . . A 18 GLY C . 31083 1
42 . 1 . 1 18 18 GLY CA C 13 45.067 0.40 . 1 . . . . A 18 GLY CA . 31083 1
43 . 1 . 1 18 18 GLY N N 15 110.768 0.40 . 1 . . . . A 18 GLY N . 31083 1
44 . 1 . 1 19 19 SER H H 1 8.074 0.04 . 1 . . . . A 19 SER H . 31083 1
45 . 1 . 1 19 19 SER HA H 1 4.248 0.04 . 1 . . . . A 19 SER HA . 31083 1
46 . 1 . 1 19 19 SER HB2 H 1 3.670 0.04 . 2 . . . . A 19 SER HB2 . 31083 1
47 . 1 . 1 19 19 SER HB3 H 1 3.670 0.04 . 2 . . . . A 19 SER HB3 . 31083 1
48 . 1 . 1 19 19 SER C C 13 174.129 0.40 . 1 . . . . A 19 SER C . 31083 1
49 . 1 . 1 19 19 SER CA C 13 58.443 0.40 . 1 . . . . A 19 SER CA . 31083 1
50 . 1 . 1 19 19 SER CB C 13 63.682 0.40 . 1 . . . . A 19 SER CB . 31083 1
51 . 1 . 1 19 19 SER N N 15 115.372 0.40 . 1 . . . . A 19 SER N . 31083 1
52 . 1 . 1 20 20 HIS H H 1 8.505 0.04 . 1 . . . . A 20 HIS H . 31083 1
53 . 1 . 1 20 20 HIS HA H 1 4.571 0.04 . 1 . . . . A 20 HIS HA . 31083 1
54 . 1 . 1 20 20 HIS HB2 H 1 3.105 0.04 . 2 . . . . A 20 HIS HB2 . 31083 1
55 . 1 . 1 20 20 HIS HB3 H 1 2.993 0.04 . 2 . . . . A 20 HIS HB3 . 31083 1
56 . 1 . 1 20 20 HIS C C 13 174.077 0.40 . 1 . . . . A 20 HIS C . 31083 1
57 . 1 . 1 20 20 HIS CA C 13 55.161 0.40 . 1 . . . . A 20 HIS CA . 31083 1
58 . 1 . 1 20 20 HIS CB C 13 29.169 0.40 . 1 . . . . A 20 HIS CB . 31083 1
59 . 1 . 1 20 20 HIS N N 15 120.622 0.40 . 1 . . . . A 20 HIS N . 31083 1
60 . 1 . 1 21 21 MET H H 1 7.941 0.04 . 1 . . . . A 21 MET H . 31083 1
61 . 1 . 1 21 21 MET N N 15 120.236 0.40 . 1 . . . . A 21 MET N . 31083 1
62 . 1 . 1 23 23 THR HA H 1 5.568 0.04 . 1 . . . . A 23 THR HA . 31083 1
63 . 1 . 1 23 23 THR HB H 1 3.808 0.04 . 1 . . . . A 23 THR HB . 31083 1
64 . 1 . 1 23 23 THR HG21 H 1 1.121 0.04 . 1 . . . . A 23 THR HG21 . 31083 1
65 . 1 . 1 23 23 THR HG22 H 1 1.121 0.04 . 1 . . . . A 23 THR HG22 . 31083 1
66 . 1 . 1 23 23 THR HG23 H 1 1.121 0.04 . 1 . . . . A 23 THR HG23 . 31083 1
67 . 1 . 1 23 23 THR C C 13 173.348 0.40 . 1 . . . . A 23 THR C . 31083 1
68 . 1 . 1 23 23 THR CA C 13 61.276 0.40 . 1 . . . . A 23 THR CA . 31083 1
69 . 1 . 1 23 23 THR CB C 13 72.216 0.40 . 1 . . . . A 23 THR CB . 31083 1
70 . 1 . 1 23 23 THR CG2 C 13 22.339 0.40 . 1 . . . . A 23 THR CG2 . 31083 1
71 . 1 . 1 24 24 VAL H H 1 9.587 0.04 . 1 . . . . A 24 VAL H . 31083 1
72 . 1 . 1 24 24 VAL HA H 1 4.938 0.04 . 1 . . . . A 24 VAL HA . 31083 1
73 . 1 . 1 24 24 VAL HB H 1 2.158 0.04 . 1 . . . . A 24 VAL HB . 31083 1
74 . 1 . 1 24 24 VAL HG11 H 1 0.802 0.04 . 2 . . . . A 24 VAL HG11 . 31083 1
75 . 1 . 1 24 24 VAL HG12 H 1 0.802 0.04 . 2 . . . . A 24 VAL HG12 . 31083 1
76 . 1 . 1 24 24 VAL HG13 H 1 0.802 0.04 . 2 . . . . A 24 VAL HG13 . 31083 1
77 . 1 . 1 24 24 VAL HG21 H 1 0.957 0.04 . 2 . . . . A 24 VAL HG21 . 31083 1
78 . 1 . 1 24 24 VAL HG22 H 1 0.957 0.04 . 2 . . . . A 24 VAL HG22 . 31083 1
79 . 1 . 1 24 24 VAL HG23 H 1 0.957 0.04 . 2 . . . . A 24 VAL HG23 . 31083 1
80 . 1 . 1 24 24 VAL C C 13 173.906 0.40 . 1 . . . . A 24 VAL C . 31083 1
81 . 1 . 1 24 24 VAL CA C 13 61.188 0.40 . 1 . . . . A 24 VAL CA . 31083 1
82 . 1 . 1 24 24 VAL CB C 13 34.445 0.40 . 1 . . . . A 24 VAL CB . 31083 1
83 . 1 . 1 24 24 VAL CG1 C 13 21.080 0.40 . 2 . . . . A 24 VAL CG1 . 31083 1
84 . 1 . 1 24 24 VAL CG2 C 13 23.557 0.40 . 2 . . . . A 24 VAL CG2 . 31083 1
85 . 1 . 1 24 24 VAL N N 15 126.523 0.40 . 1 . . . . A 24 VAL N . 31083 1
86 . 1 . 1 25 25 GLU H H 1 8.958 0.04 . 1 . . . . A 25 GLU H . 31083 1
87 . 1 . 1 25 25 GLU HA H 1 5.421 0.04 . 1 . . . . A 25 GLU HA . 31083 1
88 . 1 . 1 25 25 GLU HB2 H 1 1.806 0.04 . 2 . . . . A 25 GLU HB2 . 31083 1
89 . 1 . 1 25 25 GLU HB3 H 1 1.554 0.04 . 2 . . . . A 25 GLU HB3 . 31083 1
90 . 1 . 1 25 25 GLU HG2 H 1 1.892 0.04 . 2 . . . . A 25 GLU HG2 . 31083 1
91 . 1 . 1 25 25 GLU HG3 H 1 1.790 0.04 . 2 . . . . A 25 GLU HG3 . 31083 1
92 . 1 . 1 25 25 GLU C C 13 174.257 0.40 . 1 . . . . A 25 GLU C . 31083 1
93 . 1 . 1 25 25 GLU CA C 13 54.217 0.40 . 1 . . . . A 25 GLU CA . 31083 1
94 . 1 . 1 25 25 GLU CB C 13 33.120 0.40 . 1 . . . . A 25 GLU CB . 31083 1
95 . 1 . 1 25 25 GLU CG C 13 35.971 0.40 . 1 . . . . A 25 GLU CG . 31083 1
96 . 1 . 1 25 25 GLU N N 15 129.294 0.40 . 1 . . . . A 25 GLU N . 31083 1
97 . 1 . 1 26 26 VAL H H 1 8.824 0.04 . 1 . . . . A 26 VAL H . 31083 1
98 . 1 . 1 26 26 VAL HA H 1 4.435 0.04 . 1 . . . . A 26 VAL HA . 31083 1
99 . 1 . 1 26 26 VAL HB H 1 2.048 0.04 . 1 . . . . A 26 VAL HB . 31083 1
100 . 1 . 1 26 26 VAL HG11 H 1 0.763 0.04 . 2 . . . . A 26 VAL HG11 . 31083 1
101 . 1 . 1 26 26 VAL HG12 H 1 0.763 0.04 . 2 . . . . A 26 VAL HG12 . 31083 1
102 . 1 . 1 26 26 VAL HG13 H 1 0.763 0.04 . 2 . . . . A 26 VAL HG13 . 31083 1
103 . 1 . 1 26 26 VAL HG21 H 1 0.872 0.04 . 2 . . . . A 26 VAL HG21 . 31083 1
104 . 1 . 1 26 26 VAL HG22 H 1 0.872 0.04 . 2 . . . . A 26 VAL HG22 . 31083 1
105 . 1 . 1 26 26 VAL HG23 H 1 0.872 0.04 . 2 . . . . A 26 VAL HG23 . 31083 1
106 . 1 . 1 26 26 VAL C C 13 175.020 0.40 . 1 . . . . A 26 VAL C . 31083 1
107 . 1 . 1 26 26 VAL CA C 13 59.955 0.40 . 1 . . . . A 26 VAL CA . 31083 1
108 . 1 . 1 26 26 VAL CB C 13 33.486 0.40 . 1 . . . . A 26 VAL CB . 31083 1
109 . 1 . 1 26 26 VAL CG1 C 13 20.791 0.40 . 2 . . . . A 26 VAL CG1 . 31083 1
110 . 1 . 1 26 26 VAL CG2 C 13 18.974 0.40 . 2 . . . . A 26 VAL CG2 . 31083 1
111 . 1 . 1 26 26 VAL N N 15 123.578 0.40 . 1 . . . . A 26 VAL N . 31083 1
112 . 1 . 1 27 27 ASN H H 1 9.678 0.04 . 1 . . . . A 27 ASN H . 31083 1
113 . 1 . 1 27 27 ASN HA H 1 4.285 0.04 . 1 . . . . A 27 ASN HA . 31083 1
114 . 1 . 1 27 27 ASN HB2 H 1 3.006 0.04 . 2 . . . . A 27 ASN HB2 . 31083 1
115 . 1 . 1 27 27 ASN HB3 H 1 2.579 0.04 . 2 . . . . A 27 ASN HB3 . 31083 1
116 . 1 . 1 27 27 ASN C C 13 174.855 0.40 . 1 . . . . A 27 ASN C . 31083 1
117 . 1 . 1 27 27 ASN CA C 13 54.125 0.40 . 1 . . . . A 27 ASN CA . 31083 1
118 . 1 . 1 27 27 ASN CB C 13 37.832 0.40 . 1 . . . . A 27 ASN CB . 31083 1
119 . 1 . 1 27 27 ASN N N 15 128.303 0.40 . 1 . . . . A 27 ASN N . 31083 1
120 . 1 . 1 28 28 GLY H H 1 8.710 0.04 . 1 . . . . A 28 GLY H . 31083 1
121 . 1 . 1 28 28 GLY HA2 H 1 3.988 0.04 . 2 . . . . A 28 GLY HA2 . 31083 1
122 . 1 . 1 28 28 GLY HA3 H 1 3.512 0.04 . 2 . . . . A 28 GLY HA3 . 31083 1
123 . 1 . 1 28 28 GLY C C 13 173.618 0.40 . 1 . . . . A 28 GLY C . 31083 1
124 . 1 . 1 28 28 GLY CA C 13 45.251 0.40 . 1 . . . . A 28 GLY CA . 31083 1
125 . 1 . 1 28 28 GLY N N 15 103.325 0.40 . 1 . . . . A 28 GLY N . 31083 1
126 . 1 . 1 29 29 VAL H H 1 7.816 0.04 . 1 . . . . A 29 VAL H . 31083 1
127 . 1 . 1 29 29 VAL HA H 1 3.889 0.04 . 1 . . . . A 29 VAL HA . 31083 1
128 . 1 . 1 29 29 VAL HB H 1 1.899 0.04 . 1 . . . . A 29 VAL HB . 31083 1
129 . 1 . 1 29 29 VAL HG11 H 1 0.754 0.04 . 2 . . . . A 29 VAL HG11 . 31083 1
130 . 1 . 1 29 29 VAL HG12 H 1 0.754 0.04 . 2 . . . . A 29 VAL HG12 . 31083 1
131 . 1 . 1 29 29 VAL HG13 H 1 0.754 0.04 . 2 . . . . A 29 VAL HG13 . 31083 1
132 . 1 . 1 29 29 VAL HG21 H 1 0.393 0.04 . 2 . . . . A 29 VAL HG21 . 31083 1
133 . 1 . 1 29 29 VAL HG22 H 1 0.393 0.04 . 2 . . . . A 29 VAL HG22 . 31083 1
134 . 1 . 1 29 29 VAL HG23 H 1 0.393 0.04 . 2 . . . . A 29 VAL HG23 . 31083 1
135 . 1 . 1 29 29 VAL C C 13 173.854 0.40 . 1 . . . . A 29 VAL C . 31083 1
136 . 1 . 1 29 29 VAL CA C 13 61.719 0.40 . 1 . . . . A 29 VAL CA . 31083 1
137 . 1 . 1 29 29 VAL CB C 13 32.914 0.40 . 1 . . . . A 29 VAL CB . 31083 1
138 . 1 . 1 29 29 VAL CG1 C 13 20.991 0.40 . 2 . . . . A 29 VAL CG1 . 31083 1
139 . 1 . 1 29 29 VAL CG2 C 13 20.824 0.40 . 2 . . . . A 29 VAL CG2 . 31083 1
140 . 1 . 1 29 29 VAL N N 15 123.525 0.40 . 1 . . . . A 29 VAL N . 31083 1
141 . 1 . 1 30 30 LYS H H 1 7.932 0.04 . 1 . . . . A 30 LYS H . 31083 1
142 . 1 . 1 30 30 LYS HA H 1 4.821 0.04 . 1 . . . . A 30 LYS HA . 31083 1
143 . 1 . 1 30 30 LYS HB2 H 1 1.415 0.04 . 2 . . . . A 30 LYS HB2 . 31083 1
144 . 1 . 1 30 30 LYS HB3 H 1 1.379 0.04 . 2 . . . . A 30 LYS HB3 . 31083 1
145 . 1 . 1 30 30 LYS HG2 H 1 0.965 0.04 . 2 . . . . A 30 LYS HG2 . 31083 1
146 . 1 . 1 30 30 LYS HG3 H 1 0.965 0.04 . 2 . . . . A 30 LYS HG3 . 31083 1
147 . 1 . 1 30 30 LYS HD2 H 1 1.437 0.04 . 2 . . . . A 30 LYS HD2 . 31083 1
148 . 1 . 1 30 30 LYS HD3 H 1 1.437 0.04 . 2 . . . . A 30 LYS HD3 . 31083 1
149 . 1 . 1 30 30 LYS HE2 H 1 2.741 0.04 . 2 . . . . A 30 LYS HE2 . 31083 1
150 . 1 . 1 30 30 LYS HE3 H 1 2.741 0.04 . 2 . . . . A 30 LYS HE3 . 31083 1
151 . 1 . 1 30 30 LYS C C 13 175.435 0.40 . 1 . . . . A 30 LYS C . 31083 1
152 . 1 . 1 30 30 LYS CA C 13 55.236 0.40 . 1 . . . . A 30 LYS CA . 31083 1
153 . 1 . 1 30 30 LYS CB C 13 34.570 0.40 . 1 . . . . A 30 LYS CB . 31083 1
154 . 1 . 1 30 30 LYS CG C 13 25.607 0.40 . 1 . . . . A 30 LYS CG . 31083 1
155 . 1 . 1 30 30 LYS CD C 13 29.117 0.40 . 1 . . . . A 30 LYS CD . 31083 1
156 . 1 . 1 30 30 LYS CE C 13 41.925 0.40 . 1 . . . . A 30 LYS CE . 31083 1
157 . 1 . 1 30 30 LYS N N 15 124.182 0.40 . 1 . . . . A 30 LYS N . 31083 1
158 . 1 . 1 31 31 TYR H H 1 9.178 0.04 . 1 . . . . A 31 TYR H . 31083 1
159 . 1 . 1 31 31 TYR HA H 1 4.445 0.04 . 1 . . . . A 31 TYR HA . 31083 1
160 . 1 . 1 31 31 TYR HB2 H 1 2.829 0.04 . 2 . . . . A 31 TYR HB2 . 31083 1
161 . 1 . 1 31 31 TYR HB3 H 1 2.713 0.04 . 2 . . . . A 31 TYR HB3 . 31083 1
162 . 1 . 1 31 31 TYR HD1 H 1 6.925 0.04 . 3 . . . . A 31 TYR HD1 . 31083 1
163 . 1 . 1 31 31 TYR HD2 H 1 6.925 0.04 . 3 . . . . A 31 TYR HD2 . 31083 1
164 . 1 . 1 31 31 TYR HE1 H 1 6.503 0.04 . 3 . . . . A 31 TYR HE1 . 31083 1
165 . 1 . 1 31 31 TYR HE2 H 1 6.503 0.04 . 3 . . . . A 31 TYR HE2 . 31083 1
166 . 1 . 1 31 31 TYR C C 13 174.008 0.40 . 1 . . . . A 31 TYR C . 31083 1
167 . 1 . 1 31 31 TYR CA C 13 56.601 0.40 . 1 . . . . A 31 TYR CA . 31083 1
168 . 1 . 1 31 31 TYR CB C 13 40.653 0.40 . 1 . . . . A 31 TYR CB . 31083 1
169 . 1 . 1 31 31 TYR CD1 C 13 133.418 0.40 . 3 . . . . A 31 TYR CD1 . 31083 1
170 . 1 . 1 31 31 TYR CD2 C 13 133.418 0.40 . 3 . . . . A 31 TYR CD2 . 31083 1
171 . 1 . 1 31 31 TYR CE1 C 13 117.815 0.40 . 3 . . . . A 31 TYR CE1 . 31083 1
172 . 1 . 1 31 31 TYR CE2 C 13 117.815 0.40 . 3 . . . . A 31 TYR CE2 . 31083 1
173 . 1 . 1 31 31 TYR N N 15 122.953 0.40 . 1 . . . . A 31 TYR N . 31083 1
174 . 1 . 1 32 32 ASP H H 1 8.300 0.04 . 1 . . . . A 32 ASP H . 31083 1
175 . 1 . 1 32 32 ASP HA H 1 5.211 0.04 . 1 . . . . A 32 ASP HA . 31083 1
176 . 1 . 1 32 32 ASP HB2 H 1 2.431 0.04 . 2 . . . . A 32 ASP HB2 . 31083 1
177 . 1 . 1 32 32 ASP HB3 H 1 2.267 0.04 . 2 . . . . A 32 ASP HB3 . 31083 1
178 . 1 . 1 32 32 ASP C C 13 175.585 0.40 . 1 . . . . A 32 ASP C . 31083 1
179 . 1 . 1 32 32 ASP CA C 13 53.767 0.40 . 1 . . . . A 32 ASP CA . 31083 1
180 . 1 . 1 32 32 ASP CB C 13 42.932 0.40 . 1 . . . . A 32 ASP CB . 31083 1
181 . 1 . 1 32 32 ASP N N 15 122.974 0.40 . 1 . . . . A 32 ASP N . 31083 1
182 . 1 . 1 33 33 PHE H H 1 8.889 0.04 . 1 . . . . A 33 PHE H . 31083 1
183 . 1 . 1 33 33 PHE HA H 1 4.594 0.04 . 1 . . . . A 33 PHE HA . 31083 1
184 . 1 . 1 33 33 PHE HB2 H 1 3.161 0.04 . 2 . . . . A 33 PHE HB2 . 31083 1
185 . 1 . 1 33 33 PHE HB3 H 1 2.599 0.04 . 2 . . . . A 33 PHE HB3 . 31083 1
186 . 1 . 1 33 33 PHE HD1 H 1 7.147 0.04 . 3 . . . . A 33 PHE HD1 . 31083 1
187 . 1 . 1 33 33 PHE HD2 H 1 7.147 0.04 . 3 . . . . A 33 PHE HD2 . 31083 1
188 . 1 . 1 33 33 PHE HZ H 1 7.124 0.04 . 3 . . . . A 33 PHE HZ . 31083 1
189 . 1 . 1 33 33 PHE C C 13 175.073 0.40 . 1 . . . . A 33 PHE C . 31083 1
190 . 1 . 1 33 33 PHE CA C 13 57.356 0.40 . 1 . . . . A 33 PHE CA . 31083 1
191 . 1 . 1 33 33 PHE CB C 13 43.245 0.40 . 1 . . . . A 33 PHE CB . 31083 1
192 . 1 . 1 33 33 PHE CD1 C 13 132.030 0.40 . 3 . . . . A 33 PHE CD1 . 31083 1
193 . 1 . 1 33 33 PHE CD2 C 13 132.030 0.40 . 3 . . . . A 33 PHE CD2 . 31083 1
194 . 1 . 1 33 33 PHE CZ C 13 129.552 0.40 . 1 . . . . A 33 PHE CZ . 31083 1
195 . 1 . 1 33 33 PHE N N 15 118.945 0.40 . 1 . . . . A 33 PHE N . 31083 1
196 . 1 . 1 34 34 ASP H H 1 8.619 0.04 . 1 . . . . A 34 ASP H . 31083 1
197 . 1 . 1 34 34 ASP HA H 1 4.569 0.04 . 1 . . . . A 34 ASP HA . 31083 1
198 . 1 . 1 34 34 ASP HB2 H 1 2.676 0.04 . 2 . . . . A 34 ASP HB2 . 31083 1
199 . 1 . 1 34 34 ASP HB3 H 1 2.575 0.04 . 2 . . . . A 34 ASP HB3 . 31083 1
200 . 1 . 1 34 34 ASP CA C 13 55.001 0.40 . 1 . . . . A 34 ASP CA . 31083 1
201 . 1 . 1 34 34 ASP CB C 13 41.295 0.40 . 1 . . . . A 34 ASP CB . 31083 1
202 . 1 . 1 34 34 ASP N N 15 119.844 0.40 . 1 . . . . A 34 ASP N . 31083 1
203 . 1 . 1 35 35 ASN HA H 1 5.106 0.04 . 1 . . . . A 35 ASN HA . 31083 1
204 . 1 . 1 35 35 ASN HB2 H 1 2.932 0.04 . 2 . . . . A 35 ASN HB2 . 31083 1
205 . 1 . 1 35 35 ASN HB3 H 1 2.766 0.04 . 2 . . . . A 35 ASN HB3 . 31083 1
206 . 1 . 1 35 35 ASN CA C 13 50.215 0.40 . 1 . . . . A 35 ASN CA . 31083 1
207 . 1 . 1 35 35 ASN CB C 13 39.733 0.40 . 1 . . . . A 35 ASN CB . 31083 1
208 . 1 . 1 36 36 PRO HA H 1 4.183 0.04 . 1 . . . . A 36 PRO HA . 31083 1
209 . 1 . 1 36 36 PRO HB2 H 1 2.323 0.04 . 2 . . . . A 36 PRO HB2 . 31083 1
210 . 1 . 1 36 36 PRO HB3 H 1 2.006 0.04 . 2 . . . . A 36 PRO HB3 . 31083 1
211 . 1 . 1 36 36 PRO HG2 H 1 2.095 0.04 . 2 . . . . A 36 PRO HG2 . 31083 1
212 . 1 . 1 36 36 PRO HG3 H 1 1.945 0.04 . 2 . . . . A 36 PRO HG3 . 31083 1
213 . 1 . 1 36 36 PRO HD2 H 1 3.890 0.04 . 2 . . . . A 36 PRO HD2 . 31083 1
214 . 1 . 1 36 36 PRO HD3 H 1 3.890 0.04 . 2 . . . . A 36 PRO HD3 . 31083 1
215 . 1 . 1 36 36 PRO C C 13 178.503 0.40 . 1 . . . . A 36 PRO C . 31083 1
216 . 1 . 1 36 36 PRO CA C 13 64.785 0.40 . 1 . . . . A 36 PRO CA . 31083 1
217 . 1 . 1 36 36 PRO CB C 13 32.550 0.40 . 1 . . . . A 36 PRO CB . 31083 1
218 . 1 . 1 36 36 PRO CG C 13 27.294 0.40 . 1 . . . . A 36 PRO CG . 31083 1
219 . 1 . 1 36 36 PRO CD C 13 51.085 0.40 . 1 . . . . A 36 PRO CD . 31083 1
220 . 1 . 1 37 37 GLU H H 1 8.104 0.04 . 1 . . . . A 37 GLU H . 31083 1
221 . 1 . 1 37 37 GLU HA H 1 3.950 0.04 . 1 . . . . A 37 GLU HA . 31083 1
222 . 1 . 1 37 37 GLU HB2 H 1 1.986 0.04 . 2 . . . . A 37 GLU HB2 . 31083 1
223 . 1 . 1 37 37 GLU HB3 H 1 1.849 0.04 . 2 . . . . A 37 GLU HB3 . 31083 1
224 . 1 . 1 37 37 GLU HG2 H 1 2.207 0.04 . 2 . . . . A 37 GLU HG2 . 31083 1
225 . 1 . 1 37 37 GLU HG3 H 1 2.147 0.04 . 2 . . . . A 37 GLU HG3 . 31083 1
226 . 1 . 1 37 37 GLU C C 13 178.817 0.40 . 1 . . . . A 37 GLU C . 31083 1
227 . 1 . 1 37 37 GLU CA C 13 59.350 0.40 . 1 . . . . A 37 GLU CA . 31083 1
228 . 1 . 1 37 37 GLU CB C 13 28.534 0.40 . 1 . . . . A 37 GLU CB . 31083 1
229 . 1 . 1 37 37 GLU CG C 13 36.489 0.40 . 1 . . . . A 37 GLU CG . 31083 1
230 . 1 . 1 37 37 GLU N N 15 119.598 0.40 . 1 . . . . A 37 GLU N . 31083 1
231 . 1 . 1 38 38 GLN H H 1 7.734 0.04 . 1 . . . . A 38 GLN H . 31083 1
232 . 1 . 1 38 38 GLN HA H 1 3.788 0.04 . 1 . . . . A 38 GLN HA . 31083 1
233 . 1 . 1 38 38 GLN HB2 H 1 1.961 0.04 . 2 . . . . A 38 GLN HB2 . 31083 1
234 . 1 . 1 38 38 GLN HB3 H 1 1.916 0.04 . 2 . . . . A 38 GLN HB3 . 31083 1
235 . 1 . 1 38 38 GLN HG2 H 1 2.343 0.04 . 2 . . . . A 38 GLN HG2 . 31083 1
236 . 1 . 1 38 38 GLN HG3 H 1 2.131 0.04 . 2 . . . . A 38 GLN HG3 . 31083 1
237 . 1 . 1 38 38 GLN C C 13 178.098 0.40 . 1 . . . . A 38 GLN C . 31083 1
238 . 1 . 1 38 38 GLN CA C 13 58.057 0.40 . 1 . . . . A 38 GLN CA . 31083 1
239 . 1 . 1 38 38 GLN CB C 13 28.827 0.40 . 1 . . . . A 38 GLN CB . 31083 1
240 . 1 . 1 38 38 GLN CG C 13 34.260 0.40 . 1 . . . . A 38 GLN CG . 31083 1
241 . 1 . 1 38 38 GLN N N 15 119.789 0.40 . 1 . . . . A 38 GLN N . 31083 1
242 . 1 . 1 39 39 ALA H H 1 6.951 0.04 . 1 . . . . A 39 ALA H . 31083 1
243 . 1 . 1 39 39 ALA HA H 1 2.507 0.04 . 1 . . . . A 39 ALA HA . 31083 1
244 . 1 . 1 39 39 ALA HB1 H 1 1.077 0.04 . 1 . . . . A 39 ALA HB1 . 31083 1
245 . 1 . 1 39 39 ALA HB2 H 1 1.077 0.04 . 1 . . . . A 39 ALA HB2 . 31083 1
246 . 1 . 1 39 39 ALA HB3 H 1 1.077 0.04 . 1 . . . . A 39 ALA HB3 . 31083 1
247 . 1 . 1 39 39 ALA C C 13 176.795 0.40 . 1 . . . . A 39 ALA C . 31083 1
248 . 1 . 1 39 39 ALA CA C 13 54.149 0.40 . 1 . . . . A 39 ALA CA . 31083 1
249 . 1 . 1 39 39 ALA CB C 13 18.583 0.40 . 1 . . . . A 39 ALA CB . 31083 1
250 . 1 . 1 39 39 ALA N N 15 120.861 0.40 . 1 . . . . A 39 ALA N . 31083 1
251 . 1 . 1 40 40 ARG H H 1 7.412 0.04 . 1 . . . . A 40 ARG H . 31083 1
252 . 1 . 1 40 40 ARG HA H 1 2.485 0.04 . 1 . . . . A 40 ARG HA . 31083 1
253 . 1 . 1 40 40 ARG HB2 H 1 1.545 0.04 . 2 . . . . A 40 ARG HB2 . 31083 1
254 . 1 . 1 40 40 ARG HB3 H 1 1.545 0.04 . 2 . . . . A 40 ARG HB3 . 31083 1
255 . 1 . 1 40 40 ARG HG2 H 1 1.250 0.04 . 2 . . . . A 40 ARG HG2 . 31083 1
256 . 1 . 1 40 40 ARG HG3 H 1 1.220 0.04 . 2 . . . . A 40 ARG HG3 . 31083 1
257 . 1 . 1 40 40 ARG HD2 H 1 3.006 0.04 . 2 . . . . A 40 ARG HD2 . 31083 1
258 . 1 . 1 40 40 ARG HD3 H 1 3.006 0.04 . 2 . . . . A 40 ARG HD3 . 31083 1
259 . 1 . 1 40 40 ARG C C 13 177.477 0.40 . 1 . . . . A 40 ARG C . 31083 1
260 . 1 . 1 40 40 ARG CA C 13 58.902 0.40 . 1 . . . . A 40 ARG CA . 31083 1
261 . 1 . 1 40 40 ARG CB C 13 29.271 0.40 . 1 . . . . A 40 ARG CB . 31083 1
262 . 1 . 1 40 40 ARG CG C 13 26.401 0.40 . 1 . . . . A 40 ARG CG . 31083 1
263 . 1 . 1 40 40 ARG CD C 13 42.742 0.40 . 1 . . . . A 40 ARG CD . 31083 1
264 . 1 . 1 40 40 ARG N N 15 117.153 0.40 . 1 . . . . A 40 ARG N . 31083 1
265 . 1 . 1 41 41 GLU H H 1 7.534 0.04 . 1 . . . . A 41 GLU H . 31083 1
266 . 1 . 1 41 41 GLU HA H 1 3.652 0.04 . 1 . . . . A 41 GLU HA . 31083 1
267 . 1 . 1 41 41 GLU HB2 H 1 1.815 0.04 . 2 . . . . A 41 GLU HB2 . 31083 1
268 . 1 . 1 41 41 GLU HB3 H 1 1.749 0.04 . 2 . . . . A 41 GLU HB3 . 31083 1
269 . 1 . 1 41 41 GLU HG2 H 1 2.182 0.04 . 2 . . . . A 41 GLU HG2 . 31083 1
270 . 1 . 1 41 41 GLU HG3 H 1 1.969 0.04 . 2 . . . . A 41 GLU HG3 . 31083 1
271 . 1 . 1 41 41 GLU C C 13 179.161 0.40 . 1 . . . . A 41 GLU C . 31083 1
272 . 1 . 1 41 41 GLU CA C 13 59.134 0.40 . 1 . . . . A 41 GLU CA . 31083 1
273 . 1 . 1 41 41 GLU CB C 13 29.114 0.40 . 1 . . . . A 41 GLU CB . 31083 1
274 . 1 . 1 41 41 GLU CG C 13 35.899 0.40 . 1 . . . . A 41 GLU CG . 31083 1
275 . 1 . 1 41 41 GLU N N 15 117.386 0.40 . 1 . . . . A 41 GLU N . 31083 1
276 . 1 . 1 42 42 MET H H 1 7.502 0.04 . 1 . . . . A 42 MET H . 31083 1
277 . 1 . 1 42 42 MET HA H 1 3.889 0.04 . 1 . . . . A 42 MET HA . 31083 1
278 . 1 . 1 42 42 MET HB2 H 1 1.662 0.04 . 2 . . . . A 42 MET HB2 . 31083 1
279 . 1 . 1 42 42 MET HB3 H 1 1.477 0.04 . 2 . . . . A 42 MET HB3 . 31083 1
280 . 1 . 1 42 42 MET HG2 H 1 2.245 0.04 . 2 . . . . A 42 MET HG2 . 31083 1
281 . 1 . 1 42 42 MET HG3 H 1 2.245 0.04 . 2 . . . . A 42 MET HG3 . 31083 1
282 . 1 . 1 42 42 MET HE1 H 1 1.554 0.04 . 1 . . . . A 42 MET HE1 . 31083 1
283 . 1 . 1 42 42 MET HE2 H 1 1.554 0.04 . 1 . . . . A 42 MET HE2 . 31083 1
284 . 1 . 1 42 42 MET HE3 H 1 1.554 0.04 . 1 . . . . A 42 MET HE3 . 31083 1
285 . 1 . 1 42 42 MET C C 13 177.413 0.40 . 1 . . . . A 42 MET C . 31083 1
286 . 1 . 1 42 42 MET CA C 13 57.692 0.40 . 1 . . . . A 42 MET CA . 31083 1
287 . 1 . 1 42 42 MET CB C 13 30.771 0.40 . 1 . . . . A 42 MET CB . 31083 1
288 . 1 . 1 42 42 MET CG C 13 32.268 0.40 . 1 . . . . A 42 MET CG . 31083 1
289 . 1 . 1 42 42 MET N N 15 117.998 0.40 . 1 . . . . A 42 MET N . 31083 1
290 . 1 . 1 43 43 ALA H H 1 8.129 0.04 . 1 . . . . A 43 ALA H . 31083 1
291 . 1 . 1 43 43 ALA HA H 1 3.610 0.04 . 1 . . . . A 43 ALA HA . 31083 1
292 . 1 . 1 43 43 ALA HB1 H 1 0.988 0.04 . 1 . . . . A 43 ALA HB1 . 31083 1
293 . 1 . 1 43 43 ALA HB2 H 1 0.988 0.04 . 1 . . . . A 43 ALA HB2 . 31083 1
294 . 1 . 1 43 43 ALA HB3 H 1 0.988 0.04 . 1 . . . . A 43 ALA HB3 . 31083 1
295 . 1 . 1 43 43 ALA C C 13 178.402 0.40 . 1 . . . . A 43 ALA C . 31083 1
296 . 1 . 1 43 43 ALA CA C 13 54.900 0.40 . 1 . . . . A 43 ALA CA . 31083 1
297 . 1 . 1 43 43 ALA CB C 13 17.919 0.40 . 1 . . . . A 43 ALA CB . 31083 1
298 . 1 . 1 43 43 ALA N N 15 120.802 0.40 . 1 . . . . A 43 ALA N . 31083 1
299 . 1 . 1 44 44 GLU H H 1 7.990 0.04 . 1 . . . . A 44 GLU H . 31083 1
300 . 1 . 1 44 44 GLU HA H 1 3.644 0.04 . 1 . . . . A 44 GLU HA . 31083 1
301 . 1 . 1 44 44 GLU HB2 H 1 1.817 0.04 . 2 . . . . A 44 GLU HB2 . 31083 1
302 . 1 . 1 44 44 GLU HB3 H 1 1.817 0.04 . 2 . . . . A 44 GLU HB3 . 31083 1
303 . 1 . 1 44 44 GLU HG2 H 1 2.258 0.04 . 2 . . . . A 44 GLU HG2 . 31083 1
304 . 1 . 1 44 44 GLU HG3 H 1 2.038 0.04 . 2 . . . . A 44 GLU HG3 . 31083 1
305 . 1 . 1 44 44 GLU C C 13 179.293 0.40 . 1 . . . . A 44 GLU C . 31083 1
306 . 1 . 1 44 44 GLU CA C 13 59.095 0.40 . 1 . . . . A 44 GLU CA . 31083 1
307 . 1 . 1 44 44 GLU CB C 13 28.959 0.40 . 1 . . . . A 44 GLU CB . 31083 1
308 . 1 . 1 44 44 GLU CG C 13 36.308 0.40 . 1 . . . . A 44 GLU CG . 31083 1
309 . 1 . 1 44 44 GLU N N 15 114.848 0.40 . 1 . . . . A 44 GLU N . 31083 1
310 . 1 . 1 45 45 ARG H H 1 7.712 0.04 . 1 . . . . A 45 ARG H . 31083 1
311 . 1 . 1 45 45 ARG HA H 1 3.869 0.04 . 1 . . . . A 45 ARG HA . 31083 1
312 . 1 . 1 45 45 ARG HB2 H 1 1.795 0.04 . 2 . . . . A 45 ARG HB2 . 31083 1
313 . 1 . 1 45 45 ARG HB3 H 1 1.765 0.04 . 2 . . . . A 45 ARG HB3 . 31083 1
314 . 1 . 1 45 45 ARG HG2 H 1 1.587 0.04 . 2 . . . . A 45 ARG HG2 . 31083 1
315 . 1 . 1 45 45 ARG HG3 H 1 1.437 0.04 . 2 . . . . A 45 ARG HG3 . 31083 1
316 . 1 . 1 45 45 ARG HD2 H 1 3.022 0.04 . 2 . . . . A 45 ARG HD2 . 31083 1
317 . 1 . 1 45 45 ARG HD3 H 1 3.022 0.04 . 2 . . . . A 45 ARG HD3 . 31083 1
318 . 1 . 1 45 45 ARG C C 13 179.638 0.40 . 1 . . . . A 45 ARG C . 31083 1
319 . 1 . 1 45 45 ARG CA C 13 59.354 0.40 . 1 . . . . A 45 ARG CA . 31083 1
320 . 1 . 1 45 45 ARG CB C 13 30.181 0.40 . 1 . . . . A 45 ARG CB . 31083 1
321 . 1 . 1 45 45 ARG CG C 13 26.804 0.40 . 1 . . . . A 45 ARG CG . 31083 1
322 . 1 . 1 45 45 ARG CD C 13 43.407 0.40 . 1 . . . . A 45 ARG CD . 31083 1
323 . 1 . 1 45 45 ARG N N 15 120.168 0.40 . 1 . . . . A 45 ARG N . 31083 1
324 . 1 . 1 46 46 ILE H H 1 8.483 0.04 . 1 . . . . A 46 ILE H . 31083 1
325 . 1 . 1 46 46 ILE HA H 1 3.545 0.04 . 1 . . . . A 46 ILE HA . 31083 1
326 . 1 . 1 46 46 ILE HB H 1 1.586 0.04 . 1 . . . . A 46 ILE HB . 31083 1
327 . 1 . 1 46 46 ILE HG12 H 1 1.494 0.04 . 2 . . . . A 46 ILE HG12 . 31083 1
328 . 1 . 1 46 46 ILE HG13 H 1 0.918 0.04 . 2 . . . . A 46 ILE HG13 . 31083 1
329 . 1 . 1 46 46 ILE HG21 H 1 0.714 0.04 . 1 . . . . A 46 ILE HG21 . 31083 1
330 . 1 . 1 46 46 ILE HG22 H 1 0.714 0.04 . 1 . . . . A 46 ILE HG22 . 31083 1
331 . 1 . 1 46 46 ILE HG23 H 1 0.714 0.04 . 1 . . . . A 46 ILE HG23 . 31083 1
332 . 1 . 1 46 46 ILE HD11 H 1 0.512 0.04 . 1 . . . . A 46 ILE HD11 . 31083 1
333 . 1 . 1 46 46 ILE HD12 H 1 0.512 0.04 . 1 . . . . A 46 ILE HD12 . 31083 1
334 . 1 . 1 46 46 ILE HD13 H 1 0.512 0.04 . 1 . . . . A 46 ILE HD13 . 31083 1
335 . 1 . 1 46 46 ILE C C 13 178.340 0.40 . 1 . . . . A 46 ILE C . 31083 1
336 . 1 . 1 46 46 ILE CA C 13 64.319 0.40 . 1 . . . . A 46 ILE CA . 31083 1
337 . 1 . 1 46 46 ILE CB C 13 37.414 0.40 . 1 . . . . A 46 ILE CB . 31083 1
338 . 1 . 1 46 46 ILE CG1 C 13 28.575 0.40 . 1 . . . . A 46 ILE CG1 . 31083 1
339 . 1 . 1 46 46 ILE CG2 C 13 18.184 0.40 . 1 . . . . A 46 ILE CG2 . 31083 1
340 . 1 . 1 46 46 ILE CD1 C 13 12.831 0.40 . 1 . . . . A 46 ILE CD1 . 31083 1
341 . 1 . 1 46 46 ILE N N 15 121.551 0.40 . 1 . . . . A 46 ILE N . 31083 1
342 . 1 . 1 47 47 ALA H H 1 8.431 0.04 . 1 . . . . A 47 ALA H . 31083 1
343 . 1 . 1 47 47 ALA HA H 1 3.497 0.04 . 1 . . . . A 47 ALA HA . 31083 1
344 . 1 . 1 47 47 ALA HB1 H 1 1.151 0.04 . 1 . . . . A 47 ALA HB1 . 31083 1
345 . 1 . 1 47 47 ALA HB2 H 1 1.151 0.04 . 1 . . . . A 47 ALA HB2 . 31083 1
346 . 1 . 1 47 47 ALA HB3 H 1 1.151 0.04 . 1 . . . . A 47 ALA HB3 . 31083 1
347 . 1 . 1 47 47 ALA C C 13 179.744 0.40 . 1 . . . . A 47 ALA C . 31083 1
348 . 1 . 1 47 47 ALA CA C 13 56.174 0.40 . 1 . . . . A 47 ALA CA . 31083 1
349 . 1 . 1 47 47 ALA CB C 13 18.070 0.40 . 1 . . . . A 47 ALA CB . 31083 1
350 . 1 . 1 47 47 ALA N N 15 122.180 0.40 . 1 . . . . A 47 ALA N . 31083 1
351 . 1 . 1 48 48 LYS H H 1 7.845 0.04 . 1 . . . . A 48 LYS H . 31083 1
352 . 1 . 1 48 48 LYS HA H 1 4.015 0.04 . 1 . . . . A 48 LYS HA . 31083 1
353 . 1 . 1 48 48 LYS HB2 H 1 1.811 0.04 . 2 . . . . A 48 LYS HB2 . 31083 1
354 . 1 . 1 48 48 LYS HB3 H 1 1.777 0.04 . 2 . . . . A 48 LYS HB3 . 31083 1
355 . 1 . 1 48 48 LYS HG2 H 1 1.418 0.04 . 2 . . . . A 48 LYS HG2 . 31083 1
356 . 1 . 1 48 48 LYS HG3 H 1 1.330 0.04 . 2 . . . . A 48 LYS HG3 . 31083 1
357 . 1 . 1 48 48 LYS HD2 H 1 1.553 0.04 . 2 . . . . A 48 LYS HD2 . 31083 1
358 . 1 . 1 48 48 LYS HD3 H 1 1.553 0.04 . 2 . . . . A 48 LYS HD3 . 31083 1
359 . 1 . 1 48 48 LYS HE2 H 1 2.846 0.04 . 2 . . . . A 48 LYS HE2 . 31083 1
360 . 1 . 1 48 48 LYS HE3 H 1 2.846 0.04 . 2 . . . . A 48 LYS HE3 . 31083 1
361 . 1 . 1 48 48 LYS C C 13 179.898 0.40 . 1 . . . . A 48 LYS C . 31083 1
362 . 1 . 1 48 48 LYS CA C 13 58.920 0.40 . 1 . . . . A 48 LYS CA . 31083 1
363 . 1 . 1 48 48 LYS CB C 13 31.785 0.40 . 1 . . . . A 48 LYS CB . 31083 1
364 . 1 . 1 48 48 LYS CG C 13 24.853 0.40 . 1 . . . . A 48 LYS CG . 31083 1
365 . 1 . 1 48 48 LYS CD C 13 28.914 0.40 . 1 . . . . A 48 LYS CD . 31083 1
366 . 1 . 1 48 48 LYS CE C 13 41.989 0.40 . 1 . . . . A 48 LYS CE . 31083 1
367 . 1 . 1 48 48 LYS N N 15 116.423 0.40 . 1 . . . . A 48 LYS N . 31083 1
368 . 1 . 1 49 49 SER H H 1 7.701 0.04 . 1 . . . . A 49 SER H . 31083 1
369 . 1 . 1 49 49 SER HA H 1 4.112 0.04 . 1 . . . . A 49 SER HA . 31083 1
370 . 1 . 1 49 49 SER HB2 H 1 3.879 0.04 . 2 . . . . A 49 SER HB2 . 31083 1
371 . 1 . 1 49 49 SER HB3 H 1 3.843 0.04 . 2 . . . . A 49 SER HB3 . 31083 1
372 . 1 . 1 49 49 SER C C 13 175.428 0.40 . 1 . . . . A 49 SER C . 31083 1
373 . 1 . 1 49 49 SER CA C 13 61.307 0.40 . 1 . . . . A 49 SER CA . 31083 1
374 . 1 . 1 49 49 SER CB C 13 63.032 0.40 . 1 . . . . A 49 SER CB . 31083 1
375 . 1 . 1 49 49 SER N N 15 115.222 0.40 . 1 . . . . A 49 SER N . 31083 1
376 . 1 . 1 50 50 LEU H H 1 7.500 0.04 . 1 . . . . A 50 LEU H . 31083 1
377 . 1 . 1 50 50 LEU HA H 1 4.297 0.04 . 1 . . . . A 50 LEU HA . 31083 1
378 . 1 . 1 50 50 LEU HB2 H 1 1.427 0.04 . 2 . . . . A 50 LEU HB2 . 31083 1
379 . 1 . 1 50 50 LEU HB3 H 1 1.339 0.04 . 2 . . . . A 50 LEU HB3 . 31083 1
380 . 1 . 1 50 50 LEU HG H 1 1.644 0.04 . 1 . . . . A 50 LEU HG . 31083 1
381 . 1 . 1 50 50 LEU HD11 H 1 0.612 0.04 . 2 . . . . A 50 LEU HD11 . 31083 1
382 . 1 . 1 50 50 LEU HD12 H 1 0.612 0.04 . 2 . . . . A 50 LEU HD12 . 31083 1
383 . 1 . 1 50 50 LEU HD13 H 1 0.612 0.04 . 2 . . . . A 50 LEU HD13 . 31083 1
384 . 1 . 1 50 50 LEU HD21 H 1 0.626 0.04 . 2 . . . . A 50 LEU HD21 . 31083 1
385 . 1 . 1 50 50 LEU HD22 H 1 0.626 0.04 . 2 . . . . A 50 LEU HD22 . 31083 1
386 . 1 . 1 50 50 LEU HD23 H 1 0.626 0.04 . 2 . . . . A 50 LEU HD23 . 31083 1
387 . 1 . 1 50 50 LEU C C 13 177.055 0.40 . 1 . . . . A 50 LEU C . 31083 1
388 . 1 . 1 50 50 LEU CA C 13 54.355 0.40 . 1 . . . . A 50 LEU CA . 31083 1
389 . 1 . 1 50 50 LEU CB C 13 43.425 0.40 . 1 . . . . A 50 LEU CB . 31083 1
390 . 1 . 1 50 50 LEU CG C 13 25.950 0.40 . 1 . . . . A 50 LEU CG . 31083 1
391 . 1 . 1 50 50 LEU CD1 C 13 25.921 0.40 . 2 . . . . A 50 LEU CD1 . 31083 1
392 . 1 . 1 50 50 LEU CD2 C 13 21.562 0.40 . 2 . . . . A 50 LEU CD2 . 31083 1
393 . 1 . 1 50 50 LEU N N 15 118.025 0.40 . 1 . . . . A 50 LEU N . 31083 1
394 . 1 . 1 51 51 GLY H H 1 7.710 0.04 . 1 . . . . A 51 GLY H . 31083 1
395 . 1 . 1 51 51 GLY HA2 H 1 3.875 0.04 . 2 . . . . A 51 GLY HA2 . 31083 1
396 . 1 . 1 51 51 GLY HA3 H 1 3.840 0.04 . 2 . . . . A 51 GLY HA3 . 31083 1
397 . 1 . 1 51 51 GLY C C 13 174.580 0.40 . 1 . . . . A 51 GLY C . 31083 1
398 . 1 . 1 51 51 GLY CA C 13 46.373 0.40 . 1 . . . . A 51 GLY CA . 31083 1
399 . 1 . 1 51 51 GLY N N 15 110.046 0.40 . 1 . . . . A 51 GLY N . 31083 1
400 . 1 . 1 52 52 LEU H H 1 7.956 0.04 . 1 . . . . A 52 LEU H . 31083 1
401 . 1 . 1 52 52 LEU HA H 1 4.641 0.04 . 1 . . . . A 52 LEU HA . 31083 1
402 . 1 . 1 52 52 LEU HB2 H 1 1.605 0.04 . 2 . . . . A 52 LEU HB2 . 31083 1
403 . 1 . 1 52 52 LEU HB3 H 1 1.069 0.04 . 2 . . . . A 52 LEU HB3 . 31083 1
404 . 1 . 1 52 52 LEU HG H 1 1.293 0.04 . 1 . . . . A 52 LEU HG . 31083 1
405 . 1 . 1 52 52 LEU HD11 H 1 0.650 0.04 . 2 . . . . A 52 LEU HD11 . 31083 1
406 . 1 . 1 52 52 LEU HD12 H 1 0.650 0.04 . 2 . . . . A 52 LEU HD12 . 31083 1
407 . 1 . 1 52 52 LEU HD13 H 1 0.650 0.04 . 2 . . . . A 52 LEU HD13 . 31083 1
408 . 1 . 1 52 52 LEU HD21 H 1 0.719 0.04 . 2 . . . . A 52 LEU HD21 . 31083 1
409 . 1 . 1 52 52 LEU HD22 H 1 0.719 0.04 . 2 . . . . A 52 LEU HD22 . 31083 1
410 . 1 . 1 52 52 LEU HD23 H 1 0.719 0.04 . 2 . . . . A 52 LEU HD23 . 31083 1
411 . 1 . 1 52 52 LEU C C 13 174.640 0.40 . 1 . . . . A 52 LEU C . 31083 1
412 . 1 . 1 52 52 LEU CA C 13 52.879 0.40 . 1 . . . . A 52 LEU CA . 31083 1
413 . 1 . 1 52 52 LEU CB C 13 44.496 0.40 . 1 . . . . A 52 LEU CB . 31083 1
414 . 1 . 1 52 52 LEU CG C 13 26.022 0.40 . 1 . . . . A 52 LEU CG . 31083 1
415 . 1 . 1 52 52 LEU CD1 C 13 26.037 0.40 . 2 . . . . A 52 LEU CD1 . 31083 1
416 . 1 . 1 52 52 LEU CD2 C 13 21.402 0.40 . 2 . . . . A 52 LEU CD2 . 31083 1
417 . 1 . 1 52 52 LEU N N 15 120.493 0.40 . 1 . . . . A 52 LEU N . 31083 1
418 . 1 . 1 53 53 GLN H H 1 8.471 0.04 . 1 . . . . A 53 GLN H . 31083 1
419 . 1 . 1 53 53 GLN HA H 1 4.559 0.04 . 1 . . . . A 53 GLN HA . 31083 1
420 . 1 . 1 53 53 GLN HB2 H 1 1.967 0.04 . 2 . . . . A 53 GLN HB2 . 31083 1
421 . 1 . 1 53 53 GLN HB3 H 1 1.831 0.04 . 2 . . . . A 53 GLN HB3 . 31083 1
422 . 1 . 1 53 53 GLN HG2 H 1 2.226 0.04 . 2 . . . . A 53 GLN HG2 . 31083 1
423 . 1 . 1 53 53 GLN HG3 H 1 2.226 0.04 . 2 . . . . A 53 GLN HG3 . 31083 1
424 . 1 . 1 53 53 GLN C C 13 174.117 0.40 . 1 . . . . A 53 GLN C . 31083 1
425 . 1 . 1 53 53 GLN CA C 13 54.089 0.40 . 1 . . . . A 53 GLN CA . 31083 1
426 . 1 . 1 53 53 GLN CB C 13 32.043 0.40 . 1 . . . . A 53 GLN CB . 31083 1
427 . 1 . 1 53 53 GLN CG C 13 33.766 0.40 . 1 . . . . A 53 GLN CG . 31083 1
428 . 1 . 1 53 53 GLN N N 15 117.298 0.40 . 1 . . . . A 53 GLN N . 31083 1
429 . 1 . 1 54 54 VAL H H 1 8.326 0.04 . 1 . . . . A 54 VAL H . 31083 1
430 . 1 . 1 54 54 VAL HA H 1 4.455 0.04 . 1 . . . . A 54 VAL HA . 31083 1
431 . 1 . 1 54 54 VAL HB H 1 1.813 0.04 . 1 . . . . A 54 VAL HB . 31083 1
432 . 1 . 1 54 54 VAL HG11 H 1 0.781 0.04 . 2 . . . . A 54 VAL HG11 . 31083 1
433 . 1 . 1 54 54 VAL HG12 H 1 0.781 0.04 . 2 . . . . A 54 VAL HG12 . 31083 1
434 . 1 . 1 54 54 VAL HG13 H 1 0.781 0.04 . 2 . . . . A 54 VAL HG13 . 31083 1
435 . 1 . 1 54 54 VAL HG21 H 1 0.613 0.04 . 2 . . . . A 54 VAL HG21 . 31083 1
436 . 1 . 1 54 54 VAL HG22 H 1 0.613 0.04 . 2 . . . . A 54 VAL HG22 . 31083 1
437 . 1 . 1 54 54 VAL HG23 H 1 0.613 0.04 . 2 . . . . A 54 VAL HG23 . 31083 1
438 . 1 . 1 54 54 VAL C C 13 175.832 0.40 . 1 . . . . A 54 VAL C . 31083 1
439 . 1 . 1 54 54 VAL CA C 13 61.471 0.40 . 1 . . . . A 54 VAL CA . 31083 1
440 . 1 . 1 54 54 VAL CB C 13 32.982 0.40 . 1 . . . . A 54 VAL CB . 31083 1
441 . 1 . 1 54 54 VAL CG1 C 13 22.507 0.40 . 2 . . . . A 54 VAL CG1 . 31083 1
442 . 1 . 1 54 54 VAL CG2 C 13 22.681 0.40 . 2 . . . . A 54 VAL CG2 . 31083 1
443 . 1 . 1 54 54 VAL N N 15 119.275 0.40 . 1 . . . . A 54 VAL N . 31083 1
444 . 1 . 1 55 55 ARG H H 1 9.240 0.04 . 1 . . . . A 55 ARG H . 31083 1
445 . 1 . 1 55 55 ARG HA H 1 4.549 0.04 . 1 . . . . A 55 ARG HA . 31083 1
446 . 1 . 1 55 55 ARG HB2 H 1 1.636 0.04 . 2 . . . . A 55 ARG HB2 . 31083 1
447 . 1 . 1 55 55 ARG HB3 H 1 1.547 0.04 . 2 . . . . A 55 ARG HB3 . 31083 1
448 . 1 . 1 55 55 ARG HG2 H 1 1.368 0.04 . 2 . . . . A 55 ARG HG2 . 31083 1
449 . 1 . 1 55 55 ARG HG3 H 1 1.298 0.04 . 2 . . . . A 55 ARG HG3 . 31083 1
450 . 1 . 1 55 55 ARG HD2 H 1 3.092 0.04 . 2 . . . . A 55 ARG HD2 . 31083 1
451 . 1 . 1 55 55 ARG HD3 H 1 2.953 0.04 . 2 . . . . A 55 ARG HD3 . 31083 1
452 . 1 . 1 55 55 ARG C C 13 173.971 0.40 . 1 . . . . A 55 ARG C . 31083 1
453 . 1 . 1 55 55 ARG CA C 13 54.459 0.40 . 1 . . . . A 55 ARG CA . 31083 1
454 . 1 . 1 55 55 ARG CB C 13 32.879 0.40 . 1 . . . . A 55 ARG CB . 31083 1
455 . 1 . 1 55 55 ARG CG C 13 27.228 0.40 . 1 . . . . A 55 ARG CG . 31083 1
456 . 1 . 1 55 55 ARG CD C 13 43.042 0.40 . 1 . . . . A 55 ARG CD . 31083 1
457 . 1 . 1 55 55 ARG N N 15 129.522 0.40 . 1 . . . . A 55 ARG N . 31083 1
458 . 1 . 1 56 56 LEU H H 1 8.618 0.04 . 1 . . . . A 56 LEU H . 31083 1
459 . 1 . 1 56 56 LEU HA H 1 4.438 0.04 . 1 . . . . A 56 LEU HA . 31083 1
460 . 1 . 1 56 56 LEU HB2 H 1 1.440 0.04 . 2 . . . . A 56 LEU HB2 . 31083 1
461 . 1 . 1 56 56 LEU HB3 H 1 1.168 0.04 . 2 . . . . A 56 LEU HB3 . 31083 1
462 . 1 . 1 56 56 LEU HG H 1 1.096 0.04 . 1 . . . . A 56 LEU HG . 31083 1
463 . 1 . 1 56 56 LEU HD11 H 1 0.525 0.04 . 2 . . . . A 56 LEU HD11 . 31083 1
464 . 1 . 1 56 56 LEU HD12 H 1 0.525 0.04 . 2 . . . . A 56 LEU HD12 . 31083 1
465 . 1 . 1 56 56 LEU HD13 H 1 0.525 0.04 . 2 . . . . A 56 LEU HD13 . 31083 1
466 . 1 . 1 56 56 LEU HD21 H 1 0.044 0.04 . 2 . . . . A 56 LEU HD21 . 31083 1
467 . 1 . 1 56 56 LEU HD22 H 1 0.044 0.04 . 2 . . . . A 56 LEU HD22 . 31083 1
468 . 1 . 1 56 56 LEU HD23 H 1 0.044 0.04 . 2 . . . . A 56 LEU HD23 . 31083 1
469 . 1 . 1 56 56 LEU C C 13 175.904 0.40 . 1 . . . . A 56 LEU C . 31083 1
470 . 1 . 1 56 56 LEU CA C 13 54.642 0.40 . 1 . . . . A 56 LEU CA . 31083 1
471 . 1 . 1 56 56 LEU CB C 13 41.716 0.40 . 1 . . . . A 56 LEU CB . 31083 1
472 . 1 . 1 56 56 LEU CG C 13 27.432 0.40 . 1 . . . . A 56 LEU CG . 31083 1
473 . 1 . 1 56 56 LEU CD1 C 13 25.194 0.40 . 2 . . . . A 56 LEU CD1 . 31083 1
474 . 1 . 1 56 56 LEU CD2 C 13 22.042 0.40 . 2 . . . . A 56 LEU CD2 . 31083 1
475 . 1 . 1 56 56 LEU N N 15 127.062 0.40 . 1 . . . . A 56 LEU N . 31083 1
476 . 1 . 1 57 57 GLU H H 1 8.741 0.04 . 1 . . . . A 57 GLU H . 31083 1
477 . 1 . 1 57 57 GLU HA H 1 4.336 0.04 . 1 . . . . A 57 GLU HA . 31083 1
478 . 1 . 1 57 57 GLU HB2 H 1 1.781 0.04 . 2 . . . . A 57 GLU HB2 . 31083 1
479 . 1 . 1 57 57 GLU HB3 H 1 1.583 0.04 . 2 . . . . A 57 GLU HB3 . 31083 1
480 . 1 . 1 57 57 GLU HG2 H 1 1.983 0.04 . 2 . . . . A 57 GLU HG2 . 31083 1
481 . 1 . 1 57 57 GLU HG3 H 1 1.928 0.04 . 2 . . . . A 57 GLU HG3 . 31083 1
482 . 1 . 1 57 57 GLU C C 13 175.695 0.40 . 1 . . . . A 57 GLU C . 31083 1
483 . 1 . 1 57 57 GLU CA C 13 54.747 0.40 . 1 . . . . A 57 GLU CA . 31083 1
484 . 1 . 1 57 57 GLU CB C 13 31.128 0.40 . 1 . . . . A 57 GLU CB . 31083 1
485 . 1 . 1 57 57 GLU CG C 13 35.931 0.40 . 1 . . . . A 57 GLU CG . 31083 1
486 . 1 . 1 57 57 GLU N N 15 129.178 0.40 . 1 . . . . A 57 GLU N . 31083 1
487 . 1 . 1 58 58 GLY H H 1 8.784 0.04 . 1 . . . . A 58 GLY H . 31083 1
488 . 1 . 1 58 58 GLY HA2 H 1 3.802 0.04 . 2 . . . . A 58 GLY HA2 . 31083 1
489 . 1 . 1 58 58 GLY HA3 H 1 3.409 0.04 . 2 . . . . A 58 GLY HA3 . 31083 1
490 . 1 . 1 58 58 GLY C C 13 173.903 0.40 . 1 . . . . A 58 GLY C . 31083 1
491 . 1 . 1 58 58 GLY CA C 13 47.346 0.40 . 1 . . . . A 58 GLY CA . 31083 1
492 . 1 . 1 58 58 GLY N N 15 117.208 0.40 . 1 . . . . A 58 GLY N . 31083 1
493 . 1 . 1 59 59 ASP H H 1 8.509 0.04 . 1 . . . . A 59 ASP H . 31083 1
494 . 1 . 1 59 59 ASP HA H 1 4.563 0.04 . 1 . . . . A 59 ASP HA . 31083 1
495 . 1 . 1 59 59 ASP HB2 H 1 3.051 0.04 . 2 . . . . A 59 ASP HB2 . 31083 1
496 . 1 . 1 59 59 ASP HB3 H 1 2.521 0.04 . 2 . . . . A 59 ASP HB3 . 31083 1
497 . 1 . 1 59 59 ASP C C 13 174.077 0.40 . 1 . . . . A 59 ASP C . 31083 1
498 . 1 . 1 59 59 ASP CA C 13 54.241 0.40 . 1 . . . . A 59 ASP CA . 31083 1
499 . 1 . 1 59 59 ASP CB C 13 41.688 0.40 . 1 . . . . A 59 ASP CB . 31083 1
500 . 1 . 1 59 59 ASP N N 15 127.053 0.40 . 1 . . . . A 59 ASP N . 31083 1
501 . 1 . 1 60 60 THR H H 1 7.803 0.04 . 1 . . . . A 60 THR H . 31083 1
502 . 1 . 1 60 60 THR HA H 1 4.874 0.04 . 1 . . . . A 60 THR HA . 31083 1
503 . 1 . 1 60 60 THR HB H 1 3.963 0.04 . 1 . . . . A 60 THR HB . 31083 1
504 . 1 . 1 60 60 THR HG21 H 1 0.929 0.04 . 1 . . . . A 60 THR HG21 . 31083 1
505 . 1 . 1 60 60 THR HG22 H 1 0.929 0.04 . 1 . . . . A 60 THR HG22 . 31083 1
506 . 1 . 1 60 60 THR HG23 H 1 0.929 0.04 . 1 . . . . A 60 THR HG23 . 31083 1
507 . 1 . 1 60 60 THR CA C 13 61.284 0.40 . 1 . . . . A 60 THR CA . 31083 1
508 . 1 . 1 60 60 THR CB C 13 71.164 0.40 . 1 . . . . A 60 THR CB . 31083 1
509 . 1 . 1 60 60 THR CG2 C 13 21.840 0.40 . 1 . . . . A 60 THR CG2 . 31083 1
510 . 1 . 1 60 60 THR N N 15 115.795 0.40 . 1 . . . . A 60 THR N . 31083 1
511 . 1 . 1 61 61 PHE HA H 1 4.541 0.04 . 1 . . . . A 61 PHE HA . 31083 1
512 . 1 . 1 61 61 PHE HB2 H 1 3.016 0.04 . 2 . . . . A 61 PHE HB2 . 31083 1
513 . 1 . 1 61 61 PHE HB3 H 1 2.475 0.04 . 2 . . . . A 61 PHE HB3 . 31083 1
514 . 1 . 1 61 61 PHE HD1 H 1 6.844 0.04 . 3 . . . . A 61 PHE HD1 . 31083 1
515 . 1 . 1 61 61 PHE HD2 H 1 6.844 0.04 . 3 . . . . A 61 PHE HD2 . 31083 1
516 . 1 . 1 61 61 PHE C C 13 173.615 0.40 . 1 . . . . A 61 PHE C . 31083 1
517 . 1 . 1 61 61 PHE CA C 13 57.312 0.40 . 1 . . . . A 61 PHE CA . 31083 1
518 . 1 . 1 61 61 PHE CB C 13 39.710 0.40 . 1 . . . . A 61 PHE CB . 31083 1
519 . 1 . 1 61 61 PHE CD1 C 13 131.772 0.40 . 3 . . . . A 61 PHE CD1 . 31083 1
520 . 1 . 1 61 61 PHE CD2 C 13 131.772 0.40 . 3 . . . . A 61 PHE CD2 . 31083 1
521 . 1 . 1 62 62 LYS H H 1 9.083 0.04 . 1 . . . . A 62 LYS H . 31083 1
522 . 1 . 1 62 62 LYS HA H 1 4.658 0.04 . 1 . . . . A 62 LYS HA . 31083 1
523 . 1 . 1 62 62 LYS HB2 H 1 1.632 0.04 . 2 . . . . A 62 LYS HB2 . 31083 1
524 . 1 . 1 62 62 LYS HB3 H 1 1.632 0.04 . 2 . . . . A 62 LYS HB3 . 31083 1
525 . 1 . 1 62 62 LYS HG2 H 1 1.195 0.04 . 2 . . . . A 62 LYS HG2 . 31083 1
526 . 1 . 1 62 62 LYS HG3 H 1 1.195 0.04 . 2 . . . . A 62 LYS HG3 . 31083 1
527 . 1 . 1 62 62 LYS HD2 H 1 1.421 0.04 . 2 . . . . A 62 LYS HD2 . 31083 1
528 . 1 . 1 62 62 LYS HD3 H 1 1.421 0.04 . 2 . . . . A 62 LYS HD3 . 31083 1
529 . 1 . 1 62 62 LYS HE2 H 1 2.726 0.04 . 2 . . . . A 62 LYS HE2 . 31083 1
530 . 1 . 1 62 62 LYS HE3 H 1 2.726 0.04 . 2 . . . . A 62 LYS HE3 . 31083 1
531 . 1 . 1 62 62 LYS C C 13 175.015 0.40 . 1 . . . . A 62 LYS C . 31083 1
532 . 1 . 1 62 62 LYS CA C 13 55.124 0.40 . 1 . . . . A 62 LYS CA . 31083 1
533 . 1 . 1 62 62 LYS CB C 13 33.863 0.40 . 1 . . . . A 62 LYS CB . 31083 1
534 . 1 . 1 62 62 LYS CG C 13 25.511 0.40 . 1 . . . . A 62 LYS CG . 31083 1
535 . 1 . 1 62 62 LYS CD C 13 29.032 0.40 . 1 . . . . A 62 LYS CD . 31083 1
536 . 1 . 1 62 62 LYS CE C 13 41.817 0.40 . 1 . . . . A 62 LYS CE . 31083 1
537 . 1 . 1 62 62 LYS N N 15 125.918 0.40 . 1 . . . . A 62 LYS N . 31083 1
538 . 1 . 1 63 63 ILE H H 1 8.325 0.04 . 1 . . . . A 63 ILE H . 31083 1
539 . 1 . 1 63 63 ILE HA H 1 4.905 0.04 . 1 . . . . A 63 ILE HA . 31083 1
540 . 1 . 1 63 63 ILE HB H 1 1.883 0.04 . 1 . . . . A 63 ILE HB . 31083 1
541 . 1 . 1 63 63 ILE HG12 H 1 1.305 0.04 . 2 . . . . A 63 ILE HG12 . 31083 1
542 . 1 . 1 63 63 ILE HG13 H 1 1.073 0.04 . 2 . . . . A 63 ILE HG13 . 31083 1
543 . 1 . 1 63 63 ILE HG21 H 1 0.650 0.04 . 1 . . . . A 63 ILE HG21 . 31083 1
544 . 1 . 1 63 63 ILE HG22 H 1 0.650 0.04 . 1 . . . . A 63 ILE HG22 . 31083 1
545 . 1 . 1 63 63 ILE HG23 H 1 0.650 0.04 . 1 . . . . A 63 ILE HG23 . 31083 1
546 . 1 . 1 63 63 ILE HD11 H 1 0.696 0.04 . 1 . . . . A 63 ILE HD11 . 31083 1
547 . 1 . 1 63 63 ILE HD12 H 1 0.696 0.04 . 1 . . . . A 63 ILE HD12 . 31083 1
548 . 1 . 1 63 63 ILE HD13 H 1 0.696 0.04 . 1 . . . . A 63 ILE HD13 . 31083 1
549 . 1 . 1 63 63 ILE C C 13 175.267 0.40 . 1 . . . . A 63 ILE C . 31083 1
550 . 1 . 1 63 63 ILE CA C 13 59.981 0.40 . 1 . . . . A 63 ILE CA . 31083 1
551 . 1 . 1 63 63 ILE CB C 13 36.986 0.40 . 1 . . . . A 63 ILE CB . 31083 1
552 . 1 . 1 63 63 ILE CG1 C 13 27.694 0.40 . 1 . . . . A 63 ILE CG1 . 31083 1
553 . 1 . 1 63 63 ILE CG2 C 13 19.223 0.40 . 1 . . . . A 63 ILE CG2 . 31083 1
554 . 1 . 1 63 63 ILE CD1 C 13 14.279 0.40 . 1 . . . . A 63 ILE CD1 . 31083 1
555 . 1 . 1 63 63 ILE N N 15 125.277 0.40 . 1 . . . . A 63 ILE N . 31083 1
556 . 1 . 1 64 64 GLU H H 1 8.660 0.04 . 1 . . . . A 64 GLU H . 31083 1
557 . 1 . 1 64 64 GLU HA H 1 4.277 0.04 . 1 . . . . A 64 GLU HA . 31083 1
558 . 1 . 1 64 64 GLU HB2 H 1 1.953 0.04 . 2 . . . . A 64 GLU HB2 . 31083 1
559 . 1 . 1 64 64 GLU HB3 H 1 1.812 0.04 . 2 . . . . A 64 GLU HB3 . 31083 1
560 . 1 . 1 64 64 GLU HG2 H 1 2.029 0.04 . 2 . . . . A 64 GLU HG2 . 31083 1
561 . 1 . 1 64 64 GLU HG3 H 1 1.917 0.04 . 2 . . . . A 64 GLU HG3 . 31083 1
562 . 1 . 1 64 64 GLU CA C 13 57.149 0.40 . 1 . . . . A 64 GLU CA . 31083 1
563 . 1 . 1 64 64 GLU CB C 13 32.178 0.40 . 1 . . . . A 64 GLU CB . 31083 1
564 . 1 . 1 64 64 GLU CG C 13 35.038 0.40 . 1 . . . . A 64 GLU CG . 31083 1
565 . 1 . 1 64 64 GLU N N 15 130.778 0.40 . 1 . . . . A 64 GLU N . 31083 1
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