###################################
# 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_chemical_shift_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_1
_Assigned_chem_shift_list.Entry_ID 10241
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $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 13C-separated NOESY' 1 $sample_1 isotropic 10241 1
2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10241 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 6 6 SER HA H 1 4.486 0.030 . 1 . . . . 6 SER HA . 10241 1
2 . 1 1 6 6 SER HB2 H 1 3.888 0.030 . 2 . . . . 6 SER HB2 . 10241 1
3 . 1 1 6 6 SER CA C 13 58.492 0.300 . 1 . . . . 6 SER CA . 10241 1
4 . 1 1 6 6 SER CB C 13 64.343 0.300 . 1 . . . . 6 SER CB . 10241 1
5 . 1 1 7 7 GLY H H 1 8.044 0.030 . 1 . . . . 7 GLY H . 10241 1
6 . 1 1 7 7 GLY HA2 H 1 4.458 0.030 . 2 . . . . 7 GLY HA2 . 10241 1
7 . 1 1 7 7 GLY HA3 H 1 3.780 0.030 . 2 . . . . 7 GLY HA3 . 10241 1
8 . 1 1 7 7 GLY C C 13 174.131 0.300 . 1 . . . . 7 GLY C . 10241 1
9 . 1 1 7 7 GLY CA C 13 45.458 0.300 . 1 . . . . 7 GLY CA . 10241 1
10 . 1 1 7 7 GLY N N 15 116.867 0.300 . 1 . . . . 7 GLY N . 10241 1
11 . 1 1 8 8 TRP H H 1 8.111 0.030 . 1 . . . . 8 TRP H . 10241 1
12 . 1 1 8 8 TRP HA H 1 4.626 0.030 . 1 . . . . 8 TRP HA . 10241 1
13 . 1 1 8 8 TRP HB2 H 1 3.257 0.030 . 1 . . . . 8 TRP HB2 . 10241 1
14 . 1 1 8 8 TRP HB3 H 1 3.257 0.030 . 1 . . . . 8 TRP HB3 . 10241 1
15 . 1 1 8 8 TRP HD1 H 1 7.250 0.030 . 1 . . . . 8 TRP HD1 . 10241 1
16 . 1 1 8 8 TRP HE1 H 1 10.159 0.030 . 1 . . . . 8 TRP HE1 . 10241 1
17 . 1 1 8 8 TRP HE3 H 1 7.564 0.030 . 1 . . . . 8 TRP HE3 . 10241 1
18 . 1 1 8 8 TRP HH2 H 1 7.180 0.030 . 1 . . . . 8 TRP HH2 . 10241 1
19 . 1 1 8 8 TRP HZ2 H 1 7.447 0.030 . 1 . . . . 8 TRP HZ2 . 10241 1
20 . 1 1 8 8 TRP HZ3 H 1 7.101 0.030 . 1 . . . . 8 TRP HZ3 . 10241 1
21 . 1 1 8 8 TRP C C 13 176.673 0.300 . 1 . . . . 8 TRP C . 10241 1
22 . 1 1 8 8 TRP CA C 13 57.729 0.300 . 1 . . . . 8 TRP CA . 10241 1
23 . 1 1 8 8 TRP CB C 13 29.413 0.300 . 1 . . . . 8 TRP CB . 10241 1
24 . 1 1 8 8 TRP CD1 C 13 127.339 0.300 . 1 . . . . 8 TRP CD1 . 10241 1
25 . 1 1 8 8 TRP CE3 C 13 120.986 0.300 . 1 . . . . 8 TRP CE3 . 10241 1
26 . 1 1 8 8 TRP CH2 C 13 124.739 0.300 . 1 . . . . 8 TRP CH2 . 10241 1
27 . 1 1 8 8 TRP CZ2 C 13 114.632 0.300 . 1 . . . . 8 TRP CZ2 . 10241 1
28 . 1 1 8 8 TRP CZ3 C 13 122.143 0.300 . 1 . . . . 8 TRP CZ3 . 10241 1
29 . 1 1 8 8 TRP N N 15 121.258 0.300 . 1 . . . . 8 TRP N . 10241 1
30 . 1 1 8 8 TRP NE1 N 15 129.645 0.300 . 1 . . . . 8 TRP NE1 . 10241 1
31 . 1 1 9 9 GLN H H 1 8.229 0.030 . 1 . . . . 9 GLN H . 10241 1
32 . 1 1 9 9 GLN HA H 1 4.133 0.030 . 1 . . . . 9 GLN HA . 10241 1
33 . 1 1 9 9 GLN HB2 H 1 1.987 0.030 . 2 . . . . 9 GLN HB2 . 10241 1
34 . 1 1 9 9 GLN HB3 H 1 1.773 0.030 . 2 . . . . 9 GLN HB3 . 10241 1
35 . 1 1 9 9 GLN HE21 H 1 7.334 0.030 . 2 . . . . 9 GLN HE21 . 10241 1
36 . 1 1 9 9 GLN HE22 H 1 6.792 0.030 . 2 . . . . 9 GLN HE22 . 10241 1
37 . 1 1 9 9 GLN HG2 H 1 2.141 0.030 . 2 . . . . 9 GLN HG2 . 10241 1
38 . 1 1 9 9 GLN HG3 H 1 2.058 0.030 . 2 . . . . 9 GLN HG3 . 10241 1
39 . 1 1 9 9 GLN C C 13 176.147 0.300 . 1 . . . . 9 GLN C . 10241 1
40 . 1 1 9 9 GLN CA C 13 56.283 0.300 . 1 . . . . 9 GLN CA . 10241 1
41 . 1 1 9 9 GLN CB C 13 29.125 0.300 . 1 . . . . 9 GLN CB . 10241 1
42 . 1 1 9 9 GLN CG C 13 33.523 0.300 . 1 . . . . 9 GLN CG . 10241 1
43 . 1 1 9 9 GLN N N 15 122.756 0.300 . 1 . . . . 9 GLN N . 10241 1
44 . 1 1 9 9 GLN NE2 N 15 112.298 0.300 . 1 . . . . 9 GLN NE2 . 10241 1
45 . 1 1 10 10 GLY H H 1 7.500 0.030 . 1 . . . . 10 GLY H . 10241 1
46 . 1 1 10 10 GLY HA2 H 1 3.744 0.030 . 2 . . . . 10 GLY HA2 . 10241 1
47 . 1 1 10 10 GLY HA3 H 1 3.714 0.030 . 2 . . . . 10 GLY HA3 . 10241 1
48 . 1 1 10 10 GLY C C 13 174.092 0.300 . 1 . . . . 10 GLY C . 10241 1
49 . 1 1 10 10 GLY CA C 13 45.335 0.300 . 1 . . . . 10 GLY CA . 10241 1
50 . 1 1 10 10 GLY N N 15 108.221 0.300 . 1 . . . . 10 GLY N . 10241 1
51 . 1 1 11 11 LEU H H 1 8.029 0.030 . 1 . . . . 11 LEU H . 10241 1
52 . 1 1 11 11 LEU HA H 1 4.368 0.030 . 1 . . . . 11 LEU HA . 10241 1
53 . 1 1 11 11 LEU HB2 H 1 1.692 0.030 . 2 . . . . 11 LEU HB2 . 10241 1
54 . 1 1 11 11 LEU HB3 H 1 1.633 0.030 . 2 . . . . 11 LEU HB3 . 10241 1
55 . 1 1 11 11 LEU HD11 H 1 0.935 0.030 . 1 . . . . 11 LEU HD1 . 10241 1
56 . 1 1 11 11 LEU HD12 H 1 0.935 0.030 . 1 . . . . 11 LEU HD1 . 10241 1
57 . 1 1 11 11 LEU HD13 H 1 0.935 0.030 . 1 . . . . 11 LEU HD1 . 10241 1
58 . 1 1 11 11 LEU HD21 H 1 0.884 0.030 . 1 . . . . 11 LEU HD2 . 10241 1
59 . 1 1 11 11 LEU HD22 H 1 0.884 0.030 . 1 . . . . 11 LEU HD2 . 10241 1
60 . 1 1 11 11 LEU HD23 H 1 0.884 0.030 . 1 . . . . 11 LEU HD2 . 10241 1
61 . 1 1 11 11 LEU HG H 1 1.639 0.030 . 1 . . . . 11 LEU HG . 10241 1
62 . 1 1 11 11 LEU C C 13 177.808 0.300 . 1 . . . . 11 LEU C . 10241 1
63 . 1 1 11 11 LEU CA C 13 55.348 0.300 . 1 . . . . 11 LEU CA . 10241 1
64 . 1 1 11 11 LEU CB C 13 42.515 0.300 . 1 . . . . 11 LEU CB . 10241 1
65 . 1 1 11 11 LEU CD1 C 13 25.142 0.300 . 2 . . . . 11 LEU CD1 . 10241 1
66 . 1 1 11 11 LEU CD2 C 13 23.517 0.300 . 2 . . . . 11 LEU CD2 . 10241 1
67 . 1 1 11 11 LEU CG C 13 27.152 0.300 . 1 . . . . 11 LEU CG . 10241 1
68 . 1 1 11 11 LEU N N 15 121.136 0.300 . 1 . . . . 11 LEU N . 10241 1
69 . 1 1 12 12 SER H H 1 8.388 0.030 . 1 . . . . 12 SER H . 10241 1
70 . 1 1 12 12 SER HA H 1 4.370 0.030 . 1 . . . . 12 SER HA . 10241 1
71 . 1 1 12 12 SER HB2 H 1 3.893 0.030 . 1 . . . . 12 SER HB2 . 10241 1
72 . 1 1 12 12 SER HB3 H 1 3.893 0.030 . 1 . . . . 12 SER HB3 . 10241 1
73 . 1 1 12 12 SER CA C 13 58.716 0.300 . 1 . . . . 12 SER CA . 10241 1
74 . 1 1 12 12 SER CB C 13 63.835 0.300 . 1 . . . . 12 SER CB . 10241 1
75 . 1 1 12 12 SER N N 15 116.252 0.300 . 1 . . . . 12 SER N . 10241 1
76 . 1 1 13 13 SER HA H 1 4.481 0.030 . 1 . . . . 13 SER HA . 10241 1
77 . 1 1 13 13 SER HB2 H 1 3.925 0.030 . 1 . . . . 13 SER HB2 . 10241 1
78 . 1 1 13 13 SER HB3 H 1 3.925 0.030 . 1 . . . . 13 SER HB3 . 10241 1
79 . 1 1 13 13 SER C C 13 175.161 0.300 . 1 . . . . 13 SER C . 10241 1
80 . 1 1 13 13 SER CA C 13 58.442 0.300 . 1 . . . . 13 SER CA . 10241 1
81 . 1 1 13 13 SER CB C 13 63.798 0.300 . 1 . . . . 13 SER CB . 10241 1
82 . 1 1 14 14 LYS H H 1 8.372 0.030 . 1 . . . . 14 LYS H . 10241 1
83 . 1 1 14 14 LYS HA H 1 4.226 0.030 . 1 . . . . 14 LYS HA . 10241 1
84 . 1 1 14 14 LYS HB2 H 1 1.866 0.030 . 2 . . . . 14 LYS HB2 . 10241 1
85 . 1 1 14 14 LYS HB3 H 1 1.728 0.030 . 2 . . . . 14 LYS HB3 . 10241 1
86 . 1 1 14 14 LYS HD2 H 1 1.619 0.030 . 1 . . . . 14 LYS HD2 . 10241 1
87 . 1 1 14 14 LYS HD3 H 1 1.619 0.030 . 1 . . . . 14 LYS HD3 . 10241 1
88 . 1 1 14 14 LYS HE2 H 1 2.894 0.030 . 1 . . . . 14 LYS HE2 . 10241 1
89 . 1 1 14 14 LYS HE3 H 1 2.894 0.030 . 1 . . . . 14 LYS HE3 . 10241 1
90 . 1 1 14 14 LYS HG2 H 1 1.425 0.030 . 2 . . . . 14 LYS HG2 . 10241 1
91 . 1 1 14 14 LYS HG3 H 1 1.342 0.030 . 2 . . . . 14 LYS HG3 . 10241 1
92 . 1 1 14 14 LYS C C 13 177.249 0.300 . 1 . . . . 14 LYS C . 10241 1
93 . 1 1 14 14 LYS CA C 13 57.303 0.300 . 1 . . . . 14 LYS CA . 10241 1
94 . 1 1 14 14 LYS CB C 13 32.694 0.300 . 1 . . . . 14 LYS CB . 10241 1
95 . 1 1 14 14 LYS CD C 13 29.187 0.300 . 1 . . . . 14 LYS CD . 10241 1
96 . 1 1 14 14 LYS CE C 13 42.090 0.300 . 1 . . . . 14 LYS CE . 10241 1
97 . 1 1 14 14 LYS CG C 13 25.159 0.300 . 1 . . . . 14 LYS CG . 10241 1
98 . 1 1 14 14 LYS N N 15 123.245 0.300 . 1 . . . . 14 LYS N . 10241 1
99 . 1 1 15 15 GLY H H 1 8.213 0.030 . 1 . . . . 15 GLY H . 10241 1
100 . 1 1 15 15 GLY HA2 H 1 3.924 0.030 . 1 . . . . 15 GLY HA2 . 10241 1
101 . 1 1 15 15 GLY HA3 H 1 3.924 0.030 . 1 . . . . 15 GLY HA3 . 10241 1
102 . 1 1 15 15 GLY C C 13 173.863 0.300 . 1 . . . . 15 GLY C . 10241 1
103 . 1 1 15 15 GLY CA C 13 45.599 0.300 . 1 . . . . 15 GLY CA . 10241 1
104 . 1 1 15 15 GLY N N 15 107.368 0.300 . 1 . . . . 15 GLY N . 10241 1
105 . 1 1 16 16 ASP H H 1 8.091 0.030 . 1 . . . . 16 ASP H . 10241 1
106 . 1 1 16 16 ASP HA H 1 4.711 0.030 . 1 . . . . 16 ASP HA . 10241 1
107 . 1 1 16 16 ASP HB2 H 1 2.780 0.030 . 2 . . . . 16 ASP HB2 . 10241 1
108 . 1 1 16 16 ASP HB3 H 1 2.605 0.030 . 2 . . . . 16 ASP HB3 . 10241 1
109 . 1 1 16 16 ASP C C 13 176.074 0.300 . 1 . . . . 16 ASP C . 10241 1
110 . 1 1 16 16 ASP CA C 13 54.167 0.300 . 1 . . . . 16 ASP CA . 10241 1
111 . 1 1 16 16 ASP CB C 13 41.155 0.300 . 1 . . . . 16 ASP CB . 10241 1
112 . 1 1 16 16 ASP N N 15 119.368 0.300 . 1 . . . . 16 ASP N . 10241 1
113 . 1 1 17 17 LEU H H 1 7.757 0.030 . 1 . . . . 17 LEU H . 10241 1
114 . 1 1 17 17 LEU HA H 1 4.641 0.030 . 1 . . . . 17 LEU HA . 10241 1
115 . 1 1 17 17 LEU HB2 H 1 1.704 0.030 . 1 . . . . 17 LEU HB2 . 10241 1
116 . 1 1 17 17 LEU HB3 H 1 1.704 0.030 . 1 . . . . 17 LEU HB3 . 10241 1
117 . 1 1 17 17 LEU HD11 H 1 0.949 0.030 . 1 . . . . 17 LEU HD1 . 10241 1
118 . 1 1 17 17 LEU HD12 H 1 0.949 0.030 . 1 . . . . 17 LEU HD1 . 10241 1
119 . 1 1 17 17 LEU HD13 H 1 0.949 0.030 . 1 . . . . 17 LEU HD1 . 10241 1
120 . 1 1 17 17 LEU HD21 H 1 1.031 0.030 . 1 . . . . 17 LEU HD2 . 10241 1
121 . 1 1 17 17 LEU HD22 H 1 1.031 0.030 . 1 . . . . 17 LEU HD2 . 10241 1
122 . 1 1 17 17 LEU HD23 H 1 1.031 0.030 . 1 . . . . 17 LEU HD2 . 10241 1
123 . 1 1 17 17 LEU HG H 1 1.760 0.030 . 1 . . . . 17 LEU HG . 10241 1
124 . 1 1 17 17 LEU C C 13 174.627 0.300 . 1 . . . . 17 LEU C . 10241 1
125 . 1 1 17 17 LEU CA C 13 53.286 0.300 . 1 . . . . 17 LEU CA . 10241 1
126 . 1 1 17 17 LEU CB C 13 41.003 0.300 . 1 . . . . 17 LEU CB . 10241 1
127 . 1 1 17 17 LEU CD1 C 13 26.227 0.300 . 2 . . . . 17 LEU CD1 . 10241 1
128 . 1 1 17 17 LEU CD2 C 13 22.708 0.300 . 2 . . . . 17 LEU CD2 . 10241 1
129 . 1 1 17 17 LEU CG C 13 27.217 0.300 . 1 . . . . 17 LEU CG . 10241 1
130 . 1 1 17 17 LEU N N 15 122.770 0.300 . 1 . . . . 17 LEU N . 10241 1
131 . 1 1 18 18 PRO HA H 1 4.619 0.030 . 1 . . . . 18 PRO HA . 10241 1
132 . 1 1 18 18 PRO HB2 H 1 2.557 0.030 . 2 . . . . 18 PRO HB2 . 10241 1
133 . 1 1 18 18 PRO HB3 H 1 1.970 0.030 . 2 . . . . 18 PRO HB3 . 10241 1
134 . 1 1 18 18 PRO HD2 H 1 3.978 0.030 . 2 . . . . 18 PRO HD2 . 10241 1
135 . 1 1 18 18 PRO HD3 H 1 3.921 0.030 . 2 . . . . 18 PRO HD3 . 10241 1
136 . 1 1 18 18 PRO HG2 H 1 2.200 0.030 . 2 . . . . 18 PRO HG2 . 10241 1
137 . 1 1 18 18 PRO HG3 H 1 2.107 0.030 . 2 . . . . 18 PRO HG3 . 10241 1
138 . 1 1 18 18 PRO C C 13 175.014 0.300 . 1 . . . . 18 PRO C . 10241 1
139 . 1 1 18 18 PRO CA C 13 62.756 0.300 . 1 . . . . 18 PRO CA . 10241 1
140 . 1 1 18 18 PRO CB C 13 32.631 0.300 . 1 . . . . 18 PRO CB . 10241 1
141 . 1 1 18 18 PRO CD C 13 50.423 0.300 . 1 . . . . 18 PRO CD . 10241 1
142 . 1 1 18 18 PRO CG C 13 27.426 0.300 . 1 . . . . 18 PRO CG . 10241 1
143 . 1 1 19 19 GLN H H 1 8.295 0.030 . 1 . . . . 19 GLN H . 10241 1
144 . 1 1 19 19 GLN HA H 1 5.396 0.030 . 1 . . . . 19 GLN HA . 10241 1
145 . 1 1 19 19 GLN HB2 H 1 1.886 0.030 . 2 . . . . 19 GLN HB2 . 10241 1
146 . 1 1 19 19 GLN HB3 H 1 1.803 0.030 . 2 . . . . 19 GLN HB3 . 10241 1
147 . 1 1 19 19 GLN HE21 H 1 7.182 0.030 . 2 . . . . 19 GLN HE21 . 10241 1
148 . 1 1 19 19 GLN HE22 H 1 6.509 0.030 . 2 . . . . 19 GLN HE22 . 10241 1
149 . 1 1 19 19 GLN HG2 H 1 2.422 0.030 . 2 . . . . 19 GLN HG2 . 10241 1
150 . 1 1 19 19 GLN HG3 H 1 2.061 0.030 . 2 . . . . 19 GLN HG3 . 10241 1
151 . 1 1 19 19 GLN C C 13 176.012 0.300 . 1 . . . . 19 GLN C . 10241 1
152 . 1 1 19 19 GLN CA C 13 54.094 0.300 . 1 . . . . 19 GLN CA . 10241 1
153 . 1 1 19 19 GLN CB C 13 32.478 0.300 . 1 . . . . 19 GLN CB . 10241 1
154 . 1 1 19 19 GLN CG C 13 34.456 0.300 . 1 . . . . 19 GLN CG . 10241 1
155 . 1 1 19 19 GLN N N 15 117.612 0.300 . 1 . . . . 19 GLN N . 10241 1
156 . 1 1 19 19 GLN NE2 N 15 108.357 0.300 . 1 . . . . 19 GLN NE2 . 10241 1
157 . 1 1 20 20 VAL H H 1 9.005 0.030 . 1 . . . . 20 VAL H . 10241 1
158 . 1 1 20 20 VAL HA H 1 5.133 0.030 . 1 . . . . 20 VAL HA . 10241 1
159 . 1 1 20 20 VAL HB H 1 1.641 0.030 . 1 . . . . 20 VAL HB . 10241 1
160 . 1 1 20 20 VAL HG11 H 1 -0.130 0.030 . 1 . . . . 20 VAL HG1 . 10241 1
161 . 1 1 20 20 VAL HG12 H 1 -0.130 0.030 . 1 . . . . 20 VAL HG1 . 10241 1
162 . 1 1 20 20 VAL HG13 H 1 -0.130 0.030 . 1 . . . . 20 VAL HG1 . 10241 1
163 . 1 1 20 20 VAL HG21 H 1 0.569 0.030 . 1 . . . . 20 VAL HG2 . 10241 1
164 . 1 1 20 20 VAL HG22 H 1 0.569 0.030 . 1 . . . . 20 VAL HG2 . 10241 1
165 . 1 1 20 20 VAL HG23 H 1 0.569 0.030 . 1 . . . . 20 VAL HG2 . 10241 1
166 . 1 1 20 20 VAL C C 13 173.875 0.300 . 1 . . . . 20 VAL C . 10241 1
167 . 1 1 20 20 VAL CA C 13 57.486 0.300 . 1 . . . . 20 VAL CA . 10241 1
168 . 1 1 20 20 VAL CB C 13 35.076 0.300 . 1 . . . . 20 VAL CB . 10241 1
169 . 1 1 20 20 VAL CG1 C 13 20.270 0.300 . 2 . . . . 20 VAL CG1 . 10241 1
170 . 1 1 20 20 VAL CG2 C 13 19.231 0.300 . 2 . . . . 20 VAL CG2 . 10241 1
171 . 1 1 20 20 VAL N N 15 112.092 0.300 . 1 . . . . 20 VAL N . 10241 1
172 . 1 1 21 21 GLU H H 1 8.901 0.030 . 1 . . . . 21 GLU H . 10241 1
173 . 1 1 21 21 GLU HA H 1 5.199 0.030 . 1 . . . . 21 GLU HA . 10241 1
174 . 1 1 21 21 GLU HB2 H 1 1.825 0.030 . 1 . . . . 21 GLU HB2 . 10241 1
175 . 1 1 21 21 GLU HB3 H 1 1.825 0.030 . 1 . . . . 21 GLU HB3 . 10241 1
176 . 1 1 21 21 GLU HG2 H 1 1.990 0.030 . 1 . . . . 21 GLU HG2 . 10241 1
177 . 1 1 21 21 GLU HG3 H 1 1.990 0.030 . 1 . . . . 21 GLU HG3 . 10241 1
178 . 1 1 21 21 GLU C C 13 175.780 0.300 . 1 . . . . 21 GLU C . 10241 1
179 . 1 1 21 21 GLU CA C 13 53.268 0.300 . 1 . . . . 21 GLU CA . 10241 1
180 . 1 1 21 21 GLU CB C 13 32.997 0.300 . 1 . . . . 21 GLU CB . 10241 1
181 . 1 1 21 21 GLU CG C 13 36.794 0.300 . 1 . . . . 21 GLU CG . 10241 1
182 . 1 1 21 21 GLU N N 15 119.970 0.300 . 1 . . . . 21 GLU N . 10241 1
183 . 1 1 22 22 ILE H H 1 8.656 0.030 . 1 . . . . 22 ILE H . 10241 1
184 . 1 1 22 22 ILE HA H 1 4.742 0.030 . 1 . . . . 22 ILE HA . 10241 1
185 . 1 1 22 22 ILE HB H 1 2.247 0.030 . 1 . . . . 22 ILE HB . 10241 1
186 . 1 1 22 22 ILE HD11 H 1 0.213 0.030 . 1 . . . . 22 ILE HD1 . 10241 1
187 . 1 1 22 22 ILE HD12 H 1 0.213 0.030 . 1 . . . . 22 ILE HD1 . 10241 1
188 . 1 1 22 22 ILE HD13 H 1 0.213 0.030 . 1 . . . . 22 ILE HD1 . 10241 1
189 . 1 1 22 22 ILE HG12 H 1 1.512 0.030 . 2 . . . . 22 ILE HG12 . 10241 1
190 . 1 1 22 22 ILE HG13 H 1 1.028 0.030 . 2 . . . . 22 ILE HG13 . 10241 1
191 . 1 1 22 22 ILE HG21 H 1 0.858 0.030 . 1 . . . . 22 ILE HG2 . 10241 1
192 . 1 1 22 22 ILE HG22 H 1 0.858 0.030 . 1 . . . . 22 ILE HG2 . 10241 1
193 . 1 1 22 22 ILE HG23 H 1 0.858 0.030 . 1 . . . . 22 ILE HG2 . 10241 1
194 . 1 1 22 22 ILE C C 13 179.107 0.300 . 1 . . . . 22 ILE C . 10241 1
195 . 1 1 22 22 ILE CA C 13 58.064 0.300 . 1 . . . . 22 ILE CA . 10241 1
196 . 1 1 22 22 ILE CB C 13 34.481 0.300 . 1 . . . . 22 ILE CB . 10241 1
197 . 1 1 22 22 ILE CD1 C 13 9.816 0.300 . 1 . . . . 22 ILE CD1 . 10241 1
198 . 1 1 22 22 ILE CG1 C 13 26.877 0.300 . 1 . . . . 22 ILE CG1 . 10241 1
199 . 1 1 22 22 ILE CG2 C 13 18.451 0.300 . 1 . . . . 22 ILE CG2 . 10241 1
200 . 1 1 22 22 ILE N N 15 125.654 0.300 . 1 . . . . 22 ILE N . 10241 1
201 . 1 1 23 23 THR H H 1 9.206 0.030 . 1 . . . . 23 THR H . 10241 1
202 . 1 1 23 23 THR HA H 1 4.230 0.030 . 1 . . . . 23 THR HA . 10241 1
203 . 1 1 23 23 THR HB H 1 4.254 0.030 . 1 . . . . 23 THR HB . 10241 1
204 . 1 1 23 23 THR HG21 H 1 1.097 0.030 . 1 . . . . 23 THR HG2 . 10241 1
205 . 1 1 23 23 THR HG22 H 1 1.097 0.030 . 1 . . . . 23 THR HG2 . 10241 1
206 . 1 1 23 23 THR HG23 H 1 1.097 0.030 . 1 . . . . 23 THR HG2 . 10241 1
207 . 1 1 23 23 THR C C 13 174.481 0.300 . 1 . . . . 23 THR C . 10241 1
208 . 1 1 23 23 THR CA C 13 62.787 0.300 . 1 . . . . 23 THR CA . 10241 1
209 . 1 1 23 23 THR CB C 13 68.779 0.300 . 1 . . . . 23 THR CB . 10241 1
210 . 1 1 23 23 THR CG2 C 13 22.564 0.300 . 1 . . . . 23 THR CG2 . 10241 1
211 . 1 1 23 23 THR N N 15 122.259 0.300 . 1 . . . . 23 THR N . 10241 1
212 . 1 1 24 24 LYS H H 1 7.443 0.030 . 1 . . . . 24 LYS H . 10241 1
213 . 1 1 24 24 LYS HA H 1 4.332 0.030 . 1 . . . . 24 LYS HA . 10241 1
214 . 1 1 24 24 LYS HB2 H 1 1.630 0.030 . 2 . . . . 24 LYS HB2 . 10241 1
215 . 1 1 24 24 LYS HB3 H 1 1.564 0.030 . 2 . . . . 24 LYS HB3 . 10241 1
216 . 1 1 24 24 LYS HD2 H 1 1.233 0.030 . 1 . . . . 24 LYS HD2 . 10241 1
217 . 1 1 24 24 LYS HD3 H 1 1.233 0.030 . 1 . . . . 24 LYS HD3 . 10241 1
218 . 1 1 24 24 LYS HE2 H 1 2.447 0.030 . 2 . . . . 24 LYS HE2 . 10241 1
219 . 1 1 24 24 LYS HE3 H 1 2.104 0.030 . 2 . . . . 24 LYS HE3 . 10241 1
220 . 1 1 24 24 LYS HG2 H 1 1.255 0.030 . 1 . . . . 24 LYS HG2 . 10241 1
221 . 1 1 24 24 LYS HG3 H 1 1.255 0.030 . 1 . . . . 24 LYS HG3 . 10241 1
222 . 1 1 24 24 LYS C C 13 172.169 0.300 . 1 . . . . 24 LYS C . 10241 1
223 . 1 1 24 24 LYS CA C 13 55.154 0.300 . 1 . . . . 24 LYS CA . 10241 1
224 . 1 1 24 24 LYS CB C 13 35.137 0.300 . 1 . . . . 24 LYS CB . 10241 1
225 . 1 1 24 24 LYS CD C 13 29.363 0.300 . 1 . . . . 24 LYS CD . 10241 1
226 . 1 1 24 24 LYS CE C 13 41.632 0.300 . 1 . . . . 24 LYS CE . 10241 1
227 . 1 1 24 24 LYS CG C 13 23.717 0.300 . 1 . . . . 24 LYS CG . 10241 1
228 . 1 1 24 24 LYS N N 15 121.874 0.300 . 1 . . . . 24 LYS N . 10241 1
229 . 1 1 25 25 ALA H H 1 8.259 0.030 . 1 . . . . 25 ALA H . 10241 1
230 . 1 1 25 25 ALA HA H 1 3.914 0.030 . 1 . . . . 25 ALA HA . 10241 1
231 . 1 1 25 25 ALA HB1 H 1 1.348 0.030 . 1 . . . . 25 ALA HB . 10241 1
232 . 1 1 25 25 ALA HB2 H 1 1.348 0.030 . 1 . . . . 25 ALA HB . 10241 1
233 . 1 1 25 25 ALA HB3 H 1 1.348 0.030 . 1 . . . . 25 ALA HB . 10241 1
234 . 1 1 25 25 ALA C C 13 176.411 0.300 . 1 . . . . 25 ALA C . 10241 1
235 . 1 1 25 25 ALA CA C 13 53.409 0.300 . 1 . . . . 25 ALA CA . 10241 1
236 . 1 1 25 25 ALA CB C 13 19.113 0.300 . 1 . . . . 25 ALA CB . 10241 1
237 . 1 1 25 25 ALA N N 15 121.708 0.300 . 1 . . . . 25 ALA N . 10241 1
238 . 1 1 26 26 PHE H H 1 8.058 0.030 . 1 . . . . 26 PHE H . 10241 1
239 . 1 1 26 26 PHE HA H 1 4.742 0.030 . 1 . . . . 26 PHE HA . 10241 1
240 . 1 1 26 26 PHE HB2 H 1 2.855 0.030 . 2 . . . . 26 PHE HB2 . 10241 1
241 . 1 1 26 26 PHE HB3 H 1 2.459 0.030 . 2 . . . . 26 PHE HB3 . 10241 1
242 . 1 1 26 26 PHE HD1 H 1 7.129 0.030 . 1 . . . . 26 PHE HD1 . 10241 1
243 . 1 1 26 26 PHE HD2 H 1 7.129 0.030 . 1 . . . . 26 PHE HD2 . 10241 1
244 . 1 1 26 26 PHE HE1 H 1 7.459 0.030 . 1 . . . . 26 PHE HE1 . 10241 1
245 . 1 1 26 26 PHE HE2 H 1 7.459 0.030 . 1 . . . . 26 PHE HE2 . 10241 1
246 . 1 1 26 26 PHE HZ H 1 7.587 0.030 . 1 . . . . 26 PHE HZ . 10241 1
247 . 1 1 26 26 PHE C C 13 172.769 0.300 . 1 . . . . 26 PHE C . 10241 1
248 . 1 1 26 26 PHE CA C 13 56.354 0.300 . 1 . . . . 26 PHE CA . 10241 1
249 . 1 1 26 26 PHE CB C 13 42.608 0.300 . 1 . . . . 26 PHE CB . 10241 1
250 . 1 1 26 26 PHE CD1 C 13 132.695 0.300 . 1 . . . . 26 PHE CD1 . 10241 1
251 . 1 1 26 26 PHE CD2 C 13 132.695 0.300 . 1 . . . . 26 PHE CD2 . 10241 1
252 . 1 1 26 26 PHE CE1 C 13 131.739 0.300 . 1 . . . . 26 PHE CE1 . 10241 1
253 . 1 1 26 26 PHE CE2 C 13 131.739 0.300 . 1 . . . . 26 PHE CE2 . 10241 1
254 . 1 1 26 26 PHE CZ C 13 130.131 0.300 . 1 . . . . 26 PHE CZ . 10241 1
255 . 1 1 26 26 PHE N N 15 121.151 0.300 . 1 . . . . 26 PHE N . 10241 1
256 . 1 1 27 27 PHE H H 1 7.752 0.030 . 1 . . . . 27 PHE H . 10241 1
257 . 1 1 27 27 PHE HA H 1 4.469 0.030 . 1 . . . . 27 PHE HA . 10241 1
258 . 1 1 27 27 PHE HB2 H 1 2.854 0.030 . 2 . . . . 27 PHE HB2 . 10241 1
259 . 1 1 27 27 PHE HB3 H 1 2.637 0.030 . 2 . . . . 27 PHE HB3 . 10241 1
260 . 1 1 27 27 PHE HD1 H 1 7.224 0.030 . 1 . . . . 27 PHE HD1 . 10241 1
261 . 1 1 27 27 PHE HD2 H 1 7.224 0.030 . 1 . . . . 27 PHE HD2 . 10241 1
262 . 1 1 27 27 PHE HE1 H 1 7.304 0.030 . 1 . . . . 27 PHE HE1 . 10241 1
263 . 1 1 27 27 PHE HE2 H 1 7.304 0.030 . 1 . . . . 27 PHE HE2 . 10241 1
264 . 1 1 27 27 PHE HZ H 1 7.264 0.030 . 1 . . . . 27 PHE HZ . 10241 1
265 . 1 1 27 27 PHE C C 13 173.594 0.300 . 1 . . . . 27 PHE C . 10241 1
266 . 1 1 27 27 PHE CA C 13 56.088 0.300 . 1 . . . . 27 PHE CA . 10241 1
267 . 1 1 27 27 PHE CB C 13 39.425 0.300 . 1 . . . . 27 PHE CB . 10241 1
268 . 1 1 27 27 PHE CD1 C 13 132.168 0.300 . 1 . . . . 27 PHE CD1 . 10241 1
269 . 1 1 27 27 PHE CD2 C 13 132.168 0.300 . 1 . . . . 27 PHE CD2 . 10241 1
270 . 1 1 27 27 PHE CE1 C 13 131.158 0.300 . 1 . . . . 27 PHE CE1 . 10241 1
271 . 1 1 27 27 PHE CE2 C 13 131.158 0.300 . 1 . . . . 27 PHE CE2 . 10241 1
272 . 1 1 27 27 PHE CZ C 13 129.623 0.300 . 1 . . . . 27 PHE CZ . 10241 1
273 . 1 1 27 27 PHE N N 15 125.818 0.300 . 1 . . . . 27 PHE N . 10241 1
274 . 1 1 28 28 ALA H H 1 8.045 0.030 . 1 . . . . 28 ALA H . 10241 1
275 . 1 1 28 28 ALA HA H 1 4.002 0.030 . 1 . . . . 28 ALA HA . 10241 1
276 . 1 1 28 28 ALA HB1 H 1 1.304 0.030 . 1 . . . . 28 ALA HB . 10241 1
277 . 1 1 28 28 ALA HB2 H 1 1.304 0.030 . 1 . . . . 28 ALA HB . 10241 1
278 . 1 1 28 28 ALA HB3 H 1 1.304 0.030 . 1 . . . . 28 ALA HB . 10241 1
279 . 1 1 28 28 ALA C C 13 178.303 0.300 . 1 . . . . 28 ALA C . 10241 1
280 . 1 1 28 28 ALA CA C 13 52.898 0.300 . 1 . . . . 28 ALA CA . 10241 1
281 . 1 1 28 28 ALA CB C 13 20.853 0.300 . 1 . . . . 28 ALA CB . 10241 1
282 . 1 1 28 28 ALA N N 15 126.105 0.300 . 1 . . . . 28 ALA N . 10241 1
283 . 1 1 29 29 LYS H H 1 9.282 0.030 . 1 . . . . 29 LYS H . 10241 1
284 . 1 1 29 29 LYS HA H 1 4.524 0.030 . 1 . . . . 29 LYS HA . 10241 1
285 . 1 1 29 29 LYS HB2 H 1 2.007 0.030 . 2 . . . . 29 LYS HB2 . 10241 1
286 . 1 1 29 29 LYS HB3 H 1 1.961 0.030 . 2 . . . . 29 LYS HB3 . 10241 1
287 . 1 1 29 29 LYS HD2 H 1 1.778 0.030 . 1 . . . . 29 LYS HD2 . 10241 1
288 . 1 1 29 29 LYS HD3 H 1 1.778 0.030 . 1 . . . . 29 LYS HD3 . 10241 1
289 . 1 1 29 29 LYS HE2 H 1 3.069 0.030 . 1 . . . . 29 LYS HE2 . 10241 1
290 . 1 1 29 29 LYS HE3 H 1 3.069 0.030 . 1 . . . . 29 LYS HE3 . 10241 1
291 . 1 1 29 29 LYS HG2 H 1 1.562 0.030 . 1 . . . . 29 LYS HG2 . 10241 1
292 . 1 1 29 29 LYS HG3 H 1 1.562 0.030 . 1 . . . . 29 LYS HG3 . 10241 1
293 . 1 1 29 29 LYS C C 13 176.347 0.300 . 1 . . . . 29 LYS C . 10241 1
294 . 1 1 29 29 LYS CA C 13 56.187 0.300 . 1 . . . . 29 LYS CA . 10241 1
295 . 1 1 29 29 LYS CB C 13 34.585 0.300 . 1 . . . . 29 LYS CB . 10241 1
296 . 1 1 29 29 LYS CD C 13 28.826 0.300 . 1 . . . . 29 LYS CD . 10241 1
297 . 1 1 29 29 LYS CE C 13 42.258 0.300 . 1 . . . . 29 LYS CE . 10241 1
298 . 1 1 29 29 LYS CG C 13 24.706 0.300 . 1 . . . . 29 LYS CG . 10241 1
299 . 1 1 29 29 LYS N N 15 120.760 0.300 . 1 . . . . 29 LYS N . 10241 1
300 . 1 1 30 30 GLN H H 1 7.738 0.030 . 1 . . . . 30 GLN H . 10241 1
301 . 1 1 30 30 GLN HA H 1 4.657 0.030 . 1 . . . . 30 GLN HA . 10241 1
302 . 1 1 30 30 GLN HB2 H 1 2.346 0.030 . 2 . . . . 30 GLN HB2 . 10241 1
303 . 1 1 30 30 GLN HB3 H 1 1.836 0.030 . 2 . . . . 30 GLN HB3 . 10241 1
304 . 1 1 30 30 GLN HE21 H 1 7.895 0.030 . 2 . . . . 30 GLN HE21 . 10241 1
305 . 1 1 30 30 GLN HE22 H 1 6.724 0.030 . 2 . . . . 30 GLN HE22 . 10241 1
306 . 1 1 30 30 GLN HG2 H 1 2.410 0.030 . 2 . . . . 30 GLN HG2 . 10241 1
307 . 1 1 30 30 GLN HG3 H 1 2.288 0.030 . 2 . . . . 30 GLN HG3 . 10241 1
308 . 1 1 30 30 GLN C C 13 177.059 0.300 . 1 . . . . 30 GLN C . 10241 1
309 . 1 1 30 30 GLN CA C 13 53.885 0.300 . 1 . . . . 30 GLN CA . 10241 1
310 . 1 1 30 30 GLN CB C 13 31.349 0.300 . 1 . . . . 30 GLN CB . 10241 1
311 . 1 1 30 30 GLN CG C 13 33.111 0.300 . 1 . . . . 30 GLN CG . 10241 1
312 . 1 1 30 30 GLN N N 15 116.957 0.300 . 1 . . . . 30 GLN N . 10241 1
313 . 1 1 30 30 GLN NE2 N 15 113.089 0.300 . 1 . . . . 30 GLN NE2 . 10241 1
314 . 1 1 31 31 ALA H H 1 8.719 0.030 . 1 . . . . 31 ALA H . 10241 1
315 . 1 1 31 31 ALA HA H 1 4.189 0.030 . 1 . . . . 31 ALA HA . 10241 1
316 . 1 1 31 31 ALA HB1 H 1 1.498 0.030 . 1 . . . . 31 ALA HB . 10241 1
317 . 1 1 31 31 ALA HB2 H 1 1.498 0.030 . 1 . . . . 31 ALA HB . 10241 1
318 . 1 1 31 31 ALA HB3 H 1 1.498 0.030 . 1 . . . . 31 ALA HB . 10241 1
319 . 1 1 31 31 ALA C C 13 177.686 0.300 . 1 . . . . 31 ALA C . 10241 1
320 . 1 1 31 31 ALA CA C 13 54.960 0.300 . 1 . . . . 31 ALA CA . 10241 1
321 . 1 1 31 31 ALA CB C 13 18.859 0.300 . 1 . . . . 31 ALA CB . 10241 1
322 . 1 1 31 31 ALA N N 15 122.985 0.300 . 1 . . . . 31 ALA N . 10241 1
323 . 1 1 32 32 ASP H H 1 8.436 0.030 . 1 . . . . 32 ASP H . 10241 1
324 . 1 1 32 32 ASP HA H 1 4.904 0.030 . 1 . . . . 32 ASP HA . 10241 1
325 . 1 1 32 32 ASP HB2 H 1 3.151 0.030 . 2 . . . . 32 ASP HB2 . 10241 1
326 . 1 1 32 32 ASP HB3 H 1 2.981 0.030 . 2 . . . . 32 ASP HB3 . 10241 1
327 . 1 1 32 32 ASP C C 13 176.845 0.300 . 1 . . . . 32 ASP C . 10241 1
328 . 1 1 32 32 ASP CA C 13 54.044 0.300 . 1 . . . . 32 ASP CA . 10241 1
329 . 1 1 32 32 ASP CB C 13 40.166 0.300 . 1 . . . . 32 ASP CB . 10241 1
330 . 1 1 32 32 ASP N N 15 113.224 0.300 . 1 . . . . 32 ASP N . 10241 1
331 . 1 1 33 33 GLU H H 1 7.632 0.030 . 1 . . . . 33 GLU H . 10241 1
332 . 1 1 33 33 GLU HA H 1 5.578 0.030 . 1 . . . . 33 GLU HA . 10241 1
333 . 1 1 33 33 GLU HB2 H 1 2.525 0.030 . 1 . . . . 33 GLU HB2 . 10241 1
334 . 1 1 33 33 GLU HB3 H 1 2.525 0.030 . 1 . . . . 33 GLU HB3 . 10241 1
335 . 1 1 33 33 GLU HG2 H 1 2.696 0.030 . 2 . . . . 33 GLU HG2 . 10241 1
336 . 1 1 33 33 GLU HG3 H 1 2.446 0.030 . 2 . . . . 33 GLU HG3 . 10241 1
337 . 1 1 33 33 GLU C C 13 175.518 0.300 . 1 . . . . 33 GLU C . 10241 1
338 . 1 1 33 33 GLU CA C 13 55.437 0.300 . 1 . . . . 33 GLU CA . 10241 1
339 . 1 1 33 33 GLU CB C 13 33.079 0.300 . 1 . . . . 33 GLU CB . 10241 1
340 . 1 1 33 33 GLU CG C 13 36.927 0.300 . 1 . . . . 33 GLU CG . 10241 1
341 . 1 1 33 33 GLU N N 15 119.902 0.300 . 1 . . . . 33 GLU N . 10241 1
342 . 1 1 34 34 VAL H H 1 8.311 0.030 . 1 . . . . 34 VAL H . 10241 1
343 . 1 1 34 34 VAL HA H 1 4.791 0.030 . 1 . . . . 34 VAL HA . 10241 1
344 . 1 1 34 34 VAL HB H 1 1.604 0.030 . 1 . . . . 34 VAL HB . 10241 1
345 . 1 1 34 34 VAL HG11 H 1 0.772 0.030 . 1 . . . . 34 VAL HG1 . 10241 1
346 . 1 1 34 34 VAL HG12 H 1 0.772 0.030 . 1 . . . . 34 VAL HG1 . 10241 1
347 . 1 1 34 34 VAL HG13 H 1 0.772 0.030 . 1 . . . . 34 VAL HG1 . 10241 1
348 . 1 1 34 34 VAL HG21 H 1 0.786 0.030 . 1 . . . . 34 VAL HG2 . 10241 1
349 . 1 1 34 34 VAL HG22 H 1 0.786 0.030 . 1 . . . . 34 VAL HG2 . 10241 1
350 . 1 1 34 34 VAL HG23 H 1 0.786 0.030 . 1 . . . . 34 VAL HG2 . 10241 1
351 . 1 1 34 34 VAL C C 13 171.861 0.300 . 1 . . . . 34 VAL C . 10241 1
352 . 1 1 34 34 VAL CA C 13 58.152 0.300 . 1 . . . . 34 VAL CA . 10241 1
353 . 1 1 34 34 VAL CB C 13 35.881 0.300 . 1 . . . . 34 VAL CB . 10241 1
354 . 1 1 34 34 VAL CG1 C 13 18.566 0.300 . 2 . . . . 34 VAL CG1 . 10241 1
355 . 1 1 34 34 VAL CG2 C 13 21.245 0.300 . 2 . . . . 34 VAL CG2 . 10241 1
356 . 1 1 34 34 VAL N N 15 119.872 0.300 . 1 . . . . 34 VAL N . 10241 1
357 . 1 1 35 35 THR H H 1 8.047 0.030 . 1 . . . . 35 THR H . 10241 1
358 . 1 1 35 35 THR HA H 1 4.559 0.030 . 1 . . . . 35 THR HA . 10241 1
359 . 1 1 35 35 THR HB H 1 4.054 0.030 . 1 . . . . 35 THR HB . 10241 1
360 . 1 1 35 35 THR HG21 H 1 1.183 0.030 . 1 . . . . 35 THR HG2 . 10241 1
361 . 1 1 35 35 THR HG22 H 1 1.183 0.030 . 1 . . . . 35 THR HG2 . 10241 1
362 . 1 1 35 35 THR HG23 H 1 1.183 0.030 . 1 . . . . 35 THR HG2 . 10241 1
363 . 1 1 35 35 THR C C 13 174.643 0.300 . 1 . . . . 35 THR C . 10241 1
364 . 1 1 35 35 THR CA C 13 62.859 0.300 . 1 . . . . 35 THR CA . 10241 1
365 . 1 1 35 35 THR CB C 13 69.626 0.300 . 1 . . . . 35 THR CB . 10241 1
366 . 1 1 35 35 THR CG2 C 13 22.593 0.300 . 1 . . . . 35 THR CG2 . 10241 1
367 . 1 1 35 35 THR N N 15 123.767 0.300 . 1 . . . . 35 THR N . 10241 1
368 . 1 1 36 36 LEU H H 1 9.001 0.030 . 1 . . . . 36 LEU H . 10241 1
369 . 1 1 36 36 LEU HA H 1 4.571 0.030 . 1 . . . . 36 LEU HA . 10241 1
370 . 1 1 36 36 LEU HB2 H 1 1.479 0.030 . 2 . . . . 36 LEU HB2 . 10241 1
371 . 1 1 36 36 LEU HB3 H 1 1.376 0.030 . 2 . . . . 36 LEU HB3 . 10241 1
372 . 1 1 36 36 LEU HD11 H 1 -0.063 0.030 . 1 . . . . 36 LEU HD1 . 10241 1
373 . 1 1 36 36 LEU HD12 H 1 -0.063 0.030 . 1 . . . . 36 LEU HD1 . 10241 1
374 . 1 1 36 36 LEU HD13 H 1 -0.063 0.030 . 1 . . . . 36 LEU HD1 . 10241 1
375 . 1 1 36 36 LEU HD21 H 1 0.552 0.030 . 1 . . . . 36 LEU HD2 . 10241 1
376 . 1 1 36 36 LEU HD22 H 1 0.552 0.030 . 1 . . . . 36 LEU HD2 . 10241 1
377 . 1 1 36 36 LEU HD23 H 1 0.552 0.030 . 1 . . . . 36 LEU HD2 . 10241 1
378 . 1 1 36 36 LEU HG H 1 1.566 0.030 . 1 . . . . 36 LEU HG . 10241 1
379 . 1 1 36 36 LEU C C 13 176.087 0.300 . 1 . . . . 36 LEU C . 10241 1
380 . 1 1 36 36 LEU CA C 13 53.374 0.300 . 1 . . . . 36 LEU CA . 10241 1
381 . 1 1 36 36 LEU CB C 13 47.954 0.300 . 1 . . . . 36 LEU CB . 10241 1
382 . 1 1 36 36 LEU CD1 C 13 26.144 0.300 . 2 . . . . 36 LEU CD1 . 10241 1
383 . 1 1 36 36 LEU CD2 C 13 23.647 0.300 . 2 . . . . 36 LEU CD2 . 10241 1
384 . 1 1 36 36 LEU CG C 13 25.528 0.300 . 1 . . . . 36 LEU CG . 10241 1
385 . 1 1 36 36 LEU N N 15 127.439 0.300 . 1 . . . . 36 LEU N . 10241 1
386 . 1 1 37 37 GLN H H 1 8.889 0.030 . 1 . . . . 37 GLN H . 10241 1
387 . 1 1 37 37 GLN HA H 1 4.298 0.030 . 1 . . . . 37 GLN HA . 10241 1
388 . 1 1 37 37 GLN HB2 H 1 1.995 0.030 . 2 . . . . 37 GLN HB2 . 10241 1
389 . 1 1 37 37 GLN HB3 H 1 1.859 0.030 . 2 . . . . 37 GLN HB3 . 10241 1
390 . 1 1 37 37 GLN HE21 H 1 7.425 0.030 . 2 . . . . 37 GLN HE21 . 10241 1
391 . 1 1 37 37 GLN HE22 H 1 6.701 0.030 . 2 . . . . 37 GLN HE22 . 10241 1
392 . 1 1 37 37 GLN HG2 H 1 2.312 0.030 . 1 . . . . 37 GLN HG2 . 10241 1
393 . 1 1 37 37 GLN HG3 H 1 2.312 0.030 . 1 . . . . 37 GLN HG3 . 10241 1
394 . 1 1 37 37 GLN C C 13 175.508 0.300 . 1 . . . . 37 GLN C . 10241 1
395 . 1 1 37 37 GLN CA C 13 53.621 0.300 . 1 . . . . 37 GLN CA . 10241 1
396 . 1 1 37 37 GLN CB C 13 30.567 0.300 . 1 . . . . 37 GLN CB . 10241 1
397 . 1 1 37 37 GLN CG C 13 34.265 0.300 . 1 . . . . 37 GLN CG . 10241 1
398 . 1 1 37 37 GLN N N 15 121.687 0.300 . 1 . . . . 37 GLN N . 10241 1
399 . 1 1 37 37 GLN NE2 N 15 111.948 0.300 . 1 . . . . 37 GLN NE2 . 10241 1
400 . 1 1 38 38 GLN H H 1 8.517 0.030 . 1 . . . . 38 GLN H . 10241 1
401 . 1 1 38 38 GLN HA H 1 3.378 0.030 . 1 . . . . 38 GLN HA . 10241 1
402 . 1 1 38 38 GLN HB2 H 1 1.929 0.030 . 2 . . . . 38 GLN HB2 . 10241 1
403 . 1 1 38 38 GLN HB3 H 1 1.797 0.030 . 2 . . . . 38 GLN HB3 . 10241 1
404 . 1 1 38 38 GLN HE21 H 1 7.520 0.030 . 2 . . . . 38 GLN HE21 . 10241 1
405 . 1 1 38 38 GLN HE22 H 1 6.876 0.030 . 2 . . . . 38 GLN HE22 . 10241 1
406 . 1 1 38 38 GLN HG2 H 1 2.195 0.030 . 1 . . . . 38 GLN HG2 . 10241 1
407 . 1 1 38 38 GLN HG3 H 1 2.195 0.030 . 1 . . . . 38 GLN HG3 . 10241 1
408 . 1 1 38 38 GLN C C 13 176.738 0.300 . 1 . . . . 38 GLN C . 10241 1
409 . 1 1 38 38 GLN CA C 13 58.584 0.300 . 1 . . . . 38 GLN CA . 10241 1
410 . 1 1 38 38 GLN CB C 13 28.151 0.300 . 1 . . . . 38 GLN CB . 10241 1
411 . 1 1 38 38 GLN CG C 13 33.853 0.300 . 1 . . . . 38 GLN CG . 10241 1
412 . 1 1 38 38 GLN N N 15 120.664 0.300 . 1 . . . . 38 GLN N . 10241 1
413 . 1 1 38 38 GLN NE2 N 15 111.690 0.300 . 1 . . . . 38 GLN NE2 . 10241 1
414 . 1 1 39 39 ALA H H 1 9.200 0.030 . 1 . . . . 39 ALA H . 10241 1
415 . 1 1 39 39 ALA HA H 1 3.948 0.030 . 1 . . . . 39 ALA HA . 10241 1
416 . 1 1 39 39 ALA HB1 H 1 1.641 0.030 . 1 . . . . 39 ALA HB . 10241 1
417 . 1 1 39 39 ALA HB2 H 1 1.641 0.030 . 1 . . . . 39 ALA HB . 10241 1
418 . 1 1 39 39 ALA HB3 H 1 1.641 0.030 . 1 . . . . 39 ALA HB . 10241 1
419 . 1 1 39 39 ALA C C 13 177.251 0.300 . 1 . . . . 39 ALA C . 10241 1
420 . 1 1 39 39 ALA CA C 13 54.731 0.300 . 1 . . . . 39 ALA CA . 10241 1
421 . 1 1 39 39 ALA CB C 13 17.134 0.300 . 1 . . . . 39 ALA CB . 10241 1
422 . 1 1 39 39 ALA N N 15 123.253 0.300 . 1 . . . . 39 ALA N . 10241 1
423 . 1 1 40 40 ASP H H 1 8.025 0.030 . 1 . . . . 40 ASP H . 10241 1
424 . 1 1 40 40 ASP HA H 1 4.498 0.030 . 1 . . . . 40 ASP HA . 10241 1
425 . 1 1 40 40 ASP HB2 H 1 2.763 0.030 . 2 . . . . 40 ASP HB2 . 10241 1
426 . 1 1 40 40 ASP HB3 H 1 2.024 0.030 . 2 . . . . 40 ASP HB3 . 10241 1
427 . 1 1 40 40 ASP C C 13 175.010 0.300 . 1 . . . . 40 ASP C . 10241 1
428 . 1 1 40 40 ASP CA C 13 56.407 0.300 . 1 . . . . 40 ASP CA . 10241 1
429 . 1 1 40 40 ASP CB C 13 41.713 0.300 . 1 . . . . 40 ASP CB . 10241 1
430 . 1 1 40 40 ASP N N 15 121.075 0.300 . 1 . . . . 40 ASP N . 10241 1
431 . 1 1 41 41 VAL H H 1 7.518 0.030 . 1 . . . . 41 VAL H . 10241 1
432 . 1 1 41 41 VAL HA H 1 5.060 0.030 . 1 . . . . 41 VAL HA . 10241 1
433 . 1 1 41 41 VAL HB H 1 1.859 0.030 . 1 . . . . 41 VAL HB . 10241 1
434 . 1 1 41 41 VAL HG11 H 1 0.880 0.030 . 1 . . . . 41 VAL HG1 . 10241 1
435 . 1 1 41 41 VAL HG12 H 1 0.880 0.030 . 1 . . . . 41 VAL HG1 . 10241 1
436 . 1 1 41 41 VAL HG13 H 1 0.880 0.030 . 1 . . . . 41 VAL HG1 . 10241 1
437 . 1 1 41 41 VAL HG21 H 1 0.993 0.030 . 1 . . . . 41 VAL HG2 . 10241 1
438 . 1 1 41 41 VAL HG22 H 1 0.993 0.030 . 1 . . . . 41 VAL HG2 . 10241 1
439 . 1 1 41 41 VAL HG23 H 1 0.993 0.030 . 1 . . . . 41 VAL HG2 . 10241 1
440 . 1 1 41 41 VAL C C 13 176.546 0.300 . 1 . . . . 41 VAL C . 10241 1
441 . 1 1 41 41 VAL CA C 13 61.818 0.300 . 1 . . . . 41 VAL CA . 10241 1
442 . 1 1 41 41 VAL CB C 13 32.997 0.300 . 1 . . . . 41 VAL CB . 10241 1
443 . 1 1 41 41 VAL CG1 C 13 21.834 0.300 . 2 . . . . 41 VAL CG1 . 10241 1
444 . 1 1 41 41 VAL CG2 C 13 21.601 0.300 . 2 . . . . 41 VAL CG2 . 10241 1
445 . 1 1 41 41 VAL N N 15 119.767 0.300 . 1 . . . . 41 VAL N . 10241 1
446 . 1 1 42 42 VAL H H 1 9.086 0.030 . 1 . . . . 42 VAL H . 10241 1
447 . 1 1 42 42 VAL HA H 1 4.528 0.030 . 1 . . . . 42 VAL HA . 10241 1
448 . 1 1 42 42 VAL HB H 1 1.585 0.030 . 1 . . . . 42 VAL HB . 10241 1
449 . 1 1 42 42 VAL HG11 H 1 0.630 0.030 . 1 . . . . 42 VAL HG1 . 10241 1
450 . 1 1 42 42 VAL HG12 H 1 0.630 0.030 . 1 . . . . 42 VAL HG1 . 10241 1
451 . 1 1 42 42 VAL HG13 H 1 0.630 0.030 . 1 . . . . 42 VAL HG1 . 10241 1
452 . 1 1 42 42 VAL HG21 H 1 0.359 0.030 . 1 . . . . 42 VAL HG2 . 10241 1
453 . 1 1 42 42 VAL HG22 H 1 0.359 0.030 . 1 . . . . 42 VAL HG2 . 10241 1
454 . 1 1 42 42 VAL HG23 H 1 0.359 0.030 . 1 . . . . 42 VAL HG2 . 10241 1
455 . 1 1 42 42 VAL C C 13 173.762 0.300 . 1 . . . . 42 VAL C . 10241 1
456 . 1 1 42 42 VAL CA C 13 60.363 0.300 . 1 . . . . 42 VAL CA . 10241 1
457 . 1 1 42 42 VAL CB C 13 35.736 0.300 . 1 . . . . 42 VAL CB . 10241 1
458 . 1 1 42 42 VAL CG1 C 13 20.904 0.300 . 2 . . . . 42 VAL CG1 . 10241 1
459 . 1 1 42 42 VAL CG2 C 13 21.575 0.300 . 2 . . . . 42 VAL CG2 . 10241 1
460 . 1 1 42 42 VAL N N 15 129.212 0.300 . 1 . . . . 42 VAL N . 10241 1
461 . 1 1 43 43 LEU H H 1 8.855 0.030 . 1 . . . . 43 LEU H . 10241 1
462 . 1 1 43 43 LEU HA H 1 4.651 0.030 . 1 . . . . 43 LEU HA . 10241 1
463 . 1 1 43 43 LEU HB2 H 1 1.751 0.030 . 2 . . . . 43 LEU HB2 . 10241 1
464 . 1 1 43 43 LEU HB3 H 1 1.578 0.030 . 2 . . . . 43 LEU HB3 . 10241 1
465 . 1 1 43 43 LEU HD11 H 1 0.911 0.030 . 1 . . . . 43 LEU HD1 . 10241 1
466 . 1 1 43 43 LEU HD12 H 1 0.911 0.030 . 1 . . . . 43 LEU HD1 . 10241 1
467 . 1 1 43 43 LEU HD13 H 1 0.911 0.030 . 1 . . . . 43 LEU HD1 . 10241 1
468 . 1 1 43 43 LEU HD21 H 1 0.877 0.030 . 1 . . . . 43 LEU HD2 . 10241 1
469 . 1 1 43 43 LEU HD22 H 1 0.877 0.030 . 1 . . . . 43 LEU HD2 . 10241 1
470 . 1 1 43 43 LEU HD23 H 1 0.877 0.030 . 1 . . . . 43 LEU HD2 . 10241 1
471 . 1 1 43 43 LEU HG H 1 1.530 0.030 . 1 . . . . 43 LEU HG . 10241 1
472 . 1 1 43 43 LEU C C 13 175.853 0.300 . 1 . . . . 43 LEU C . 10241 1
473 . 1 1 43 43 LEU CA C 13 54.132 0.300 . 1 . . . . 43 LEU CA . 10241 1
474 . 1 1 43 43 LEU CB C 13 44.039 0.300 . 1 . . . . 43 LEU CB . 10241 1
475 . 1 1 43 43 LEU CD1 C 13 25.281 0.300 . 2 . . . . 43 LEU CD1 . 10241 1
476 . 1 1 43 43 LEU CD2 C 13 25.528 0.300 . 2 . . . . 43 LEU CD2 . 10241 1
477 . 1 1 43 43 LEU CG C 13 26.923 0.300 . 1 . . . . 43 LEU CG . 10241 1
478 . 1 1 43 43 LEU N N 15 128.624 0.300 . 1 . . . . 43 LEU N . 10241 1
479 . 1 1 44 44 VAL H H 1 8.835 0.030 . 1 . . . . 44 VAL H . 10241 1
480 . 1 1 44 44 VAL HA H 1 3.837 0.030 . 1 . . . . 44 VAL HA . 10241 1
481 . 1 1 44 44 VAL HB H 1 2.044 0.030 . 1 . . . . 44 VAL HB . 10241 1
482 . 1 1 44 44 VAL HG11 H 1 0.941 0.030 . 1 . . . . 44 VAL HG1 . 10241 1
483 . 1 1 44 44 VAL HG12 H 1 0.941 0.030 . 1 . . . . 44 VAL HG1 . 10241 1
484 . 1 1 44 44 VAL HG13 H 1 0.941 0.030 . 1 . . . . 44 VAL HG1 . 10241 1
485 . 1 1 44 44 VAL HG21 H 1 0.856 0.030 . 1 . . . . 44 VAL HG2 . 10241 1
486 . 1 1 44 44 VAL HG22 H 1 0.856 0.030 . 1 . . . . 44 VAL HG2 . 10241 1
487 . 1 1 44 44 VAL HG23 H 1 0.856 0.030 . 1 . . . . 44 VAL HG2 . 10241 1
488 . 1 1 44 44 VAL C C 13 174.445 0.300 . 1 . . . . 44 VAL C . 10241 1
489 . 1 1 44 44 VAL CA C 13 64.603 0.300 . 1 . . . . 44 VAL CA . 10241 1
490 . 1 1 44 44 VAL CB C 13 32.325 0.300 . 1 . . . . 44 VAL CB . 10241 1
491 . 1 1 44 44 VAL CG1 C 13 22.564 0.300 . 2 . . . . 44 VAL CG1 . 10241 1
492 . 1 1 44 44 VAL CG2 C 13 23.965 0.300 . 2 . . . . 44 VAL CG2 . 10241 1
493 . 1 1 44 44 VAL N N 15 126.525 0.300 . 1 . . . . 44 VAL N . 10241 1
494 . 1 1 45 45 LEU H H 1 9.166 0.030 . 1 . . . . 45 LEU H . 10241 1
495 . 1 1 45 45 LEU HA H 1 4.488 0.030 . 1 . . . . 45 LEU HA . 10241 1
496 . 1 1 45 45 LEU HB2 H 1 1.652 0.030 . 1 . . . . 45 LEU HB2 . 10241 1
497 . 1 1 45 45 LEU HB3 H 1 1.652 0.030 . 1 . . . . 45 LEU HB3 . 10241 1
498 . 1 1 45 45 LEU HD11 H 1 0.787 0.030 . 1 . . . . 45 LEU HD1 . 10241 1
499 . 1 1 45 45 LEU HD12 H 1 0.787 0.030 . 1 . . . . 45 LEU HD1 . 10241 1
500 . 1 1 45 45 LEU HD13 H 1 0.787 0.030 . 1 . . . . 45 LEU HD1 . 10241 1
501 . 1 1 45 45 LEU HD21 H 1 0.818 0.030 . 1 . . . . 45 LEU HD2 . 10241 1
502 . 1 1 45 45 LEU HD22 H 1 0.818 0.030 . 1 . . . . 45 LEU HD2 . 10241 1
503 . 1 1 45 45 LEU HD23 H 1 0.818 0.030 . 1 . . . . 45 LEU HD2 . 10241 1
504 . 1 1 45 45 LEU HG H 1 1.657 0.030 . 1 . . . . 45 LEU HG . 10241 1
505 . 1 1 45 45 LEU C C 13 177.820 0.300 . 1 . . . . 45 LEU C . 10241 1
506 . 1 1 45 45 LEU CA C 13 56.137 0.300 . 1 . . . . 45 LEU CA . 10241 1
507 . 1 1 45 45 LEU CB C 13 43.957 0.300 . 1 . . . . 45 LEU CB . 10241 1
508 . 1 1 45 45 LEU CD1 C 13 25.374 0.300 . 2 . . . . 45 LEU CD1 . 10241 1
509 . 1 1 45 45 LEU CD2 C 13 23.494 0.300 . 2 . . . . 45 LEU CD2 . 10241 1
510 . 1 1 45 45 LEU CG C 13 27.793 0.300 . 1 . . . . 45 LEU CG . 10241 1
511 . 1 1 45 45 LEU N N 15 127.543 0.300 . 1 . . . . 45 LEU N . 10241 1
512 . 1 1 46 46 GLN H H 1 8.074 0.030 . 1 . . . . 46 GLN H . 10241 1
513 . 1 1 46 46 GLN HA H 1 4.643 0.030 . 1 . . . . 46 GLN HA . 10241 1
514 . 1 1 46 46 GLN HB2 H 1 2.016 0.030 . 2 . . . . 46 GLN HB2 . 10241 1
515 . 1 1 46 46 GLN HB3 H 1 1.882 0.030 . 2 . . . . 46 GLN HB3 . 10241 1
516 . 1 1 46 46 GLN HE21 H 1 7.252 0.030 . 2 . . . . 46 GLN HE21 . 10241 1
517 . 1 1 46 46 GLN HE22 H 1 6.740 0.030 . 2 . . . . 46 GLN HE22 . 10241 1
518 . 1 1 46 46 GLN HG2 H 1 2.359 0.030 . 2 . . . . 46 GLN HG2 . 10241 1
519 . 1 1 46 46 GLN HG3 H 1 2.233 0.030 . 2 . . . . 46 GLN HG3 . 10241 1
520 . 1 1 46 46 GLN C C 13 173.225 0.300 . 1 . . . . 46 GLN C . 10241 1
521 . 1 1 46 46 GLN CA C 13 55.277 0.300 . 1 . . . . 46 GLN CA . 10241 1
522 . 1 1 46 46 GLN CB C 13 33.285 0.300 . 1 . . . . 46 GLN CB . 10241 1
523 . 1 1 46 46 GLN CG C 13 34.100 0.300 . 1 . . . . 46 GLN CG . 10241 1
524 . 1 1 46 46 GLN N N 15 115.961 0.300 . 1 . . . . 46 GLN N . 10241 1
525 . 1 1 46 46 GLN NE2 N 15 110.671 0.300 . 1 . . . . 46 GLN NE2 . 10241 1
526 . 1 1 47 47 GLN H H 1 8.683 0.030 . 1 . . . . 47 GLN H . 10241 1
527 . 1 1 47 47 GLN HA H 1 5.194 0.030 . 1 . . . . 47 GLN HA . 10241 1
528 . 1 1 47 47 GLN HB2 H 1 2.124 0.030 . 2 . . . . 47 GLN HB2 . 10241 1
529 . 1 1 47 47 GLN HB3 H 1 1.892 0.030 . 2 . . . . 47 GLN HB3 . 10241 1
530 . 1 1 47 47 GLN HE21 H 1 7.738 0.030 . 2 . . . . 47 GLN HE21 . 10241 1
531 . 1 1 47 47 GLN HE22 H 1 6.681 0.030 . 2 . . . . 47 GLN HE22 . 10241 1
532 . 1 1 47 47 GLN HG2 H 1 2.308 0.030 . 1 . . . . 47 GLN HG2 . 10241 1
533 . 1 1 47 47 GLN HG3 H 1 2.308 0.030 . 1 . . . . 47 GLN HG3 . 10241 1
534 . 1 1 47 47 GLN C C 13 174.366 0.300 . 1 . . . . 47 GLN C . 10241 1
535 . 1 1 47 47 GLN CA C 13 55.243 0.300 . 1 . . . . 47 GLN CA . 10241 1
536 . 1 1 47 47 GLN CB C 13 31.473 0.300 . 1 . . . . 47 GLN CB . 10241 1
537 . 1 1 47 47 GLN CG C 13 33.337 0.300 . 1 . . . . 47 GLN CG . 10241 1
538 . 1 1 47 47 GLN N N 15 121.742 0.300 . 1 . . . . 47 GLN N . 10241 1
539 . 1 1 47 47 GLN NE2 N 15 110.865 0.300 . 1 . . . . 47 GLN NE2 . 10241 1
540 . 1 1 48 48 GLU H H 1 9.201 0.030 . 1 . . . . 48 GLU H . 10241 1
541 . 1 1 48 48 GLU HA H 1 4.669 0.030 . 1 . . . . 48 GLU HA . 10241 1
542 . 1 1 48 48 GLU HB2 H 1 2.106 0.030 . 2 . . . . 48 GLU HB2 . 10241 1
543 . 1 1 48 48 GLU HB3 H 1 1.992 0.030 . 2 . . . . 48 GLU HB3 . 10241 1
544 . 1 1 48 48 GLU HG2 H 1 2.228 0.030 . 1 . . . . 48 GLU HG2 . 10241 1
545 . 1 1 48 48 GLU HG3 H 1 2.228 0.030 . 1 . . . . 48 GLU HG3 . 10241 1
546 . 1 1 48 48 GLU C C 13 175.622 0.300 . 1 . . . . 48 GLU C . 10241 1
547 . 1 1 48 48 GLU CA C 13 56.134 0.300 . 1 . . . . 48 GLU CA . 10241 1
548 . 1 1 48 48 GLU CB C 13 33.098 0.300 . 1 . . . . 48 GLU CB . 10241 1
549 . 1 1 48 48 GLU CG C 13 36.049 0.300 . 1 . . . . 48 GLU CG . 10241 1
550 . 1 1 48 48 GLU N N 15 124.529 0.300 . 1 . . . . 48 GLU N . 10241 1
551 . 1 1 49 49 ASP H H 1 9.177 0.030 . 1 . . . . 49 ASP H . 10241 1
552 . 1 1 49 49 ASP HA H 1 4.424 0.030 . 1 . . . . 49 ASP HA . 10241 1
553 . 1 1 49 49 ASP HB2 H 1 2.963 0.030 . 2 . . . . 49 ASP HB2 . 10241 1
554 . 1 1 49 49 ASP HB3 H 1 2.585 0.030 . 2 . . . . 49 ASP HB3 . 10241 1
555 . 1 1 49 49 ASP C C 13 175.771 0.300 . 1 . . . . 49 ASP C . 10241 1
556 . 1 1 49 49 ASP CA C 13 56.001 0.300 . 1 . . . . 49 ASP CA . 10241 1
557 . 1 1 49 49 ASP CB C 13 40.478 0.300 . 1 . . . . 49 ASP CB . 10241 1
558 . 1 1 49 49 ASP N N 15 125.649 0.300 . 1 . . . . 49 ASP N . 10241 1
559 . 1 1 50 50 GLY H H 1 8.750 0.030 . 1 . . . . 50 GLY H . 10241 1
560 . 1 1 50 50 GLY HA2 H 1 4.266 0.030 . 2 . . . . 50 GLY HA2 . 10241 1
561 . 1 1 50 50 GLY HA3 H 1 3.753 0.030 . 2 . . . . 50 GLY HA3 . 10241 1
562 . 1 1 50 50 GLY C C 13 174.455 0.300 . 1 . . . . 50 GLY C . 10241 1
563 . 1 1 50 50 GLY CA C 13 45.969 0.300 . 1 . . . . 50 GLY CA . 10241 1
564 . 1 1 50 50 GLY N N 15 108.057 0.300 . 1 . . . . 50 GLY N . 10241 1
565 . 1 1 51 51 TRP H H 1 8.427 0.030 . 1 . . . . 51 TRP H . 10241 1
566 . 1 1 51 51 TRP HA H 1 4.877 0.030 . 1 . . . . 51 TRP HA . 10241 1
567 . 1 1 51 51 TRP HB2 H 1 3.466 0.030 . 2 . . . . 51 TRP HB2 . 10241 1
568 . 1 1 51 51 TRP HB3 H 1 3.018 0.030 . 2 . . . . 51 TRP HB3 . 10241 1
569 . 1 1 51 51 TRP HD1 H 1 7.354 0.030 . 1 . . . . 51 TRP HD1 . 10241 1
570 . 1 1 51 51 TRP HE1 H 1 10.051 0.030 . 1 . . . . 51 TRP HE1 . 10241 1
571 . 1 1 51 51 TRP HE3 H 1 7.464 0.030 . 1 . . . . 51 TRP HE3 . 10241 1
572 . 1 1 51 51 TRP HH2 H 1 7.368 0.030 . 1 . . . . 51 TRP HH2 . 10241 1
573 . 1 1 51 51 TRP HZ2 H 1 7.506 0.030 . 1 . . . . 51 TRP HZ2 . 10241 1
574 . 1 1 51 51 TRP HZ3 H 1 6.864 0.030 . 1 . . . . 51 TRP HZ3 . 10241 1
575 . 1 1 51 51 TRP C C 13 173.525 0.300 . 1 . . . . 51 TRP C . 10241 1
576 . 1 1 51 51 TRP CA C 13 57.270 0.300 . 1 . . . . 51 TRP CA . 10241 1
577 . 1 1 51 51 TRP CB C 13 32.690 0.300 . 1 . . . . 51 TRP CB . 10241 1
578 . 1 1 51 51 TRP CD1 C 13 127.226 0.300 . 1 . . . . 51 TRP CD1 . 10241 1
579 . 1 1 51 51 TRP CE3 C 13 119.704 0.300 . 1 . . . . 51 TRP CE3 . 10241 1
580 . 1 1 51 51 TRP CH2 C 13 125.181 0.300 . 1 . . . . 51 TRP CH2 . 10241 1
581 . 1 1 51 51 TRP CZ2 C 13 114.598 0.300 . 1 . . . . 51 TRP CZ2 . 10241 1
582 . 1 1 51 51 TRP CZ3 C 13 120.866 0.300 . 1 . . . . 51 TRP CZ3 . 10241 1
583 . 1 1 51 51 TRP N N 15 122.784 0.300 . 1 . . . . 51 TRP N . 10241 1
584 . 1 1 51 51 TRP NE1 N 15 130.168 0.300 . 1 . . . . 51 TRP NE1 . 10241 1
585 . 1 1 52 52 LEU H H 1 9.368 0.030 . 1 . . . . 52 LEU H . 10241 1
586 . 1 1 52 52 LEU HA H 1 4.987 0.030 . 1 . . . . 52 LEU HA . 10241 1
587 . 1 1 52 52 LEU HB2 H 1 0.654 0.030 . 2 . . . . 52 LEU HB2 . 10241 1
588 . 1 1 52 52 LEU HB3 H 1 0.342 0.030 . 2 . . . . 52 LEU HB3 . 10241 1
589 . 1 1 52 52 LEU HD11 H 1 0.954 0.030 . 1 . . . . 52 LEU HD1 . 10241 1
590 . 1 1 52 52 LEU HD12 H 1 0.954 0.030 . 1 . . . . 52 LEU HD1 . 10241 1
591 . 1 1 52 52 LEU HD13 H 1 0.954 0.030 . 1 . . . . 52 LEU HD1 . 10241 1
592 . 1 1 52 52 LEU HD21 H 1 0.623 0.030 . 1 . . . . 52 LEU HD2 . 10241 1
593 . 1 1 52 52 LEU HD22 H 1 0.623 0.030 . 1 . . . . 52 LEU HD2 . 10241 1
594 . 1 1 52 52 LEU HD23 H 1 0.623 0.030 . 1 . . . . 52 LEU HD2 . 10241 1
595 . 1 1 52 52 LEU HG H 1 1.183 0.030 . 1 . . . . 52 LEU HG . 10241 1
596 . 1 1 52 52 LEU C C 13 173.005 0.300 . 1 . . . . 52 LEU C . 10241 1
597 . 1 1 52 52 LEU CA C 13 52.634 0.300 . 1 . . . . 52 LEU CA . 10241 1
598 . 1 1 52 52 LEU CB C 13 43.833 0.300 . 1 . . . . 52 LEU CB . 10241 1
599 . 1 1 52 52 LEU CD1 C 13 24.143 0.300 . 2 . . . . 52 LEU CD1 . 10241 1
600 . 1 1 52 52 LEU CD2 C 13 26.467 0.300 . 2 . . . . 52 LEU CD2 . 10241 1
601 . 1 1 52 52 LEU CG C 13 27.409 0.300 . 1 . . . . 52 LEU CG . 10241 1
602 . 1 1 52 52 LEU N N 15 121.750 0.300 . 1 . . . . 52 LEU N . 10241 1
603 . 1 1 53 53 TYR H H 1 8.267 0.030 . 1 . . . . 53 TYR H . 10241 1
604 . 1 1 53 53 TYR HA H 1 4.513 0.030 . 1 . . . . 53 TYR HA . 10241 1
605 . 1 1 53 53 TYR HB2 H 1 1.848 0.030 . 2 . . . . 53 TYR HB2 . 10241 1
606 . 1 1 53 53 TYR HB3 H 1 -0.007 0.030 . 2 . . . . 53 TYR HB3 . 10241 1
607 . 1 1 53 53 TYR HD1 H 1 5.627 0.030 . 1 . . . . 53 TYR HD1 . 10241 1
608 . 1 1 53 53 TYR HD2 H 1 5.627 0.030 . 1 . . . . 53 TYR HD2 . 10241 1
609 . 1 1 53 53 TYR HE1 H 1 6.551 0.030 . 1 . . . . 53 TYR HE1 . 10241 1
610 . 1 1 53 53 TYR HE2 H 1 6.551 0.030 . 1 . . . . 53 TYR HE2 . 10241 1
611 . 1 1 53 53 TYR C C 13 176.111 0.300 . 1 . . . . 53 TYR C . 10241 1
612 . 1 1 53 53 TYR CA C 13 55.283 0.300 . 1 . . . . 53 TYR CA . 10241 1
613 . 1 1 53 53 TYR CB C 13 39.251 0.300 . 1 . . . . 53 TYR CB . 10241 1
614 . 1 1 53 53 TYR CD1 C 13 132.359 0.300 . 1 . . . . 53 TYR CD1 . 10241 1
615 . 1 1 53 53 TYR CD2 C 13 132.359 0.300 . 1 . . . . 53 TYR CD2 . 10241 1
616 . 1 1 53 53 TYR CE1 C 13 117.224 0.300 . 1 . . . . 53 TYR CE1 . 10241 1
617 . 1 1 53 53 TYR CE2 C 13 117.224 0.300 . 1 . . . . 53 TYR CE2 . 10241 1
618 . 1 1 53 53 TYR N N 15 122.457 0.300 . 1 . . . . 53 TYR N . 10241 1
619 . 1 1 54 54 GLY H H 1 8.238 0.030 . 1 . . . . 54 GLY H . 10241 1
620 . 1 1 54 54 GLY HA2 H 1 4.706 0.030 . 2 . . . . 54 GLY HA2 . 10241 1
621 . 1 1 54 54 GLY HA3 H 1 3.802 0.030 . 2 . . . . 54 GLY HA3 . 10241 1
622 . 1 1 54 54 GLY C C 13 168.928 0.300 . 1 . . . . 54 GLY C . 10241 1
623 . 1 1 54 54 GLY CA C 13 45.792 0.300 . 1 . . . . 54 GLY CA . 10241 1
624 . 1 1 54 54 GLY N N 15 112.598 0.300 . 1 . . . . 54 GLY N . 10241 1
625 . 1 1 55 55 GLU H H 1 8.400 0.030 . 1 . . . . 55 GLU H . 10241 1
626 . 1 1 55 55 GLU HA H 1 4.718 0.030 . 1 . . . . 55 GLU HA . 10241 1
627 . 1 1 55 55 GLU HB2 H 1 1.811 0.030 . 2 . . . . 55 GLU HB2 . 10241 1
628 . 1 1 55 55 GLU HB3 H 1 1.722 0.030 . 2 . . . . 55 GLU HB3 . 10241 1
629 . 1 1 55 55 GLU HG2 H 1 1.897 0.030 . 2 . . . . 55 GLU HG2 . 10241 1
630 . 1 1 55 55 GLU HG3 H 1 1.690 0.030 . 2 . . . . 55 GLU HG3 . 10241 1
631 . 1 1 55 55 GLU C C 13 175.540 0.300 . 1 . . . . 55 GLU C . 10241 1
632 . 1 1 55 55 GLU CA C 13 53.268 0.300 . 1 . . . . 55 GLU CA . 10241 1
633 . 1 1 55 55 GLU CB C 13 34.264 0.300 . 1 . . . . 55 GLU CB . 10241 1
634 . 1 1 55 55 GLU CG C 13 35.807 0.300 . 1 . . . . 55 GLU CG . 10241 1
635 . 1 1 55 55 GLU N N 15 118.345 0.300 . 1 . . . . 55 GLU N . 10241 1
636 . 1 1 56 56 ARG H H 1 9.654 0.030 . 1 . . . . 56 ARG H . 10241 1
637 . 1 1 56 56 ARG HA H 1 4.309 0.030 . 1 . . . . 56 ARG HA . 10241 1
638 . 1 1 56 56 ARG HB2 H 1 2.375 0.030 . 2 . . . . 56 ARG HB2 . 10241 1
639 . 1 1 56 56 ARG HB3 H 1 1.328 0.030 . 2 . . . . 56 ARG HB3 . 10241 1
640 . 1 1 56 56 ARG HD2 H 1 3.131 0.030 . 2 . . . . 56 ARG HD2 . 10241 1
641 . 1 1 56 56 ARG HD3 H 1 3.017 0.030 . 2 . . . . 56 ARG HD3 . 10241 1
642 . 1 1 56 56 ARG HE H 1 8.553 0.030 . 1 . . . . 56 ARG HE . 10241 1
643 . 1 1 56 56 ARG HG2 H 1 1.661 0.030 . 1 . . . . 56 ARG HG2 . 10241 1
644 . 1 1 56 56 ARG HG3 H 1 1.661 0.030 . 1 . . . . 56 ARG HG3 . 10241 1
645 . 1 1 56 56 ARG C C 13 176.838 0.300 . 1 . . . . 56 ARG C . 10241 1
646 . 1 1 56 56 ARG CA C 13 57.492 0.300 . 1 . . . . 56 ARG CA . 10241 1
647 . 1 1 56 56 ARG CB C 13 30.854 0.300 . 1 . . . . 56 ARG CB . 10241 1
648 . 1 1 56 56 ARG CD C 13 44.284 0.300 . 1 . . . . 56 ARG CD . 10241 1
649 . 1 1 56 56 ARG CG C 13 27.590 0.300 . 1 . . . . 56 ARG CG . 10241 1
650 . 1 1 56 56 ARG N N 15 129.571 0.300 . 1 . . . . 56 ARG N . 10241 1
651 . 1 1 56 56 ARG NE N 15 82.035 0.300 . 1 . . . . 56 ARG NE . 10241 1
652 . 1 1 57 57 LEU H H 1 8.195 0.030 . 1 . . . . 57 LEU H . 10241 1
653 . 1 1 57 57 LEU HA H 1 4.021 0.030 . 1 . . . . 57 LEU HA . 10241 1
654 . 1 1 57 57 LEU HB2 H 1 1.584 0.030 . 1 . . . . 57 LEU HB2 . 10241 1
655 . 1 1 57 57 LEU HB3 H 1 1.584 0.030 . 1 . . . . 57 LEU HB3 . 10241 1
656 . 1 1 57 57 LEU HD11 H 1 0.859 0.030 . 1 . . . . 57 LEU HD1 . 10241 1
657 . 1 1 57 57 LEU HD12 H 1 0.859 0.030 . 1 . . . . 57 LEU HD1 . 10241 1
658 . 1 1 57 57 LEU HD13 H 1 0.859 0.030 . 1 . . . . 57 LEU HD1 . 10241 1
659 . 1 1 57 57 LEU HD21 H 1 0.866 0.030 . 1 . . . . 57 LEU HD2 . 10241 1
660 . 1 1 57 57 LEU HD22 H 1 0.866 0.030 . 1 . . . . 57 LEU HD2 . 10241 1
661 . 1 1 57 57 LEU HD23 H 1 0.866 0.030 . 1 . . . . 57 LEU HD2 . 10241 1
662 . 1 1 57 57 LEU HG H 1 1.606 0.030 . 1 . . . . 57 LEU HG . 10241 1
663 . 1 1 57 57 LEU C C 13 179.671 0.300 . 1 . . . . 57 LEU C . 10241 1
664 . 1 1 57 57 LEU CA C 13 58.338 0.300 . 1 . . . . 57 LEU CA . 10241 1
665 . 1 1 57 57 LEU CB C 13 41.939 0.300 . 1 . . . . 57 LEU CB . 10241 1
666 . 1 1 57 57 LEU CD1 C 13 24.963 0.300 . 2 . . . . 57 LEU CD1 . 10241 1
667 . 1 1 57 57 LEU CD2 C 13 24.080 0.300 . 2 . . . . 57 LEU CD2 . 10241 1
668 . 1 1 57 57 LEU CG C 13 27.646 0.300 . 1 . . . . 57 LEU CG . 10241 1
669 . 1 1 57 57 LEU N N 15 129.973 0.300 . 1 . . . . 57 LEU N . 10241 1
670 . 1 1 58 58 ARG H H 1 8.494 0.030 . 1 . . . . 58 ARG H . 10241 1
671 . 1 1 58 58 ARG HA H 1 4.112 0.030 . 1 . . . . 58 ARG HA . 10241 1
672 . 1 1 58 58 ARG HB2 H 1 1.929 0.030 . 2 . . . . 58 ARG HB2 . 10241 1
673 . 1 1 58 58 ARG HB3 H 1 1.592 0.030 . 2 . . . . 58 ARG HB3 . 10241 1
674 . 1 1 58 58 ARG HD2 H 1 3.273 0.030 . 2 . . . . 58 ARG HD2 . 10241 1
675 . 1 1 58 58 ARG HD3 H 1 3.160 0.030 . 2 . . . . 58 ARG HD3 . 10241 1
676 . 1 1 58 58 ARG HG2 H 1 1.528 0.030 . 1 . . . . 58 ARG HG2 . 10241 1
677 . 1 1 58 58 ARG HG3 H 1 1.528 0.030 . 1 . . . . 58 ARG HG3 . 10241 1
678 . 1 1 58 58 ARG C C 13 176.402 0.300 . 1 . . . . 58 ARG C . 10241 1
679 . 1 1 58 58 ARG CA C 13 59.139 0.300 . 1 . . . . 58 ARG CA . 10241 1
680 . 1 1 58 58 ARG CB C 13 30.106 0.300 . 1 . . . . 58 ARG CB . 10241 1
681 . 1 1 58 58 ARG CD C 13 43.190 0.300 . 1 . . . . 58 ARG CD . 10241 1
682 . 1 1 58 58 ARG CG C 13 26.766 0.300 . 1 . . . . 58 ARG CG . 10241 1
683 . 1 1 58 58 ARG N N 15 115.005 0.300 . 1 . . . . 58 ARG N . 10241 1
684 . 1 1 59 59 ASP H H 1 7.392 0.030 . 1 . . . . 59 ASP H . 10241 1
685 . 1 1 59 59 ASP HA H 1 4.803 0.030 . 1 . . . . 59 ASP HA . 10241 1
686 . 1 1 59 59 ASP HB2 H 1 3.072 0.030 . 2 . . . . 59 ASP HB2 . 10241 1
687 . 1 1 59 59 ASP HB3 H 1 2.524 0.030 . 2 . . . . 59 ASP HB3 . 10241 1
688 . 1 1 59 59 ASP C C 13 176.801 0.300 . 1 . . . . 59 ASP C . 10241 1
689 . 1 1 59 59 ASP CA C 13 52.827 0.300 . 1 . . . . 59 ASP CA . 10241 1
690 . 1 1 59 59 ASP CB C 13 42.144 0.300 . 1 . . . . 59 ASP CB . 10241 1
691 . 1 1 59 59 ASP N N 15 113.739 0.300 . 1 . . . . 59 ASP N . 10241 1
692 . 1 1 60 60 GLY H H 1 8.435 0.030 . 1 . . . . 60 GLY H . 10241 1
693 . 1 1 60 60 GLY HA2 H 1 4.125 0.030 . 2 . . . . 60 GLY HA2 . 10241 1
694 . 1 1 60 60 GLY HA3 H 1 3.868 0.030 . 2 . . . . 60 GLY HA3 . 10241 1
695 . 1 1 60 60 GLY C C 13 174.707 0.300 . 1 . . . . 60 GLY C . 10241 1
696 . 1 1 60 60 GLY CA C 13 45.917 0.300 . 1 . . . . 60 GLY CA . 10241 1
697 . 1 1 60 60 GLY N N 15 110.642 0.300 . 1 . . . . 60 GLY N . 10241 1
698 . 1 1 61 61 GLU H H 1 7.527 0.030 . 1 . . . . 61 GLU H . 10241 1
699 . 1 1 61 61 GLU HA H 1 4.163 0.030 . 1 . . . . 61 GLU HA . 10241 1
700 . 1 1 61 61 GLU HB2 H 1 1.926 0.030 . 1 . . . . 61 GLU HB2 . 10241 1
701 . 1 1 61 61 GLU HB3 H 1 1.926 0.030 . 1 . . . . 61 GLU HB3 . 10241 1
702 . 1 1 61 61 GLU HG2 H 1 2.325 0.030 . 2 . . . . 61 GLU HG2 . 10241 1
703 . 1 1 61 61 GLU HG3 H 1 2.188 0.030 . 2 . . . . 61 GLU HG3 . 10241 1
704 . 1 1 61 61 GLU C C 13 176.225 0.300 . 1 . . . . 61 GLU C . 10241 1
705 . 1 1 61 61 GLU CA C 13 58.222 0.300 . 1 . . . . 61 GLU CA . 10241 1
706 . 1 1 61 61 GLU CB C 13 29.825 0.300 . 1 . . . . 61 GLU CB . 10241 1
707 . 1 1 61 61 GLU CG C 13 36.500 0.300 . 1 . . . . 61 GLU CG . 10241 1
708 . 1 1 61 61 GLU N N 15 123.061 0.300 . 1 . . . . 61 GLU N . 10241 1
709 . 1 1 62 62 THR H H 1 8.451 0.030 . 1 . . . . 62 THR H . 10241 1
710 . 1 1 62 62 THR HA H 1 5.666 0.030 . 1 . . . . 62 THR HA . 10241 1
711 . 1 1 62 62 THR HB H 1 3.812 0.030 . 1 . . . . 62 THR HB . 10241 1
712 . 1 1 62 62 THR HG21 H 1 0.834 0.030 . 1 . . . . 62 THR HG2 . 10241 1
713 . 1 1 62 62 THR HG22 H 1 0.834 0.030 . 1 . . . . 62 THR HG2 . 10241 1
714 . 1 1 62 62 THR HG23 H 1 0.834 0.030 . 1 . . . . 62 THR HG2 . 10241 1
715 . 1 1 62 62 THR C C 13 174.469 0.300 . 1 . . . . 62 THR C . 10241 1
716 . 1 1 62 62 THR CA C 13 59.826 0.300 . 1 . . . . 62 THR CA . 10241 1
717 . 1 1 62 62 THR CB C 13 72.751 0.300 . 1 . . . . 62 THR CB . 10241 1
718 . 1 1 62 62 THR CG2 C 13 20.406 0.300 . 1 . . . . 62 THR CG2 . 10241 1
719 . 1 1 62 62 THR N N 15 117.411 0.300 . 1 . . . . 62 THR N . 10241 1
720 . 1 1 63 63 GLY H H 1 7.931 0.030 . 1 . . . . 63 GLY H . 10241 1
721 . 1 1 63 63 GLY HA2 H 1 4.124 0.030 . 2 . . . . 63 GLY HA2 . 10241 1
722 . 1 1 63 63 GLY HA3 H 1 3.936 0.030 . 2 . . . . 63 GLY HA3 . 10241 1
723 . 1 1 63 63 GLY C C 13 170.896 0.300 . 1 . . . . 63 GLY C . 10241 1
724 . 1 1 63 63 GLY CA C 13 45.652 0.300 . 1 . . . . 63 GLY CA . 10241 1
725 . 1 1 63 63 GLY N N 15 108.439 0.300 . 1 . . . . 63 GLY N . 10241 1
726 . 1 1 64 64 TRP H H 1 9.071 0.030 . 1 . . . . 64 TRP H . 10241 1
727 . 1 1 64 64 TRP HA H 1 6.061 0.030 . 1 . . . . 64 TRP HA . 10241 1
728 . 1 1 64 64 TRP HB2 H 1 3.493 0.030 . 2 . . . . 64 TRP HB2 . 10241 1
729 . 1 1 64 64 TRP HB3 H 1 3.104 0.030 . 2 . . . . 64 TRP HB3 . 10241 1
730 . 1 1 64 64 TRP HD1 H 1 7.527 0.030 . 1 . . . . 64 TRP HD1 . 10241 1
731 . 1 1 64 64 TRP HE1 H 1 10.012 0.030 . 1 . . . . 64 TRP HE1 . 10241 1
732 . 1 1 64 64 TRP HE3 H 1 7.659 0.030 . 1 . . . . 64 TRP HE3 . 10241 1
733 . 1 1 64 64 TRP HH2 H 1 6.871 0.030 . 1 . . . . 64 TRP HH2 . 10241 1
734 . 1 1 64 64 TRP HZ2 H 1 7.120 0.030 . 1 . . . . 64 TRP HZ2 . 10241 1
735 . 1 1 64 64 TRP HZ3 H 1 6.810 0.030 . 1 . . . . 64 TRP HZ3 . 10241 1
736 . 1 1 64 64 TRP C C 13 177.395 0.300 . 1 . . . . 64 TRP C . 10241 1
737 . 1 1 64 64 TRP CA C 13 57.259 0.300 . 1 . . . . 64 TRP CA . 10241 1
738 . 1 1 64 64 TRP CB C 13 31.882 0.300 . 1 . . . . 64 TRP CB . 10241 1
739 . 1 1 64 64 TRP CD1 C 13 128.355 0.300 . 1 . . . . 64 TRP CD1 . 10241 1
740 . 1 1 64 64 TRP CE3 C 13 121.494 0.300 . 1 . . . . 64 TRP CE3 . 10241 1
741 . 1 1 64 64 TRP CH2 C 13 123.978 0.300 . 1 . . . . 64 TRP CH2 . 10241 1
742 . 1 1 64 64 TRP CZ2 C 13 114.912 0.300 . 1 . . . . 64 TRP CZ2 . 10241 1
743 . 1 1 64 64 TRP CZ3 C 13 121.383 0.300 . 1 . . . . 64 TRP CZ3 . 10241 1
744 . 1 1 64 64 TRP N N 15 119.762 0.300 . 1 . . . . 64 TRP N . 10241 1
745 . 1 1 64 64 TRP NE1 N 15 130.621 0.300 . 1 . . . . 64 TRP NE1 . 10241 1
746 . 1 1 65 65 PHE H H 1 9.657 0.030 . 1 . . . . 65 PHE H . 10241 1
747 . 1 1 65 65 PHE HA H 1 4.823 0.030 . 1 . . . . 65 PHE HA . 10241 1
748 . 1 1 65 65 PHE HB2 H 1 3.189 0.030 . 2 . . . . 65 PHE HB2 . 10241 1
749 . 1 1 65 65 PHE HB3 H 1 2.000 0.030 . 2 . . . . 65 PHE HB3 . 10241 1
750 . 1 1 65 65 PHE HD1 H 1 6.580 0.030 . 1 . . . . 65 PHE HD1 . 10241 1
751 . 1 1 65 65 PHE HD2 H 1 6.580 0.030 . 1 . . . . 65 PHE HD2 . 10241 1
752 . 1 1 65 65 PHE HE1 H 1 6.412 0.030 . 1 . . . . 65 PHE HE1 . 10241 1
753 . 1 1 65 65 PHE HE2 H 1 6.412 0.030 . 1 . . . . 65 PHE HE2 . 10241 1
754 . 1 1 65 65 PHE HZ H 1 7.225 0.030 . 1 . . . . 65 PHE HZ . 10241 1
755 . 1 1 65 65 PHE C C 13 170.814 0.300 . 1 . . . . 65 PHE C . 10241 1
756 . 1 1 65 65 PHE CA C 13 55.578 0.300 . 1 . . . . 65 PHE CA . 10241 1
757 . 1 1 65 65 PHE CB C 13 38.245 0.300 . 1 . . . . 65 PHE CB . 10241 1
758 . 1 1 65 65 PHE CD1 C 13 129.962 0.300 . 1 . . . . 65 PHE CD1 . 10241 1
759 . 1 1 65 65 PHE CD2 C 13 129.962 0.300 . 1 . . . . 65 PHE CD2 . 10241 1
760 . 1 1 65 65 PHE CE1 C 13 127.627 0.300 . 1 . . . . 65 PHE CE1 . 10241 1
761 . 1 1 65 65 PHE CE2 C 13 127.627 0.300 . 1 . . . . 65 PHE CE2 . 10241 1
762 . 1 1 65 65 PHE CZ C 13 129.644 0.300 . 1 . . . . 65 PHE CZ . 10241 1
763 . 1 1 65 65 PHE N N 15 116.076 0.300 . 1 . . . . 65 PHE N . 10241 1
764 . 1 1 66 66 PRO HA H 1 3.546 0.030 . 1 . . . . 66 PRO HA . 10241 1
765 . 1 1 66 66 PRO HB2 H 1 1.515 0.030 . 2 . . . . 66 PRO HB2 . 10241 1
766 . 1 1 66 66 PRO HB3 H 1 1.387 0.030 . 2 . . . . 66 PRO HB3 . 10241 1
767 . 1 1 66 66 PRO HD2 H 1 1.848 0.030 . 1 . . . . 66 PRO HD2 . 10241 1
768 . 1 1 66 66 PRO HD3 H 1 1.848 0.030 . 1 . . . . 66 PRO HD3 . 10241 1
769 . 1 1 66 66 PRO HG2 H 1 1.081 0.030 . 2 . . . . 66 PRO HG2 . 10241 1
770 . 1 1 66 66 PRO HG3 H 1 0.423 0.030 . 2 . . . . 66 PRO HG3 . 10241 1
771 . 1 1 66 66 PRO C C 13 177.963 0.300 . 1 . . . . 66 PRO C . 10241 1
772 . 1 1 66 66 PRO CA C 13 62.065 0.300 . 1 . . . . 66 PRO CA . 10241 1
773 . 1 1 66 66 PRO CB C 13 31.116 0.300 . 1 . . . . 66 PRO CB . 10241 1
774 . 1 1 66 66 PRO CD C 13 49.474 0.300 . 1 . . . . 66 PRO CD . 10241 1
775 . 1 1 66 66 PRO CG C 13 27.429 0.300 . 1 . . . . 66 PRO CG . 10241 1
776 . 1 1 67 67 GLU H H 1 8.081 0.030 . 1 . . . . 67 GLU H . 10241 1
777 . 1 1 67 67 GLU HA H 1 3.651 0.030 . 1 . . . . 67 GLU HA . 10241 1
778 . 1 1 67 67 GLU HB2 H 1 1.816 0.030 . 2 . . . . 67 GLU HB2 . 10241 1
779 . 1 1 67 67 GLU HB3 H 1 1.741 0.030 . 2 . . . . 67 GLU HB3 . 10241 1
780 . 1 1 67 67 GLU HG2 H 1 2.276 0.030 . 2 . . . . 67 GLU HG2 . 10241 1
781 . 1 1 67 67 GLU HG3 H 1 2.088 0.030 . 2 . . . . 67 GLU HG3 . 10241 1
782 . 1 1 67 67 GLU C C 13 177.298 0.300 . 1 . . . . 67 GLU C . 10241 1
783 . 1 1 67 67 GLU CA C 13 58.746 0.300 . 1 . . . . 67 GLU CA . 10241 1
784 . 1 1 67 67 GLU CB C 13 29.820 0.300 . 1 . . . . 67 GLU CB . 10241 1
785 . 1 1 67 67 GLU CG C 13 35.748 0.300 . 1 . . . . 67 GLU CG . 10241 1
786 . 1 1 67 67 GLU N N 15 121.549 0.300 . 1 . . . . 67 GLU N . 10241 1
787 . 1 1 68 68 ASP H H 1 8.456 0.030 . 1 . . . . 68 ASP H . 10241 1
788 . 1 1 68 68 ASP HA H 1 4.539 0.030 . 1 . . . . 68 ASP HA . 10241 1
789 . 1 1 68 68 ASP HB2 H 1 2.553 0.030 . 1 . . . . 68 ASP HB2 . 10241 1
790 . 1 1 68 68 ASP HB3 H 1 2.553 0.030 . 1 . . . . 68 ASP HB3 . 10241 1
791 . 1 1 68 68 ASP C C 13 176.157 0.300 . 1 . . . . 68 ASP C . 10241 1
792 . 1 1 68 68 ASP CA C 13 55.225 0.300 . 1 . . . . 68 ASP CA . 10241 1
793 . 1 1 68 68 ASP CB C 13 39.633 0.300 . 1 . . . . 68 ASP CB . 10241 1
794 . 1 1 68 68 ASP N N 15 113.915 0.300 . 1 . . . . 68 ASP N . 10241 1
795 . 1 1 69 69 PHE H H 1 7.661 0.030 . 1 . . . . 69 PHE H . 10241 1
796 . 1 1 69 69 PHE HA H 1 4.386 0.030 . 1 . . . . 69 PHE HA . 10241 1
797 . 1 1 69 69 PHE HB2 H 1 3.685 0.030 . 2 . . . . 69 PHE HB2 . 10241 1
798 . 1 1 69 69 PHE HB3 H 1 2.978 0.030 . 2 . . . . 69 PHE HB3 . 10241 1
799 . 1 1 69 69 PHE HD1 H 1 7.304 0.030 . 1 . . . . 69 PHE HD1 . 10241 1
800 . 1 1 69 69 PHE HD2 H 1 7.304 0.030 . 1 . . . . 69 PHE HD2 . 10241 1
801 . 1 1 69 69 PHE HE1 H 1 7.573 0.030 . 1 . . . . 69 PHE HE1 . 10241 1
802 . 1 1 69 69 PHE HE2 H 1 7.573 0.030 . 1 . . . . 69 PHE HE2 . 10241 1
803 . 1 1 69 69 PHE C C 13 173.252 0.300 . 1 . . . . 69 PHE C . 10241 1
804 . 1 1 69 69 PHE CA C 13 57.758 0.300 . 1 . . . . 69 PHE CA . 10241 1
805 . 1 1 69 69 PHE CB C 13 37.019 0.300 . 1 . . . . 69 PHE CB . 10241 1
806 . 1 1 69 69 PHE CD1 C 13 132.052 0.300 . 1 . . . . 69 PHE CD1 . 10241 1
807 . 1 1 69 69 PHE CD2 C 13 132.052 0.300 . 1 . . . . 69 PHE CD2 . 10241 1
808 . 1 1 69 69 PHE CE1 C 13 131.757 0.300 . 1 . . . . 69 PHE CE1 . 10241 1
809 . 1 1 69 69 PHE CE2 C 13 131.757 0.300 . 1 . . . . 69 PHE CE2 . 10241 1
810 . 1 1 69 69 PHE N N 15 119.727 0.300 . 1 . . . . 69 PHE N . 10241 1
811 . 1 1 70 70 ALA H H 1 7.809 0.030 . 1 . . . . 70 ALA H . 10241 1
812 . 1 1 70 70 ALA HA H 1 5.256 0.030 . 1 . . . . 70 ALA HA . 10241 1
813 . 1 1 70 70 ALA HB1 H 1 1.198 0.030 . 1 . . . . 70 ALA HB . 10241 1
814 . 1 1 70 70 ALA HB2 H 1 1.198 0.030 . 1 . . . . 70 ALA HB . 10241 1
815 . 1 1 70 70 ALA HB3 H 1 1.198 0.030 . 1 . . . . 70 ALA HB . 10241 1
816 . 1 1 70 70 ALA C C 13 175.703 0.300 . 1 . . . . 70 ALA C . 10241 1
817 . 1 1 70 70 ALA CA C 13 50.800 0.300 . 1 . . . . 70 ALA CA . 10241 1
818 . 1 1 70 70 ALA CB C 13 24.061 0.300 . 1 . . . . 70 ALA CB . 10241 1
819 . 1 1 70 70 ALA N N 15 121.782 0.300 . 1 . . . . 70 ALA N . 10241 1
820 . 1 1 71 71 ARG H H 1 8.792 0.030 . 1 . . . . 71 ARG H . 10241 1
821 . 1 1 71 71 ARG HA H 1 4.828 0.030 . 1 . . . . 71 ARG HA . 10241 1
822 . 1 1 71 71 ARG HB2 H 1 1.753 0.030 . 1 . . . . 71 ARG HB2 . 10241 1
823 . 1 1 71 71 ARG HB3 H 1 1.753 0.030 . 1 . . . . 71 ARG HB3 . 10241 1
824 . 1 1 71 71 ARG HD2 H 1 3.230 0.030 . 2 . . . . 71 ARG HD2 . 10241 1
825 . 1 1 71 71 ARG HD3 H 1 3.119 0.030 . 2 . . . . 71 ARG HD3 . 10241 1
826 . 1 1 71 71 ARG HG2 H 1 1.603 0.030 . 2 . . . . 71 ARG HG2 . 10241 1
827 . 1 1 71 71 ARG HG3 H 1 1.518 0.030 . 2 . . . . 71 ARG HG3 . 10241 1
828 . 1 1 71 71 ARG C C 13 175.613 0.300 . 1 . . . . 71 ARG C . 10241 1
829 . 1 1 71 71 ARG CA C 13 54.220 0.300 . 1 . . . . 71 ARG CA . 10241 1
830 . 1 1 71 71 ARG CB C 13 33.286 0.300 . 1 . . . . 71 ARG CB . 10241 1
831 . 1 1 71 71 ARG CD C 13 43.561 0.300 . 1 . . . . 71 ARG CD . 10241 1
832 . 1 1 71 71 ARG CG C 13 26.970 0.300 . 1 . . . . 71 ARG CG . 10241 1
833 . 1 1 71 71 ARG N N 15 119.543 0.300 . 1 . . . . 71 ARG N . 10241 1
834 . 1 1 72 72 PHE H H 1 9.194 0.030 . 1 . . . . 72 PHE H . 10241 1
835 . 1 1 72 72 PHE HA H 1 4.604 0.030 . 1 . . . . 72 PHE HA . 10241 1
836 . 1 1 72 72 PHE HB2 H 1 3.030 0.030 . 1 . . . . 72 PHE HB2 . 10241 1
837 . 1 1 72 72 PHE HB3 H 1 3.030 0.030 . 1 . . . . 72 PHE HB3 . 10241 1
838 . 1 1 72 72 PHE HD1 H 1 7.368 0.030 . 1 . . . . 72 PHE HD1 . 10241 1
839 . 1 1 72 72 PHE HD2 H 1 7.368 0.030 . 1 . . . . 72 PHE HD2 . 10241 1
840 . 1 1 72 72 PHE HE1 H 1 7.208 0.030 . 1 . . . . 72 PHE HE1 . 10241 1
841 . 1 1 72 72 PHE HE2 H 1 7.208 0.030 . 1 . . . . 72 PHE HE2 . 10241 1
842 . 1 1 72 72 PHE HZ H 1 7.117 0.030 . 1 . . . . 72 PHE HZ . 10241 1
843 . 1 1 72 72 PHE C C 13 176.818 0.300 . 1 . . . . 72 PHE C . 10241 1
844 . 1 1 72 72 PHE CA C 13 59.896 0.300 . 1 . . . . 72 PHE CA . 10241 1
845 . 1 1 72 72 PHE CB C 13 39.079 0.300 . 1 . . . . 72 PHE CB . 10241 1
846 . 1 1 72 72 PHE CD1 C 13 132.213 0.300 . 1 . . . . 72 PHE CD1 . 10241 1
847 . 1 1 72 72 PHE CD2 C 13 132.213 0.300 . 1 . . . . 72 PHE CD2 . 10241 1
848 . 1 1 72 72 PHE CE1 C 13 130.998 0.300 . 1 . . . . 72 PHE CE1 . 10241 1
849 . 1 1 72 72 PHE CE2 C 13 130.998 0.300 . 1 . . . . 72 PHE CE2 . 10241 1
850 . 1 1 72 72 PHE CZ C 13 129.720 0.300 . 1 . . . . 72 PHE CZ . 10241 1
851 . 1 1 72 72 PHE N N 15 125.006 0.300 . 1 . . . . 72 PHE N . 10241 1
852 . 1 1 73 73 ILE H H 1 8.574 0.030 . 1 . . . . 73 ILE H . 10241 1
853 . 1 1 73 73 ILE HA H 1 4.390 0.030 . 1 . . . . 73 ILE HA . 10241 1
854 . 1 1 73 73 ILE HB H 1 1.901 0.030 . 1 . . . . 73 ILE HB . 10241 1
855 . 1 1 73 73 ILE HD11 H 1 0.811 0.030 . 1 . . . . 73 ILE HD1 . 10241 1
856 . 1 1 73 73 ILE HD12 H 1 0.811 0.030 . 1 . . . . 73 ILE HD1 . 10241 1
857 . 1 1 73 73 ILE HD13 H 1 0.811 0.030 . 1 . . . . 73 ILE HD1 . 10241 1
858 . 1 1 73 73 ILE HG12 H 1 1.414 0.030 . 2 . . . . 73 ILE HG12 . 10241 1
859 . 1 1 73 73 ILE HG13 H 1 0.905 0.030 . 2 . . . . 73 ILE HG13 . 10241 1
860 . 1 1 73 73 ILE HG21 H 1 0.913 0.030 . 1 . . . . 73 ILE HG2 . 10241 1
861 . 1 1 73 73 ILE HG22 H 1 0.913 0.030 . 1 . . . . 73 ILE HG2 . 10241 1
862 . 1 1 73 73 ILE HG23 H 1 0.913 0.030 . 1 . . . . 73 ILE HG2 . 10241 1
863 . 1 1 73 73 ILE C C 13 176.086 0.300 . 1 . . . . 73 ILE C . 10241 1
864 . 1 1 73 73 ILE CA C 13 61.450 0.300 . 1 . . . . 73 ILE CA . 10241 1
865 . 1 1 73 73 ILE CB C 13 39.508 0.300 . 1 . . . . 73 ILE CB . 10241 1
866 . 1 1 73 73 ILE CD1 C 13 13.897 0.300 . 1 . . . . 73 ILE CD1 . 10241 1
867 . 1 1 73 73 ILE CG1 C 13 27.141 0.300 . 1 . . . . 73 ILE CG1 . 10241 1
868 . 1 1 73 73 ILE CG2 C 13 17.901 0.300 . 1 . . . . 73 ILE CG2 . 10241 1
869 . 1 1 73 73 ILE N N 15 120.816 0.300 . 1 . . . . 73 ILE N . 10241 1
870 . 1 1 74 74 SER H H 1 8.329 0.030 . 1 . . . . 74 SER H . 10241 1
871 . 1 1 74 74 SER HA H 1 4.626 0.030 . 1 . . . . 74 SER HA . 10241 1
872 . 1 1 74 74 SER HB2 H 1 3.959 0.030 . 2 . . . . 74 SER HB2 . 10241 1
873 . 1 1 74 74 SER HB3 H 1 3.902 0.030 . 2 . . . . 74 SER HB3 . 10241 1
874 . 1 1 74 74 SER C C 13 174.223 0.300 . 1 . . . . 74 SER C . 10241 1
875 . 1 1 74 74 SER CA C 13 58.169 0.300 . 1 . . . . 74 SER CA . 10241 1
876 . 1 1 74 74 SER CB C 13 64.370 0.300 . 1 . . . . 74 SER CB . 10241 1
877 . 1 1 74 74 SER N N 15 118.251 0.300 . 1 . . . . 74 SER N . 10241 1
878 . 1 1 75 75 GLY H H 1 8.372 0.030 . 1 . . . . 75 GLY H . 10241 1
879 . 1 1 75 75 GLY HA2 H 1 4.149 0.030 . 1 . . . . 75 GLY HA2 . 10241 1
880 . 1 1 75 75 GLY HA3 H 1 4.149 0.030 . 1 . . . . 75 GLY HA3 . 10241 1
881 . 1 1 75 75 GLY C C 13 171.907 0.300 . 1 . . . . 75 GLY C . 10241 1
882 . 1 1 75 75 GLY CA C 13 44.682 0.300 . 1 . . . . 75 GLY CA . 10241 1
883 . 1 1 75 75 GLY N N 15 109.951 0.300 . 1 . . . . 75 GLY N . 10241 1
884 . 1 1 76 76 PRO HA H 1 4.456 0.030 . 1 . . . . 76 PRO HA . 10241 1
885 . 1 1 76 76 PRO HB2 H 1 2.278 0.030 . 2 . . . . 76 PRO HB2 . 10241 1
886 . 1 1 76 76 PRO HB3 H 1 1.969 0.030 . 2 . . . . 76 PRO HB3 . 10241 1
887 . 1 1 76 76 PRO HD2 H 1 3.595 0.030 . 1 . . . . 76 PRO HD2 . 10241 1
888 . 1 1 76 76 PRO HD3 H 1 3.595 0.030 . 1 . . . . 76 PRO HD3 . 10241 1
889 . 1 1 76 76 PRO HG2 H 1 2.000 0.030 . 1 . . . . 76 PRO HG2 . 10241 1
890 . 1 1 76 76 PRO HG3 H 1 2.000 0.030 . 1 . . . . 76 PRO HG3 . 10241 1
891 . 1 1 76 76 PRO CA C 13 63.394 0.300 . 1 . . . . 76 PRO CA . 10241 1
892 . 1 1 76 76 PRO CB C 13 32.180 0.300 . 1 . . . . 76 PRO CB . 10241 1
893 . 1 1 76 76 PRO CD C 13 49.766 0.300 . 1 . . . . 76 PRO CD . 10241 1
894 . 1 1 76 76 PRO CG C 13 27.154 0.300 . 1 . . . . 76 PRO CG . 10241 1
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