###################################
# 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 18282
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
3 '3D HNCO' . . . 18282 1
4 '3D HNCA' . . . 18282 1
5 '3D HNCACB' . . . 18282 1
6 '3D HBHA(CO)NH' . . . 18282 1
7 '3D HCCH-TOCSY' . . . 18282 1
10 '3D CBCA(CO)NH' . . . 18282 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 . 2 2 1 1 MYR H121 H 1 1.0084 0.02 . 2 . . . B 1 MYR H12* . 18282 1
2 . 2 2 1 1 MYR H141 H 1 0.5974 0.02 . 2 . . . B 1 MYR H14* . 18282 1
3 . 2 2 1 1 MYR H31 H 1 1.0084 0.02 . 2 . . . B 1 MYR H3* . 18282 1
4 . 2 2 1 1 MYR H51 H 1 1.0084 0.02 . 2 . . . B 1 MYR H5* . 18282 1
5 . 1 1 1 1 GLY H H 1 7.2594 0.02 . 1 . . . A 2 GLY H . 18282 1
6 . 1 1 1 1 GLY C C 13 176.8344 0.5 . 1 . . . A 2 GLY C . 18282 1
7 . 1 1 1 1 GLY CA C 13 48.5291 0.5 . 1 . . . A 2 GLY CA . 18282 1
8 . 1 1 1 1 GLY N N 15 108.4950 0.5 . 1 . . . A 2 GLY N . 18282 1
9 . 1 1 2 2 GLN H H 1 9.3099 0.002 . 1 . . . A 3 GLN H . 18282 1
10 . 1 1 2 2 GLN HA H 1 3.8955 0.02 . 1 . . . A 3 GLN HA . 18282 1
11 . 1 1 2 2 GLN C C 13 178.6723 0.5 . 1 . . . A 3 GLN C . 18282 1
12 . 1 1 2 2 GLN CA C 13 58.7941 0.063 . 1 . . . A 3 GLN CA . 18282 1
13 . 1 1 2 2 GLN N N 15 122.2284 0.041 . 1 . . . A 3 GLN N . 18282 1
14 . 1 1 3 3 GLU H H 1 8.4887 0.007 . 1 . . . A 4 GLU H . 18282 1
15 . 1 1 3 3 GLU C C 13 175.5041 0.5 . 1 . . . A 4 GLU C . 18282 1
16 . 1 1 3 3 GLU CA C 13 59.5607 0.131 . 1 . . . A 4 GLU CA . 18282 1
17 . 1 1 3 3 GLU CB C 13 28.8759 0.067 . 1 . . . A 4 GLU CB . 18282 1
18 . 1 1 3 3 GLU N N 15 119.5292 0.033 . 1 . . . A 4 GLU N . 18282 1
19 . 1 1 4 4 LEU H H 1 8.2100 0.012 . 1 . . . A 5 LEU H . 18282 1
20 . 1 1 4 4 LEU HA H 1 3.7162 0.012 . 1 . . . A 5 LEU HA . 18282 1
21 . 1 1 4 4 LEU HB3 H 1 1.3784 0.032 . 2 . . . A 5 LEU HB3 . 18282 1
22 . 1 1 4 4 LEU HG H 1 1.0199 0.028 . 1 . . . A 5 LEU HG . 18282 1
23 . 1 1 4 4 LEU HD21 H 1 0.8450 0.012 . 2 . . . A 5 LEU HD21 . 18282 1
24 . 1 1 4 4 LEU HD22 H 1 0.8450 0.012 . 2 . . . A 5 LEU HD21 . 18282 1
25 . 1 1 4 4 LEU HD23 H 1 0.8450 0.012 . 2 . . . A 5 LEU HD21 . 18282 1
26 . 1 1 4 4 LEU C C 13 178.2756 0.5 . 1 . . . A 5 LEU C . 18282 1
27 . 1 1 4 4 LEU CA C 13 57.8135 0.152 . 1 . . . A 5 LEU CA . 18282 1
28 . 1 1 4 4 LEU CB C 13 40.8437 0.080 . 1 . . . A 5 LEU CB . 18282 1
29 . 1 1 4 4 LEU CG C 13 25.1343 0.071 . 1 . . . A 5 LEU CG . 18282 1
30 . 1 1 4 4 LEU CD2 C 13 21.8382 0.180 . 2 . . . A 5 LEU CD2 . 18282 1
31 . 1 1 4 4 LEU N N 15 114.8317 0.071 . 1 . . . A 5 LEU N . 18282 1
32 . 1 1 5 5 SER H H 1 8.2473 0.028 . 1 . . . A 6 SER H . 18282 1
33 . 1 1 5 5 SER HA H 1 4.1267 0.004 . 1 . . . A 6 SER HA . 18282 1
34 . 1 1 5 5 SER C C 13 178.5084 0.5 . 1 . . . A 6 SER C . 18282 1
35 . 1 1 5 5 SER CA C 13 60.4015 0.142 . 1 . . . A 6 SER CA . 18282 1
36 . 1 1 5 5 SER CB C 13 63.5355 0.212 . 1 . . . A 6 SER CB . 18282 1
37 . 1 1 5 5 SER N N 15 109.7259 0.052 . 1 . . . A 6 SER N . 18282 1
38 . 1 1 6 6 GLN H H 1 8.7189 0.006 . 1 . . . A 7 GLN H . 18282 1
39 . 1 1 6 6 GLN HA H 1 4.0256 0.02 . 1 . . . A 7 GLN HA . 18282 1
40 . 1 1 6 6 GLN HB3 H 1 1.9942 0.02 . 2 . . . A 7 GLN HB3 . 18282 1
41 . 1 1 6 6 GLN CA C 13 58.4736 0.5 . 1 . . . A 7 GLN CA . 18282 1
42 . 1 1 6 6 GLN N N 15 117.2031 0.079 . 1 . . . A 7 GLN N . 18282 1
43 . 1 1 7 7 HIS HB3 H 1 3.0275 0.016 . 2 . . . A 8 HIS HB3 . 18282 1
44 . 1 1 7 7 HIS C C 13 178.6224 0.5 . 1 . . . A 8 HIS C . 18282 1
45 . 1 1 8 8 GLU H H 1 7.7009 0.003 . 1 . . . A 9 GLU H . 18282 1
46 . 1 1 8 8 GLU HA H 1 3.9687 0.032 . 1 . . . A 9 GLU HA . 18282 1
47 . 1 1 8 8 GLU HB3 H 1 1.9933 0.027 . 2 . . . A 9 GLU HB3 . 18282 1
48 . 1 1 8 8 GLU C C 13 178.4081 0.5 . 1 . . . A 9 GLU C . 18282 1
49 . 1 1 8 8 GLU CA C 13 58.2436 0.5 . 1 . . . A 9 GLU CA . 18282 1
50 . 1 1 8 8 GLU CB C 13 29.0133 0.077 . 1 . . . A 9 GLU CB . 18282 1
51 . 1 1 8 8 GLU CG C 13 36.0746 0.5 . 1 . . . A 9 GLU CG . 18282 1
52 . 1 1 8 8 GLU N N 15 120.3566 0.021 . 1 . . . A 9 GLU N . 18282 1
53 . 1 1 9 9 ARG H H 1 8.9097 0.022 . 1 . . . A 10 ARG H . 18282 1
54 . 1 1 9 9 ARG HA H 1 4.1239 0.011 . 1 . . . A 10 ARG HA . 18282 1
55 . 1 1 9 9 ARG HB3 H 1 1.9089 0.024 . 2 . . . A 10 ARG HB3 . 18282 1
56 . 1 1 9 9 ARG C C 13 178.5992 0.5 . 1 . . . A 10 ARG C . 18282 1
57 . 1 1 9 9 ARG CA C 13 58.6328 0.5 . 1 . . . A 10 ARG CA . 18282 1
58 . 1 1 9 9 ARG CB C 13 29.0045 0.175 . 1 . . . A 10 ARG CB . 18282 1
59 . 1 1 9 9 ARG CD C 13 42.8720 0.123 . 1 . . . A 10 ARG CD . 18282 1
60 . 1 1 9 9 ARG N N 15 118.7907 0.065 . 1 . . . A 10 ARG N . 18282 1
61 . 1 1 10 10 TYR H H 1 7.5619 0.004 . 1 . . . A 11 TYR H . 18282 1
62 . 1 1 10 10 TYR HA H 1 4.1861 0.031 . 1 . . . A 11 TYR HA . 18282 1
63 . 1 1 10 10 TYR HB3 H 1 3.0863 0.038 . 2 . . . A 11 TYR HB3 . 18282 1
64 . 1 1 10 10 TYR HD1 H 1 6.9737 0.038 . 3 . . . A 11 TYR HD1 . 18282 1
65 . 1 1 10 10 TYR HD2 H 1 6.9737 0.038 . 3 . . . A 11 TYR HD2 . 18282 1
66 . 1 1 10 10 TYR HE1 H 1 7.1831 0.041 . 3 . . . A 11 TYR HE1 . 18282 1
67 . 1 1 10 10 TYR HE2 H 1 7.1831 0.041 . 3 . . . A 11 TYR HE2 . 18282 1
68 . 1 1 10 10 TYR C C 13 176.6445 0.5 . 1 . . . A 11 TYR C . 18282 1
69 . 1 1 10 10 TYR CA C 13 61.3108 0.103 . 1 . . . A 11 TYR CA . 18282 1
70 . 1 1 10 10 TYR CB C 13 37.9563 0.139 . 1 . . . A 11 TYR CB . 18282 1
71 . 1 1 10 10 TYR N N 15 121.2390 0.034 . 1 . . . A 11 TYR N . 18282 1
72 . 1 1 11 11 VAL H H 1 8.0872 0.026 . 1 . . . A 12 VAL H . 18282 1
73 . 1 1 11 11 VAL HA H 1 3.1189 0.024 . 1 . . . A 12 VAL HA . 18282 1
74 . 1 1 11 11 VAL HB H 1 2.0734 0.009 . 1 . . . A 12 VAL HB . 18282 1
75 . 1 1 11 11 VAL HG11 H 1 0.6344 0.020 . 2 . . . A 12 VAL HG11 . 18282 1
76 . 1 1 11 11 VAL HG12 H 1 0.6344 0.020 . 2 . . . A 12 VAL HG12 . 18282 1
77 . 1 1 11 11 VAL HG13 H 1 0.6344 0.020 . 2 . . . A 12 VAL HG13 . 18282 1
78 . 1 1 11 11 VAL HG21 H 1 1.1279 0.015 . 2 . . . A 12 VAL HG21 . 18282 1
79 . 1 1 11 11 VAL HG22 H 1 1.1279 0.015 . 2 . . . A 12 VAL HG22 . 18282 1
80 . 1 1 11 11 VAL HG23 H 1 1.1279 0.015 . 2 . . . A 12 VAL HG23 . 18282 1
81 . 1 1 11 11 VAL C C 13 177.2752 0.5 . 1 . . . A 12 VAL C . 18282 1
82 . 1 1 11 11 VAL CA C 13 66.9249 0.169 . 1 . . . A 12 VAL CA . 18282 1
83 . 1 1 11 11 VAL CB C 13 30.9809 0.143 . 1 . . . A 12 VAL CB . 18282 1
84 . 1 1 11 11 VAL CG1 C 13 22.9939 0.154 . 2 . . . A 12 VAL CG1 . 18282 1
85 . 1 1 11 11 VAL CG2 C 13 20.9904 0.069 . 2 . . . A 12 VAL CG2 . 18282 1
86 . 1 1 11 11 VAL N N 15 119.2488 0.034 . 1 . . . A 12 VAL N . 18282 1
87 . 1 1 12 12 GLU H H 1 8.3121 0.028 . 1 . . . A 13 GLU H . 18282 1
88 . 1 1 12 12 GLU HA H 1 4.2133 0.010 . 1 . . . A 13 GLU HA . 18282 1
89 . 1 1 12 12 GLU HB3 H 1 2.0664 0.02 . 2 . . . A 13 GLU HB3 . 18282 1
90 . 1 1 12 12 GLU C C 13 175.2067 0.5 . 1 . . . A 13 GLU C . 18282 1
91 . 1 1 12 12 GLU CA C 13 55.9705 0.051 . 1 . . . A 13 GLU CA . 18282 1
92 . 1 1 12 12 GLU CB C 13 28.4387 0.5 . 1 . . . A 13 GLU CB . 18282 1
93 . 1 1 12 12 GLU N N 15 119.5692 0.06 . 1 . . . A 13 GLU N . 18282 1
94 . 1 1 13 13 GLN H H 1 7.6904 0.18 . 1 . . . A 14 GLN H . 18282 1
95 . 1 1 13 13 GLN HA H 1 3.6566 0.005 . 1 . . . A 14 GLN HA . 18282 1
96 . 1 1 13 13 GLN HB3 H 1 2.1842 0.03 . 2 . . . A 14 GLN HB3 . 18282 1
97 . 1 1 13 13 GLN HG3 H 1 2.5528 0.007 . 2 . . . A 14 GLN HG3 . 18282 1
98 . 1 1 13 13 GLN CA C 13 54.2937 0.057 . 1 . . . A 14 GLN CA . 18282 1
99 . 1 1 13 13 GLN CB C 13 29.6812 0.133 . 1 . . . A 14 GLN CB . 18282 1
100 . 1 1 13 13 GLN CG C 13 37.0107 0.08 . 1 . . . A 14 GLN CG . 18282 1
101 . 1 1 13 13 GLN N N 15 119.3747 0.067 . 1 . . . A 14 GLN N . 18282 1
102 . 1 1 14 14 LEU HA H 1 3.8650 0.012 . 1 . . . A 15 LEU HA . 18282 1
103 . 1 1 14 14 LEU HB3 H 1 1.8415 0.029 . 2 . . . A 15 LEU HB3 . 18282 1
104 . 1 1 14 14 LEU HG H 1 0.7288 0.017 . 1 . . . A 15 LEU HG . 18282 1
105 . 1 1 14 14 LEU HD21 H 1 0.3437 0.005 . 2 . . . A 15 LEU HD21 . 18282 1
106 . 1 1 14 14 LEU HD22 H 1 0.3437 0.005 . 2 . . . A 15 LEU HD21 . 18282 1
107 . 1 1 14 14 LEU HD23 H 1 0.3437 0.005 . 2 . . . A 15 LEU HD21 . 18282 1
108 . 1 1 14 14 LEU CA C 13 58.1768 0.162 . 1 . . . A 15 LEU CA . 18282 1
109 . 1 1 14 14 LEU CB C 13 40.6925 0.104 . 1 . . . A 15 LEU CB . 18282 1
110 . 1 1 14 14 LEU CG C 13 25.8630 0.113 . 1 . . . A 15 LEU CG . 18282 1
111 . 1 1 14 14 LEU CD2 C 13 21.9197 0.122 . 2 . . . A 15 LEU CD2 . 18282 1
112 . 1 1 15 15 LYS HA H 1 3.7373 0.012 . 1 . . . A 16 LYS HA . 18282 1
113 . 1 1 15 15 LYS HB3 H 1 1.7511 0.023 . 2 . . . A 16 LYS HB3 . 18282 1
114 . 1 1 15 15 LYS HG3 H 1 1.3502 0.017 . 2 . . . A 16 LYS HG3 . 18282 1
115 . 1 1 15 15 LYS HD3 H 1 1.7316 0.021 . 2 . . . A 16 LYS HD3 . 18282 1
116 . 1 1 15 15 LYS HE3 H 1 2.9284 0.02 . 2 . . . A 16 LYS HE3 . 18282 1
117 . 1 1 15 15 LYS C C 13 177.8171 0.5 . 1 . . . A 16 LYS C . 18282 1
118 . 1 1 15 15 LYS CA C 13 60.3523 0.146 . 1 . . . A 16 LYS CA . 18282 1
119 . 1 1 15 15 LYS CB C 13 32.1057 0.143 . 1 . . . A 16 LYS CB . 18282 1
120 . 1 1 15 15 LYS CG C 13 25.8035 0.182 . 1 . . . A 16 LYS CG . 18282 1
121 . 1 1 15 15 LYS CD C 13 29.0638 0.203 . 1 . . . A 16 LYS CD . 18282 1
122 . 1 1 15 15 LYS CE C 13 41.4666 0.171 . 1 . . . A 16 LYS CE . 18282 1
123 . 1 1 16 16 GLN H H 1 7.8618 0.013 . 1 . . . A 17 GLN H . 18282 1
124 . 1 1 16 16 GLN HA H 1 3.8638 0.02 . 1 . . . A 17 GLN HA . 18282 1
125 . 1 1 16 16 GLN HB3 H 1 2.0510 0.02 . 1 . . . A 17 GLN HB3 . 18282 1
126 . 1 1 16 16 GLN CA C 13 58.3068 0.5 . 1 . . . A 17 GLN CA . 18282 1
127 . 1 1 16 16 GLN CB C 13 27.7878 0.5 . 1 . . . A 17 GLN CB . 18282 1
128 . 1 1 16 16 GLN N N 15 117.4981 0.015 . 1 . . . A 17 GLN N . 18282 1
129 . 1 1 17 17 ALA HA H 1 3.7935 0.008 . 1 . . . A 18 ALA HA . 18282 1
130 . 1 1 17 17 ALA HB1 H 1 1.3697 0.041 . 1 . . . A 18 ALA HB1 . 18282 1
131 . 1 1 17 17 ALA HB2 H 1 1.3697 0.041 . 1 . . . A 18 ALA HB2 . 18282 1
132 . 1 1 17 17 ALA HB3 H 1 1.3697 0.041 . 1 . . . A 18 ALA HB3 . 18282 1
133 . 1 1 17 17 ALA C C 13 179.1469 0.5 . 1 . . . A 18 ALA C . 18282 1
134 . 1 1 17 17 ALA CA C 13 54.7922 0.091 . 1 . . . A 18 ALA CA . 18282 1
135 . 1 1 17 17 ALA CB C 13 17.6932 0.128 . 1 . . . A 18 ALA CB . 18282 1
136 . 1 1 18 18 LEU H H 1 8.1682 0.021 . 1 . . . A 19 LEU H . 18282 1
137 . 1 1 18 18 LEU HA H 1 3.7842 0.028 . 1 . . . A 19 LEU HA . 18282 1
138 . 1 1 18 18 LEU HB3 H 1 1.7144 0.027 . 2 . . . A 19 LEU HB3 . 18282 1
139 . 1 1 18 18 LEU HG H 1 0.7442 0.008 . 1 . . . A 19 LEU HG . 18282 1
140 . 1 1 18 18 LEU HD21 H 1 0.6347 0.01 . 2 . . . A 19 LEU HD21 . 18282 1
141 . 1 1 18 18 LEU HD22 H 1 0.6347 0.01 . 2 . . . A 19 LEU HD21 . 18282 1
142 . 1 1 18 18 LEU HD23 H 1 0.6347 0.01 . 2 . . . A 19 LEU HD21 . 18282 1
143 . 1 1 18 18 LEU C C 13 174.9355 0.5 . 1 . . . A 19 LEU C . 18282 1
144 . 1 1 18 18 LEU CA C 13 57.7310 0.142 . 1 . . . A 19 LEU CA . 18282 1
145 . 1 1 18 18 LEU CB C 13 40.7025 0.117 . 1 . . . A 19 LEU CB . 18282 1
146 . 1 1 18 18 LEU CG C 13 25.1334 0.119 . 1 . . . A 19 LEU CG . 18282 1
147 . 1 1 18 18 LEU CD2 C 13 22.3714 0.190 . 2 . . . A 19 LEU CD2 . 18282 1
148 . 1 1 18 18 LEU N N 15 117.2781 0.124 . 1 . . . A 19 LEU N . 18282 1
149 . 1 1 19 19 LYS H H 1 8.3448 0.008 . 1 . . . A 20 LYS H . 18282 1
150 . 1 1 19 19 LYS C C 13 177.9815 0.5 . 1 . . . A 20 LYS C . 18282 1
151 . 1 1 19 19 LYS CA C 13 60.4392 0.5 . 1 . . . A 20 LYS CA . 18282 1
152 . 1 1 19 19 LYS N N 15 118.0255 0.192 . 1 . . . A 20 LYS N . 18282 1
153 . 1 1 20 20 THR H H 1 7.8957 0.022 . 1 . . . A 21 THR H . 18282 1
154 . 1 1 20 20 THR HA H 1 4.1259 0.01 . 1 . . . A 21 THR HA . 18282 1
155 . 1 1 20 20 THR HB H 1 4.2170 0.014 . 1 . . . A 21 THR HB . 18282 1
156 . 1 1 20 20 THR HG21 H 1 1.3630 0.021 . 1 . . . A 21 THR HG21 . 18282 1
157 . 1 1 20 20 THR HG22 H 1 1.3630 0.021 . 1 . . . A 21 THR HG22 . 18282 1
158 . 1 1 20 20 THR HG23 H 1 1.3630 0.021 . 1 . . . A 21 THR HG23 . 18282 1
159 . 1 1 20 20 THR C C 13 175.4686 0.5 . 1 . . . A 21 THR C . 18282 1
160 . 1 1 20 20 THR CA C 13 64.6434 0.078 . 1 . . . A 21 THR CA . 18282 1
161 . 1 1 20 20 THR CB C 13 68.6520 0.091 . 1 . . . A 21 THR CB . 18282 1
162 . 1 1 20 20 THR CG2 C 13 21.3198 0.169 . 1 . . . A 21 THR CG2 . 18282 1
163 . 1 1 20 20 THR N N 15 116.3447 0.038 . 1 . . . A 21 THR N . 18282 1
164 . 1 1 21 21 ARG H H 1 7.3170 0.023 . 1 . . . A 22 ARG H . 18282 1
165 . 1 1 21 21 ARG HA H 1 4.3747 0.022 . 1 . . . A 22 ARG HA . 18282 1
166 . 1 1 21 21 ARG HB3 H 1 2.1219 0.037 . 2 . . . A 22 ARG HB3 . 18282 1
167 . 1 1 21 21 ARG HG3 H 1 1.6074 0.045 . 2 . . . A 22 ARG HG3 . 18282 1
168 . 1 1 21 21 ARG C C 13 176.3641 0.5 . 1 . . . A 22 ARG C . 18282 1
169 . 1 1 21 21 ARG CA C 13 54.1571 0.074 . 1 . . . A 22 ARG CA . 18282 1
170 . 1 1 21 21 ARG CB C 13 29.4527 0.07 . 1 . . . A 22 ARG CB . 18282 1
171 . 1 1 21 21 ARG N N 15 118.7920 0.19 . 1 . . . A 22 ARG N . 18282 1
172 . 1 1 22 22 GLY H H 1 7.8815 0.025 . 1 . . . A 23 GLY H . 18282 1
173 . 1 1 22 22 GLY HA3 H 1 3.8539 0.03 . 2 . . . A 23 GLY HA3 . 18282 1
174 . 1 1 22 22 GLY C C 13 174.1538 0.5 . 1 . . . A 23 GLY C . 18282 1
175 . 1 1 22 22 GLY CA C 13 45.9533 0.5 . 1 . . . A 23 GLY CA . 18282 1
176 . 1 1 22 22 GLY N N 15 108.4279 0.026 . 1 . . . A 23 GLY N . 18282 1
177 . 1 1 23 23 VAL H H 1 7.4312 0.012 . 1 . . . A 24 VAL H . 18282 1
178 . 1 1 23 23 VAL HA H 1 4.0361 0.027 . 1 . . . A 24 VAL HA . 18282 1
179 . 1 1 23 23 VAL HB H 1 2.0117 0.025 . 1 . . . A 24 VAL HB . 18282 1
180 . 1 1 23 23 VAL HG21 H 1 0.9118 0.032 . 2 . . . A 24 VAL HG21 . 18282 1
181 . 1 1 23 23 VAL HG22 H 1 0.9118 0.032 . 2 . . . A 24 VAL HG22 . 18282 1
182 . 1 1 23 23 VAL HG23 H 1 0.9118 0.032 . 2 . . . A 24 VAL HG23 . 18282 1
183 . 1 1 23 23 VAL C C 13 175.6007 0.5 . 1 . . . A 24 VAL C . 18282 1
184 . 1 1 23 23 VAL CA C 13 61.6350 0.152 . 1 . . . A 24 VAL CA . 18282 1
185 . 1 1 23 23 VAL CB C 13 32.5886 0.154 . 1 . . . A 24 VAL CB . 18282 1
186 . 1 1 23 23 VAL CG2 C 13 20.6349 0.137 . 2 . . . A 24 VAL CG2 . 18282 1
187 . 1 1 23 23 VAL N N 15 117.3193 0.066 . 1 . . . A 24 VAL N . 18282 1
188 . 1 1 24 24 LYS H H 1 8.6648 0.01 . 1 . . . A 25 LYS H . 18282 1
189 . 1 1 24 24 LYS HA H 1 4.3356 0.007 . 1 . . . A 25 LYS HA . 18282 1
190 . 1 1 24 24 LYS HB3 H 1 1.7137 0.021 . 2 . . . A 25 LYS HB3 . 18282 1
191 . 1 1 24 24 LYS HE3 H 1 2.9385 0.02 . 2 . . . A 25 LYS HE3 . 18282 1
192 . 1 1 24 24 LYS C C 13 175.5503 0.5 . 1 . . . A 25 LYS C . 18282 1
193 . 1 1 24 24 LYS CA C 13 55.8113 0.108 . 1 . . . A 25 LYS CA . 18282 1
194 . 1 1 24 24 LYS CB C 13 32.2692 0.067 . 1 . . . A 25 LYS CB . 18282 1
195 . 1 1 24 24 LYS CG C 13 24.6618 0.5 . 1 . . . A 25 LYS CG . 18282 1
196 . 1 1 24 24 LYS CD C 13 29.0553 0.5 . 1 . . . A 25 LYS CD . 18282 1
197 . 1 1 24 24 LYS CE C 13 41.8716 0.22 . 1 . . . A 25 LYS CE . 18282 1
198 . 1 1 24 24 LYS N N 15 127.4240 0.051 . 1 . . . A 25 LYS N . 18282 1
199 . 1 1 25 25 VAL H H 1 7.5454 0.004 . 1 . . . A 26 VAL H . 18282 1
200 . 1 1 25 25 VAL HA H 1 4.1404 0.02 . 1 . . . A 26 VAL HA . 18282 1
201 . 1 1 25 25 VAL HB H 1 1.8120 0.026 . 1 . . . A 26 VAL HB . 18282 1
202 . 1 1 25 25 VAL HG11 H 1 0.7470 0.019 . 2 . . . A 26 VAL HG11 . 18282 1
203 . 1 1 25 25 VAL HG12 H 1 0.7470 0.019 . 2 . . . A 26 VAL HG12 . 18282 1
204 . 1 1 25 25 VAL HG13 H 1 0.7470 0.019 . 2 . . . A 26 VAL HG13 . 18282 1
205 . 1 1 25 25 VAL HG21 H 1 0.6906 0.014 . 2 . . . A 26 VAL HG21 . 18282 1
206 . 1 1 25 25 VAL HG22 H 1 0.6906 0.014 . 2 . . . A 26 VAL HG22 . 18282 1
207 . 1 1 25 25 VAL HG23 H 1 0.6906 0.014 . 2 . . . A 26 VAL HG23 . 18282 1
208 . 1 1 25 25 VAL C C 13 174.2061 0.5 . 1 . . . A 26 VAL C . 18282 1
209 . 1 1 25 25 VAL CA C 13 60.3158 0.114 . 1 . . . A 26 VAL CA . 18282 1
210 . 1 1 25 25 VAL CB C 13 33.9199 0.101 . 1 . . . A 26 VAL CB . 18282 1
211 . 1 1 25 25 VAL CG1 C 13 20.8328 0.089 . 2 . . . A 26 VAL CG1 . 18282 1
212 . 1 1 25 25 VAL CG2 C 13 21.0333 0.077 . 2 . . . A 26 VAL CG2 . 18282 1
213 . 1 1 25 25 VAL N N 15 120.7640 0.054 . 1 . . . A 26 VAL N . 18282 1
214 . 1 1 26 26 LYS H H 1 8.6081 0.012 . 1 . . . A 27 LYS H . 18282 1
215 . 1 1 26 26 LYS HA H 1 4.1154 0.02 . 1 . . . A 27 LYS HA . 18282 1
216 . 1 1 26 26 LYS HB3 H 1 1.6613 0.005 . 2 . . . A 27 LYS HB3 . 18282 1
217 . 1 1 26 26 LYS HG3 H 1 1.5016 0.028 . 2 . . . A 27 LYS HG3 . 18282 1
218 . 1 1 26 26 LYS HD3 H 1 1.7068 0.006 . 2 . . . A 27 LYS HD3 . 18282 1
219 . 1 1 26 26 LYS HE3 H 1 2.9519 0.02 . 2 . . . A 27 LYS HE3 . 18282 1
220 . 1 1 26 26 LYS CA C 13 55.2106 0.5 . 1 . . . A 27 LYS CA . 18282 1
221 . 1 1 26 26 LYS CB C 13 31.9296 0.137 . 1 . . . A 27 LYS CB . 18282 1
222 . 1 1 26 26 LYS CG C 13 24.5209 0.173 . 1 . . . A 27 LYS CG . 18282 1
223 . 1 1 26 26 LYS CD C 13 28.9923 0.052 . 1 . . . A 27 LYS CD . 18282 1
224 . 1 1 26 26 LYS CE C 13 41.8198 0.5 . 1 . . . A 27 LYS CE . 18282 1
225 . 1 1 26 26 LYS N N 15 125.7074 0.059 . 1 . . . A 27 LYS N . 18282 1
226 . 1 1 27 27 TYR CA C 13 56.4183 0.5 . 1 . . . A 28 TYR CA . 18282 1
227 . 1 1 27 27 TYR CB C 13 37.0365 0.5 . 1 . . . A 28 TYR CB . 18282 1
228 . 1 1 28 28 ALA H H 1 8.3261 0.004 . 1 . . . A 29 ALA H . 18282 1
229 . 1 1 28 28 ALA HA H 1 3.7118 0.004 . 1 . . . A 29 ALA HA . 18282 1
230 . 1 1 28 28 ALA HB1 H 1 1.2311 0.008 . 1 . . . A 29 ALA HB1 . 18282 1
231 . 1 1 28 28 ALA HB2 H 1 1.2311 0.008 . 1 . . . A 29 ALA HB2 . 18282 1
232 . 1 1 28 28 ALA HB3 H 1 1.2311 0.008 . 1 . . . A 29 ALA HB3 . 18282 1
233 . 1 1 28 28 ALA C C 13 180.2103 0.5 . 1 . . . A 29 ALA C . 18282 1
234 . 1 1 28 28 ALA CA C 13 54.9114 0.041 . 1 . . . A 29 ALA CA . 18282 1
235 . 1 1 28 28 ALA CB C 13 18.0337 0.069 . 1 . . . A 29 ALA CB . 18282 1
236 . 1 1 28 28 ALA N N 15 120.7117 0.148 . 1 . . . A 29 ALA N . 18282 1
237 . 1 1 29 29 ASP H H 1 6.9131 0.024 . 1 . . . A 30 ASP H . 18282 1
238 . 1 1 29 29 ASP HA H 1 4.3788 0.013 . 1 . . . A 30 ASP HA . 18282 1
239 . 1 1 29 29 ASP HB3 H 1 2.7081 0.029 . 2 . . . A 30 ASP HB3 . 18282 1
240 . 1 1 29 29 ASP C C 13 178.4274 0.5 . 1 . . . A 30 ASP C . 18282 1
241 . 1 1 29 29 ASP CA C 13 56.4591 0.5 . 1 . . . A 30 ASP CA . 18282 1
242 . 1 1 29 29 ASP CB C 13 39.9617 0.011 . 1 . . . A 30 ASP CB . 18282 1
243 . 1 1 29 29 ASP N N 15 117.1657 0.088 . 1 . . . A 30 ASP N . 18282 1
244 . 1 1 30 30 LEU H H 1 7.5433 0.024 . 1 . . . A 31 LEU H . 18282 1
245 . 1 1 30 30 LEU HA H 1 3.4908 0.009 . 1 . . . A 31 LEU HA . 18282 1
246 . 1 1 30 30 LEU HG H 1 0.5948 0.006 . 1 . . . A 31 LEU HG . 18282 1
247 . 1 1 30 30 LEU HD21 H 1 0.5616 0.011 . 1 . . . A 31 LEU HD21 . 18282 1
248 . 1 1 30 30 LEU HD22 H 1 0.5616 0.011 . 1 . . . A 31 LEU HD21 . 18282 1
249 . 1 1 30 30 LEU HD23 H 1 0.5616 0.011 . 1 . . . A 31 LEU HD21 . 18282 1
250 . 1 1 30 30 LEU CA C 13 56.8413 0.076 . 1 . . . A 31 LEU CA . 18282 1
251 . 1 1 30 30 LEU CB C 13 40.8880 0.159 . 1 . . . A 31 LEU CB . 18282 1
252 . 1 1 30 30 LEU CG C 13 25.4690 0.064 . 1 . . . A 31 LEU CG . 18282 1
253 . 1 1 30 30 LEU CD2 C 13 23.7594 0.105 . 2 . . . A 31 LEU CD2 . 18282 1
254 . 1 1 30 30 LEU N N 15 123.1045 0.07 . 1 . . . A 31 LEU N . 18282 1
255 . 1 1 31 31 LEU HA H 1 3.6110 0.009 . 1 . . . A 32 LEU HA . 18282 1
256 . 1 1 31 31 LEU HB3 H 1 1.3068 0.01 . 2 . . . A 32 LEU HB3 . 18282 1
257 . 1 1 31 31 LEU HG H 1 0.8029 0.014 . 1 . . . A 32 LEU HG . 18282 1
258 . 1 1 31 31 LEU C C 13 179.1197 0.5 . 1 . . . A 32 LEU C . 18282 1
259 . 1 1 31 31 LEU CA C 13 58.1028 0.084 . 1 . . . A 32 LEU CA . 18282 1
260 . 1 1 31 31 LEU CB C 13 40.5936 0.127 . 1 . . . A 32 LEU CB . 18282 1
261 . 1 1 31 31 LEU CG C 13 25.4037 0.17 . 1 . . . A 32 LEU CG . 18282 1
262 . 1 1 31 31 LEU CD2 C 13 21.7343 0.105 . 2 . . . A 32 LEU CD2 . 18282 1
263 . 1 1 32 32 LYS H H 1 7.1890 0.033 . 1 . . . A 33 LYS H . 18282 1
264 . 1 1 32 32 LYS HA H 1 4.2017 0.018 . 1 . . . A 33 LYS HA . 18282 1
265 . 1 1 32 32 LYS HB3 H 1 1.9095 0.009 . 2 . . . A 33 LYS HB3 . 18282 1
266 . 1 1 32 32 LYS C C 13 180.0445 0.5 . 1 . . . A 33 LYS C . 18282 1
267 . 1 1 32 32 LYS CA C 13 59.0808 0.088 . 1 . . . A 33 LYS CA . 18282 1
268 . 1 1 32 32 LYS CB C 13 31.7349 0.101 . 1 . . . A 33 LYS CB . 18282 1
269 . 1 1 32 32 LYS N N 15 118.0740 0.054 . 1 . . . A 33 LYS N . 18282 1
270 . 1 1 33 33 PHE H H 1 7.7684 0.035 . 1 . . . A 34 PHE H . 18282 1
271 . 1 1 33 33 PHE HB3 H 1 3.1509 0.02 . 2 . . . A 34 PHE HB3 . 18282 1
272 . 1 1 33 33 PHE HD1 H 1 6.8119 0.004 . 3 . . . A 34 PHE HD1 . 18282 1
273 . 1 1 33 33 PHE HD2 H 1 6.8119 0.004 . 3 . . . A 34 PHE HD2 . 18282 1
274 . 1 1 33 33 PHE HE1 H 1 7.0015 0.011 . 3 . . . A 34 PHE HE1 . 18282 1
275 . 1 1 33 33 PHE HE2 H 1 7.0015 0.011 . 3 . . . A 34 PHE HE2 . 18282 1
276 . 1 1 33 33 PHE CA C 13 60.4024 0.5 . 1 . . . A 34 PHE CA . 18282 1
277 . 1 1 33 33 PHE N N 15 122.9774 0.027 . 1 . . . A 34 PHE N . 18282 1
278 . 1 1 34 34 PHE HA H 1 3.7996 0.025 . 1 . . . A 35 PHE HA . 18282 1
279 . 1 1 34 34 PHE HB3 H 1 2.8974 0.05 . 2 . . . A 35 PHE HB3 . 18282 1
280 . 1 1 34 34 PHE HD1 H 1 6.9330 0.012 . 3 . . . A 35 PHE HD1 . 18282 1
281 . 1 1 34 34 PHE HD2 H 1 6.9330 0.012 . 3 . . . A 35 PHE HD2 . 18282 1
282 . 1 1 34 34 PHE HE1 H 1 6.6371 0.035 . 3 . . . A 35 PHE HE1 . 18282 1
283 . 1 1 34 34 PHE HE2 H 1 6.6371 0.035 . 3 . . . A 35 PHE HE2 . 18282 1
284 . 1 1 34 34 PHE C C 13 176.3545 0.5 . 1 . . . A 35 PHE C . 18282 1
285 . 1 1 34 34 PHE CA C 13 61.8128 0.104 . 1 . . . A 35 PHE CA . 18282 1
286 . 1 1 34 34 PHE CB C 13 37.1645 0.139 . 1 . . . A 35 PHE CB . 18282 1
287 . 1 1 35 35 ASP H H 1 8.3378 0.021 . 1 . . . A 36 ASP H . 18282 1
288 . 1 1 35 35 ASP C C 13 177.0871 0.5 . 1 . . . A 36 ASP C . 18282 1
289 . 1 1 35 35 ASP CA C 13 58.2784 0.5 . 1 . . . A 36 ASP CA . 18282 1
290 . 1 1 35 35 ASP CB C 13 39.5781 0.5 . 1 . . . A 36 ASP CB . 18282 1
291 . 1 1 35 35 ASP N N 15 119.9685 0.06 . 1 . . . A 36 ASP N . 18282 1
292 . 1 1 36 36 PHE H H 1 7.8596 0.012 . 1 . . . A 37 PHE H . 18282 1
293 . 1 1 36 36 PHE HB3 H 1 2.7683 0.01 . 2 . . . A 37 PHE HB3 . 18282 1
294 . 1 1 36 36 PHE HD1 H 1 7.5396 0.011 . 3 . . . A 37 PHE HD1 . 18282 1
295 . 1 1 36 36 PHE HD2 H 1 7.5396 0.011 . 3 . . . A 37 PHE HD2 . 18282 1
296 . 1 1 36 36 PHE C C 13 178.7880 0.5 . 1 . . . A 37 PHE C . 18282 1
297 . 1 1 36 36 PHE CA C 13 61.4159 0.18 . 1 . . . A 37 PHE CA . 18282 1
298 . 1 1 36 36 PHE CB C 13 38.3689 0.5 . 1 . . . A 37 PHE CB . 18282 1
299 . 1 1 36 36 PHE N N 15 122.9009 0.079 . 1 . . . A 37 PHE N . 18282 1
300 . 1 1 37 37 VAL H H 1 8.4514 0.015 . 1 . . . A 38 VAL H . 18282 1
301 . 1 1 37 37 VAL HA H 1 3.0996 0.02 . 1 . . . A 38 VAL HA . 18282 1
302 . 1 1 37 37 VAL HB H 1 2.3065 0.009 . 1 . . . A 38 VAL HB . 18282 1
303 . 1 1 37 37 VAL HG11 H 1 0.6985 0.008 . 2 . . . A 38 VAL HG11 . 18282 1
304 . 1 1 37 37 VAL HG12 H 1 0.6985 0.008 . 2 . . . A 38 VAL HG12 . 18282 1
305 . 1 1 37 37 VAL HG13 H 1 0.6985 0.008 . 2 . . . A 38 VAL HG13 . 18282 1
306 . 1 1 37 37 VAL HG21 H 1 0.5095 0.006 . 2 . . . A 38 VAL HG21 . 18282 1
307 . 1 1 37 37 VAL HG22 H 1 0.5095 0.006 . 2 . . . A 38 VAL HG22 . 18282 1
308 . 1 1 37 37 VAL HG23 H 1 0.5095 0.006 . 2 . . . A 38 VAL HG23 . 18282 1
309 . 1 1 37 37 VAL C C 13 176.1472 0.5 . 1 . . . A 38 VAL C . 18282 1
310 . 1 1 37 37 VAL CA C 13 67.1533 0.135 . 1 . . . A 38 VAL CA . 18282 1
311 . 1 1 37 37 VAL CB C 13 30.6248 0.086 . 1 . . . A 38 VAL CB . 18282 1
312 . 1 1 37 37 VAL CG1 C 13 23.7707 0.104 . 2 . . . A 38 VAL CG1 . 18282 1
313 . 1 1 37 37 VAL CG2 C 13 20.9663 0.084 . 2 . . . A 38 VAL CG2 . 18282 1
314 . 1 1 37 37 VAL N N 15 122.3286 0.037 . 1 . . . A 38 VAL N . 18282 1
315 . 1 1 38 38 LYS H H 1 7.5808 0.015 . 1 . . . A 39 LYS H . 18282 1
316 . 1 1 38 38 LYS HA H 1 3.4725 0.016 . 1 . . . A 39 LYS HA . 18282 1
317 . 1 1 38 38 LYS HB3 H 1 2.0096 0.004 . 2 . . . A 39 LYS HB3 . 18282 1
318 . 1 1 38 38 LYS HG3 H 1 1.4033 0.02 . 2 . . . A 39 LYS HG3 . 18282 1
319 . 1 1 38 38 LYS HD3 H 1 1.5804 0.02 . 2 . . . A 39 LYS HD3 . 18282 1
320 . 1 1 38 38 LYS HE3 H 1 2.9545 0.005 . 2 . . . A 39 LYS HE3 . 18282 1
321 . 1 1 38 38 LYS C C 13 176.3606 0.5 . 1 . . . A 39 LYS C . 18282 1
322 . 1 1 38 38 LYS CA C 13 59.5192 0.098 . 1 . . . A 39 LYS CA . 18282 1
323 . 1 1 38 38 LYS CB C 13 31.6278 0.075 . 1 . . . A 39 LYS CB . 18282 1
324 . 1 1 38 38 LYS CG C 13 24.7511 0.123 . 1 . . . A 39 LYS CG . 18282 1
325 . 1 1 38 38 LYS CD C 13 29.0573 0.168 . 1 . . . A 39 LYS CD . 18282 1
326 . 1 1 38 38 LYS CE C 13 41.9340 0.5 . 1 . . . A 39 LYS CE . 18282 1
327 . 1 1 38 38 LYS N N 15 118.8366 0.111 . 1 . . . A 39 LYS N . 18282 1
328 . 1 1 39 39 ASP H H 1 8.0520 0.006 . 1 . . . A 40 ASP H . 18282 1
329 . 1 1 39 39 ASP HA H 1 4.2605 0.03 . 1 . . . A 40 ASP HA . 18282 1
330 . 1 1 39 39 ASP HB3 H 1 2.6198 0.011 . 2 . . . A 40 ASP HB3 . 18282 1
331 . 1 1 39 39 ASP CA C 13 56.5797 0.117 . 1 . . . A 40 ASP CA . 18282 1
332 . 1 1 39 39 ASP CB C 13 40.9771 0.165 . 1 . . . A 40 ASP CB . 18282 1
333 . 1 1 39 39 ASP N N 15 116.2105 0.036 . 1 . . . A 40 ASP N . 18282 1
334 . 1 1 40 40 THR H H 1 7.2318 0.05 . 1 . . . A 41 THR H . 18282 1
335 . 1 1 40 40 THR HG1 H 1 6.1414 0.007 . 1 . . . A 41 THR HG1 . 18282 1
336 . 1 1 40 40 THR C C 13 174.5589 0.5 . 1 . . . A 41 THR C . 18282 1
337 . 1 1 40 40 THR N N 15 109.2148 0.5 . 1 . . . A 41 THR N . 18282 1
338 . 1 1 41 41 CYS H H 1 7.1974 0.006 . 1 . . . A 42 CYS H . 18282 1
339 . 1 1 41 41 CYS CA C 13 55.8649 0.5 . 1 . . . A 42 CYS CA . 18282 1
340 . 1 1 41 41 CYS CB C 13 28.4998 0.5 . 1 . . . A 42 CYS CB . 18282 1
341 . 1 1 41 41 CYS N N 15 117.9274 0.072 . 1 . . . A 42 CYS N . 18282 1
342 . 1 1 42 42 PRO HA H 1 3.9872 0.031 . 1 . . . A 43 PRO HA . 18282 1
343 . 1 1 42 42 PRO HB3 H 1 2.4449 0.033 . 2 . . . A 43 PRO HB3 . 18282 1
344 . 1 1 42 42 PRO HG3 H 1 2.0897 0.024 . 2 . . . A 43 PRO HG3 . 18282 1
345 . 1 1 42 42 PRO HD3 H 1 3.9048 0.034 . 2 . . . A 43 PRO HD3 . 18282 1
346 . 1 1 42 42 PRO C C 13 176.6875 0.5 . 1 . . . A 43 PRO C . 18282 1
347 . 1 1 42 42 PRO CA C 13 65.2060 0.126 . 1 . . . A 43 PRO CA . 18282 1
348 . 1 1 42 42 PRO CB C 13 30.7673 0.176 . 1 . . . A 43 PRO CB . 18282 1
349 . 1 1 42 42 PRO CG C 13 27.1767 0.068 . 1 . . . A 43 PRO CG . 18282 1
350 . 1 1 42 42 PRO CD C 13 50.5045 0.226 . 1 . . . A 43 PRO CD . 18282 1
351 . 1 1 43 43 TRP H H 1 6.6320 0.006 . 1 . . . A 44 TRP H . 18282 1
352 . 1 1 43 43 TRP HA H 1 4.3606 0.042 . 1 . . . A 44 TRP HA . 18282 1
353 . 1 1 43 43 TRP HE1 H 1 9.9586 0.014 . 1 . . . A 44 TRP HE1 . 18282 1
354 . 1 1 43 43 TRP HE3 H 1 7.4869 0.014 . 1 . . . A 44 TRP HE3 . 18282 1
355 . 1 1 43 43 TRP HZ2 H 1 7.0417 0.05 . 1 . . . A 44 TRP HZ2 . 18282 1
356 . 1 1 43 43 TRP HZ3 H 1 6.7939 0.05 . 1 . . . A 44 TRP HZ3 . 18282 1
357 . 1 1 43 43 TRP C C 13 176.9815 0.5 . 1 . . . A 44 TRP C . 18282 1
358 . 1 1 43 43 TRP CA C 13 61.7580 0.024 . 1 . . . A 44 TRP CA . 18282 1
359 . 1 1 43 43 TRP CB C 13 27.7708 0.039 . 1 . . . A 44 TRP CB . 18282 1
360 . 1 1 43 43 TRP N N 15 113.8053 0.043 . 1 . . . A 44 TRP N . 18282 1
361 . 1 1 43 43 TRP NE1 N 15 128.3779 0.5 . 1 . . . A 44 TRP NE1 . 18282 1
362 . 1 1 44 44 PHE H H 1 7.3020 0.007 . 1 . . . A 45 PHE H . 18282 1
363 . 1 1 44 44 PHE HA H 1 4.0434 0.012 . 1 . . . A 45 PHE HA . 18282 1
364 . 1 1 44 44 PHE HD1 H 1 6.7849 0.014 . 3 . . . A 45 PHE HD1 . 18282 1
365 . 1 1 44 44 PHE HD2 H 1 6.7849 0.014 . 3 . . . A 45 PHE HD2 . 18282 1
366 . 1 1 44 44 PHE HE1 H 1 6.9323 0.05 . 3 . . . A 45 PHE HE1 . 18282 1
367 . 1 1 44 44 PHE HE2 H 1 6.9323 0.05 . 3 . . . A 45 PHE HE2 . 18282 1
368 . 1 1 44 44 PHE CA C 13 62.9901 0.104 . 1 . . . A 45 PHE CA . 18282 1
369 . 1 1 44 44 PHE CB C 13 35.1087 0.5 . 1 . . . A 45 PHE CB . 18282 1
370 . 1 1 44 44 PHE N N 15 123.0188 0.039 . 1 . . . A 45 PHE N . 18282 1
371 . 1 1 45 45 PRO HA H 1 4.0146 0.009 . 1 . . . A 46 PRO HA . 18282 1
372 . 1 1 45 45 PRO HB3 H 1 2.5579 0.05 . 2 . . . A 46 PRO HB3 . 18282 1
373 . 1 1 45 45 PRO HG3 H 1 2.0726 0.031 . 2 . . . A 46 PRO HG3 . 18282 1
374 . 1 1 45 45 PRO HD3 H 1 3.3689 0.01 . 2 . . . A 46 PRO HD3 . 18282 1
375 . 1 1 45 45 PRO C C 13 176.4621 0.5 . 1 . . . A 46 PRO C . 18282 1
376 . 1 1 45 45 PRO CA C 13 64.5824 0.117 . 1 . . . A 46 PRO CA . 18282 1
377 . 1 1 45 45 PRO CB C 13 30.2540 0.5 . 1 . . . A 46 PRO CB . 18282 1
378 . 1 1 45 45 PRO CG C 13 27.8387 0.5 . 1 . . . A 46 PRO CG . 18282 1
379 . 1 1 45 45 PRO CD C 13 49.2874 0.12 . 1 . . . A 46 PRO CD . 18282 1
380 . 1 1 46 46 GLN H H 1 6.5442 0.026 . 1 . . . A 47 GLN H . 18282 1
381 . 1 1 46 46 GLN HA H 1 3.9405 0.005 . 1 . . . A 47 GLN HA . 18282 1
382 . 1 1 46 46 GLN HB3 H 1 2.1064 0.005 . 2 . . . A 47 GLN HB3 . 18282 1
383 . 1 1 46 46 GLN C C 13 177.2338 0.5 . 1 . . . A 47 GLN C . 18282 1
384 . 1 1 46 46 GLN CA C 13 58.3283 0.167 . 1 . . . A 47 GLN CA . 18282 1
385 . 1 1 46 46 GLN CB C 13 28.4713 0.196 . 1 . . . A 47 GLN CB . 18282 1
386 . 1 1 46 46 GLN CG C 13 33.7498 0.5 . 1 . . . A 47 GLN CG . 18282 1
387 . 1 1 46 46 GLN N N 15 114.4041 0.183 . 1 . . . A 47 GLN N . 18282 1
388 . 1 1 47 47 GLU H H 1 7.7098 0.01 . 1 . . . A 48 GLU H . 18282 1
389 . 1 1 47 47 GLU HA H 1 4.0853 0.012 . 1 . . . A 48 GLU HA . 18282 1
390 . 1 1 47 47 GLU HB3 H 1 2.1316 0.035 . 2 . . . A 48 GLU HB3 . 18282 1
391 . 1 1 47 47 GLU HG3 H 1 2.5563 0.014 . 2 . . . A 48 GLU HG3 . 18282 1
392 . 1 1 47 47 GLU C C 13 179.1303 0.5 . 1 . . . A 48 GLU C . 18282 1
393 . 1 1 47 47 GLU CA C 13 58.2152 0.139 . 1 . . . A 48 GLU CA . 18282 1
394 . 1 1 47 47 GLU CB C 13 29.2472 0.1 . 1 . . . A 48 GLU CB . 18282 1
395 . 1 1 47 47 GLU CG C 13 33.5324 0.5 . 1 . . . A 48 GLU CG . 18282 1
396 . 1 1 47 47 GLU N N 15 117.3559 0.057 . 1 . . . A 48 GLU N . 18282 1
397 . 1 1 48 48 GLY H H 1 7.2959 0.013 . 1 . . . A 49 GLY H . 18282 1
398 . 1 1 48 48 GLY HA3 H 1 3.5773 0.05 . 2 . . . A 49 GLY HA3 . 18282 1
399 . 1 1 48 48 GLY C C 13 171.0062 0.5 . 1 . . . A 49 GLY C . 18282 1
400 . 1 1 48 48 GLY CA C 13 47.0854 0.016 . 1 . . . A 49 GLY CA . 18282 1
401 . 1 1 48 48 GLY N N 15 105.4558 0.073 . 1 . . . A 49 GLY N . 18282 1
402 . 1 1 49 49 THR H H 1 7.5991 0.006 . 1 . . . A 50 THR H . 18282 1
403 . 1 1 49 49 THR HA H 1 4.2476 0.02 . 1 . . . A 50 THR HA . 18282 1
404 . 1 1 49 49 THR HB H 1 3.5107 0.008 . 1 . . . A 50 THR HB . 18282 1
405 . 1 1 49 49 THR HG21 H 1 1.1348 0.025 . 1 . . . A 50 THR HG21 . 18282 1
406 . 1 1 49 49 THR HG22 H 1 1.1348 0.025 . 1 . . . A 50 THR HG22 . 18282 1
407 . 1 1 49 49 THR HG23 H 1 1.1348 0.025 . 1 . . . A 50 THR HG23 . 18282 1
408 . 1 1 49 49 THR CA C 13 61.8302 0.088 . 1 . . . A 50 THR CA . 18282 1
409 . 1 1 49 49 THR CB C 13 70.6924 0.184 . 1 . . . A 50 THR CB . 18282 1
410 . 1 1 49 49 THR CG2 C 13 20.4543 0.5 . 1 . . . A 50 THR CG2 . 18282 1
411 . 1 1 49 49 THR N N 15 114.0149 0.087 . 1 . . . A 50 THR N . 18282 1
412 . 1 1 50 50 ILE HA H 1 4.1350 0.019 . 1 . . . A 51 ILE HA . 18282 1
413 . 1 1 50 50 ILE HB H 1 1.9859 0.011 . 1 . . . A 51 ILE HB . 18282 1
414 . 1 1 50 50 ILE HG13 H 1 1.2655 0.011 . 2 . . . A 51 ILE HG13 . 18282 1
415 . 1 1 50 50 ILE HG21 H 1 0.6242 0.011 . 1 . . . A 51 ILE HG21 . 18282 1
416 . 1 1 50 50 ILE HG22 H 1 0.6242 0.011 . 1 . . . A 51 ILE HG22 . 18282 1
417 . 1 1 50 50 ILE HG23 H 1 0.6242 0.011 . 1 . . . A 51 ILE HG23 . 18282 1
418 . 1 1 50 50 ILE HD11 H 1 0.6223 0.014 . 1 . . . A 51 ILE HD11 . 18282 1
419 . 1 1 50 50 ILE HD12 H 1 0.6223 0.014 . 1 . . . A 51 ILE HD12 . 18282 1
420 . 1 1 50 50 ILE HD13 H 1 0.6223 0.014 . 1 . . . A 51 ILE HD13 . 18282 1
421 . 1 1 50 50 ILE C C 13 172.6078 0.5 . 1 . . . A 51 ILE C . 18282 1
422 . 1 1 50 50 ILE CA C 13 59.0750 0.181 . 1 . . . A 51 ILE CA . 18282 1
423 . 1 1 50 50 ILE CB C 13 35.4159 0.131 . 1 . . . A 51 ILE CB . 18282 1
424 . 1 1 50 50 ILE CG1 C 13 26.5168 0.135 . 1 . . . A 51 ILE CG1 . 18282 1
425 . 1 1 50 50 ILE CG2 C 13 17.7612 0.189 . 1 . . . A 51 ILE CG2 . 18282 1
426 . 1 1 50 50 ILE CD1 C 13 12.4797 0.105 . 1 . . . A 51 ILE CD1 . 18282 1
427 . 1 1 51 51 ASP H H 1 7.1761 0.026 . 1 . . . A 52 ASP H . 18282 1
428 . 1 1 51 51 ASP HA H 1 4.6249 0.014 . 1 . . . A 52 ASP HA . 18282 1
429 . 1 1 51 51 ASP HB3 H 1 2.7215 0.005 . 2 . . . A 52 ASP HB3 . 18282 1
430 . 1 1 51 51 ASP C C 13 175.7700 0.5 . 1 . . . A 52 ASP C . 18282 1
431 . 1 1 51 51 ASP CA C 13 51.6342 0.164 . 1 . . . A 52 ASP CA . 18282 1
432 . 1 1 51 51 ASP CB C 13 42.5280 0.5 . 1 . . . A 52 ASP CB . 18282 1
433 . 1 1 51 51 ASP N N 15 121.8586 0.174 . 1 . . . A 52 ASP N . 18282 1
434 . 1 1 52 52 ILE H H 1 8.7774 0.018 . 1 . . . A 53 ILE H . 18282 1
435 . 1 1 52 52 ILE HA H 1 4.1499 0.014 . 1 . . . A 53 ILE HA . 18282 1
436 . 1 1 52 52 ILE HB H 1 1.9414 0.021 . 1 . . . A 53 ILE HB . 18282 1
437 . 1 1 52 52 ILE HG13 H 1 1.5550 0.010 . 2 . . . A 53 ILE HG13 . 18282 1
438 . 1 1 52 52 ILE HG21 H 1 1.0553 0.007 . 1 . . . A 53 ILE HG21 . 18282 1
439 . 1 1 52 52 ILE HG22 H 1 1.0553 0.007 . 1 . . . A 53 ILE HG22 . 18282 1
440 . 1 1 52 52 ILE HG23 H 1 1.0553 0.007 . 1 . . . A 53 ILE HG23 . 18282 1
441 . 1 1 52 52 ILE HD11 H 1 0.9821 0.02 . 1 . . . A 53 ILE HD11 . 18282 1
442 . 1 1 52 52 ILE HD12 H 1 0.9821 0.02 . 1 . . . A 53 ILE HD12 . 18282 1
443 . 1 1 52 52 ILE HD13 H 1 0.9821 0.02 . 1 . . . A 53 ILE HD13 . 18282 1
444 . 1 1 52 52 ILE C C 13 176.9611 0.5 . 1 . . . A 53 ILE C . 18282 1
445 . 1 1 52 52 ILE CA C 13 61.8992 0.117 . 1 . . . A 53 ILE CA . 18282 1
446 . 1 1 52 52 ILE CB C 13 37.7003 0.5 . 1 . . . A 53 ILE CB . 18282 1
447 . 1 1 52 52 ILE CG1 C 13 28.3247 0.11 . 1 . . . A 53 ILE CG1 . 18282 1
448 . 1 1 52 52 ILE CG2 C 13 17.9641 0.091 . 1 . . . A 53 ILE CG2 . 18282 1
449 . 1 1 52 52 ILE CD1 C 13 13.3700 0.11 . 1 . . . A 53 ILE CD1 . 18282 1
450 . 1 1 52 52 ILE N N 15 119.5492 0.071 . 1 . . . A 53 ILE N . 18282 1
451 . 1 1 53 53 LYS H H 1 8.1061 0.01 . 1 . . . A 54 LYS H . 18282 1
452 . 1 1 53 53 LYS HA H 1 4.1163 0.005 . 1 . . . A 54 LYS HA . 18282 1
453 . 1 1 53 53 LYS HB3 H 1 1.9073 0.011 . 2 . . . A 54 LYS HB3 . 18282 1
454 . 1 1 53 53 LYS C C 13 180.4481 0.5 . 1 . . . A 54 LYS C . 18282 1
455 . 1 1 53 53 LYS CA C 13 59.9339 0.087 . 1 . . . A 54 LYS CA . 18282 1
456 . 1 1 53 53 LYS CB C 13 31.8750 0.5 . 1 . . . A 54 LYS CB . 18282 1
457 . 1 1 53 53 LYS CG C 13 24.9421 0.5 . 1 . . . A 54 LYS CG . 18282 1
458 . 1 1 53 53 LYS CD C 13 29.2171 0.5 . 1 . . . A 54 LYS CD . 18282 1
459 . 1 1 53 53 LYS CE C 13 41.9354 0.5 . 1 . . . A 54 LYS CE . 18282 1
460 . 1 1 53 53 LYS N N 15 123.5146 0.048 . 1 . . . A 54 LYS N . 18282 1
461 . 1 1 54 54 ARG H H 1 9.1829 0.004 . 1 . . . A 55 ARG H . 18282 1
462 . 1 1 54 54 ARG HA H 1 4.4220 0.003 . 1 . . . A 55 ARG HA . 18282 1
463 . 1 1 54 54 ARG HG3 H 1 1.4270 0.031 . 2 . . . A 55 ARG HG3 . 18282 1
464 . 1 1 54 54 ARG C C 13 179.1585 0.5 . 1 . . . A 55 ARG C . 18282 1
465 . 1 1 54 54 ARG CA C 13 59.7259 0.117 . 1 . . . A 55 ARG CA . 18282 1
466 . 1 1 54 54 ARG N N 15 120.3706 0.087 . 1 . . . A 55 ARG N . 18282 1
467 . 1 1 55 55 TRP H H 1 8.9267 0.009 . 1 . . . A 56 TRP H . 18282 1
468 . 1 1 55 55 TRP HA H 1 4.7473 0.005 . 1 . . . A 56 TRP HA . 18282 1
469 . 1 1 55 55 TRP HB3 H 1 3.3082 0.015 . 2 . . . A 56 TRP HB3 . 18282 1
470 . 1 1 55 55 TRP HZ2 H 1 7.2699 0.04 . 1 . . . A 56 TRP HZ2 . 18282 1
471 . 1 1 55 55 TRP HZ3 H 1 6.6552 0.032 . 1 . . . A 56 TRP HZ3 . 18282 1
472 . 1 1 55 55 TRP HH2 H 1 7.0336 0.049 . 1 . . . A 56 TRP HH2 . 18282 1
473 . 1 1 55 55 TRP C C 13 179.9542 0.5 . 1 . . . A 56 TRP C . 18282 1
474 . 1 1 55 55 TRP CA C 13 60.1047 0.077 . 1 . . . A 56 TRP CA . 18282 1
475 . 1 1 55 55 TRP CB C 13 29.9971 0.5 . 1 . . . A 56 TRP CB . 18282 1
476 . 1 1 55 55 TRP N N 15 120.7552 0.082 . 1 . . . A 56 TRP N . 18282 1
477 . 1 1 56 56 ARG H H 1 9.2205 0.03 . 1 . . . A 57 ARG H . 18282 1
478 . 1 1 56 56 ARG HA H 1 4.4056 0.006 . 1 . . . A 57 ARG HA . 18282 1
479 . 1 1 56 56 ARG HB3 H 1 2.1782 0.006 . 1 . . . A 57 ARG HB3 . 18282 1
480 . 1 1 56 56 ARG C C 13 178.1012 0.5 . 1 . . . A 57 ARG C . 18282 1
481 . 1 1 56 56 ARG CA C 13 60.1984 0.121 . 1 . . . A 57 ARG CA . 18282 1
482 . 1 1 56 56 ARG CB C 13 29.5855 0.109 . 1 . . . A 57 ARG CB . 18282 1
483 . 1 1 56 56 ARG N N 15 122.1943 0.111 . 1 . . . A 57 ARG N . 18282 1
484 . 1 1 57 57 ARG H H 1 7.6053 0.002 . 1 . . . A 58 ARG H . 18282 1
485 . 1 1 57 57 ARG HA H 1 4.1858 0.003 . 1 . . . A 58 ARG HA . 18282 1
486 . 1 1 57 57 ARG HB3 H 1 2.1913 0.013 . 2 . . . A 58 ARG HB3 . 18282 1
487 . 1 1 57 57 ARG C C 13 179.4449 0.5 . 1 . . . A 58 ARG C . 18282 1
488 . 1 1 57 57 ARG CA C 13 59.8320 0.1 . 1 . . . A 58 ARG CA . 18282 1
489 . 1 1 57 57 ARG CB C 13 29.7534 0.059 . 1 . . . A 58 ARG CB . 18282 1
490 . 1 1 57 57 ARG N N 15 120.6744 0.056 . 1 . . . A 58 ARG N . 18282 1
491 . 1 1 58 58 VAL H H 1 7.8188 0.007 . 1 . . . A 59 VAL H . 18282 1
492 . 1 1 58 58 VAL HA H 1 3.6752 0.005 . 1 . . . A 59 VAL HA . 18282 1
493 . 1 1 58 58 VAL HB H 1 1.4889 0.031 . 1 . . . A 59 VAL HB . 18282 1
494 . 1 1 58 58 VAL HG11 H 1 -0.4147 0.006 . 2 . . . A 59 VAL HG11 . 18282 1
495 . 1 1 58 58 VAL HG12 H 1 -0.4147 0.006 . 2 . . . A 59 VAL HG12 . 18282 1
496 . 1 1 58 58 VAL HG13 H 1 -0.4147 0.006 . 2 . . . A 59 VAL HG13 . 18282 1
497 . 1 1 58 58 VAL HG21 H 1 0.4454 0.009 . 2 . . . A 59 VAL HG21 . 18282 1
498 . 1 1 58 58 VAL HG22 H 1 0.4454 0.009 . 2 . . . A 59 VAL HG22 . 18282 1
499 . 1 1 58 58 VAL HG23 H 1 0.4454 0.009 . 2 . . . A 59 VAL HG23 . 18282 1
500 . 1 1 58 58 VAL C C 13 176.5648 0.5 . 1 . . . A 59 VAL C . 18282 1
501 . 1 1 58 58 VAL CA C 13 65.9197 0.1 . 1 . . . A 59 VAL CA . 18282 1
502 . 1 1 58 58 VAL CB C 13 30.7850 0.059 . 1 . . . A 59 VAL CB . 18282 1
503 . 1 1 58 58 VAL CG1 C 13 22.7347 0.088 . 2 . . . A 59 VAL CG1 . 18282 1
504 . 1 1 58 58 VAL CG2 C 13 20.4342 0.073 . 2 . . . A 59 VAL CG2 . 18282 1
505 . 1 1 58 58 VAL N N 15 121.8328 0.081 . 1 . . . A 59 VAL N . 18282 1
506 . 1 1 59 59 GLY H H 1 7.5404 0.01 . 1 . . . A 60 GLY H . 18282 1
507 . 1 1 59 59 GLY HA2 H 1 4.3121 0.05 . 2 . . . A 60 GLY HA2 . 18282 1
508 . 1 1 59 59 GLY C C 13 175.9226 0.5 . 1 . . . A 60 GLY C . 18282 1
509 . 1 1 59 59 GLY CA C 13 45.9820 0.5 . 1 . . . A 60 GLY CA . 18282 1
510 . 1 1 59 59 GLY N N 15 106.5213 0.054 . 1 . . . A 60 GLY N . 18282 1
511 . 1 1 60 60 ASP H H 1 8.1972 0.003 . 1 . . . A 61 ASP H . 18282 1
512 . 1 1 60 60 ASP HA H 1 4.2611 0.006 . 1 . . . A 61 ASP HA . 18282 1
513 . 1 1 60 60 ASP HB3 H 1 2.6950 0.016 . 2 . . . A 61 ASP HB3 . 18282 1
514 . 1 1 60 60 ASP C C 13 178.5367 0.5 . 1 . . . A 61 ASP C . 18282 1
515 . 1 1 60 60 ASP CA C 13 56.9068 0.05 . 1 . . . A 61 ASP CA . 18282 1
516 . 1 1 60 60 ASP CB C 13 39.6535 0.058 . 1 . . . A 61 ASP CB . 18282 1
517 . 1 1 60 60 ASP N N 15 123.0655 0.03 . 1 . . . A 61 ASP N . 18282 1
518 . 1 1 61 61 CYS H H 1 7.8581 0.021 . 1 . . . A 62 CYS H . 18282 1
519 . 1 1 61 61 CYS C C 13 177.0825 0.5 . 1 . . . A 62 CYS C . 18282 1
520 . 1 1 61 61 CYS CA C 13 62.3803 0.094 . 1 . . . A 62 CYS CA . 18282 1
521 . 1 1 61 61 CYS CB C 13 26.0109 0.025 . 1 . . . A 62 CYS CB . 18282 1
522 . 1 1 61 61 CYS N N 15 121.0051 0.044 . 1 . . . A 62 CYS N . 18282 1
523 . 1 1 62 62 PHE H H 1 8.5296 0.011 . 1 . . . A 63 PHE H . 18282 1
524 . 1 1 62 62 PHE HA H 1 4.1174 0.011 . 1 . . . A 63 PHE HA . 18282 1
525 . 1 1 62 62 PHE HE1 H 1 7.2582 0.044 . 1 . . . A 63 PHE HE1 . 18282 1
526 . 1 1 62 62 PHE HE2 H 1 7.2582 0.044 . 1 . . . A 63 PHE HE2 . 18282 1
527 . 1 1 62 62 PHE C C 13 178.0811 0.5 . 1 . . . A 63 PHE C . 18282 1
528 . 1 1 62 62 PHE CA C 13 57.8430 0.2 . 1 . . . A 63 PHE CA . 18282 1
529 . 1 1 62 62 PHE CB C 13 36.6052 0.071 . 1 . . . A 63 PHE CB . 18282 1
530 . 1 1 62 62 PHE N N 15 119.3615 0.299 . 1 . . . A 63 PHE N . 18282 1
531 . 1 1 63 63 GLN H H 1 8.2361 0.003 . 1 . . . A 64 GLN H . 18282 1
532 . 1 1 63 63 GLN HA H 1 4.1992 0.011 . 1 . . . A 64 GLN HA . 18282 1
533 . 1 1 63 63 GLN HB2 H 1 2.0111 0.013 . 2 . . . A 64 GLN HB2 . 18282 1
534 . 1 1 63 63 GLN HB3 H 1 2.2092 0.031 . 2 . . . A 64 GLN HB3 . 18282 1
535 . 1 1 63 63 GLN HG3 H 1 2.4708 0.05 . 2 . . . A 64 GLN HG3 . 18282 1
536 . 1 1 63 63 GLN C C 13 177.6451 0.5 . 1 . . . A 64 GLN C . 18282 1
537 . 1 1 63 63 GLN CA C 13 59.0939 0.094 . 1 . . . A 64 GLN CA . 18282 1
538 . 1 1 63 63 GLN CB C 13 28.3372 0.5 . 1 . . . A 64 GLN CB . 18282 1
539 . 1 1 63 63 GLN CG C 13 33.6222 0.134 . 1 . . . A 64 GLN CG . 18282 1
540 . 1 1 63 63 GLN N N 15 118.8290 0.092 . 1 . . . A 64 GLN N . 18282 1
541 . 1 1 64 64 ASP H H 1 8.2569 0.003 . 1 . . . A 65 ASP H . 18282 1
542 . 1 1 64 64 ASP HA H 1 4.4805 0.034 . 1 . . . A 65 ASP HA . 18282 1
543 . 1 1 64 64 ASP HB3 H 1 2.8002 0.014 . 2 . . . A 65 ASP HB3 . 18282 1
544 . 1 1 64 64 ASP CA C 13 57.3008 0.089 . 1 . . . A 65 ASP CA . 18282 1
545 . 1 1 64 64 ASP CB C 13 40.7731 0.149 . 1 . . . A 65 ASP CB . 18282 1
546 . 1 1 64 64 ASP N N 15 120.2340 0.092 . 1 . . . A 65 ASP N . 18282 1
547 . 1 1 65 65 TYR HA H 1 4.5977 0.007 . 1 . . . A 66 TYR HA . 18282 1
548 . 1 1 65 65 TYR HB3 H 1 3.2578 0.038 . 2 . . . A 66 TYR HB3 . 18282 1
549 . 1 1 65 65 TYR HD1 H 1 7.2366 0.035 . 3 . . . A 66 TYR HD1 . 18282 1
550 . 1 1 65 65 TYR HD2 H 1 7.2366 0.035 . 3 . . . A 66 TYR HD2 . 18282 1
551 . 1 1 65 65 TYR HE1 H 1 6.8938 0.05 . 3 . . . A 66 TYR HE1 . 18282 1
552 . 1 1 65 65 TYR HE2 H 1 6.8938 0.05 . 3 . . . A 66 TYR HE2 . 18282 1
553 . 1 1 65 65 TYR C C 13 178.5242 0.5 . 1 . . . A 66 TYR C . 18282 1
554 . 1 1 65 65 TYR CA C 13 60.3546 0.116 . 1 . . . A 66 TYR CA . 18282 1
555 . 1 1 65 65 TYR CB C 13 37.7963 0.018 . 1 . . . A 66 TYR CB . 18282 1
556 . 1 1 66 66 TYR H H 1 9.0831 0.007 . 1 . . . A 67 TYR H . 18282 1
557 . 1 1 66 66 TYR HA H 1 4.0441 0.006 . 1 . . . A 67 TYR HA . 18282 1
558 . 1 1 66 66 TYR HB3 H 1 3.3058 0.039 . 2 . . . A 67 TYR HB3 . 18282 1
559 . 1 1 66 66 TYR HE1 H 1 6.5800 0.025 . 3 . . . A 67 TYR HE1 . 18282 1
560 . 1 1 66 66 TYR HE2 H 1 6.5800 0.025 . 3 . . . A 67 TYR HE2 . 18282 1
561 . 1 1 66 66 TYR C C 13 178.2196 0.5 . 1 . . . A 67 TYR C . 18282 1
562 . 1 1 66 66 TYR CA C 13 61.7261 0.141 . 1 . . . A 67 TYR CA . 18282 1
563 . 1 1 66 66 TYR CB C 13 38.9323 0.127 . 1 . . . A 67 TYR CB . 18282 1
564 . 1 1 66 66 TYR N N 15 122.7411 0.038 . 1 . . . A 67 TYR N . 18282 1
565 . 1 1 67 67 ASN H H 1 8.7964 0.003 . 1 . . . A 68 ASN H . 18282 1
566 . 1 1 67 67 ASN HA H 1 4.3777 0.023 . 1 . . . A 68 ASN HA . 18282 1
567 . 1 1 67 67 ASN HB3 H 1 2.9845 0.064 . 2 . . . A 68 ASN HB3 . 18282 1
568 . 1 1 67 67 ASN C C 13 176.6326 0.5 . 1 . . . A 68 ASN C . 18282 1
569 . 1 1 67 67 ASN CA C 13 55.2934 0.087 . 1 . . . A 68 ASN CA . 18282 1
570 . 1 1 67 67 ASN CB C 13 37.8597 0.5 . 1 . . . A 68 ASN CB . 18282 1
571 . 1 1 67 67 ASN N N 15 118.5301 0.093 . 1 . . . A 68 ASN N . 18282 1
572 . 1 1 68 68 THR H H 1 7.9603 0.007 . 1 . . . A 69 THR H . 18282 1
573 . 1 1 68 68 THR HA H 1 3.8723 0.021 . 1 . . . A 69 THR HA . 18282 1
574 . 1 1 68 68 THR HB H 1 3.6046 0.012 . 1 . . . A 69 THR HB . 18282 1
575 . 1 1 68 68 THR HG21 H 1 0.3130 0.003 . 1 . . . A 69 THR HG1 . 18282 1
576 . 1 1 68 68 THR HG22 H 1 0.3130 0.003 . 1 . . . A 69 THR HG1 . 18282 1
577 . 1 1 68 68 THR HG23 H 1 0.3130 0.003 . 1 . . . A 69 THR HG1 . 18282 1
578 . 1 1 68 68 THR C C 13 174.8319 0.5 . 1 . . . A 69 THR C . 18282 1
579 . 1 1 68 68 THR CA C 13 65.2236 0.13 . 1 . . . A 69 THR CA . 18282 1
580 . 1 1 68 68 THR CB C 13 69.4836 0.5 . 1 . . . A 69 THR CB . 18282 1
581 . 1 1 68 68 THR CG2 C 13 20.4235 0.06 . 1 . . . A 69 THR CG2 . 18282 1
582 . 1 1 68 68 THR N N 15 114.3280 0.064 . 1 . . . A 69 THR N . 18282 1
583 . 1 1 69 69 PHE H H 1 8.5906 0.03 . 1 . . . A 70 PHE H . 18282 1
584 . 1 1 69 69 PHE HA H 1 4.6259 0.025 . 1 . . . A 70 PHE HA . 18282 1
585 . 1 1 69 69 PHE HB3 H 1 2.7075 0.05 . 2 . . . A 70 PHE HB3 . 18282 1
586 . 1 1 69 69 PHE HD1 H 1 7.1727 0.027 . 3 . . . A 70 PHE HD1 . 18282 1
587 . 1 1 69 69 PHE HD2 H 1 7.1727 0.027 . 3 . . . A 70 PHE HD2 . 18282 1
588 . 1 1 69 69 PHE C C 13 176.4954 0.5 . 1 . . . A 70 PHE C . 18282 1
589 . 1 1 69 69 PHE CA C 13 58.4094 0.099 . 1 . . . A 70 PHE CA . 18282 1
590 . 1 1 69 69 PHE CB C 13 40.7416 0.104 . 1 . . . A 70 PHE CB . 18282 1
591 . 1 1 69 69 PHE N N 15 118.1071 0.02 . 1 . . . A 70 PHE N . 18282 1
592 . 1 1 70 70 GLY H H 1 7.8932 0.014 . 1 . . . A 71 GLY H . 18282 1
593 . 1 1 70 70 GLY HA3 H 1 3.5022 0.05 . 2 . . . A 71 GLY HA3 . 18282 1
594 . 1 1 70 70 GLY CA C 13 44.6839 0.5 . 1 . . . A 71 GLY CA . 18282 1
595 . 1 1 70 70 GLY N N 15 109.3092 0.054 . 1 . . . A 71 GLY N . 18282 1
596 . 1 1 71 71 PRO HA H 1 4.6909 0.009 . 1 . . . A 72 PRO HA . 18282 1
597 . 1 1 71 71 PRO HB3 H 1 2.4487 0.019 . 2 . . . A 72 PRO HB3 . 18282 1
598 . 1 1 71 71 PRO HG3 H 1 2.0316 0.018 . 2 . . . A 72 PRO HG3 . 18282 1
599 . 1 1 71 71 PRO HD3 H 1 3.2773 0.019 . 2 . . . A 72 PRO HD3 . 18282 1
600 . 1 1 71 71 PRO C C 13 177.7716 0.5 . 1 . . . A 72 PRO C . 18282 1
601 . 1 1 71 71 PRO CA C 13 63.4578 0.138 . 1 . . . A 72 PRO CA . 18282 1
602 . 1 1 71 71 PRO CB C 13 31.8231 0.164 . 1 . . . A 72 PRO CB . 18282 1
603 . 1 1 71 71 PRO CG C 13 26.9963 0.108 . 1 . . . A 72 PRO CG . 18282 1
604 . 1 1 71 71 PRO CD C 13 49.9004 0.172 . 1 . . . A 72 PRO CD . 18282 1
605 . 1 1 72 72 GLU H H 1 8.5953 0.007 . 1 . . . A 73 GLU H . 18282 1
606 . 1 1 72 72 GLU HA H 1 4.0605 0.036 . 1 . . . A 73 GLU HA . 18282 1
607 . 1 1 72 72 GLU HB3 H 1 1.9906 0.005 . 2 . . . A 73 GLU HB3 . 18282 1
608 . 1 1 72 72 GLU HG3 H 1 2.4497 0.009 . 2 . . . A 73 GLU HG3 . 18282 1
609 . 1 1 72 72 GLU C C 13 177.2356 0.5 . 1 . . . A 73 GLU C . 18282 1
610 . 1 1 72 72 GLU CA C 13 58.5699 0.169 . 1 . . . A 73 GLU CA . 18282 1
611 . 1 1 72 72 GLU CB C 13 28.8530 0.103 . 1 . . . A 73 GLU CB . 18282 1
612 . 1 1 72 72 GLU CG C 13 36.1405 0.135 . 1 . . . A 73 GLU CG . 18282 1
613 . 1 1 72 72 GLU N N 15 117.4206 0.08 . 1 . . . A 73 GLU N . 18282 1
614 . 1 1 73 73 LYS H H 1 7.4934 0.019 . 1 . . . A 74 LYS H . 18282 1
615 . 1 1 73 73 LYS HA H 1 4.3813 0.019 . 1 . . . A 74 LYS HA . 18282 1
616 . 1 1 73 73 LYS HB3 H 1 1.6127 0.017 . 2 . . . A 74 LYS HB3 . 18282 1
617 . 1 1 73 73 LYS HG3 H 1 1.2961 0.004 . 2 . . . A 74 LYS HG3 . 18282 1
618 . 1 1 73 73 LYS HD3 H 1 1.9703 0.01 . 2 . . . A 74 LYS HD3 . 18282 1
619 . 1 1 73 73 LYS C C 13 175.6616 0.5 . 1 . . . A 74 LYS C . 18282 1
620 . 1 1 73 73 LYS CA C 13 55.2634 0.156 . 1 . . . A 74 LYS CA . 18282 1
621 . 1 1 73 73 LYS CB C 13 33.8906 0.17 . 1 . . . A 74 LYS CB . 18282 1
622 . 1 1 73 73 LYS CG C 13 24.6897 0.5 . 1 . . . A 74 LYS CG . 18282 1
623 . 1 1 73 73 LYS CD C 13 27.5384 0.5 . 1 . . . A 74 LYS CD . 18282 1
624 . 1 1 73 73 LYS CE C 13 42.0128 0.5 . 1 . . . A 74 LYS CE . 18282 1
625 . 1 1 73 73 LYS N N 15 116.8461 0.101 . 1 . . . A 74 LYS N . 18282 1
626 . 1 1 74 74 VAL H H 1 7.3419 0.02 . 1 . . . A 75 VAL H . 18282 1
627 . 1 1 74 74 VAL HA H 1 4.4228 0.019 . 1 . . . A 75 VAL HA . 18282 1
628 . 1 1 74 74 VAL HB H 1 2.1952 0.021 . 1 . . . A 75 VAL HB . 18282 1
629 . 1 1 74 74 VAL HG21 H 1 0.5112 0.511 . 2 . . . A 75 VAL HG21 . 18282 1
630 . 1 1 74 74 VAL HG22 H 1 0.5112 0.511 . 2 . . . A 75 VAL HG22 . 18282 1
631 . 1 1 74 74 VAL HG23 H 1 0.5112 0.511 . 2 . . . A 75 VAL HG23 . 18282 1
632 . 1 1 74 74 VAL CA C 13 58.4381 0.061 . 1 . . . A 75 VAL CA . 18282 1
633 . 1 1 74 74 VAL CB C 13 33.7630 0.140 . 1 . . . A 75 VAL CB . 18282 1
634 . 1 1 74 74 VAL CG2 C 13 20.9684 0.130 . 1 . . . A 75 VAL CG2 . 18282 1
635 . 1 1 74 74 VAL N N 15 118.0557 0.054 . 1 . . . A 75 VAL N . 18282 1
636 . 1 1 75 75 PRO HA H 1 4.5850 0.003 . 1 . . . A 76 PRO HA . 18282 1
637 . 1 1 75 75 PRO HB3 H 1 2.2564 0.011 . 2 . . . A 76 PRO HB3 . 18282 1
638 . 1 1 75 75 PRO HG3 H 1 1.7348 0.05 . 2 . . . A 76 PRO HG3 . 18282 1
639 . 1 1 75 75 PRO HD3 H 1 2.7183 0.007 . 2 . . . A 76 PRO HD3 . 18282 1
640 . 1 1 75 75 PRO C C 13 178.5435 0.5 . 1 . . . A 76 PRO C . 18282 1
641 . 1 1 75 75 PRO CA C 13 61.9112 0.157 . 1 . . . A 76 PRO CA . 18282 1
642 . 1 1 75 75 PRO CB C 13 32.0353 0.128 . 1 . . . A 76 PRO CB . 18282 1
643 . 1 1 75 75 PRO CG C 13 26.9439 0.5 . 1 . . . A 76 PRO CG . 18282 1
644 . 1 1 75 75 PRO CD C 13 50.0475 0.095 . 1 . . . A 76 PRO CD . 18282 1
645 . 1 1 76 76 VAL H H 1 8.6040 0.006 . 1 . . . A 77 VAL H . 18282 1
646 . 1 1 76 76 VAL HA H 1 3.9208 0.007 . 1 . . . A 77 VAL HA . 18282 1
647 . 1 1 76 76 VAL HB H 1 2.2227 0.015 . 1 . . . A 77 VAL HB . 18282 1
648 . 1 1 76 76 VAL HG21 H 1 1.0712 0.03 . 2 . . . A 77 VAL HG21 . 18282 1
649 . 1 1 76 76 VAL HG22 H 1 1.0712 0.03 . 2 . . . A 77 VAL HG22 . 18282 1
650 . 1 1 76 76 VAL HG23 H 1 1.0712 0.03 . 2 . . . A 77 VAL HG23 . 18282 1
651 . 1 1 76 76 VAL CA C 13 65.3156 0.081 . 1 . . . A 77 VAL CA . 18282 1
652 . 1 1 76 76 VAL CB C 13 31.3163 0.112 . 1 . . . A 77 VAL CB . 18282 1
653 . 1 1 76 76 VAL CG2 C 13 20.8494 0.116 . 1 . . . A 77 VAL CG2 . 18282 1
654 . 1 1 76 76 VAL N N 15 119.8253 0.046 . 1 . . . A 77 VAL N . 18282 1
655 . 1 1 77 77 THR H H 1 7.3798 0.012 . 1 . . . A 78 THR H . 18282 1
656 . 1 1 77 77 THR HA H 1 3.9142 0.021 . 1 . . . A 78 THR HA . 18282 1
657 . 1 1 77 77 THR HB H 1 3.8825 0.024 . 1 . . . A 78 THR HB . 18282 1
658 . 1 1 77 77 THR HG21 H 1 1.1119 0.02 . 1 . . . A 78 THR HG21 . 18282 1
659 . 1 1 77 77 THR HG22 H 1 1.1119 0.02 . 1 . . . A 78 THR HG22 . 18282 1
660 . 1 1 77 77 THR HG23 H 1 1.1119 0.02 . 1 . . . A 78 THR HG23 . 18282 1
661 . 1 1 77 77 THR C C 13 175.7323 0.5 . 1 . . . A 78 THR C . 18282 1
662 . 1 1 77 77 THR CA C 13 62.8032 0.112 . 1 . . . A 78 THR CA . 18282 1
663 . 1 1 77 77 THR CB C 13 68.3566 0.116 . 1 . . . A 78 THR CB . 18282 1
664 . 1 1 77 77 THR CG2 C 13 22.0189 0.04 . 1 . . . A 78 THR CG2 . 18282 1
665 . 1 1 77 77 THR N N 15 109.3897 0.098 . 1 . . . A 78 THR N . 18282 1
666 . 1 1 78 78 ALA H H 1 7.8109 0.006 . 1 . . . A 79 ALA H . 18282 1
667 . 1 1 78 78 ALA HA H 1 4.0010 0.009 . 1 . . . A 79 ALA HA . 18282 1
668 . 1 1 78 78 ALA HB1 H 1 0.8079 0.032 . 1 . . . A 79 ALA HB1 . 18282 1
669 . 1 1 78 78 ALA HB2 H 1 0.8079 0.032 . 1 . . . A 79 ALA HB2 . 18282 1
670 . 1 1 78 78 ALA HB3 H 1 0.8079 0.032 . 1 . . . A 79 ALA HB3 . 18282 1
671 . 1 1 78 78 ALA C C 13 179.5268 0.5 . 1 . . . A 79 ALA C . 18282 1
672 . 1 1 78 78 ALA CA C 13 55.0913 0.036 . 1 . . . A 79 ALA CA . 18282 1
673 . 1 1 78 78 ALA CB C 13 17.5607 0.129 . 1 . . . A 79 ALA CB . 18282 1
674 . 1 1 78 78 ALA N N 15 123.6608 0.084 . 1 . . . A 79 ALA N . 18282 1
675 . 1 1 79 79 PHE H H 1 7.3055 0.016 . 1 . . . A 80 PHE H . 18282 1
676 . 1 1 79 79 PHE HA H 1 4.4520 0.009 . 1 . . . A 80 PHE HA . 18282 1
677 . 1 1 79 79 PHE HB3 H 1 2.9615 0.035 . 2 . . . A 80 PHE HB3 . 18282 1
678 . 1 1 79 79 PHE HD1 H 1 6.9349 0.05 . 3 . . . A 80 PHE HD1 . 18282 1
679 . 1 1 79 79 PHE HD2 H 1 6.9349 0.05 . 3 . . . A 80 PHE HD2 . 18282 1
680 . 1 1 79 79 PHE C C 13 178.5856 0.5 . 1 . . . A 80 PHE C . 18282 1
681 . 1 1 79 79 PHE CA C 13 61.6555 0.111 . 1 . . . A 80 PHE CA . 18282 1
682 . 1 1 79 79 PHE CB C 13 37.6941 0.139 . 1 . . . A 80 PHE CB . 18282 1
683 . 1 1 79 79 PHE N N 15 114.2583 0.031 . 1 . . . A 80 PHE N . 18282 1
684 . 1 1 80 80 SER H H 1 7.7333 0.015 . 1 . . . A 81 SER H . 18282 1
685 . 1 1 80 80 SER CA C 13 61.8238 0.5 . 1 . . . A 81 SER CA . 18282 1
686 . 1 1 80 80 SER N N 15 116.8649 0.059 . 1 . . . A 81 SER N . 18282 1
687 . 1 1 81 81 TYR H H 1 8.1506 0.005 . 1 . . . A 82 TYR H . 18282 1
688 . 1 1 81 81 TYR HA H 1 4.1330 0.05 . 1 . . . A 82 TYR HA . 18282 1
689 . 1 1 81 81 TYR HB3 H 1 1.5880 0.002 . 2 . . . A 82 TYR HB3 . 18282 1
690 . 1 1 81 81 TYR HD1 H 1 7.4545 0.02 . 3 . . . A 82 TYR HD1 . 18282 1
691 . 1 1 81 81 TYR HD2 H 1 7.4545 0.02 . 3 . . . A 82 TYR HD2 . 18282 1
692 . 1 1 81 81 TYR HE1 H 1 6.5577 0.05 . 3 . . . A 82 TYR HE1 . 18282 1
693 . 1 1 81 81 TYR HE2 H 1 6.5577 0.05 . 3 . . . A 82 TYR HE2 . 18282 1
694 . 1 1 81 81 TYR C C 13 177.7008 0.5 . 1 . . . A 82 TYR C . 18282 1
695 . 1 1 81 81 TYR CA C 13 60.0272 0.5 . 1 . . . A 82 TYR CA . 18282 1
696 . 1 1 81 81 TYR CB C 13 34.1040 0.038 . 1 . . . A 82 TYR CB . 18282 1
697 . 1 1 81 81 TYR N N 15 121.9317 0.058 . 1 . . . A 82 TYR N . 18282 1
698 . 1 1 82 82 TRP H H 1 8.6450 0.021 . 1 . . . A 83 TRP H . 18282 1
699 . 1 1 82 82 TRP HA H 1 4.4355 0.018 . 1 . . . A 83 TRP HA . 18282 1
700 . 1 1 82 82 TRP HB3 H 1 3.6338 0.004 . 2 . . . A 83 TRP HB3 . 18282 1
701 . 1 1 82 82 TRP CA C 13 63.9751 0.095 . 1 . . . A 83 TRP CA . 18282 1
702 . 1 1 82 82 TRP CB C 13 28.5572 0.101 . 1 . . . A 83 TRP CB . 18282 1
703 . 1 1 82 82 TRP N N 15 120.8168 0.057 . 1 . . . A 83 TRP N . 18282 1
704 . 1 1 83 83 ASN HA H 1 4.2301 0.01 . 1 . . . A 84 ASN HA . 18282 1
705 . 1 1 83 83 ASN HB3 H 1 2.9110 0.009 . 2 . . . A 84 ASN HB3 . 18282 1
706 . 1 1 83 83 ASN C C 13 176.1404 0.5 . 1 . . . A 84 ASN C . 18282 1
707 . 1 1 83 83 ASN CA C 13 56.6827 0.016 . 1 . . . A 84 ASN CA . 18282 1
708 . 1 1 83 83 ASN CB C 13 39.1156 0.067 . 1 . . . A 84 ASN CB . 18282 1
709 . 1 1 84 84 LEU H H 1 7.7511 0.013 . 1 . . . A 85 LEU H . 18282 1
710 . 1 1 84 84 LEU HA H 1 4.0542 0.012 . 1 . . . A 85 LEU HA . 18282 1
711 . 1 1 84 84 LEU HB3 H 1 1.7669 0.022 . 2 . . . A 85 LEU HB3 . 18282 1
712 . 1 1 84 84 LEU HG H 1 1.7496 0.022 . 1 . . . A 85 LEU HG . 18282 1
713 . 1 1 84 84 LEU HD21 H 1 0.8031 0.022 . 2 . . . A 85 LEU HD21 . 18282 1
714 . 1 1 84 84 LEU HD22 H 1 0.8031 0.022 . 2 . . . A 85 LEU HD21 . 18282 1
715 . 1 1 84 84 LEU HD23 H 1 0.8031 0.022 . 2 . . . A 85 LEU HD21 . 18282 1
716 . 1 1 84 84 LEU C C 13 178.3685 0.5 . 1 . . . A 85 LEU C . 18282 1
717 . 1 1 84 84 LEU CA C 13 58.2276 0.112 . 1 . . . A 85 LEU CA . 18282 1
718 . 1 1 84 84 LEU CB C 13 41.5756 0.155 . 1 . . . A 85 LEU CB . 18282 1
719 . 1 1 84 84 LEU CG C 13 26.0507 0.075 . 1 . . . A 85 LEU CG . 18282 1
720 . 1 1 84 84 LEU CD2 C 13 25.3790 0.232 . 2 . . . A 85 LEU CD2 . 18282 1
721 . 1 1 84 84 LEU N N 15 121.8838 0.032 . 1 . . . A 85 LEU N . 18282 1
722 . 1 1 85 85 ILE H H 1 7.9525 0.026 . 1 . . . A 86 ILE H . 18282 1
723 . 1 1 85 85 ILE HA H 1 3.4621 0.013 . 1 . . . A 86 ILE HA . 18282 1
724 . 1 1 85 85 ILE HB H 1 1.9762 0.013 . 1 . . . A 86 ILE HB . 18282 1
725 . 1 1 85 85 ILE HG13 H 1 1.4438 0.029 . 2 . . . A 86 ILE HG13 . 18282 1
726 . 1 1 85 85 ILE HG21 H 1 -0.4912 0.011 . 1 . . . A 86 ILE HG21 . 18282 1
727 . 1 1 85 85 ILE HG22 H 1 -0.4912 0.011 . 1 . . . A 86 ILE HG22 . 18282 1
728 . 1 1 85 85 ILE HG23 H 1 -0.4912 0.011 . 1 . . . A 86 ILE HG23 . 18282 1
729 . 1 1 85 85 ILE HD11 H 1 0.8200 0.019 . 1 . . . A 86 ILE HD11 . 18282 1
730 . 1 1 85 85 ILE HD12 H 1 0.8200 0.019 . 1 . . . A 86 ILE HD12 . 18282 1
731 . 1 1 85 85 ILE HD13 H 1 0.8200 0.019 . 1 . . . A 86 ILE HD13 . 18282 1
732 . 1 1 85 85 ILE C C 13 176.8089 0.5 . 1 . . . A 86 ILE C . 18282 1
733 . 1 1 85 85 ILE CA C 13 61.3454 0.135 . 1 . . . A 86 ILE CA . 18282 1
734 . 1 1 85 85 ILE CB C 13 34.0988 0.245 . 1 . . . A 86 ILE CB . 18282 1
735 . 1 1 85 85 ILE CG1 C 13 27.4995 0.158 . 1 . . . A 86 ILE CG1 . 18282 1
736 . 1 1 85 85 ILE CG2 C 13 16.2516 0.101 . 1 . . . A 86 ILE CG2 . 18282 1
737 . 1 1 85 85 ILE CD1 C 13 9.2365 0.101 . 1 . . . A 86 ILE CD1 . 18282 1
738 . 1 1 85 85 ILE N N 15 116.8246 0.076 . 1 . . . A 86 ILE N . 18282 1
739 . 1 1 86 86 LYS H H 1 7.8758 0.025 . 1 . . . A 87 LYS H . 18282 1
740 . 1 1 86 86 LYS HA H 1 3.2307 0.025 . 1 . . . A 87 LYS HA . 18282 1
741 . 1 1 86 86 LYS HG3 H 1 1.7470 0.028 . 2 . . . A 87 LYS HG3 . 18282 1
742 . 1 1 86 86 LYS C C 13 177.2211 0.5 . 1 . . . A 87 LYS C . 18282 1
743 . 1 1 86 86 LYS CA C 13 60.0334 0.09 . 1 . . . A 87 LYS CA . 18282 1
744 . 1 1 86 86 LYS CB C 13 31.0054 0.062 . 1 . . . A 87 LYS CB . 18282 1
745 . 1 1 86 86 LYS CG C 13 23.9580 0.5 . 1 . . . A 87 LYS CG . 18282 1
746 . 1 1 86 86 LYS CD C 13 29.0074 0.5 . 1 . . . A 87 LYS CD . 18282 1
747 . 1 1 86 86 LYS CE C 13 42.2085 0.5 . 1 . . . A 87 LYS CE . 18282 1
748 . 1 1 86 86 LYS N N 15 121.8464 0.015 . 1 . . . A 87 LYS N . 18282 1
749 . 1 1 87 87 GLU H H 1 7.6790 0.015 . 1 . . . A 88 GLU H . 18282 1
750 . 1 1 87 87 GLU HA H 1 3.8612 0.006 . 1 . . . A 88 GLU HA . 18282 1
751 . 1 1 87 87 GLU HB3 H 1 2.0439 0.03 . 2 . . . A 88 GLU HB3 . 18282 1
752 . 1 1 87 87 GLU HG3 H 1 2.2596 0.016 . 2 . . . A 88 GLU HG3 . 18282 1
753 . 1 1 87 87 GLU C C 13 178.8096 0.5 . 1 . . . A 88 GLU C . 18282 1
754 . 1 1 87 87 GLU CA C 13 58.9486 0.165 . 1 . . . A 88 GLU CA . 18282 1
755 . 1 1 87 87 GLU CB C 13 29.2210 0.101 . 1 . . . A 88 GLU CB . 18282 1
756 . 1 1 87 87 GLU CG C 13 35.8015 0.17 . 1 . . . A 88 GLU CG . 18282 1
757 . 1 1 87 87 GLU N N 15 116.3306 0.036 . 1 . . . A 88 GLU N . 18282 1
758 . 1 1 88 88 LEU H H 1 7.4407 0.016 . 1 . . . A 89 LEU H . 18282 1
759 . 1 1 88 88 LEU HA H 1 3.9093 0.006 . 1 . . . A 89 LEU HA . 18282 1
760 . 1 1 88 88 LEU HB3 H 1 1.2249 0.033 . 2 . . . A 89 LEU HB3 . 18282 1
761 . 1 1 88 88 LEU HG H 1 0.6405 0.007 . 1 . . . A 89 LEU HG . 18282 1
762 . 1 1 88 88 LEU HD21 H 1 0.6225 0.012 . 2 . . . A 89 LEU HD21 . 18282 1
763 . 1 1 88 88 LEU HD22 H 1 0.6225 0.012 . 2 . . . A 89 LEU HD21 . 18282 1
764 . 1 1 88 88 LEU HD23 H 1 0.6225 0.012 . 2 . . . A 89 LEU HD21 . 18282 1
765 . 1 1 88 88 LEU CA C 13 57.6881 0.086 . 1 . . . A 89 LEU CA . 18282 1
766 . 1 1 88 88 LEU CB C 13 41.4357 0.117 . 1 . . . A 89 LEU CB . 18282 1
767 . 1 1 88 88 LEU CG C 13 25.5798 0.167 . 1 . . . A 89 LEU CG . 18282 1
768 . 1 1 88 88 LEU CD2 C 13 22.7490 0.12 . 2 . . . A 89 LEU CD2 . 18282 1
769 . 1 1 88 88 LEU N N 15 118.0902 0.02 . 1 . . . A 89 LEU N . 18282 1
770 . 1 1 89 89 ILE HA H 1 3.3439 0.007 . 1 . . . A 90 ILE HA . 18282 1
771 . 1 1 89 89 ILE HB H 1 1.9789 0.028 . 1 . . . A 90 ILE HB . 18282 1
772 . 1 1 89 89 ILE HG13 H 1 1.6202 0.006 . 2 . . . A 90 ILE HG13 . 18282 1
773 . 1 1 89 89 ILE HG21 H 1 0.6075 0.019 . 1 . . . A 90 ILE HG21 . 18282 1
774 . 1 1 89 89 ILE HG22 H 1 0.6075 0.019 . 1 . . . A 90 ILE HG22 . 18282 1
775 . 1 1 89 89 ILE HG23 H 1 0.6075 0.019 . 1 . . . A 90 ILE HG23 . 18282 1
776 . 1 1 89 89 ILE HD11 H 1 0.0245 0.015 . 1 . . . A 90 ILE HD11 . 18282 1
777 . 1 1 89 89 ILE HD12 H 1 0.0245 0.015 . 1 . . . A 90 ILE HD12 . 18282 1
778 . 1 1 89 89 ILE HD13 H 1 0.0245 0.015 . 1 . . . A 90 ILE HD13 . 18282 1
779 . 1 1 89 89 ILE CA C 13 65.0817 0.106 . 1 . . . A 90 ILE CA . 18282 1
780 . 1 1 89 89 ILE CB C 13 37.5558 0.161 . 1 . . . A 90 ILE CB . 18282 1
781 . 1 1 89 89 ILE CG1 C 13 28.1388 0.140 . 1 . . . A 90 ILE CG1 . 18282 1
782 . 1 1 89 89 ILE CG2 C 13 17.2421 0.146 . 1 . . . A 90 ILE CG2 . 18282 1
783 . 1 1 89 89 ILE CD1 C 13 13.2509 0.134 . 1 . . . A 90 ILE CD1 . 18282 1
784 . 1 1 90 90 ASP HA H 1 3.8941 0.05 . 1 . . . A 91 ASP HA . 18282 1
785 . 1 1 90 90 ASP CA C 13 57.6785 0.5 . 1 . . . A 91 ASP CA . 18282 1
786 . 1 1 90 90 ASP CB C 13 40.5461 0.5 . 1 . . . A 91 ASP CB . 18282 1
787 . 1 1 91 91 LYS H H 1 7.9030 0.012 . 1 . . . A 92 LYS H . 18282 1
788 . 1 1 91 91 LYS HB3 H 1 1.8980 0.045 . 2 . . . A 92 LYS HB3 . 18282 1
789 . 1 1 91 91 LYS CA C 13 54.6000 0.5 . 1 . . . A 92 LYS CA . 18282 1
790 . 1 1 91 91 LYS CB C 13 32.0142 0.5 . 1 . . . A 92 LYS CB . 18282 1
791 . 1 1 91 91 LYS N N 15 119.4219 0.122 . 1 . . . A 92 LYS N . 18282 1
792 . 1 1 92 92 LYS HA H 1 4.5407 0.05 . 1 . . . A 93 LYS HA . 18282 1
793 . 1 1 92 92 LYS HB3 H 1 1.7532 0.05 . 2 . . . A 93 LYS HB3 . 18282 1
794 . 1 1 92 92 LYS HG3 H 1 1.4888 0.05 . 2 . . . A 93 LYS HG3 . 18282 1
795 . 1 1 92 92 LYS HD3 H 1 1.6406 0.05 . 2 . . . A 93 LYS HD3 . 18282 1
796 . 1 1 92 92 LYS HE3 H 1 3.0667 0.05 . 2 . . . A 93 LYS HE3 . 18282 1
797 . 1 1 92 92 LYS CA C 13 55.2017 0.047 . 1 . . . A 93 LYS CA . 18282 1
798 . 1 1 92 92 LYS CB C 13 31.7576 0.151 . 1 . . . A 93 LYS CB . 18282 1
799 . 1 1 92 92 LYS CG C 13 24.7737 0.5 . 1 . . . A 93 LYS CG . 18282 1
800 . 1 1 92 92 LYS CD C 13 29.0884 0.5 . 1 . . . A 93 LYS CD . 18282 1
801 . 1 1 92 92 LYS CE C 13 41.9735 0.5 . 1 . . . A 93 LYS CE . 18282 1
802 . 1 1 93 93 GLU H H 1 8.1405 0.004 . 1 . . . A 94 GLU H . 18282 1
803 . 1 1 93 93 GLU HA H 1 4.2833 0.021 . 1 . . . A 94 GLU HA . 18282 1
804 . 1 1 93 93 GLU HB3 H 1 2.0050 0.002 . 2 . . . A 94 GLU HB3 . 18282 1
805 . 1 1 93 93 GLU C C 13 175.6133 0.5 . 1 . . . A 94 GLU C . 18282 1
806 . 1 1 93 93 GLU CA C 13 56.2961 0.5 . 1 . . . A 94 GLU CA . 18282 1
807 . 1 1 93 93 GLU CB C 13 29.4154 0.119 . 1 . . . A 94 GLU CB . 18282 1
808 . 1 1 93 93 GLU CG C 13 36.0902 0.5 . 1 . . . A 94 GLU CG . 18282 1
809 . 1 1 93 93 GLU N N 15 115.9221 0.109 . 1 . . . A 94 GLU N . 18282 1
810 . 1 1 94 94 VAL H H 1 8.0029 0.002 . 1 . . . A 95 VAL H . 18282 1
811 . 1 1 94 94 VAL HA H 1 3.7732 0.003 . 1 . . . A 95 VAL HA . 18282 1
812 . 1 1 94 94 VAL HB H 1 2.0646 0.006 . 1 . . . A 95 VAL HB . 18282 1
813 . 1 1 94 94 VAL HG21 H 1 0.8809 0.027 . 2 . . . A 95 VAL HG21 . 18282 1
814 . 1 1 94 94 VAL HG22 H 1 0.8809 0.027 . 2 . . . A 95 VAL HG22 . 18282 1
815 . 1 1 94 94 VAL HG23 H 1 0.8809 0.027 . 2 . . . A 95 VAL HG23 . 18282 1
816 . 1 1 94 94 VAL CA C 13 62.2566 0.043 . 1 . . . A 95 VAL CA . 18282 1
817 . 1 1 94 94 VAL CB C 13 32.0475 0.238 . 1 . . . A 95 VAL CB . 18282 1
818 . 1 1 94 94 VAL CG2 C 13 20.2930 0.5 . 2 . . . A 95 VAL CG2 . 18282 1
819 . 1 1 94 94 VAL N N 15 121.3042 0.052 . 1 . . . A 95 VAL N . 18282 1
820 . 1 1 95 95 ASN H H 1 7.5185 0.003 . 1 . . . A 96 ASN H . 18282 1
821 . 1 1 96 96 PRO HA H 1 4.3192 0.008 . 1 . . . A 97 PRO HA . 18282 1
822 . 1 1 96 96 PRO HB3 H 1 2.4024 0.013 . 2 . . . A 97 PRO HB3 . 18282 1
823 . 1 1 96 96 PRO HD3 H 1 3.6783 0.006 . 2 . . . A 97 PRO HD3 . 18282 1
824 . 1 1 96 96 PRO C C 13 179.0877 0.5 . 1 . . . A 97 PRO C . 18282 1
825 . 1 1 96 96 PRO CA C 13 64.9625 0.150 . 1 . . . A 97 PRO CA . 18282 1
826 . 1 1 96 96 PRO CB C 13 32.0352 0.065 . 1 . . . A 97 PRO CB . 18282 1
827 . 1 1 96 96 PRO CD C 13 49.8270 0.053 . 1 . . . A 97 PRO CD . 18282 1
828 . 1 1 97 97 GLN H H 1 8.3506 0.036 . 1 . . . A 98 GLN H . 18282 1
829 . 1 1 97 97 GLN HA H 1 3.9518 0.011 . 1 . . . A 98 GLN HA . 18282 1
830 . 1 1 97 97 GLN HB3 H 1 2.0329 0.015 . 2 . . . A 98 GLN HB3 . 18282 1
831 . 1 1 97 97 GLN HG3 H 1 2.4268 0.018 . 2 . . . A 98 GLN HG3 . 18282 1
832 . 1 1 97 97 GLN C C 13 179.2716 0.5 . 1 . . . A 98 GLN C . 18282 1
833 . 1 1 97 97 GLN CA C 13 55.6914 0.113 . 1 . . . A 98 GLN CA . 18282 1
834 . 1 1 97 97 GLN CB C 13 28.3783 0.173 . 1 . . . A 98 GLN CB . 18282 1
835 . 1 1 97 97 GLN CG C 13 33.4670 0.038 . 1 . . . A 98 GLN CG . 18282 1
836 . 1 1 97 97 GLN N N 15 117.7928 0.112 . 1 . . . A 98 GLN N . 18282 1
837 . 1 1 98 98 VAL H H 1 7.9008 0.024 . 1 . . . A 99 VAL H . 18282 1
838 . 1 1 98 98 VAL HA H 1 3.4401 0.011 . 1 . . . A 99 VAL HA . 18282 1
839 . 1 1 98 98 VAL HB H 1 2.1389 0.016 . 1 . . . A 99 VAL HB . 18282 1
840 . 1 1 98 98 VAL HG11 H 1 0.8256 0.01 . 2 . . . A 99 VAL HG11 . 18282 1
841 . 1 1 98 98 VAL HG12 H 1 0.8256 0.01 . 2 . . . A 99 VAL HG12 . 18282 1
842 . 1 1 98 98 VAL HG13 H 1 0.8256 0.01 . 2 . . . A 99 VAL HG13 . 18282 1
843 . 1 1 98 98 VAL HG21 H 1 0.8582 0.023 . 2 . . . A 99 VAL HG21 . 18282 1
844 . 1 1 98 98 VAL HG22 H 1 0.8582 0.023 . 2 . . . A 99 VAL HG22 . 18282 1
845 . 1 1 98 98 VAL HG23 H 1 0.8582 0.023 . 2 . . . A 99 VAL HG23 . 18282 1
846 . 1 1 98 98 VAL CA C 13 67.7757 0.063 . 1 . . . A 99 VAL CA . 18282 1
847 . 1 1 98 98 VAL CB C 13 31.5738 0.098 . 1 . . . A 99 VAL CB . 18282 1
848 . 1 1 98 98 VAL CG1 C 13 21.6638 0.038 . 2 . . . A 99 VAL CG1 . 18282 1
849 . 1 1 98 98 VAL CG2 C 13 21.8547 0.147 . 2 . . . A 99 VAL CG2 . 18282 1
850 . 1 1 98 98 VAL N N 15 121.2469 0.036 . 1 . . . A 99 VAL N . 18282 1
851 . 1 1 100 100 ALA HA H 1 4.2180 0.009 . 1 . . . A 101 ALA HA . 18282 1
852 . 1 1 100 100 ALA HB1 H 1 1.4084 0.011 . 1 . . . A 101 ALA HB1 . 18282 1
853 . 1 1 100 100 ALA HB2 H 1 1.4084 0.011 . 1 . . . A 101 ALA HB2 . 18282 1
854 . 1 1 100 100 ALA HB3 H 1 1.4084 0.011 . 1 . . . A 101 ALA HB3 . 18282 1
855 . 1 1 100 100 ALA C C 13 179.5986 0.5 . 1 . . . A 101 ALA C . 18282 1
856 . 1 1 100 100 ALA CA C 13 54.6851 0.08 . 1 . . . A 101 ALA CA . 18282 1
857 . 1 1 100 100 ALA CB C 13 17.5620 0.088 . 1 . . . A 101 ALA CB . 18282 1
858 . 1 1 101 101 ALA H H 1 7.5589 0.016 . 1 . . . A 102 ALA H . 18282 1
859 . 1 1 101 101 ALA HA H 1 4.0045 0.004 . 1 . . . A 102 ALA HA . 18282 1
860 . 1 1 101 101 ALA HB1 H 1 1.3065 0.018 . 1 . . . A 102 ALA HB1 . 18282 1
861 . 1 1 101 101 ALA HB2 H 1 1.3065 0.018 . 1 . . . A 102 ALA HB2 . 18282 1
862 . 1 1 101 101 ALA HB3 H 1 1.3065 0.018 . 1 . . . A 102 ALA HB3 . 18282 1
863 . 1 1 101 101 ALA C C 13 180.9699 0.5 . 1 . . . A 102 ALA C . 18282 1
864 . 1 1 101 101 ALA CA C 13 55.0133 0.075 . 1 . . . A 102 ALA CA . 18282 1
865 . 1 1 101 101 ALA CB C 13 17.4220 0.088 . 1 . . . A 102 ALA CB . 18282 1
866 . 1 1 101 101 ALA N N 15 119.5334 0.015 . 1 . . . A 102 ALA N . 18282 1
867 . 1 1 102 102 VAL H H 1 8.8506 0.007 . 1 . . . A 103 VAL H . 18282 1
868 . 1 1 102 102 VAL HA H 1 4.0866 0.017 . 1 . . . A 103 VAL HA . 18282 1
869 . 1 1 102 102 VAL HB H 1 2.0515 0.037 . 1 . . . A 103 VAL HB . 18282 1
870 . 1 1 102 102 VAL HG21 H 1 0.8242 0.018 . 2 . . . A 103 VAL HG21 . 18282 1
871 . 1 1 102 102 VAL HG22 H 1 0.8242 0.018 . 2 . . . A 103 VAL HG22 . 18282 1
872 . 1 1 102 102 VAL HG23 H 1 0.8242 0.018 . 2 . . . A 103 VAL HG23 . 18282 1
873 . 1 1 102 102 VAL C C 13 175.6657 0.5 . 1 . . . A 103 VAL C . 18282 1
874 . 1 1 102 102 VAL CA C 13 61.8498 0.075 . 1 . . . A 103 VAL CA . 18282 1
875 . 1 1 102 102 VAL CB C 13 32.5760 0.094 . 1 . . . A 103 VAL CB . 18282 1
876 . 1 1 102 102 VAL CG2 C 13 20.6504 0.096 . 2 . . . A 103 VAL CG2 . 18282 1
877 . 1 1 102 102 VAL N N 15 122.6692 0.025 . 1 . . . A 103 VAL N . 18282 1
878 . 1 1 103 103 ALA H H 1 8.3741 0.004 . 1 . . . A 104 ALA H . 18282 1
879 . 1 1 103 103 ALA HA H 1 4.2881 0.003 . 1 . . . A 104 ALA HA . 18282 1
880 . 1 1 103 103 ALA HB1 H 1 1.3801 0.04 . 1 . . . A 104 ALA HB1 . 18282 1
881 . 1 1 103 103 ALA HB2 H 1 1.3801 0.04 . 1 . . . A 104 ALA HB2 . 18282 1
882 . 1 1 103 103 ALA HB3 H 1 1.3801 0.04 . 1 . . . A 104 ALA HB3 . 18282 1
883 . 1 1 103 103 ALA C C 13 177.3439 0.5 . 1 . . . A 104 ALA C . 18282 1
884 . 1 1 103 103 ALA CA C 13 52.1941 0.076 . 1 . . . A 104 ALA CA . 18282 1
885 . 1 1 103 103 ALA CB C 13 19.0212 0.056 . 1 . . . A 104 ALA CB . 18282 1
886 . 1 1 103 103 ALA N N 15 128.0477 0.055 . 1 . . . A 104 ALA N . 18282 1
887 . 1 1 104 104 GLN H H 1 8.3743 0.003 . 1 . . . A 105 GLN H . 18282 1
888 . 1 1 104 104 GLN HA H 1 4.2811 0.05 . 1 . . . A 105 GLN HA . 18282 1
889 . 1 1 104 104 GLN HB3 H 1 1.8352 0.05 . 2 . . . A 105 GLN HB3 . 18282 1
890 . 1 1 104 104 GLN CA C 13 55.6556 0.5 . 1 . . . A 105 GLN CA . 18282 1
891 . 1 1 104 104 GLN CB C 13 32.5806 0.5 . 1 . . . A 105 GLN CB . 18282 1
892 . 1 1 104 104 GLN N N 15 120.2846 0.031 . 1 . . . A 105 GLN N . 18282 1
893 . 1 1 105 105 THR HA H 1 4.2932 0.047 . 1 . . . A 106 THR HA . 18282 1
894 . 1 1 105 105 THR HB H 1 4.2196 0.05 . 1 . . . A 106 THR HB . 18282 1
895 . 1 1 105 105 THR C C 13 174.3836 0.5 . 1 . . . A 106 THR C . 18282 1
896 . 1 1 105 105 THR CA C 13 61.6628 0.193 . 1 . . . A 106 THR CA . 18282 1
897 . 1 1 105 105 THR CB C 13 69.4583 0.05 . 1 . . . A 106 THR CB . 18282 1
898 . 1 1 106 106 GLU H H 1 8.4148 0.003 . 1 . . . A 107 GLU H . 18282 1
899 . 1 1 106 106 GLU HA H 1 4.2410 0.002 . 1 . . . A 107 GLU HA . 18282 1
900 . 1 1 106 106 GLU HB3 H 1 1.9208 0.023 . 2 . . . A 107 GLU HB3 . 18282 1
901 . 1 1 106 106 GLU C C 13 176.3310 0.5 . 1 . . . A 107 GLU C . 18282 1
902 . 1 1 106 106 GLU CA C 13 56.6210 0.052 . 1 . . . A 107 GLU CA . 18282 1
903 . 1 1 106 106 GLU CB C 13 30.0044 0.059 . 1 . . . A 107 GLU CB . 18282 1
904 . 1 1 106 106 GLU CG C 13 36.0098 0.5 . 1 . . . A 107 GLU CG . 18282 1
905 . 1 1 106 106 GLU N N 15 122.7442 0.024 . 1 . . . A 107 GLU N . 18282 1
906 . 1 1 107 107 GLU H H 1 8.3340 0.01 . 1 . . . A 108 GLU H . 18282 1
907 . 1 1 107 107 GLU HA H 1 4.1840 0.006 . 1 . . . A 108 GLU HA . 18282 1
908 . 1 1 107 107 GLU HB3 H 1 1.8649 0.035 . 2 . . . A 108 GLU HB3 . 18282 1
909 . 1 1 107 107 GLU HG3 H 1 2.1664 0.007 . 2 . . . A 108 GLU HG3 . 18282 1
910 . 1 1 107 107 GLU C C 13 176.4039 0.5 . 1 . . . A 108 GLU C . 18282 1
911 . 1 1 107 107 GLU CA C 13 56.7214 0.082 . 1 . . . A 108 GLU CA . 18282 1
912 . 1 1 107 107 GLU CB C 13 29.7697 0.235 . 1 . . . A 108 GLU CB . 18282 1
913 . 1 1 107 107 GLU CG C 13 35.9186 0.067 . 1 . . . A 108 GLU CG . 18282 1
914 . 1 1 107 107 GLU N N 15 121.9935 0.035 . 1 . . . A 108 GLU N . 18282 1
915 . 1 1 108 108 ILE H H 1 8.0683 0.027 . 1 . . . A 109 ILE H . 18282 1
916 . 1 1 108 108 ILE HA H 1 4.0517 0.006 . 1 . . . A 109 ILE HA . 18282 1
917 . 1 1 108 108 ILE HB H 1 1.8096 0.005 . 1 . . . A 109 ILE HB . 18282 1
918 . 1 1 108 108 ILE HG12 H 1 1.1411 0.021 . 2 . . . A 109 ILE HG12 . 18282 1
919 . 1 1 108 108 ILE HG13 H 1 1.4345 0.002 . 2 . . . A 109 ILE HG13 . 18282 1
920 . 1 1 108 108 ILE HG21 H 1 0.8484 0.012 . 1 . . . A 109 ILE HG21 . 18282 1
921 . 1 1 108 108 ILE HG22 H 1 0.8484 0.012 . 1 . . . A 109 ILE HG22 . 18282 1
922 . 1 1 108 108 ILE HG23 H 1 0.8484 0.012 . 1 . . . A 109 ILE HG23 . 18282 1
923 . 1 1 108 108 ILE HD11 H 1 0.8045 0.006 . 1 . . . A 109 ILE HD11 . 18282 1
924 . 1 1 108 108 ILE HD12 H 1 0.8045 0.006 . 1 . . . A 109 ILE HD12 . 18282 1
925 . 1 1 108 108 ILE HD13 H 1 0.8045 0.006 . 1 . . . A 109 ILE HD13 . 18282 1
926 . 1 1 108 108 ILE C C 13 176.2614 0.5 . 1 . . . A 109 ILE C . 18282 1
927 . 1 1 108 108 ILE CA C 13 61.2452 0.151 . 1 . . . A 109 ILE CA . 18282 1
928 . 1 1 108 108 ILE CB C 13 38.1572 0.078 . 1 . . . A 109 ILE CB . 18282 1
929 . 1 1 108 108 ILE CG1 C 13 27.1299 0.067 . 1 . . . A 109 ILE CG1 . 18282 1
930 . 1 1 108 108 ILE CG2 C 13 17.2810 0.114 . 1 . . . A 109 ILE CG2 . 18282 1
931 . 1 1 108 108 ILE CD1 C 13 12.4997 0.046 . 1 . . . A 109 ILE CD1 . 18282 1
932 . 1 1 108 108 ILE N N 15 122.2043 0.02 . 1 . . . A 109 ILE N . 18282 1
933 . 1 1 109 109 LEU H H 1 8.1874 0.013 . 1 . . . A 110 LEU H . 18282 1
934 . 1 1 109 109 LEU HA H 1 4.2953 0.01 . 1 . . . A 110 LEU HA . 18282 1
935 . 1 1 109 109 LEU HB3 H 1 1.5833 0.02 . 2 . . . A 110 LEU HB3 . 18282 1
936 . 1 1 109 109 LEU HG H 1 1.5156 0.051 . 1 . . . A 110 LEU HG . 18282 1
937 . 1 1 109 109 LEU C C 13 177.2753 0.5 . 1 . . . A 110 LEU C . 18282 1
938 . 1 1 109 109 LEU CA C 13 55.1034 0.114 . 1 . . . A 110 LEU CA . 18282 1
939 . 1 1 109 109 LEU CB C 13 41.9293 0.167 . 1 . . . A 110 LEU CB . 18282 1
940 . 1 1 109 109 LEU CG C 13 26.8036 0.113 . 1 . . . A 110 LEU CG . 18282 1
941 . 1 1 109 109 LEU CD2 C 13 23.8371 0.112 . 2 . . . A 110 LEU CD2 . 18282 1
942 . 1 1 109 109 LEU N N 15 125.6077 0.024 . 1 . . . A 110 LEU N . 18282 1
943 . 1 1 110 110 LYS H H 1 8.2056 0.007 . 1 . . . A 111 LYS H . 18282 1
944 . 1 1 110 110 LYS HA H 1 4.2781 0.005 . 1 . . . A 111 LYS HA . 18282 1
945 . 1 1 110 110 LYS HB3 H 1 1.7935 0.016 . 2 . . . A 111 LYS HB3 . 18282 1
946 . 1 1 110 110 LYS HG3 H 1 1.3806 0.028 . 2 . . . A 111 LYS HG3 . 18282 1
947 . 1 1 110 110 LYS HD3 H 1 1.6371 0.01 . 2 . . . A 111 LYS HD3 . 18282 1
948 . 1 1 110 110 LYS C C 13 176.6056 0.5 . 1 . . . A 111 LYS C . 18282 1
949 . 1 1 110 110 LYS CA C 13 56.1246 0.114 . 1 . . . A 111 LYS CA . 18282 1
950 . 1 1 110 110 LYS CB C 13 32.4229 0.167 . 1 . . . A 111 LYS CB . 18282 1
951 . 1 1 110 110 LYS CG C 13 24.5683 0.065 . 1 . . . A 111 LYS CG . 18282 1
952 . 1 1 110 110 LYS CD C 13 28.9473 0.145 . 1 . . . A 111 LYS CD . 18282 1
953 . 1 1 110 110 LYS CE C 13 41.9298 0.026 . 1 . . . A 111 LYS CE . 18282 1
954 . 1 1 110 110 LYS N N 15 122.1537 0.059 . 1 . . . A 111 LYS N . 18282 1
955 . 1 1 111 111 SER H H 1 8.2173 0.013 . 1 . . . A 112 SER H . 18282 1
956 . 1 1 111 111 SER HA H 1 4.3949 0.002 . 1 . . . A 112 SER HA . 18282 1
957 . 1 1 111 111 SER HB2 H 1 3.8396 0.05 . 2 . . . A 112 SER HB2 . 18282 1
958 . 1 1 111 111 SER HB3 H 1 3.8394 0.05 . 2 . . . A 112 SER HB3 . 18282 1
959 . 1 1 111 111 SER C C 13 175.1680 0.5 . 1 . . . A 112 SER C . 18282 1
960 . 1 1 111 111 SER CA C 13 58.4555 0.177 . 1 . . . A 112 SER CA . 18282 1
961 . 1 1 111 111 SER CB C 13 63.4946 0.035 . 1 . . . A 112 SER CB . 18282 1
962 . 1 1 111 111 SER N N 15 116.3809 0.278 . 1 . . . A 112 SER N . 18282 1
963 . 1 1 112 112 ASN H H 1 7.9495 0.006 . 1 . . . A 113 ASN H . 18282 1
964 . 1 1 112 112 ASN HA H 1 4.6988 0.016 . 1 . . . A 113 ASN HA . 18282 1
965 . 1 1 112 112 ASN HB3 H 1 2.7581 0.024 . 2 . . . A 113 ASN HB3 . 18282 1
966 . 1 1 112 112 ASN C C 13 175.5518 0.5 . 1 . . . A 113 ASN C . 18282 1
967 . 1 1 112 112 ASN CA C 13 53.5920 0.219 . 1 . . . A 113 ASN CA . 18282 1
968 . 1 1 112 112 ASN CB C 13 38.7723 0.111 . 1 . . . A 113 ASN CB . 18282 1
969 . 1 1 112 112 ASN N N 15 119.7985 0.034 . 1 . . . A 113 ASN N . 18282 1
970 . 1 1 113 113 SER H H 1 7.9701 0.007 . 1 . . . A 114 SER H . 18282 1
971 . 1 1 113 113 SER HA H 1 4.3822 0.05 . 1 . . . A 114 SER HA . 18282 1
972 . 1 1 113 113 SER HB3 H 1 3.8617 0.022 . 2 . . . A 114 SER HB3 . 18282 1
973 . 1 1 113 113 SER C C 13 174.5583 0.5 . 1 . . . A 114 SER C . 18282 1
974 . 1 1 113 113 SER CA C 13 58.9187 0.013 . 1 . . . A 114 SER CA . 18282 1
975 . 1 1 113 113 SER CB C 13 63.4943 0.05 . 1 . . . A 114 SER CB . 18282 1
976 . 1 1 113 113 SER N N 15 115.4299 0.016 . 1 . . . A 114 SER N . 18282 1
977 . 1 1 114 114 GLN H H 1 8.3820 0.002 . 1 . . . A 115 GLN H . 18282 1
978 . 1 1 114 114 GLN HA H 1 4.3474 0.05 . 1 . . . A 115 GLN HA . 18282 1
979 . 1 1 114 114 GLN HB3 H 1 2.0877 0.026 . 2 . . . A 115 GLN HB3 . 18282 1
980 . 1 1 114 114 GLN C C 13 176.2463 0.5 . 1 . . . A 115 GLN C . 18282 1
981 . 1 1 114 114 GLN CA C 13 56.0356 0.036 . 1 . . . A 115 GLN CA . 18282 1
982 . 1 1 114 114 GLN CB C 13 29.1958 0.5 . 1 . . . A 115 GLN CB . 18282 1
983 . 1 1 114 114 GLN N N 15 121.9728 0.04 . 1 . . . A 115 GLN N . 18282 1
984 . 1 1 115 115 THR H H 1 8.0699 0.005 . 1 . . . A 116 THR H . 18282 1
985 . 1 1 115 115 THR HA H 1 4.2376 0.013 . 1 . . . A 116 THR HA . 18282 1
986 . 1 1 115 115 THR HB H 1 4.1647 0.01 . 1 . . . A 116 THR HB . 18282 1
987 . 1 1 115 115 THR C C 13 174.2763 0.5 . 1 . . . A 116 THR C . 18282 1
988 . 1 1 115 115 THR CA C 13 62.2212 0.088 . 1 . . . A 116 THR CA . 18282 1
989 . 1 1 115 115 THR CB C 13 69.4054 0.014 . 1 . . . A 116 THR CB . 18282 1
990 . 1 1 115 115 THR N N 15 114.7008 0.054 . 1 . . . A 116 THR N . 18282 1
991 . 1 1 116 116 ASP H H 1 8.2880 0.007 . 1 . . . A 117 ASP H . 18282 1
992 . 1 1 116 116 ASP HA H 1 4.5751 0.004 . 1 . . . A 117 ASP HA . 18282 1
993 . 1 1 116 116 ASP HB3 H 1 2.6909 0.015 . 2 . . . A 117 ASP HB3 . 18282 1
994 . 1 1 116 116 ASP C C 13 176.2406 0.5 . 1 . . . A 117 ASP C . 18282 1
995 . 1 1 116 116 ASP CA C 13 54.2864 0.109 . 1 . . . A 117 ASP CA . 18282 1
996 . 1 1 116 116 ASP CB C 13 40.6090 0.028 . 1 . . . A 117 ASP CB . 18282 1
997 . 1 1 116 116 ASP N N 15 122.5657 0.014 . 1 . . . A 117 ASP N . 18282 1
998 . 1 1 117 117 LEU H H 1 8.0877 0.004 . 1 . . . A 118 LEU H . 18282 1
999 . 1 1 117 117 LEU HA H 1 4.1632 0.015 . 1 . . . A 118 LEU HA . 18282 1
1000 . 1 1 117 117 LEU HB3 H 1 1.5370 0.021 . 2 . . . A 118 LEU HB3 . 18282 1
1001 . 1 1 117 117 LEU HG H 1 0.8355 0.22 . 1 . . . A 118 LEU HG . 18282 1
1002 . 1 1 117 117 LEU HD21 H 1 0.7556 0.04 . 2 . . . A 118 LEU HD21 . 18282 1
1003 . 1 1 117 117 LEU HD22 H 1 0.7556 0.04 . 2 . . . A 118 LEU HD21 . 18282 1
1004 . 1 1 117 117 LEU HD23 H 1 0.7556 0.04 . 2 . . . A 118 LEU HD21 . 18282 1
1005 . 1 1 117 117 LEU C C 13 177.6367 0.5 . 1 . . . A 118 LEU C . 18282 1
1006 . 1 1 117 117 LEU CA C 13 55.4751 0.112 . 1 . . . A 118 LEU CA . 18282 1
1007 . 1 1 117 117 LEU CB C 13 41.9639 0.185 . 1 . . . A 118 LEU CB . 18282 1
1008 . 1 1 117 117 LEU CG C 13 24.7501 0.066 . 1 . . . A 118 LEU CG . 18282 1
1009 . 1 1 117 117 LEU CD2 C 13 23.0796 0.1 . 2 . . . A 118 LEU CD2 . 18282 1
1010 . 1 1 117 117 LEU N N 15 122.1176 0.029 . 1 . . . A 118 LEU N . 18282 1
1011 . 1 1 118 118 GLU H H 1 8.1344 0.005 . 1 . . . A 119 GLU H . 18282 1
1012 . 1 1 118 118 GLU HA H 1 4.0860 0.018 . 1 . . . A 119 GLU HA . 18282 1
1013 . 1 1 118 118 GLU C C 13 176.2648 0.5 . 1 . . . A 119 GLU C . 18282 1
1014 . 1 1 118 118 GLU CA C 13 56.5694 0.073 . 1 . . . A 119 GLU CA . 18282 1
1015 . 1 1 118 118 GLU CB C 13 29.4858 0.105 . 1 . . . A 119 GLU CB . 18282 1
1016 . 1 1 118 118 GLU CG C 13 35.8965 0.5 . 1 . . . A 119 GLU CG . 18282 1
1017 . 1 1 118 118 GLU N N 15 119.5271 0.051 . 1 . . . A 119 GLU N . 18282 1
1018 . 1 1 119 119 HIS H H 1 8.1341 0.003 . 1 . . . A 120 HIS H . 18282 1
1019 . 1 1 119 119 HIS HA H 1 4.4847 0.05 . 1 . . . A 120 HIS HA . 18282 1
1020 . 1 1 119 119 HIS HB3 H 1 3.0570 0.05 . 2 . . . A 120 HIS HB3 . 18282 1
1021 . 1 1 119 119 HIS CA C 13 55.4216 0.011 . 1 . . . A 120 HIS CA . 18282 1
1022 . 1 1 119 119 HIS CB C 13 28.6284 0.011 . 1 . . . A 120 HIS CB . 18282 1
1023 . 1 1 119 119 HIS N N 15 118.0762 0.067 . 1 . . . A 120 HIS N . 18282 1
1024 . 1 1 120 120 HIS H H 1 8.3719 0.002 . 1 . . . A 121 HIS H . 18282 1
1025 . 1 1 120 120 HIS HA H 1 4.2418 0.017 . 1 . . . A 121 HIS HA . 18282 1
1026 . 1 1 120 120 HIS CA C 13 56.7316 0.5 . 1 . . . A 121 HIS CA . 18282 1
1027 . 1 1 120 120 HIS N N 15 119.3233 0.036 . 1 . . . A 121 HIS N . 18282 1
1028 . 1 1 121 121 HIS H H 1 7.9002 0.006 . 1 . . . A 122 HIS H . 18282 1
1029 . 1 1 121 121 HIS CA C 13 57.0363 0.5 . 1 . . . A 122 HIS CA . 18282 1
1030 . 1 1 121 121 HIS CB C 13 29.9233 0.5 . 1 . . . A 122 HIS CB . 18282 1
1031 . 1 1 121 121 HIS N N 15 126.0319 0.063 . 1 . . . A 122 HIS N . 18282 1
1032 . 1 1 122 122 HIS H H 1 8.5948 0.003 . 1 . . . A 123 HIS H . 18282 1
1033 . 1 1 122 122 HIS HA H 1 4.5949 0.008 . 1 . . . A 123 HIS HA . 18282 1
1034 . 1 1 122 122 HIS HB3 H 1 3.0969 0.024 . 2 . . . A 123 HIS HB3 . 18282 1
1035 . 1 1 122 122 HIS CA C 13 55.3716 0.026 . 1 . . . A 123 HIS CA . 18282 1
1036 . 1 1 122 122 HIS CB C 13 29.1654 0.111 . 1 . . . A 123 HIS CB . 18282 1
1037 . 1 1 122 122 HIS N N 15 121.0117 0.05 . 1 . . . A 123 HIS N . 18282 1
1038 . 1 1 123 123 HIS H H 1 8.5578 0.004 . 1 . . . A 124 HIS H . 18282 1
1039 . 1 1 123 123 HIS CA C 13 57.3805 0.052 . 1 . . . A 124 HIS CA . 18282 1
1040 . 1 1 123 123 HIS CB C 13 35.4906 0.07 . 1 . . . A 124 HIS CB . 18282 1
1041 . 1 1 123 123 HIS N N 15 120.3427 0.051 . 1 . . . A 124 HIS N . 18282 1
1042 . 1 1 124 124 HIS H H 1 8.0692 0.004 . 1 . . . A 125 HIS H . 18282 1
1043 . 1 1 124 124 HIS HA H 1 4.4050 0.004 . 1 . . . A 125 HIS HA . 18282 1
1044 . 1 1 124 124 HIS HB3 H 1 3.0485 0.05 . 2 . . . A 125 HIS HB3 . 18282 1
1045 . 1 1 124 124 HIS CA C 13 56.8796 0.5 . 1 . . . A 125 HIS CA . 18282 1
1046 . 1 1 124 124 HIS CB C 13 29.5355 0.157 . 1 . . . A 125 HIS CB . 18282 1
1047 . 1 1 124 124 HIS N N 15 120.0947 0.009 . 1 . . . A 125 HIS N . 18282 1
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